A0A5K4F868_SCHMA Loading...

P-type phospholipid transporter

AlphaFold DB , UniProt , Accession A0A5K4F868, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,393 aa.

						>A0A5K4F868_SCHMA|A0A5K4F868
MKCKIFHRTQSTTHNHHHLSKRQVYAHNYINLNGDKFPYHYCHNRICSTHYKWYNFIIKNLYEQFHNIANLYFLLIIVTYYFVDHVGSVTVTIMPLVILISITMIKDGIDDLLRYHSDKQLNSMKYLLLNIDFDRKSIKWIYKKASLLNVGDIICCFNNQSFPCDLLLLYSSHFNGYVYINTMNLDGENNIKKYNTLKQYQSSYANYIMTTTNNTTYKNNNSSIGDDDYNEKQFNELDFQSMIEHLYLQVICEQPNENLTSFQGYYKTAQHLNVAPVAPDEDGSHDGDETCFPLTYKNLVLRGSKLISTDYIIGLVIYTGKDTKLSLNSSKNLKRKYSTRENLSNIILLIFMVAMVTITLLITILSTIWIKNNTKKIWYIDFELLTIWQFIRTIIRFLFIINYLIPISIIVTIEFQQLLLSHFISNDIHMYNPIENISSHANNSQLADELGQIKFLFCDKTGTLTQNFMVLYSCCLLNKEEVYLCDTYTTYNTTTDNHTTYNTTTDNPTTYNTTTDNHTIYNDHSNNDSNRINLLSKENSYIKYLKLPDMNKDFREFLTIITLCHTVELKNYNKLNDTTEMDHHNGNSNIQQSSMNNYEPCRYYEYEATSSDEKALVEGASKLGVVFSGKEPDLNETGSNRLYIDYWSYSSTTTTTKKESNNEKFLNRQCYIVDAVLEFDPIRKRMSVMVRYPDGTYYVLSKGAESTILDPEKCSTTSKYQRSRAIHYVNEYALNGLRTLVFAKRQLTQSIYMKLLKNLKLASNLLNDERIHALKQCYNDIEYDMEPIYVTAIEDKLQPGVKNCIKALKEAGIQIWILTGDKAETAITICQSIEHFTSNMSLIKIMNCLTLQSTAYKIYEQLDTLQLYKDYHKQKDNHHHNSSSYTIPRIKTINYGRSSSMSRSSSMLKSSSMSRSSSMLKSSSSYMNGMYNNNNNSNDDTYYYCGNSKSNFFLFNRKHCLLNRYIRYKHKKHPGIANESIGLVIDGKSLQYALHTSLRDSFLELCMSVTTVLCCRMTPLQKASIVKLVQIGLAKHSRLSMKPVIAAVGDGGNDVAMILQANIGVGVYGKEGREAVRAADYSVTEFRHIKRLFLLHGHWSYYRITITMLFFYHKAVAFVCNQLCVIYNNGYSEIPSFGTILFICYNLTMTFLVSLGYGMFERHIEEKILLNKPYLYKAISYQANLKAWYIFLWVIDGIWHGFITYFIPYYCLAGGNLYAEAIFYQINHHNTNGNYDFTMIGNASFVYLWISVTIRSTIWTKDFNLMLILCHIGTTLNLVILFVFQTFVPSTSNEYQRYAQLCRSPAFWFTFPLTVFIANAPGLLWRLASDTWWTIFIEMKNVPKSNKRKFYIKNPLVWLRALVYGRTGRNDSILQSKENDTNTFKEEINHSSQ
					

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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	35.4	Very low	32.4	Very low	239 Å²	239	177.3 Å²	177.3	100%	1.177	87%	0.868	S	S	*	*				0	54.5	0	-67.2	176.3	171	0	0	112.9
2	K	28.7	Very low	32.2	Very low	202 Å²	202	173.7 Å²	173.7	88%	0.878	86%	0.864	S	S	*	*			trans	-75.4	168.6	141.9	-69.4	174.8	177.2	175.3	0	107.3
3	C	30.8	Very low	32.2	Very low	128 Å²	128	168.9 Å²	168.9	87%	0.865	85%	0.85	S	S	*	*			trans	75.7	96.8	-178.4	-55.4	0	0	0	0	116.9
4	K	34.6	Very low	32	Very low	209 Å²	209	168.9 Å²	168.9	91%	0.909	85%	0.846	S	S	*	*	S	Bend		178.3	-5.9	129.3	-101.2	-179.8	179.6	-176.4	0	116.2
5	I	36	Very low	31.8	Very low	169 Å²	169	166.9 Å²	166.9	87%	0.867	84%	0.838	S	S	*	*	S	Bend	trans	-106.5	60.4	-179	-44.8	178.1	0	0	0	111.6
6	F	36.5	Very low	31.9	Very low	201 Å²	201	166.2 Å²	166.2	88%	0.882	83%	0.831	S	S	*	*	S	Bend	trans	-143.2	14.2	177.8	-124.6	-83.1	0	0	0	115.2
7	H	33.3	Very low	32	Very low	161 Å²	161	167.5 Å²	167.5	75%	0.745	83%	0.834	S	S	*	*			trans	-134.9	43.1	-174.8	-102.9	-67	0	0	0	114.2
8	R	30.1	Very low	32.5	Very low	241 Å²	241	165.9 Å²	165.9	91%	0.909	82%	0.823	S	S	*	*	S	Bend	trans	-136.7	45.3	173.7	-149.5	179.1	-171.2	179.7	3.1	115
9	T	31.8	Very low	33.5	Very low	138 Å²	138	164.1 Å²	164.1	85%	0.847	82%	0.816	S	S	*	*			trans	-158.2	68.5	157.2	45.5	0	0	0	0	109.6
10	Q	30.5	Very low	35	Very low	157 Å²	157	160.4 Å²	160.4	73%	0.734	81%	0.806	S	S	*	*			trans	-137.5	73.2	166.4	-89.6	-172.2	-30.9	0	0	108.7
11	S	28.9	Very low	36.9	Very low	105 Å²	105	157.8 Å²	157.8	73%	0.734	79%	0.79	S	S	*	*	S	Bend	trans	-165.3	61.1	172	56.9	0	0	0	0	109.9
12	T	30.2	Very low	39.3	Very low	134 Å²	134	146.7 Å²	146.7	82%	0.822	74%	0.735	S	S	*	*			trans	-168.4	53.6	166.3	21.9	0	0	0	0	108.8	H14	T12-H14 PolarHBondContact O-N 3.04Å; T12-H14 VanDerWaalsContact O-N 3.1Å
13	T	31.3	Very low	42	Very low	112 Å²	112	139.8 Å²	139.8	69%	0.687	71%	0.706	S	S	*	*			trans	-86.3	56.6	179.1	47.4	0	0	0	0	112.1
14	H	29.6	Very low	44.6	Very low	169 Å²	169	133.8 Å²	133.8	78%	0.782	67%	0.665	S	S	*	*	S	Bend	trans	-144	144.9	160.7	-79.7	-80.8	0	0	0	107.3	T12	T12-H14 PolarHBondContact O-N 3.04Å; T12-H14 VanDerWaalsContact O-N 3.1Å
15	N	29.1	Very low	47.1	Very low	138 Å²	138	124.6 Å²	124.6	74%	0.738	63%	0.625	S	S	*	*			trans	81.7	53.1	-178.2	-52.8	-15.2	0	0	0	118	H17	N15-H17 VanDerWaalsContact C-N 3.33Å; N15-H17 PolarHBondContact O-N 3.13Å
16	H	33.2	Very low	49.3	Very low	156 Å²	156	116.7 Å²	116.7	72%	0.722	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-76.8	-4.8	172.9	-100.1	-58.2	0	0	0	116.3
17	H	33.9	Very low	51.4	Low	189 Å²	189	108.1 Å²	108.1	88%	0.875	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-87.6	-7.1	-176.7	-90.4	-76.9	0	0	0	116.1	N15	N15-H17 VanDerWaalsContact C-N 3.33Å; N15-H17 PolarHBondContact O-N 3.13Å
18	H	40.4	Very low	53.3	Low	139 Å²	139	102.2 Å²	102.2	64%	0.644	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-89.5	3.8	-173.7	-99.2	-80.6	0	0	0	116.3	S20	H18-S20 VanDerWaalsContact C-N 3.29Å; H18-S20 PolarHBondContact O-N 3.11Å; H18-S20 VanDerWaalsContact O-N 3.07Å
19	L	52.6	Low	55.4	Low	130 Å²	130	92 Å²	92	68%	0.681	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-4.8	-165.6	-98.9	93.1	0	0	0	117.5
20	S	62.7	Low	57.2	Low	90 Å²	90	87.8 Å²	87.8	63%	0.629	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-17.5	-172.2	58.1	0	0	0	0	115.9	H18	H18-S20 VanDerWaalsContact C-N 3.29Å; H18-S20 PolarHBondContact O-N 3.11Å; H18-S20 VanDerWaalsContact O-N 3.07Å
21	K	76.3	Confident	58.9	Low	106 Å²	106	83.1 Å²	83.1	46%	0.461	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	153.4	-172.7	-62.2	179.5	178.8	-179.7	0	111.9	I251 C252 Q254 Y265	K21-I251 HydrophobicContact CB-CG2 4.15Å; K21-I251 HydrophobicContact CD-CG2 3.79Å; K21-I251 HydrophobicContact CG-CG2 4.46Å; K21-C252 CarbonylContact C-O 3.53Å; K21-C252 WeakPolarHBondContact CA-O 3.24Å; K21-Q254 PolarHBondContact O-NE2 3.16Å; K21-Y265 PolarHBondContact NZ-OH 3.35Å
22	R	84.8	Confident	60.8	Low	7 Å²	7	78.8 Å²	78.8	3%	0.026	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.9	171.6	-177.4	-178.1	-176.5	117.7	-13.2	108.8	V24 Y41 V150 I251 C252 I317 Y318 D322	R22-V24 HydrophobicContact CG-CG2 4.28Å; R22-Y41 HydrophobicContact CG-CE1 4.09Å; R22-V150 VanDerWaalsContact NH2-CG2 3.32Å; R22-I251 WeakPolarHBondContact O-CA 3.43Å; R22-C252 PolarHBondContact N-O 3.32Å; R22-C252 PolarHBondContact O-N 3.42Å; R22-I317 PolarHBondContact NE-O 3.43Å; R22-I317 PolarHBondContact NH2-O 3.29Å; R22-Y318 VanDerWaalsContact CD-CE1 3.49Å; R22-D322 IonicContact CZ-OD2 2.71Å; R22-D322 IonicContact NH1-OD2 3.43Å; R22-D322 PolarHBondContact NH1-OD2 3.47Å; R22-D322 IonicContact NH2-OD2 3.21Å; R22-D322 PolarHBondContact NH2-OD2 3.12Å
23	Q	85.3	Confident	62.5	Low	57 Å²	57	78.5 Å²	78.5	27%	0.266	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.3	177.3	-64.1	-176.2	-12.2	0	0	109.6	Y25 F37 Y41 V250 I251	Q23-Y25 HydrophobicContact CB-CE2 4.23Å; Q23-Y25 PolarHBondContact OE1-OH 3.16Å; Q23-F37 HydrophobicContact CB-CZ 4.25Å; Q23-Y41 PolarHBondContact O-OH 3.34Å; Q23-V250 CarbonylContact C-O 3.52Å; Q23-V250 WeakPolarHBondContact CA-O 3.38Å; Q23-I251 HydrophobicContact CG-CG1 4.29Å
24	V	86.2	Confident	64.1	Low	1 Å²	1	74 Å²	74	1%	0.006	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.3	178.5	178.6	0	0	0	0	108.5	R22 V150 V250 L315 I317	R22-V24 HydrophobicContact CG-CG2 4.28Å; V24-V150 HydrophobicContact CB-CG1 4.24Å; V24-V150 HydrophobicContact CG1-CG1 3.69Å; V24-V150 HydrophobicContact CG2-CG1 3.57Å; V24-V250 HydrophobicContact CB-CB 4.36Å; V24-V250 PolarHBondContact N-O 2.89Å; V24-V250 PolarHBondContact O-N 3.39Å; V24-L315 HydrophobicContact CG1-CD2 4.36Å; V24-I317 HydrophobicContact CB-CD1 4.27Å; V24-I317 HydrophobicContact CG1-CD1 4.16Å; V24-I317 HydrophobicContact CG2-CD1 4.38Å
25	Y	85.6	Confident	66	Low	17 Å²	17	69.5 Å²	69.5	7%	0.067	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.2	176.3	-62.5	-98.6	0	0	0	109	Q23 H27 N28 Y29 I30 F37 G151 Y247 Q249	Q23-Y25 HydrophobicContact CB-CE2 4.23Å; Q23-Y25 PolarHBondContact OE1-OH 3.16Å; Y25-H27 PolarHBondContact O-N 3.47Å; Y25-N28 PolarHBondContact O-N 2.86Å; Y25-N28 VanDerWaalsContact O-N 3.08Å; Y25-Y29 WeakPolarHBondContact CB-O 3.35Å; Y25-Y29 WeakPolarHBondContact CD1-O 3.49Å; Y25-I30 HydrophobicContact CE1-CG2 4.29Å; Y25-F37 HydrophobicContact CD2-CB 4.11Å; Y25-F37 AromaticContact CD2-CD1 3.77Å; Y25-F37 HydrophobicContact CD2-CD1 3.77Å; Y25-F37 AromaticContact CD2-CD2 3.89Å; Y25-F37 HydrophobicContact CD2-CD2 3.89Å; Y25-F37 HydrophobicContact CD2-CE1 4.04Å; Y25-F37 HydrophobicContact CD2-CE2 4.17Å; Y25-F37 AromaticContact CD2-CG 3.67Å; Y25-F37 HydrophobicContact CD2-CG 3.67Å; Y25-F37 HydrophobicContact CD2-CZ 4.23Å; Y25-F37 HydrophobicContact CE2-CD1 4.07Å; Y25-F37 AromaticContact CE2-CD2 3.6Å; Y25-F37 HydrophobicContact CE2-CD2 3.6Å; Y25-F37 AromaticContact CE2-CE1 3.97Å; Y25-F37 HydrophobicContact CE2-CE1 3.97Å; Y25-F37 AromaticContact CE2-CE2 3.51Å; Y25-F37 HydrophobicContact CE2-CE2 3.51Å; Y25-F37 AromaticContact CE2-CG 3.89Å; Y25-F37 HydrophobicContact CE2-CG 3.89Å; Y25-F37 AromaticContact CE2-CZ 3.69Å; Y25-F37 HydrophobicContact CE2-CZ 3.69Å; Y25-G151 WeakPolarHBondContact O-CA 3.42Å; Y25-Y247 HydrophobicContact CD1-CE2 4.43Å; Y25-Q249 HydrophobicContact CD1-CB 4.29Å; Y25-Q249 HydrophobicContact CD1-CG 4.06Å; Y25-Q249 HydrophobicContact CE1-CB 4.26Å; Y25-Q249 HydrophobicContact CE1-CG 3.66Å; Y25-Q249 PolarHBondContact OH-NE2 3.11Å
26	A	83.3	Confident	67.9	Low	2 Å²	2	70.2 Å²	70.2	2%	0.017	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-59.4	136.3	174.7	0	0	0	0	0	111.1	N28 Y29 I153 L248 L315	A26-N28 PolarHBondContact O-N 3.09Å; A26-Y29 PolarHBondContact O-N 2.91Å; A26-I153 HydrophobicContact CB-CD1 4.28Å; A26-L248 HydrophobicContact CB-CB 3.91Å; A26-L248 PolarHBondContact N-O 3.35Å; A26-L315 HydrophobicContact CB-CD1 4.14Å
27	H	79.7	Confident	69.7	Low	21 Å²	21	64.1 Å²	64.1	10%	0.097	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	58.5	10.6	-174	-45	94.8	0	0	0	115.1	Y25 Y29 I131 G151 I153	Y25-H27 PolarHBondContact O-N 3.47Å; H27-Y29 HydrophobicContact CB-CD2 3.55Å; H27-Y29 HydrophobicContact CB-CE2 3.46Å; H27-Y29 VanDerWaalsContact CB-CE2 3.46Å; H27-Y29 WeakPolarHBondContact O-CE2 3.37Å; H27-I131 HydrophobicContact CB-CD1 4.41Å; H27-G151 WeakPolarHBondContact CA-O 3.35Å; H27-G151 PolarHBondContact N-O 2.95Å; H27-I153 WeakPolarHBondContact CE1-CD1 3.33Å; H27-I153 WeakPolarHBondContact NE2-CD1 3.49Å
28	N	73.5	Confident	71.2	Confident	38 Å²	38	60.1 Å²	60.1	20%	0.203	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	69	17	-175.9	-63	-69	0	0	0	116.8	Y25 A26 K36 F37 V150	Y25-N28 PolarHBondContact O-N 2.86Å; Y25-N28 VanDerWaalsContact O-N 3.08Å; A26-N28 PolarHBondContact O-N 3.09Å; N28-K36 CarbonylContact O-C 3.19Å; N28-K36 WeakPolarHBondContact O-CA 3.19Å; N28-F37 PolarHBondContact O-N 3.07Å; N28-V150 PolarHBondContact ND2-O 3.37Å; N28-V150 PolarHBondContact OD1-O 3.45Å
29	Y	73.6	Confident	72.5	Confident	27 Å²	27	60.5 Å²	60.5	11%	0.106	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-95.4	125.1	-179.9	-56	-60.2	0	0	0	112.7	Y25 A26 H27 G34 D35 K36 I131 F133 Y247	Y25-Y29 WeakPolarHBondContact CB-O 3.35Å; Y25-Y29 WeakPolarHBondContact CD1-O 3.49Å; A26-Y29 PolarHBondContact O-N 2.91Å; H27-Y29 HydrophobicContact CB-CD2 3.55Å; H27-Y29 HydrophobicContact CB-CE2 3.46Å; H27-Y29 VanDerWaalsContact CB-CE2 3.46Å; H27-Y29 WeakPolarHBondContact O-CE2 3.37Å; Y29-G34 VanDerWaalsContact CD1-C 3.5Å; Y29-G34 VanDerWaalsContact CD1-O 3.26Å; Y29-G34 WeakPolarHBondContact CD1-O 3.36Å; Y29-G34 WeakPolarHBondContact CE1-O 3.4Å; Y29-D35 CarbonylContact C-O 3.56Å; Y29-D35 WeakPolarHBondContact CA-O 3.38Å; Y29-K36 HydrophobicContact CD1-CG 4.13Å; Y29-K36 HydrophobicContact CE1-CG 3.93Å; Y29-I131 PolarHBondContact OH-O 2.72Å; Y29-F133 HydrophobicContact CD1-CE2 4.42Å; Y29-F133 HydrophobicContact CD1-CZ 4.47Å; Y29-F133 AromaticContact CD2-CE2 3.72Å; Y29-F133 HydrophobicContact CD2-CE2 3.72Å; Y29-F133 AromaticContact CD2-CZ 3.86Å; Y29-F133 HydrophobicContact CD2-CZ 3.86Å; Y29-F133 HydrophobicContact CE1-CD2 4.22Å; Y29-F133 AromaticContact CE1-CE2 3.94Å; Y29-F133 HydrophobicContact CE1-CE2 3.94Å; Y29-F133 HydrophobicContact CE1-CZ 4.41Å; Y29-F133 HydrophobicContact CE2-CD2 4.02Å; Y29-F133 AromaticContact CE2-CE2 3.19Å; Y29-F133 HydrophobicContact CE2-CE2 3.19Å; Y29-F133 AromaticContact CE2-CZ 3.84Å; Y29-F133 HydrophobicContact CE2-CZ 3.84Å; Y29-F133 HydrophobicContact CG-CE2 4.32Å; Y29-F133 HydrophobicContact CG-CZ 4.21Å; Y29-F133 AromaticContact CZ-CD2 3.68Å; Y29-F133 AromaticContact CZ-CE2 3.31Å; Y29-Y247 WeakPolarHBondContact O-CE2 3.47Å
30	I	70	Confident	73.4	Confident	49 Å²	49	63.6 Å²	63.6	25%	0.251	32%	0.32	S	S	.	.	S	Bend	trans	-72.4	-44.6	174.2	-49.7	175	0	0	0	110	Y25 D35 F37 Y247	Y25-I30 HydrophobicContact CE1-CG2 4.29Å; I30-D35 PolarHBondContact N-O 3.3Å; I30-F37 HydrophobicContact CD1-CB 4.47Å; I30-F37 HydrophobicContact CD1-CD2 4Å; I30-F37 HydrophobicContact CG1-CB 3.85Å; I30-F37 HydrophobicContact CG1-CD2 3.83Å; I30-F37 HydrophobicContact CG1-CG 4.32Å; I30-Y247 WeakPolarHBondContact O-CE2 3.37Å; I30-Y247 PolarHBondContact O-OH 3.31Å
31	N	67.3	Low	74.5	Confident	58 Å²	58	61.7 Å²	61.7	31%	0.31	30%	0.299	S	S	.	.	S	Bend	trans	-121.4	158.7	-173.7	-60.9	-28.4	0	0	0	109.5	N33 G34 D35	N31-N33 HydrophobicContact CB-CB 4.47Å; N31-N33 PolarHBondContact O-N 3.33Å; N31-N33 VanDerWaalsContact O-N 3.08Å; N31-G34 PolarHBondContact O-N 2.97Å; N31-D35 HydrophobicContact CB-CB 4.29Å; N31-D35 PolarHBondContact ND2-OD2 3.34Å
32	L	68.6	Low	74.9	Confident	15 Å²	15	58.6 Å²	58.6	8%	0.079	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-18.2	173	-59.6	170.8	0	0	0	112.7	G34 I243 E244 Y247 L272	L32-G34 PolarHBondContact O-N 3.46Å; L32-I243 HydrophobicContact CD2-CG2 3.75Å; L32-E244 HydrophobicContact CD1-CG 3.8Å; L32-E244 HydrophobicContact CD2-CG 3.99Å; L32-Y247 HydrophobicContact CD2-CD2 4.34Å; L32-Y247 HydrophobicContact CD2-CG 4.31Å; L32-L272 HydrophobicContact CD1-CD1 4.38Å; L32-L272 HydrophobicContact CD2-CD1 4.48Å; L32-L272 HydrophobicContact CG-CD1 3.99Å
33	N	64.5	Low	75.1	Confident	127 Å²	127	64.6 Å²	64.6	68%	0.679	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	1	179.2	-59.6	-7.7	0	0	0	114.6	N31	N31-N33 HydrophobicContact CB-CB 4.47Å; N31-N33 PolarHBondContact O-N 3.33Å; N31-N33 VanDerWaalsContact O-N 3.08Å
34	G	65.6	Low	75.3	Confident	17 Å²	17	62 Å²	62	18%	0.175	31%	0.307	C	S	.	.			trans	86.5	9.2	179.8	0	0	0	0	0	115.4	Y29 N31 L32 K36	Y29-G34 VanDerWaalsContact CD1-C 3.5Å; Y29-G34 VanDerWaalsContact CD1-O 3.26Å; Y29-G34 WeakPolarHBondContact CD1-O 3.36Å; Y29-G34 WeakPolarHBondContact CE1-O 3.4Å; N31-G34 PolarHBondContact O-N 2.97Å; L32-G34 PolarHBondContact O-N 3.46Å; G34-K36 PolarHBondContact O-N 3.47Å
35	D	69.4	Low	75.3	Confident	75 Å²	75	68.7 Å²	68.7	40%	0.401	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-61.4	117.1	176.5	-68	-47.1	0	0	0	111.5	Y29 I30 N31	Y29-D35 CarbonylContact C-O 3.56Å; Y29-D35 WeakPolarHBondContact CA-O 3.38Å; I30-D35 PolarHBondContact N-O 3.3Å; N31-D35 HydrophobicContact CB-CB 4.29Å; N31-D35 PolarHBondContact ND2-OD2 3.34Å
36	K	70.3	Confident	75.2	Confident	153 Å²	153	69.7 Å²	69.7	67%	0.665	34%	0.338	S	S	*	.	B	Isolated β-bridge	trans	-80.9	134.7	-175.9	-71.7	174.2	-178.1	165.3	0	112.7	N28 Y29 G34 P38	N28-K36 CarbonylContact O-C 3.19Å; N28-K36 WeakPolarHBondContact O-CA 3.19Å; Y29-K36 HydrophobicContact CD1-CG 4.13Å; Y29-K36 HydrophobicContact CE1-CG 3.93Å; G34-K36 PolarHBondContact O-N 3.47Å; K36-P38 WeakPolarHBondContact O-CD 3.49Å
37	F	71.2	Confident	74.8	Confident	28 Å²	28	73.2 Å²	73.2	12%	0.123	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-68.5	118.7	179.3	-170.6	-127.5	0	0	0	111.8	Q23 Y25 N28 I30 Y39 Y41	Q23-F37 HydrophobicContact CB-CZ 4.25Å; Y25-F37 HydrophobicContact CD2-CB 4.11Å; Y25-F37 AromaticContact CD2-CD1 3.77Å; Y25-F37 HydrophobicContact CD2-CD1 3.77Å; Y25-F37 AromaticContact CD2-CD2 3.89Å; Y25-F37 HydrophobicContact CD2-CD2 3.89Å; Y25-F37 HydrophobicContact CD2-CE1 4.04Å; Y25-F37 HydrophobicContact CD2-CE2 4.17Å; Y25-F37 AromaticContact CD2-CG 3.67Å; Y25-F37 HydrophobicContact CD2-CG 3.67Å; Y25-F37 HydrophobicContact CD2-CZ 4.23Å; Y25-F37 HydrophobicContact CE2-CD1 4.07Å; Y25-F37 AromaticContact CE2-CD2 3.6Å; Y25-F37 HydrophobicContact CE2-CD2 3.6Å; Y25-F37 AromaticContact CE2-CE1 3.97Å; Y25-F37 HydrophobicContact CE2-CE1 3.97Å; Y25-F37 AromaticContact CE2-CE2 3.51Å; Y25-F37 HydrophobicContact CE2-CE2 3.51Å; Y25-F37 AromaticContact CE2-CG 3.89Å; Y25-F37 HydrophobicContact CE2-CG 3.89Å; Y25-F37 AromaticContact CE2-CZ 3.69Å; Y25-F37 HydrophobicContact CE2-CZ 3.69Å; N28-F37 PolarHBondContact O-N 3.07Å; I30-F37 HydrophobicContact CD1-CB 4.47Å; I30-F37 HydrophobicContact CD1-CD2 4Å; I30-F37 HydrophobicContact CG1-CB 3.85Å; I30-F37 HydrophobicContact CG1-CD2 3.83Å; I30-F37 HydrophobicContact CG1-CG 4.32Å; F37-Y39 AromaticContact CD1-CD2 3.94Å; F37-Y39 HydrophobicContact CD1-CD2 3.94Å; F37-Y39 HydrophobicContact CD1-CG 4.26Å; F37-Y39 HydrophobicContact CD2-CD2 4.1Å; F37-Y39 AromaticContact CE1-CD2 3.34Å; F37-Y39 HydrophobicContact CE1-CD2 3.34Å; F37-Y39 HydrophobicContact CE1-CE2 4.12Å; F37-Y39 AromaticContact CE1-CG 3.65Å; F37-Y39 HydrophobicContact CE1-CG 3.65Å; F37-Y39 AromaticContact CE2-CD2 3.52Å; F37-Y39 HydrophobicContact CE2-CD2 3.52Å; F37-Y39 AromaticContact CE2-CE2 3.73Å; F37-Y39 HydrophobicContact CE2-CE2 3.73Å; F37-Y39 HydrophobicContact CG-CD2 4.31Å; F37-Y39 AromaticContact CZ-CD2 3.1Å; F37-Y39 HydrophobicContact CZ-CD2 3.1Å; F37-Y39 AromaticContact CZ-CE2 3.43Å; F37-Y39 HydrophobicContact CZ-CE2 3.43Å; F37-Y39 VanDerWaalsContact CZ-CE2 3.43Å; F37-Y39 AromaticContact CZ-CG 3.85Å; F37-Y39 HydrophobicContact CZ-CG 3.85Å; F37-Y39 PolarHBondContact O-N 3.4Å; F37-Y41 HydrophobicContact CE1-CE2 4.34Å
38	P	63.8	Low	74.4	Confident	105 Å²	105	73.9 Å²	73.9	68%	0.682	37%	0.369	S	S	*	.			trans	-81.8	29.1	-167	33.3	-37.9	0	0	0	114.9	K36	K36-P38 WeakPolarHBondContact O-CD 3.49Å
39	Y	68	Low	74.5	Confident	148 Å²	148	73.4 Å²	73.4	58%	0.58	37%	0.367	S	S	*	.			trans	-94.7	117.3	-178.3	-88.1	-100.1	0	0	0	113.3	F37 Y41	F37-Y39 AromaticContact CD1-CD2 3.94Å; F37-Y39 HydrophobicContact CD1-CD2 3.94Å; F37-Y39 HydrophobicContact CD1-CG 4.26Å; F37-Y39 HydrophobicContact CD2-CD2 4.1Å; F37-Y39 AromaticContact CE1-CD2 3.34Å; F37-Y39 HydrophobicContact CE1-CD2 3.34Å; F37-Y39 HydrophobicContact CE1-CE2 4.12Å; F37-Y39 AromaticContact CE1-CG 3.65Å; F37-Y39 HydrophobicContact CE1-CG 3.65Å; F37-Y39 AromaticContact CE2-CD2 3.52Å; F37-Y39 HydrophobicContact CE2-CD2 3.52Å; F37-Y39 AromaticContact CE2-CE2 3.73Å; F37-Y39 HydrophobicContact CE2-CE2 3.73Å; F37-Y39 HydrophobicContact CG-CD2 4.31Å; F37-Y39 AromaticContact CZ-CD2 3.1Å; F37-Y39 HydrophobicContact CZ-CD2 3.1Å; F37-Y39 AromaticContact CZ-CE2 3.43Å; F37-Y39 HydrophobicContact CZ-CE2 3.43Å; F37-Y39 VanDerWaalsContact CZ-CE2 3.43Å; F37-Y39 AromaticContact CZ-CG 3.85Å; F37-Y39 HydrophobicContact CZ-CG 3.85Å; F37-Y39 PolarHBondContact O-N 3.4Å; Y39-Y41 PolarHBondContact O-N 3.18Å
40	H	72.3	Confident	74.5	Confident	194 Å²	194	74.7 Å²	74.7	90%	0.898	37%	0.374	S	S	*	.			trans	-78.7	85.7	171.3	-76.1	-53.7	0	0	0	112.3
41	Y	85.6	Confident	75	Confident	50 Å²	50	72.8 Å²	72.8	20%	0.196	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-69.8	161.2	164	-65	-64.8	0	0	0	112.2	R22 Q23 F37 Y39 V150	R22-Y41 HydrophobicContact CG-CE1 4.09Å; Q23-Y41 PolarHBondContact O-OH 3.34Å; F37-Y41 HydrophobicContact CE1-CE2 4.34Å; Y39-Y41 PolarHBondContact O-N 3.18Å; Y41-V150 HydrophobicContact CD1-CG2 4.44Å; Y41-V150 HydrophobicContact CD2-CB 3.59Å; Y41-V150 HydrophobicContact CD2-CG1 3.74Å; Y41-V150 HydrophobicContact CD2-CG2 3.9Å; Y41-V150 HydrophobicContact CE2-CB 4.29Å; Y41-V150 HydrophobicContact CE2-CG1 3.92Å; Y41-V150 HydrophobicContact CG-CB 3.96Å; Y41-V150 HydrophobicContact CG-CG1 4.27Å; Y41-V150 HydrophobicContact CG-CG2 3.7Å
42	C	85.1	Confident	75.8	Confident	42 Å²	42	75.3 Å²	75.3	28%	0.284	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-72.2	138.1	-179.3	73.8	0	0	0	0	112	T319 D322	C42-T319 WeakPolarHBondContact O-CB 3.43Å; C42-T319 PolarHBondContact O-OG1 3.35Å; C42-T319 PolarHBondContact SG-O 3.36Å; C42-D322 PolarHBondContact SG-OD1 2.67Å
43	H	87.8	Confident	76.4	Confident	132 Å²	132	85.6 Å²	85.6	61%	0.611	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-62.6	148.1	178.3	-59.2	-61.5	0	0	0	112.1	R45 G320	H43-R45 PolarHBondContact O-N 2.94Å; H43-G320 WeakPolarHBondContact O-CA 3.34Å
44	N	90.7	Very high	77.5	Confident	3 Å²	3	86.1 Å²	86.1	2%	0.016	40%	0.403	C	S	.	.			trans	-73.8	20.2	178.5	-160.1	45	0	0	0	115	A145 L148 P163 T319 G320	N44-A145 WeakPolarHBondContact CB-O 3.25Å; N44-A145 PolarHBondContact ND2-O 3.3Å; N44-L148 HydrophobicContact CB-CB 4.33Å; N44-L148 WeakPolarHBondContact CB-O 3.42Å; N44-P163 PolarHBondContact ND2-O 3.4Å; N44-P163 PolarHBondContact OD1-O 3.37Å; N44-T319 HydrophobicContact CB-CG2 4.11Å; N44-G320 PolarHBondContact OD1-N 2.91Å
45	R	86.5	Confident	78.5	Confident	141 Å²	141	87.4 Å²	87.4	53%	0.532	41%	0.406	S	S	.	.			trans	-78.2	122.8	178.6	-177.5	178.3	173	176.6	-1.1	111.3	H43 N122	H43-R45 PolarHBondContact O-N 2.94Å; R45-N122 WeakPolarHBondContact CA-OD1 3.27Å
46	I	81.6	Confident	79.4	Confident	39 Å²	39	85.9 Å²	85.9	20%	0.2	40%	0.396	C	S	.	.			trans	-82.7	137.1	172.9	-53.2	169.5	0	0	0	108.8	L121 N122 R302	I46-L121 HydrophobicContact CD1-CB 4.19Å; I46-L121 HydrophobicContact CD1-CD1 4.05Å; I46-N122 PolarHBondContact N-OD1 3.45Å; I46-N122 PolarHBondContact O-ND2 3.28Å; I46-R302 VanDerWaalsContact CD1-NH2 3.28Å
47	C	76.6	Confident	80.3	Confident	75 Å²	75	83.3 Å²	83.3	51%	0.507	39%	0.389	S	S	.	.			trans	-145.4	105	-179.8	-156.7	0	0	0	0	108.9	T49 D118	C47-T49 PolarHBondContact SG-OG1 3Å; C47-T49 VanDerWaalsContact SG-OG1 3.37Å; C47-D118 VanDerWaalsContact CA-OD2 3.31Å; C47-D118 WeakPolarHBondContact CA-OD2 3.44Å
48	S	71.5	Confident	81.1	Confident	35 Å²	35	88 Å²	88	25%	0.245	41%	0.414	C	S	.	.			trans	-100.1	-4.4	177.1	64.5	0	0	0	0	113.3	R114 D118	S48-R114 PolarHBondContact O-NH1 2.97Å; S48-D118 WeakPolarHBondContact CB-OD1 3.39Å; S48-D118 PolarHBondContact N-OD1 3.24Å; S48-D118 PolarHBondContact N-OD2 3.38Å; S48-D118 PolarHBondContact OG-OD1 3.23Å; S48-D118 PolarHBondContact OG-OD2 2.68Å
49	T	75.3	Confident	82.1	Confident	28 Å²	28	86 Å²	86	17%	0.172	40%	0.395	C	S	.	.			trans	-60.5	136.3	174.2	66.8	0	0	0	0	111.9	C47 Y51 D111 R114	C47-T49 PolarHBondContact SG-OG1 3Å; C47-T49 VanDerWaalsContact SG-OG1 3.37Å; T49-Y51 VanDerWaalsContact C-N 3.33Å; T49-Y51 WeakPolarHBondContact CB-O 3.5Å; T49-Y51 PolarHBondContact OG1-O 3.19Å; T49-D111 WeakPolarHBondContact CA-OD1 3.25Å; T49-D111 VanDerWaalsContact CB-OD1 3.28Å; T49-D111 WeakPolarHBondContact CB-OD1 3.47Å; T49-R114 HydrophobicContact CG2-CB 4.28Å
50	H	72.9	Confident	83.1	Confident	55 Å²	55	79 Å²	79	26%	0.255	37%	0.367	S	S	.	.	S	Bend	trans	-74.8	-26.6	174.8	-80.2	-41.1	0	0	0	112.4	K59 D111 R114 L333	H50-K59 PolarHBondContact O-NZ 3.43Å; H50-D111 PolarHBondContact N-OD1 3.43Å; H50-R114 PolarHBondContact CD2-NH1 3.41Å; H50-L333 PolarHBondContact NE2-O 3.1Å
51	Y	80.3	Confident	83.7	Confident	8 Å²	8	72.2 Å²	72.2	3%	0.031	34%	0.337	C	S	.	.			trans	-118.2	166.5	179.4	-47.7	-75.7	0	0	0	110.7	T49 F56 K59 N60 E63 D107 D111 R335	T49-Y51 VanDerWaalsContact C-N 3.33Å; T49-Y51 WeakPolarHBondContact CB-O 3.5Å; T49-Y51 PolarHBondContact OG1-O 3.19Å; Y51-F56 HydrophobicContact CD1-CD2 4.37Å; Y51-F56 AromaticContact CD2-CD2 3.73Å; Y51-F56 HydrophobicContact CD2-CD2 3.73Å; Y51-F56 HydrophobicContact CD2-CE2 4.07Å; Y51-F56 HydrophobicContact CE2-CD2 4.35Å; Y51-F56 HydrophobicContact CE2-CE2 4.34Å; Y51-F56 AromaticContact CG-CD2 3.75Å; Y51-F56 HydrophobicContact CG-CD2 3.75Å; Y51-K59 HydrophobicContact CD1-CB 4.05Å; Y51-K59 HydrophobicContact CD1-CD 3.94Å; Y51-K59 HydrophobicContact CD1-CG 4.01Å; Y51-K59 HydrophobicContact CE1-CB 4.2Å; Y51-K59 HydrophobicContact CE1-CD 4.18Å; Y51-K59 HydrophobicContact CE1-CG 3.91Å; Y51-N60 HydrophobicContact CE1-CB 4.17Å; Y51-E63 PolarHBondContact OH-OE2 2.93Å; Y51-D107 HydrophobicContact CE2-CB 4.34Å; Y51-D107 PolarHBondContact OH-OD2 2.94Å; Y51-D107 VanDerWaalsContact OH-OD2 3.12Å; Y51-D111 WeakPolarHBondContact CA-OD2 3.45Å; Y51-D111 WeakPolarHBondContact CB-OD2 3.31Å; Y51-D111 HydrophobicContact CD2-CB 4.06Å; Y51-D111 PolarHBondContact N-OD2 3.26Å; Y51-D111 VanDerWaalsContact N-OD2 3.12Å; Y51-R335 PolarHBondContact OH-NH1 3.07Å
52	K	83.4	Confident	83.7	Confident	112 Å²	112	78.2 Å²	78.2	49%	0.487	36%	0.361	S	S	.	.			trans	-115.8	147.4	160.5	-63.9	-179.3	176.7	-173	0	105.8	Y54 N55 F56	K52-Y54 HydrophobicContact CB-CD1 4.07Å; K52-Y54 HydrophobicContact CB-CE1 3.85Å; K52-Y54 HydrophobicContact CD-CE1 3.53Å; K52-Y54 HydrophobicContact CD-CE2 4.47Å; K52-Y54 VanDerWaalsContact CD-OH 3.25Å; K52-Y54 WeakPolarHBondContact CD-OH 3.49Å; K52-Y54 HydrophobicContact CG-CE1 4.37Å; K52-Y54 PolarHBondContact NZ-OH 3.05Å; K52-Y54 PolarHBondContact O-N 3.35Å; K52-N55 PolarHBondContact N-OD1 2.58Å; K52-N55 PolarHBondContact O-N 3.49Å; K52-N55 PolarHBondContact O-OD1 3.17Å; K52-F56 PolarHBondContact O-N 2.84Å
53	W	82.3	Confident	83.4	Confident	231 Å²	231	77.8 Å²	77.8	88%	0.875	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.4	-40	-176.9	72.1	-95	0	0	0	113.7
54	Y	86.5	Confident	83.1	Confident	137 Å²	137	72.5 Å²	72.5	54%	0.537	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-22.2	-180	67.2	-102	0	0	0	115.4	K52	K52-Y54 HydrophobicContact CB-CD1 4.07Å; K52-Y54 HydrophobicContact CB-CE1 3.85Å; K52-Y54 HydrophobicContact CD-CE1 3.53Å; K52-Y54 HydrophobicContact CD-CE2 4.47Å; K52-Y54 VanDerWaalsContact CD-OH 3.25Å; K52-Y54 WeakPolarHBondContact CD-OH 3.49Å; K52-Y54 HydrophobicContact CG-CE1 4.37Å; K52-Y54 PolarHBondContact NZ-OH 3.05Å; K52-Y54 PolarHBondContact O-N 3.35Å
55	N	88.5	Confident	82.7	Confident	44 Å²	44	75.5 Å²	75.5	24%	0.235	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-8.2	-179.3	80.2	10.3	0	0	0	113.2	K52 I57 I58 K59	K52-N55 PolarHBondContact N-OD1 2.58Å; K52-N55 PolarHBondContact O-N 3.49Å; K52-N55 PolarHBondContact O-OD1 3.17Å; N55-I57 PolarHBondContact O-N 3.06Å; N55-I58 PolarHBondContact O-N 3.14Å; N55-K59 VanDerWaalsContact O-CB 3.26Å; N55-K59 WeakPolarHBondContact O-CB 3.28Å; N55-K59 PolarHBondContact O-N 2.91Å
56	F	88	Confident	82.2	Confident	43 Å²	43	74.2 Å²	74.2	19%	0.189	34%	0.343	C	S	.	.	H	α-helix	trans	-47.3	-59.6	-178.2	174.9	-107.6	0	0	0	112	Y51 K52 I58 K59 N60 M104	Y51-F56 HydrophobicContact CD1-CD2 4.37Å; Y51-F56 AromaticContact CD2-CD2 3.73Å; Y51-F56 HydrophobicContact CD2-CD2 3.73Å; Y51-F56 HydrophobicContact CD2-CE2 4.07Å; Y51-F56 HydrophobicContact CE2-CD2 4.35Å; Y51-F56 HydrophobicContact CE2-CE2 4.34Å; Y51-F56 AromaticContact CG-CD2 3.75Å; Y51-F56 HydrophobicContact CG-CD2 3.75Å; K52-F56 PolarHBondContact O-N 2.84Å; F56-I58 PolarHBondContact O-N 3.05Å; F56-K59 PolarHBondContact O-N 3.42Å; F56-N60 WeakPolarHBondContact O-CB 3.41Å; F56-N60 PolarHBondContact O-N 3.3Å; F56-M104 HydrophobicContact CD1-CE 4.44Å; F56-M104 HydrophobicContact CE1-CE 3.99Å; F56-M104 WeakPolarHBondContact CZ-O 3.42Å
57	I	87.5	Confident	81.8	Confident	99 Å²	99	74 Å²	74	51%	0.508	34%	0.342	S	S	.	.	H	α-helix	trans	-58	-53	-176.4	-58.1	177.9	0	0	0	111.5	N55 K59 L61 M104	N55-I57 PolarHBondContact O-N 3.06Å; I57-K59 PolarHBondContact O-N 3.17Å; I57-L61 HydrophobicContact CG2-CD1 3.78Å; I57-L61 HydrophobicContact CG2-CG 4.46Å; I57-L61 VanDerWaalsContact O-CB 3.31Å; I57-L61 WeakPolarHBondContact O-CB 3.49Å; I57-L61 VanDerWaalsContact O-CG 3.23Å; I57-L61 WeakPolarHBondContact O-CG 3.11Å; I57-L61 PolarHBondContact O-N 2.91Å; I57-M104 HydrophobicContact CB-CE 4.24Å; I57-M104 HydrophobicContact CG1-CE 3.93Å; I57-M104 HydrophobicContact CG2-CE 4.1Å
58	I	88.5	Confident	82	Confident	126 Å²	126	73.1 Å²	73.1	65%	0.646	33%	0.332	S	S	*	.	H	α-helix	trans	-66.2	-41.9	-174.9	-61.2	173.4	0	0	0	111.5	N55 F56 Y62	N55-I58 PolarHBondContact O-N 3.14Å; F56-I58 PolarHBondContact O-N 3.05Å; I58-Y62 WeakPolarHBondContact O-CB 3.45Å; I58-Y62 PolarHBondContact O-N 3.14Å; I58-Y62 VanDerWaalsContact O-N 3.1Å
59	K	86.4	Confident	82.3	Confident	65 Å²	65	71.5 Å²	71.5	28%	0.283	32%	0.32	S	S	.	.	H	α-helix	trans	-75.2	-39.8	-178.2	-175.3	172.4	172	-78.4	0	111.8	H50 Y51 N55 F56 I57 Y62 E63	H50-K59 PolarHBondContact O-NZ 3.43Å; Y51-K59 HydrophobicContact CD1-CB 4.05Å; Y51-K59 HydrophobicContact CD1-CD 3.94Å; Y51-K59 HydrophobicContact CD1-CG 4.01Å; Y51-K59 HydrophobicContact CE1-CB 4.2Å; Y51-K59 HydrophobicContact CE1-CD 4.18Å; Y51-K59 HydrophobicContact CE1-CG 3.91Å; N55-K59 VanDerWaalsContact O-CB 3.26Å; N55-K59 WeakPolarHBondContact O-CB 3.28Å; N55-K59 PolarHBondContact O-N 2.91Å; F56-K59 PolarHBondContact O-N 3.42Å; I57-K59 PolarHBondContact O-N 3.17Å; K59-Y62 PolarHBondContact O-N 2.94Å; K59-E63 WeakPolarHBondContact CE-OE1 3.27Å; K59-E63 IonicContact NZ-OE1 2.65Å; K59-E63 PolarHBondContact NZ-OE1 2.9Å; K59-E63 WeakPolarHBondContact O-CG 3.23Å; K59-E63 PolarHBondContact O-N 3.35Å
60	N	87.3	Confident	82.5	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-64.3	-49.1	176	-169.6	-34.5	0	0	0	110.4	Y51 F56 Y62 E63 Q64 D107	Y51-N60 HydrophobicContact CE1-CB 4.17Å; F56-N60 WeakPolarHBondContact O-CB 3.41Å; F56-N60 PolarHBondContact O-N 3.3Å; N60-Y62 VanDerWaalsContact C-N 3.31Å; N60-Y62 PolarHBondContact O-N 2.96Å; N60-E63 CarbonylContact O-C 3.6Å; N60-E63 WeakPolarHBondContact O-CA 3.11Å; N60-E63 WeakPolarHBondContact O-CB 3.43Å; N60-E63 PolarHBondContact O-N 2.88Å; N60-Q64 WeakPolarHBondContact O-CG 3.46Å; N60-Q64 PolarHBondContact O-N 3.48Å; N60-Q64 PolarHBondContact OD1-NE2 3.33Å; N60-D107 VanDerWaalsContact ND2-CB 3.3Å; N60-D107 WeakPolarHBondContact ND2-CB 3.26Å
61	L	85.7	Confident	83	Confident	51 Å²	51	72 Å²	72	27%	0.267	32%	0.323	S	S	.	.	H	α-helix	trans	-55.7	-44.7	173.3	-72.4	171.5	0	0	0	112.1	I57 E63 Q64 F65 I100 M104	I57-L61 HydrophobicContact CG2-CD1 3.78Å; I57-L61 HydrophobicContact CG2-CG 4.46Å; I57-L61 VanDerWaalsContact O-CB 3.31Å; I57-L61 WeakPolarHBondContact O-CB 3.49Å; I57-L61 VanDerWaalsContact O-CG 3.23Å; I57-L61 WeakPolarHBondContact O-CG 3.11Å; I57-L61 PolarHBondContact O-N 2.91Å; L61-E63 VanDerWaalsContact C-N 3.32Å; L61-E63 PolarHBondContact O-N 3.26Å; L61-Q64 PolarHBondContact O-N 2.94Å; L61-F65 HydrophobicContact CD2-CE2 4.46Å; L61-F65 VanDerWaalsContact O-CD2 3.23Å; L61-F65 WeakPolarHBondContact O-CD2 3.29Å; L61-F65 PolarHBondContact O-N 3.04Å; L61-I100 HydrophobicContact CD2-CG2 3.6Å; L61-M104 HydrophobicContact CD2-SD 4.19Å; L61-M104 HydrophobicContact CG-SD 4.42Å
62	Y	85.5	Confident	83.1	Confident	177 Å²	177	72.2 Å²	72.2	69%	0.694	32%	0.324	S	S	*	.	H	α-helix	trans	-60.3	-39.3	175.7	178.5	-91.2	0	0	0	113	I58 K59 N60 H66	I58-Y62 WeakPolarHBondContact O-CB 3.45Å; I58-Y62 PolarHBondContact O-N 3.14Å; I58-Y62 VanDerWaalsContact O-N 3.1Å; K59-Y62 PolarHBondContact O-N 2.94Å; N60-Y62 VanDerWaalsContact C-N 3.31Å; N60-Y62 PolarHBondContact O-N 2.96Å; Y62-H66 PolarHBondContact O-N 2.93Å
63	E	78.2	Confident	83	Confident	32 Å²	32	67.4 Å²	67.4	15%	0.15	30%	0.303	C	S	.	.	H	α-helix	trans	-66.8	-41.1	174.2	-72.8	175.3	-148.9	0	0	111.6	Y51 K59 N60 L61 H66 R335	Y51-E63 PolarHBondContact OH-OE2 2.93Å; K59-E63 WeakPolarHBondContact CE-OE1 3.27Å; K59-E63 IonicContact NZ-OE1 2.65Å; K59-E63 PolarHBondContact NZ-OE1 2.9Å; K59-E63 WeakPolarHBondContact O-CG 3.23Å; K59-E63 PolarHBondContact O-N 3.35Å; N60-E63 CarbonylContact O-C 3.6Å; N60-E63 WeakPolarHBondContact O-CA 3.11Å; N60-E63 WeakPolarHBondContact O-CB 3.43Å; N60-E63 PolarHBondContact O-N 2.88Å; L61-E63 VanDerWaalsContact C-N 3.32Å; L61-E63 PolarHBondContact O-N 3.26Å; E63-H66 VanDerWaalsContact O-CB 3.22Å; E63-H66 WeakPolarHBondContact O-CB 3.04Å; E63-H66 PolarHBondContact O-N 2.97Å; E63-R335 IonicContact OE2-CZ 3.39Å; E63-R335 IonicContact OE2-NH1 3.1Å; E63-R335 PolarHBondContact OE2-NH1 3.35Å
64	Q	81.2	Confident	82.9	Confident	21 Å²	21	59.8 Å²	59.8	10%	0.098	28%	0.279	C	S	.	.	H	α-helix	trans	-66.6	-37.2	176.9	-67	-172	26.8	0	0	113.4	N60 L61 H66 N67 N70 T103	N60-Q64 WeakPolarHBondContact O-CG 3.46Å; N60-Q64 PolarHBondContact O-N 3.48Å; N60-Q64 PolarHBondContact OD1-NE2 3.33Å; L61-Q64 PolarHBondContact O-N 2.94Å; Q64-H66 PolarHBondContact O-N 3.42Å; Q64-N67 WeakPolarHBondContact O-CB 3.48Å; Q64-N67 PolarHBondContact O-N 3.19Å; Q64-N67 VanDerWaalsContact O-N 3.12Å; Q64-N70 PolarHBondContact O-ND2 3.43Å; Q64-T103 PolarHBondContact NE2-OG1 2.67Å; Q64-T103 PolarHBondContact OE1-OG1 2.88Å; Q64-T103 VanDerWaalsContact OE1-OG1 3.12Å
65	F	82.4	Confident	82.7	Confident	67 Å²	67	58 Å²	58	29%	0.294	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-3.2	175.7	-80.7	-70.1	0	0	0	113.8	L61 N67 N70 L74 I100	L61-F65 HydrophobicContact CD2-CE2 4.46Å; L61-F65 VanDerWaalsContact O-CD2 3.23Å; L61-F65 WeakPolarHBondContact O-CD2 3.29Å; L61-F65 PolarHBondContact O-N 3.04Å; F65-N67 PolarHBondContact O-N 2.98Å; F65-N70 HydrophobicContact CD1-CB 4Å; F65-N70 HydrophobicContact CE1-CB 4.15Å; F65-N70 WeakPolarHBondContact CE1-O 3.46Å; F65-L74 HydrophobicContact CE1-CB 4.1Å; F65-L74 HydrophobicContact CE1-CD1 3.67Å; F65-L74 HydrophobicContact CZ-CD1 3.7Å; F65-I100 HydrophobicContact CZ-CD1 4.47Å
66	H	77.5	Confident	82.4	Confident	114 Å²	114	56.3 Å²	56.3	53%	0.528	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-13.4	165.1	-162.7	-71.7	0	0	0	112.2	Y62 E63 Q64	Y62-H66 PolarHBondContact O-N 2.93Å; E63-H66 VanDerWaalsContact O-CB 3.22Å; E63-H66 WeakPolarHBondContact O-CB 3.04Å; E63-H66 PolarHBondContact O-N 2.97Å; Q64-H66 PolarHBondContact O-N 3.42Å
67	N	73.1	Confident	82.1	Confident	35 Å²	35	56.5 Å²	56.5	19%	0.187	27%	0.272	C	S	.	.	S	Bend	trans	-83.5	121.7	167.5	-170.6	-31.6	0	0	0	110.2	Q64 F65 A69 N70 N345 I410	Q64-N67 WeakPolarHBondContact O-CB 3.48Å; Q64-N67 PolarHBondContact O-N 3.19Å; Q64-N67 VanDerWaalsContact O-N 3.12Å; F65-N67 PolarHBondContact O-N 2.98Å; N67-A69 PolarHBondContact O-N 3.41Å; N67-A69 WeakPolarHBondContact OD1-CB 3.33Å; N67-A69 PolarHBondContact OD1-N 2.9Å; N67-A69 VanDerWaalsContact OD1-N 3.08Å; N67-N70 PolarHBondContact O-N 3.07Å; N67-N70 VanDerWaalsContact O-N 3.11Å; N67-N345 PolarHBondContact OD1-OD1 3.49Å; N67-I410 WeakPolarHBondContact ND2-CD1 3.42Å
68	I	80.2	Confident	81.9	Confident	56 Å²	56	55.5 Å²	55.5	29%	0.287	27%	0.27	S	S	.	.	H	α-helix	trans	-60.8	-30.4	-174.9	-53.7	-176.6	0	0	0	111.6	N70 L71 Y72 N345 M352	I68-N70 PolarHBondContact O-N 2.94Å; I68-L71 PolarHBondContact O-N 3.43Å; I68-Y72 WeakPolarHBondContact O-CB 3.48Å; I68-Y72 PolarHBondContact O-N 2.91Å; I68-N345 HydrophobicContact CD1-CB 3.93Å; I68-N345 HydrophobicContact CG1-CB 4.15Å; I68-M352 HydrophobicContact CG2-CE 3.96Å; I68-M352 HydrophobicContact CG2-SD 3.82Å
69	A	76.9	Confident	81.6	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-63.1	-40.1	177.3	0	0	0	0	0	112.9	N67 L71 Y72 F73 L348 I410	N67-A69 PolarHBondContact O-N 3.41Å; N67-A69 WeakPolarHBondContact OD1-CB 3.33Å; N67-A69 PolarHBondContact OD1-N 2.9Å; N67-A69 VanDerWaalsContact OD1-N 3.08Å; A69-L71 VanDerWaalsContact C-N 3.32Å; A69-L71 PolarHBondContact O-N 2.86Å; A69-Y72 WeakPolarHBondContact O-CB 3.18Å; A69-Y72 PolarHBondContact O-N 3.05Å; A69-F73 HydrophobicContact CB-CE2 4.07Å; A69-F73 WeakPolarHBondContact O-CD2 3.42Å; A69-F73 WeakPolarHBondContact O-CG 3.47Å; A69-F73 PolarHBondContact O-N 2.63Å; A69-L348 HydrophobicContact CB-CD1 4.33Å; A69-I410 HydrophobicContact CB-CD1 3.61Å
70	N	80.4	Confident	81.2	Confident	7 Å²	7	49 Å²	49	4%	0.037	24%	0.24	C	C	.	.	H	α-helix	trans	-66.9	-38	179.9	-68.3	-18.8	0	0	0	110.9	Q64 F65 N67 I68 L74	Q64-N70 PolarHBondContact O-ND2 3.43Å; F65-N70 HydrophobicContact CD1-CB 4Å; F65-N70 HydrophobicContact CE1-CB 4.15Å; F65-N70 WeakPolarHBondContact CE1-O 3.46Å; N67-N70 PolarHBondContact O-N 3.07Å; N67-N70 VanDerWaalsContact O-N 3.11Å; I68-N70 PolarHBondContact O-N 2.94Å; N70-L74 WeakPolarHBondContact O-CB 3.33Å; N70-L74 PolarHBondContact O-N 3.08Å; N70-L74 VanDerWaalsContact O-N 3.14Å
71	L	82.5	Confident	80.8	Confident	85 Å²	85	58.7 Å²	58.7	45%	0.445	28%	0.277	S	S	.	.	H	α-helix	trans	-63	-42.4	171.3	-178.2	65.6	0	0	0	111.8	I68 A69 L74 L75	I68-L71 PolarHBondContact O-N 3.43Å; A69-L71 VanDerWaalsContact C-N 3.32Å; A69-L71 PolarHBondContact O-N 2.86Å; L71-L74 PolarHBondContact O-N 2.92Å; L71-L75 HydrophobicContact CG-CD1 4.47Å; L71-L75 WeakPolarHBondContact O-CG 3.33Å; L71-L75 PolarHBondContact O-N 3.08Å
72	Y	83.4	Confident	80.6	Confident	14 Å²	14	60.9 Å²	60.9	6%	0.055	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-46.1	177	160.1	-93.2	0	0	0	113	I68 A69 L74 L75 I76 M352 M355 N402 I405	I68-Y72 WeakPolarHBondContact O-CB 3.48Å; I68-Y72 PolarHBondContact O-N 2.91Å; A69-Y72 WeakPolarHBondContact O-CB 3.18Å; A69-Y72 PolarHBondContact O-N 3.05Å; Y72-L74 VanDerWaalsContact C-N 3.29Å; Y72-L74 PolarHBondContact O-N 3.1Å; Y72-L75 WeakPolarHBondContact O-CB 3.31Å; Y72-L75 PolarHBondContact O-N 2.7Å; Y72-L75 VanDerWaalsContact O-N 3.13Å; Y72-I76 HydrophobicContact CD2-CD1 4.39Å; Y72-I76 HydrophobicContact CE1-CD1 3.85Å; Y72-I76 HydrophobicContact CE2-CD1 3.57Å; Y72-I76 HydrophobicContact CE2-CG1 4.26Å; Y72-I76 PolarHBondContact O-N 2.89Å; Y72-I76 WeakPolarHBondContact OH-CD1 3.47Å; Y72-M352 HydrophobicContact CD1-CE 4.25Å; Y72-M352 HydrophobicContact CD2-CE 4.18Å; Y72-M352 HydrophobicContact CD2-CG 3.82Å; Y72-M352 HydrophobicContact CD2-SD 4.1Å; Y72-M352 HydrophobicContact CE2-CG 4.21Å; Y72-M352 HydrophobicContact CG-CE 3.7Å; Y72-M352 HydrophobicContact CG-CG 4.27Å; Y72-M352 HydrophobicContact CG-SD 4.17Å; Y72-M355 HydrophobicContact CE2-CE 3.73Å; Y72-M355 HydrophobicContact CE2-SD 3.69Å; Y72-M355 PolarHBondContact OH-SD 3.33Å; Y72-N402 PolarHBondContact OH-O 2.81Å; Y72-N402 PolarHBondContact OH-OD1 3.4Å; Y72-I405 HydrophobicContact CD1-CD1 4.17Å; Y72-I405 HydrophobicContact CD1-CG2 4.28Å; Y72-I405 HydrophobicContact CD2-CD1 4.29Å; Y72-I405 HydrophobicContact CE1-CB 3.81Å; Y72-I405 HydrophobicContact CE1-CD1 3.83Å; Y72-I405 HydrophobicContact CE1-CG1 4.2Å; Y72-I405 HydrophobicContact CE1-CG2 4.06Å; Y72-I405 HydrophobicContact CE2-CD1 3.93Å; Y72-I405 HydrophobicContact CG-CD1 4.38Å
73	F	80.3	Confident	80	Confident	11 Å²	11	53.1 Å²	53.1	5%	0.048	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-35.7	177	-64.1	-54.5	0	0	0	111.7	A69 I76 I77 L96 I405 I407	A69-F73 HydrophobicContact CB-CE2 4.07Å; A69-F73 WeakPolarHBondContact O-CD2 3.42Å; A69-F73 WeakPolarHBondContact O-CG 3.47Å; A69-F73 PolarHBondContact O-N 2.63Å; F73-I76 PolarHBondContact O-N 2.96Å; F73-I77 WeakPolarHBondContact O-CD1 3.49Å; F73-I77 VanDerWaalsContact O-CG1 3.28Å; F73-I77 WeakPolarHBondContact O-CG1 3.46Å; F73-I77 PolarHBondContact O-N 3.05Å; F73-L96 HydrophobicContact CB-CD1 3.88Å; F73-L96 HydrophobicContact CB-CD2 3.9Å; F73-L96 HydrophobicContact CB-CG 4.45Å; F73-L96 HydrophobicContact CD2-CD1 4.01Å; F73-L96 HydrophobicContact CG-CD1 4.29Å; F73-I405 HydrophobicContact CE1-CG2 4.36Å; F73-I405 HydrophobicContact CZ-CG2 3.85Å; F73-I407 HydrophobicContact CD1-CG1 3.94Å; F73-I407 HydrophobicContact CE1-CB 4.38Å; F73-I407 HydrophobicContact CE1-CD1 4.33Å; F73-I407 HydrophobicContact CE1-CG1 3.34Å; F73-I407 HydrophobicContact CE2-CB 4.32Å; F73-I407 HydrophobicContact CE2-CG1 4.06Å; F73-I407 HydrophobicContact CE2-CG2 4.4Å; F73-I407 HydrophobicContact CZ-CB 3.98Å; F73-I407 HydrophobicContact CZ-CG1 3.43Å; F73-I407 VanDerWaalsContact CZ-CG1 3.43Å
74	L	80.2	Confident	79.5	Confident	70 Å²	70	56.3 Å²	56.3	37%	0.366	27%	0.274	S	S	.	.	H	α-helix	trans	-62.9	-42.3	171.6	-177.7	149.7	0	0	0	112.1	F65 N70 L71 Y72 I76 I77 V78	F65-L74 HydrophobicContact CE1-CB 4.1Å; F65-L74 HydrophobicContact CE1-CD1 3.67Å; F65-L74 HydrophobicContact CZ-CD1 3.7Å; N70-L74 WeakPolarHBondContact O-CB 3.33Å; N70-L74 PolarHBondContact O-N 3.08Å; N70-L74 VanDerWaalsContact O-N 3.14Å; L71-L74 PolarHBondContact O-N 2.92Å; Y72-L74 VanDerWaalsContact C-N 3.29Å; Y72-L74 PolarHBondContact O-N 3.1Å; L74-I76 VanDerWaalsContact C-N 3.33Å; L74-I76 PolarHBondContact O-N 3.05Å; L74-I77 PolarHBondContact O-N 3.22Å; L74-V78 PolarHBondContact O-N 2.73Å; L74-V78 VanDerWaalsContact O-N 3.15Å
75	L	83	Confident	78.3	Confident	101 Å²	101	64 Å²	64	53%	0.529	31%	0.31	S	S	.	.	H	α-helix	trans	-61.9	-40	175.1	-72.3	169.1	0	0	0	112	L71 Y72 V78 T79	L71-L75 HydrophobicContact CG-CD1 4.47Å; L71-L75 WeakPolarHBondContact O-CG 3.33Å; L71-L75 PolarHBondContact O-N 3.08Å; Y72-L75 WeakPolarHBondContact O-CB 3.31Å; Y72-L75 PolarHBondContact O-N 2.7Å; Y72-L75 VanDerWaalsContact O-N 3.13Å; L75-V78 WeakPolarHBondContact O-CB 3.29Å; L75-V78 PolarHBondContact O-N 2.63Å; L75-T79 PolarHBondContact O-N 2.9Å; L75-T79 VanDerWaalsContact O-N 3.11Å
76	I	82.6	Confident	77.2	Confident	7 Å²	7	62.5 Å²	62.5	4%	0.036	31%	0.306	C	S	.	.	H	α-helix	trans	-67.7	-37.2	176.6	-76.3	-173	0	0	0	112.3	Y72 F73 L74 V78 T79 Y80 F399 N402	Y72-I76 HydrophobicContact CD2-CD1 4.39Å; Y72-I76 HydrophobicContact CE1-CD1 3.85Å; Y72-I76 HydrophobicContact CE2-CD1 3.57Å; Y72-I76 HydrophobicContact CE2-CG1 4.26Å; Y72-I76 PolarHBondContact O-N 2.89Å; Y72-I76 WeakPolarHBondContact OH-CD1 3.47Å; F73-I76 PolarHBondContact O-N 2.96Å; L74-I76 VanDerWaalsContact C-N 3.33Å; L74-I76 PolarHBondContact O-N 3.05Å; I76-V78 PolarHBondContact O-N 2.88Å; I76-T79 WeakPolarHBondContact CA-OG1 3.37Å; I76-T79 PolarHBondContact O-N 3.11Å; I76-T79 PolarHBondContact O-OG1 2.73Å; I76-Y80 HydrophobicContact CG2-CD2 4.28Å; I76-Y80 HydrophobicContact CG2-CE2 3.82Å; I76-Y80 VanDerWaalsContact O-CD2 3.29Å; I76-Y80 WeakPolarHBondContact O-CD2 3.33Å; I76-Y80 PolarHBondContact O-N 3.34Å; I76-F399 HydrophobicContact CG2-CD1 4.38Å; I76-F399 HydrophobicContact CG2-CE1 4.2Å; I76-N402 HydrophobicContact CD1-CB 3.97Å; I76-N402 VanDerWaalsContact CD1-CG 3.43Å; I76-N402 WeakPolarHBondContact CD1-OD1 3.26Å
77	I	80.6	Confident	76.5	Confident	47 Å²	47	58.2 Å²	58.2	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-59	-38.2	172.7	-69.6	163.2	0	0	0	110.8	F73 L74 Y80 I93 L96	F73-I77 WeakPolarHBondContact O-CD1 3.49Å; F73-I77 VanDerWaalsContact O-CG1 3.28Å; F73-I77 WeakPolarHBondContact O-CG1 3.46Å; F73-I77 PolarHBondContact O-N 3.05Å; L74-I77 PolarHBondContact O-N 3.22Å; I77-Y80 PolarHBondContact O-N 3.47Å; I77-I93 HydrophobicContact CD1-CG1 3.9Å; I77-I93 HydrophobicContact CG1-CG1 3.82Å; I77-I93 HydrophobicContact CG2-CD1 3.9Å; I77-I93 HydrophobicContact CG2-CG1 3.93Å; I77-L96 HydrophobicContact CD1-CD2 3.48Å; I77-L96 VanDerWaalsContact CD1-CD2 3.48Å
78	V	83.3	Confident	76.3	Confident	79 Å²	79	59.4 Å²	59.4	48%	0.479	30%	0.304	S	S	.	.	H	α-helix	trans	-65.9	-37.3	173.3	176	0	0	0	0	111.9	L74 L75 I76 Y80 Y81 F82	L74-V78 PolarHBondContact O-N 2.73Å; L74-V78 VanDerWaalsContact O-N 3.15Å; L75-V78 WeakPolarHBondContact O-CB 3.29Å; L75-V78 PolarHBondContact O-N 2.63Å; I76-V78 PolarHBondContact O-N 2.88Å; V78-Y80 VanDerWaalsContact C-N 3.27Å; V78-Y80 PolarHBondContact O-N 3.41Å; V78-Y81 WeakPolarHBondContact O-CB 3.4Å; V78-Y81 PolarHBondContact O-N 2.73Å; V78-F82 HydrophobicContact CG1-CE2 4.28Å
79	T	82.3	Confident	76	Confident	29 Å²	29	59.7 Å²	59.7	18%	0.178	31%	0.308	C	S	.	.	H	α-helix	trans	-66	-24.7	178.7	58.4	0	0	0	0	114.3	L75 I76 Y81 F82 F399	L75-T79 PolarHBondContact O-N 2.9Å; L75-T79 VanDerWaalsContact O-N 3.11Å; I76-T79 WeakPolarHBondContact CA-OG1 3.37Å; I76-T79 PolarHBondContact O-N 3.11Å; I76-T79 PolarHBondContact O-OG1 2.73Å; T79-Y81 PolarHBondContact O-N 3.28Å; T79-F82 PolarHBondContact O-N 3.27Å; T79-F82 VanDerWaalsContact O-N 3.15Å; T79-F399 WeakPolarHBondContact OG1-CE1 3.4Å
80	Y	78.6	Confident	75.9	Confident	26 Å²	26	64.4 Å²	64.4	10%	0.102	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-62.8	-20.2	175.7	-85.1	-76	0	0	0	113.9	I76 I77 V78 F82 V89 T92 F399	I76-Y80 HydrophobicContact CG2-CD2 4.28Å; I76-Y80 HydrophobicContact CG2-CE2 3.82Å; I76-Y80 VanDerWaalsContact O-CD2 3.29Å; I76-Y80 WeakPolarHBondContact O-CD2 3.33Å; I76-Y80 PolarHBondContact O-N 3.34Å; I77-Y80 PolarHBondContact O-N 3.47Å; V78-Y80 VanDerWaalsContact C-N 3.27Å; V78-Y80 PolarHBondContact O-N 3.41Å; Y80-F82 VanDerWaalsContact C-N 3.26Å; Y80-F82 PolarHBondContact O-N 3.25Å; Y80-V89 HydrophobicContact CD1-CG2 4Å; Y80-V89 HydrophobicContact CG-CG1 4.28Å; Y80-V89 HydrophobicContact CG-CG2 4.15Å; Y80-T92 HydrophobicContact CE2-CG2 3.76Å; Y80-T92 WeakPolarHBondContact CE2-OG1 3.34Å; Y80-T92 VanDerWaalsContact OH-CG2 3.27Å; Y80-T92 WeakPolarHBondContact OH-CG2 3.29Å; Y80-F399 HydrophobicContact CD1-CD1 4.44Å; Y80-F399 AromaticContact CD1-CE1 3.83Å; Y80-F399 HydrophobicContact CD1-CE1 3.83Å; Y80-F399 HydrophobicContact CD1-CE2 4.1Å; Y80-F399 AromaticContact CD1-CZ 3.65Å; Y80-F399 HydrophobicContact CD1-CZ 3.65Å; Y80-F399 HydrophobicContact CD2-CD1 4.35Å; Y80-F399 AromaticContact CD2-CE1 3.57Å; Y80-F399 HydrophobicContact CD2-CE1 3.57Å; Y80-F399 HydrophobicContact CD2-CZ 4.06Å; Y80-F399 AromaticContact CE1-CD1 3.84Å; Y80-F399 HydrophobicContact CE1-CD1 3.84Å; Y80-F399 HydrophobicContact CE1-CD2 4.27Å; Y80-F399 AromaticContact CE1-CE1 3.68Å; Y80-F399 HydrophobicContact CE1-CE1 3.68Å; Y80-F399 HydrophobicContact CE1-CE2 4.11Å; Y80-F399 HydrophobicContact CE1-CG 4.15Å; Y80-F399 AromaticContact CE1-CZ 3.84Å; Y80-F399 HydrophobicContact CE1-CZ 3.84Å; Y80-F399 AromaticContact CE2-CD1 3.72Å; Y80-F399 HydrophobicContact CE2-CD1 3.72Å; Y80-F399 AromaticContact CE2-CE1 3.4Å; Y80-F399 HydrophobicContact CE2-CE1 3.4Å; Y80-F399 VanDerWaalsContact CE2-CE1 3.4Å; Y80-F399 HydrophobicContact CE2-CZ 4.22Å; Y80-F399 AromaticContact CG-CE1 3.77Å; Y80-F399 HydrophobicContact CG-CE1 3.77Å; Y80-F399 AromaticContact CG-CZ 3.76Å; Y80-F399 HydrophobicContact CG-CZ 3.76Å; Y80-F399 AromaticContact CZ-CD1 3.42Å; Y80-F399 VanDerWaalsContact CZ-CD1 3.42Å; Y80-F399 AromaticContact CZ-CE1 3.45Å; Y80-F399 VanDerWaalsContact CZ-CE1 3.45Å; Y80-F399 WeakPolarHBondContact OH-CD1 3.49Å
81	Y	79.9	Confident	75.4	Confident	203 Å²	203	65.4 Å²	65.4	80%	0.796	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-71.8	-18.3	176.7	-172	-102.4	0	0	0	113.5	V78 T79	V78-Y81 WeakPolarHBondContact O-CB 3.4Å; V78-Y81 PolarHBondContact O-N 2.73Å; T79-Y81 PolarHBondContact O-N 3.28Å
82	F	80.5	Confident	74.8	Confident	96 Å²	96	61.9 Å²	61.9	42%	0.421	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-103.3	2.4	-171.7	-63.2	-79.6	0	0	0	114.7	V78 T79 Y80 W388 I395	V78-F82 HydrophobicContact CG1-CE2 4.28Å; T79-F82 PolarHBondContact O-N 3.27Å; T79-F82 VanDerWaalsContact O-N 3.15Å; Y80-F82 VanDerWaalsContact C-N 3.26Å; Y80-F82 PolarHBondContact O-N 3.25Å; F82-W388 AromaticContact CD1-CH2 3.99Å; F82-W388 HydrophobicContact CD1-CH2 3.99Å; F82-W388 HydrophobicContact CD1-CZ2 4.36Å; F82-I395 HydrophobicContact CB-CD1 4.16Å
83	V	73	Confident	74.6	Confident	14 Å²	14	64.1 Å²	64.1	9%	0.085	34%	0.337	C	S	.	.	S	Bend	trans	-141.9	126.8	-171.6	171.8	0	0	0	0	112.4	V86 I395 R396 F399	V83-V86 HydrophobicContact CG1-CG2 4.41Å; V83-I395 HydrophobicContact CB-CG2 4.38Å; V83-I395 HydrophobicContact CG2-CB 3.62Å; V83-I395 HydrophobicContact CG2-CD1 4.3Å; V83-I395 HydrophobicContact CG2-CG2 3.43Å; V83-I395 VanDerWaalsContact CG2-CG2 3.43Å; V83-R396 HydrophobicContact CG1-CG 3.52Å; V83-F399 HydrophobicContact CB-CE2 3.98Å; V83-F399 HydrophobicContact CG1-CE2 4.06Å; V83-F399 HydrophobicContact CG2-CE2 4.34Å
84	D	67.8	Low	74.5	Confident	100 Å²	100	68.6 Å²	68.6	54%	0.535	36%	0.36	S	S	.	.			trans	-76.1	125.1	174.2	-51.1	-63.3	0	0	0	112.2	V86 R396	D84-V86 PolarHBondContact O-N 2.82Å; D84-R396 PolarHBondContact O-NH2 3.23Å
85	H	56.5	Low	74.3	Confident	183 Å²	183	66.6 Å²	66.6	85%	0.847	35%	0.35	S	S	*	.	S	Bend	trans	51.7	47.3	152.6	-62.5	-62.5	0	0	0	120.5
86	V	59.3	Low	74	Confident	34 Å²	34	62.3 Å²	62.3	21%	0.206	33%	0.328	C	S	.	.	S	Bend	trans	-91.7	-18.2	160.7	-176.9	0	0	0	0	112.8	V83 D84 R396	V83-V86 HydrophobicContact CG1-CG2 4.41Å; D84-V86 PolarHBondContact O-N 2.82Å; V86-R396 HydrophobicContact CG2-CB 4.23Å; V86-R396 HydrophobicContact CG2-CG 3.7Å
87	G	62.5	Low	74.1	Confident	24 Å²	24	65.7 Å²	65.7	25%	0.247	35%	0.349	C	S	.	.	S	Bend	trans	-172	170.3	176	0	0	0	0	0	112.1
88	S	69	Low	74.2	Confident	61 Å²	61	67.2 Å²	67.2	43%	0.427	36%	0.357	S	S	.	.			trans	-83	128.2	178.7	49.1	0	0	0	0	111.8	T90 V91	S88-T90 PolarHBondContact O-N 2.84Å; S88-V91 WeakPolarHBondContact O-CB 3.29Å; S88-V91 PolarHBondContact O-N 3.16Å; S88-V91 WeakPolarHBondContact OG-CG2 3.07Å
89	V	72.8	Confident	73.9	Confident	61 Å²	61	63.6 Å²	63.6	37%	0.37	34%	0.335	S	S	.	.	H	α-helix	trans	-59.6	-33.9	-179.5	-171.2	0	0	0	0	112	Y80 V91 T92 I93	Y80-V89 HydrophobicContact CD1-CG2 4Å; Y80-V89 HydrophobicContact CG-CG1 4.28Å; Y80-V89 HydrophobicContact CG-CG2 4.15Å; V89-V91 PolarHBondContact O-N 2.72Å; V89-T92 PolarHBondContact O-N 2.66Å; V89-T92 PolarHBondContact O-OG1 2.76Å; V89-I93 HydrophobicContact CG1-CD1 3.61Å; V89-I93 HydrophobicContact CG1-CG1 4.12Å; V89-I93 PolarHBondContact O-N 3.07Å; V89-I93 VanDerWaalsContact O-N 3.14Å
90	T	75.5	Confident	73.9	Confident	101 Å²	101	63.4 Å²	63.4	62%	0.62	33%	0.332	S	S	*	.	H	α-helix	trans	-53.6	-35.3	174.9	-42.1	0	0	0	0	112.5	S88 T92 M94	S88-T90 PolarHBondContact O-N 2.84Å; T90-T92 PolarHBondContact O-N 3.13Å; T90-M94 WeakPolarHBondContact O-CB 3.34Å; T90-M94 PolarHBondContact O-N 3.05Å
91	V	69.6	Low	74.3	Confident	28 Å²	28	64.7 Å²	64.7	17%	0.17	35%	0.345	C	S	.	.	H	α-helix	trans	-70.9	-28.5	-174.4	152.4	0	0	0	0	113.2	S88 V89 P95 T1139 I1143	S88-V91 WeakPolarHBondContact O-CB 3.29Å; S88-V91 PolarHBondContact O-N 3.16Å; S88-V91 WeakPolarHBondContact OG-CG2 3.07Å; V89-V91 PolarHBondContact O-N 2.72Å; V91-P95 WeakPolarHBondContact O-CD 3.34Å; V91-P95 VanDerWaalsContact O-CG 3.28Å; V91-P95 WeakPolarHBondContact O-CG 3.48Å; V91-T1139 HydrophobicContact CG1-CG2 4.49Å; V91-I1143 HydrophobicContact CB-CD1 3.9Å; V91-I1143 HydrophobicContact CG1-CD1 3.35Å; V91-I1143 HydrophobicContact CG1-CG1 3.51Å; V91-I1143 HydrophobicContact CG2-CD1 3.47Å; V91-I1143 VanDerWaalsContact CG2-CD1 3.47Å
92	T	70.7	Confident	74.5	Confident	10 Å²	10	59 Å²	59	6%	0.061	33%	0.328	C	S	.	.	H	α-helix	trans	-93.4	-34.8	174.7	49	0	0	0	0	113	Y80 V89 T90	Y80-T92 HydrophobicContact CE2-CG2 3.76Å; Y80-T92 WeakPolarHBondContact CE2-OG1 3.34Å; Y80-T92 VanDerWaalsContact OH-CG2 3.27Å; Y80-T92 WeakPolarHBondContact OH-CG2 3.29Å; V89-T92 PolarHBondContact O-N 2.66Å; V89-T92 PolarHBondContact O-OG1 2.76Å; T90-T92 PolarHBondContact O-N 3.13Å
93	I	78.6	Confident	74.5	Confident	62 Å²	62	54.9 Å²	54.9	32%	0.318	31%	0.31	S	S	.	.	H	α-helix	trans	-67.6	-47.4	177.6	-67.2	-178.4	0	0	0	111.1	I77 V89 L96 V97	I77-I93 HydrophobicContact CD1-CG1 3.9Å; I77-I93 HydrophobicContact CG1-CG1 3.82Å; I77-I93 HydrophobicContact CG2-CD1 3.9Å; I77-I93 HydrophobicContact CG2-CG1 3.93Å; V89-I93 HydrophobicContact CG1-CD1 3.61Å; V89-I93 HydrophobicContact CG1-CG1 4.12Å; V89-I93 PolarHBondContact O-N 3.07Å; V89-I93 VanDerWaalsContact O-N 3.14Å; I93-L96 WeakPolarHBondContact O-CB 3.11Å; I93-L96 PolarHBondContact O-N 2.58Å; I93-L96 VanDerWaalsContact O-N 3.1Å; I93-V97 HydrophobicContact CG2-CG2 3.77Å; I93-V97 WeakPolarHBondContact O-CG2 3.1Å; I93-V97 PolarHBondContact O-N 2.91Å
94	M	79.2	Confident	75.2	Confident	105 Å²	105	55.8 Å²	55.8	52%	0.517	31%	0.314	S	S	.	.	H	α-helix	trans	-64.5	-42.7	-167	-165.4	-84.4	-168.4	0	0	113.6	T90 L96 V97 I98	T90-M94 WeakPolarHBondContact O-CB 3.34Å; T90-M94 PolarHBondContact O-N 3.05Å; M94-L96 VanDerWaalsContact C-N 3.32Å; M94-L96 PolarHBondContact O-N 2.86Å; M94-V97 PolarHBondContact O-N 3.46Å; M94-I98 HydrophobicContact CE-CD1 3.54Å; M94-I98 HydrophobicContact CE-CG1 4.26Å; M94-I98 PolarHBondContact O-N 2.92Å; M94-I98 HydrophobicContact SD-CD1 3.45Å; M94-I98 WeakPolarHBondContact SD-CD1 3.39Å; M94-I98 HydrophobicContact SD-CG1 4.01Å
95	P	74.1	Confident	76.2	Confident	27 Å²	27	56.3 Å²	56.3	18%	0.175	32%	0.316	C	S	.	.	H	α-helix	trans	-61.4	-35.9	171.9	-24.6	35.9	0	0	0	113.7	V91 L99 I407	V91-P95 WeakPolarHBondContact O-CD 3.34Å; V91-P95 VanDerWaalsContact O-CG 3.28Å; V91-P95 WeakPolarHBondContact O-CG 3.48Å; P95-L99 VanDerWaalsContact O-CB 3.22Å; P95-L99 WeakPolarHBondContact O-CB 3.18Å; P95-L99 PolarHBondContact O-N 3.17Å; P95-I407 HydrophobicContact CB-CD1 4.49Å; P95-I407 HydrophobicContact CB-CG2 4.36Å
96	L	77.8	Confident	77.4	Confident	11 Å²	11	48.7 Å²	48.7	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-68.9	-41.6	176.9	-175	70.1	0	0	0	111.5	F73 I77 I93 M94 L99 I100	F73-L96 HydrophobicContact CB-CD1 3.88Å; F73-L96 HydrophobicContact CB-CD2 3.9Å; F73-L96 HydrophobicContact CB-CG 4.45Å; F73-L96 HydrophobicContact CD2-CD1 4.01Å; F73-L96 HydrophobicContact CG-CD1 4.29Å; I77-L96 HydrophobicContact CD1-CD2 3.48Å; I77-L96 VanDerWaalsContact CD1-CD2 3.48Å; I93-L96 WeakPolarHBondContact O-CB 3.11Å; I93-L96 PolarHBondContact O-N 2.58Å; I93-L96 VanDerWaalsContact O-N 3.1Å; M94-L96 VanDerWaalsContact C-N 3.32Å; M94-L96 PolarHBondContact O-N 2.86Å; L96-L99 HydrophobicContact CD1-CD2 4.41Å; L96-L99 WeakPolarHBondContact O-CB 3.32Å; L96-L99 PolarHBondContact O-N 3.28Å; L96-I100 HydrophobicContact CD1-CD1 4.29Å; L96-I100 HydrophobicContact CG-CD1 3.99Å; L96-I100 WeakPolarHBondContact O-CB 3.33Å; L96-I100 WeakPolarHBondContact O-CG1 3.09Å; L96-I100 PolarHBondContact O-N 3.45Å
97	V	83.6	Confident	78.5	Confident	79 Å²	79	47.6 Å²	47.6	48%	0.479	27%	0.273	S	S	.	.	H	α-helix	trans	-64.9	-42	176.8	172.9	0	0	0	0	111	I93 M94 S101	I93-V97 HydrophobicContact CG2-CG2 3.77Å; I93-V97 WeakPolarHBondContact O-CG2 3.1Å; I93-V97 PolarHBondContact O-N 2.91Å; M94-V97 PolarHBondContact O-N 3.46Å; V97-S101 VanDerWaalsContact O-CB 3.31Å; V97-S101 WeakPolarHBondContact O-CB 3.41Å; V97-S101 PolarHBondContact O-N 3.07Å; V97-S101 PolarHBondContact O-OG 3.15Å
98	I	82.7	Confident	79.6	Confident	78 Å²	78	47.1 Å²	47.1	40%	0.4	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-48.5	172	-74.7	-175.3	0	0	0	110.8	M94 I100 S101 I102	M94-I98 HydrophobicContact CE-CD1 3.54Å; M94-I98 HydrophobicContact CE-CG1 4.26Å; M94-I98 PolarHBondContact O-N 2.92Å; M94-I98 HydrophobicContact SD-CD1 3.45Å; M94-I98 WeakPolarHBondContact SD-CD1 3.39Å; M94-I98 HydrophobicContact SD-CG1 4.01Å; I98-I100 PolarHBondContact O-N 3.26Å; I98-S101 PolarHBondContact O-N 3.11Å; I98-S101 VanDerWaalsContact O-N 3.13Å; I98-I102 HydrophobicContact CG2-CD1 3.59Å; I98-I102 HydrophobicContact CG2-CG1 4.25Å; I98-I102 WeakPolarHBondContact O-CG1 3.36Å; I98-I102 PolarHBondContact O-N 3.45Å
99	L	77.2	Confident	80.4	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-55.1	-51.3	180	174.2	153.6	0	0	0	111.6	P95 L96 S101 I102 T103 I407 V411	P95-L99 VanDerWaalsContact O-CB 3.22Å; P95-L99 WeakPolarHBondContact O-CB 3.18Å; P95-L99 PolarHBondContact O-N 3.17Å; L96-L99 HydrophobicContact CD1-CD2 4.41Å; L96-L99 WeakPolarHBondContact O-CB 3.32Å; L96-L99 PolarHBondContact O-N 3.28Å; L99-S101 VanDerWaalsContact C-N 3.31Å; L99-S101 PolarHBondContact O-N 2.7Å; L99-I102 PolarHBondContact O-N 3.12Å; L99-T103 WeakPolarHBondContact O-CG2 3.4Å; L99-T103 PolarHBondContact O-N 3.24Å; L99-T103 PolarHBondContact O-OG1 2.56Å; L99-T103 VanDerWaalsContact O-OG1 3.05Å; L99-I407 HydrophobicContact CD1-CG2 3.94Å; L99-I407 WeakPolarHBondContact CD1-O 3.14Å; L99-V411 HydrophobicContact CB-CG2 3.95Å; L99-V411 HydrophobicContact CD1-CG2 3.59Å; L99-V411 HydrophobicContact CG-CG2 3.42Å; L99-V411 VanDerWaalsContact CG-CG2 3.42Å
100	I	83.2	Confident	80.5	Confident	25 Å²	25	48.4 Å²	48.4	13%	0.128	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-37.6	178.2	-70	172.4	0	0	0	111	L61 F65 L96 I98 T103 M104	L61-I100 HydrophobicContact CD2-CG2 3.6Å; F65-I100 HydrophobicContact CZ-CD1 4.47Å; L96-I100 HydrophobicContact CD1-CD1 4.29Å; L96-I100 HydrophobicContact CG-CD1 3.99Å; L96-I100 WeakPolarHBondContact O-CB 3.33Å; L96-I100 WeakPolarHBondContact O-CG1 3.09Å; L96-I100 PolarHBondContact O-N 3.45Å; I98-I100 PolarHBondContact O-N 3.26Å; I100-T103 WeakPolarHBondContact CA-OG1 3.19Å; I100-T103 PolarHBondContact O-OG1 2.82Å; I100-M104 HydrophobicContact CG2-CG 4.43Å; I100-M104 HydrophobicContact CG2-SD 4.02Å; I100-M104 VanDerWaalsContact O-CB 3.31Å; I100-M104 WeakPolarHBondContact O-CB 3.34Å; I100-M104 WeakPolarHBondContact O-CG 3.38Å; I100-M104 PolarHBondContact O-N 3Å
101	S	87.1	Confident	80.8	Confident	53 Å²	53	44.5 Å²	44.5	37%	0.371	24%	0.243	S	C	.	.	H	α-helix	trans	-67.5	-43.3	178.9	-58.8	0	0	0	0	112.2	V97 I98 L99 M104 I105	V97-S101 VanDerWaalsContact O-CB 3.31Å; V97-S101 WeakPolarHBondContact O-CB 3.41Å; V97-S101 PolarHBondContact O-N 3.07Å; V97-S101 PolarHBondContact O-OG 3.15Å; I98-S101 PolarHBondContact O-N 3.11Å; I98-S101 VanDerWaalsContact O-N 3.13Å; L99-S101 VanDerWaalsContact C-N 3.31Å; L99-S101 PolarHBondContact O-N 2.7Å; S101-M104 PolarHBondContact O-N 2.73Å; S101-I105 WeakPolarHBondContact O-CD1 3.37Å; S101-I105 VanDerWaalsContact O-CG1 3.25Å; S101-I105 WeakPolarHBondContact O-CG1 3.21Å; S101-I105 PolarHBondContact O-N 3.28Å
102	I	84.4	Confident	81.5	Confident	84 Å²	84	48 Å²	48	43%	0.431	26%	0.26	S	S	.	.	H	α-helix	trans	-63.3	-46.5	178.4	-69.3	170.5	0	0	0	110.7	I98 L99 I105 K106	I98-I102 HydrophobicContact CG2-CD1 3.59Å; I98-I102 HydrophobicContact CG2-CG1 4.25Å; I98-I102 WeakPolarHBondContact O-CG1 3.36Å; I98-I102 PolarHBondContact O-N 3.45Å; L99-I102 PolarHBondContact O-N 3.12Å; I102-I105 PolarHBondContact O-N 3.24Å; I102-K106 PolarHBondContact O-N 2.74Å
103	T	80.7	Confident	82	Confident	9 Å²	9	52.6 Å²	52.6	6%	0.055	28%	0.283	C	S	.	.	H	α-helix	trans	-67.3	-36.6	178.7	52.6	0	0	0	0	111.8	Q64 L99 I100 D107	Q64-T103 PolarHBondContact NE2-OG1 2.67Å; Q64-T103 PolarHBondContact OE1-OG1 2.88Å; Q64-T103 VanDerWaalsContact OE1-OG1 3.12Å; L99-T103 WeakPolarHBondContact O-CG2 3.4Å; L99-T103 PolarHBondContact O-N 3.24Å; L99-T103 PolarHBondContact O-OG1 2.56Å; L99-T103 VanDerWaalsContact O-OG1 3.05Å; I100-T103 WeakPolarHBondContact CA-OG1 3.19Å; I100-T103 PolarHBondContact O-OG1 2.82Å; T103-D107 PolarHBondContact O-N 3.38Å; T103-D107 VanDerWaalsContact O-N 3.09Å
104	M	86.7	Confident	81.8	Confident	32 Å²	32	53.7 Å²	53.7	16%	0.158	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-49.6	169.9	-77.8	-178.5	64.1	0	0	111.8	F56 I57 L61 I100 S101 K106 D107 G108	F56-M104 HydrophobicContact CD1-CE 4.44Å; F56-M104 HydrophobicContact CE1-CE 3.99Å; F56-M104 WeakPolarHBondContact CZ-O 3.42Å; I57-M104 HydrophobicContact CB-CE 4.24Å; I57-M104 HydrophobicContact CG1-CE 3.93Å; I57-M104 HydrophobicContact CG2-CE 4.1Å; L61-M104 HydrophobicContact CD2-SD 4.19Å; L61-M104 HydrophobicContact CG-SD 4.42Å; I100-M104 HydrophobicContact CG2-CG 4.43Å; I100-M104 HydrophobicContact CG2-SD 4.02Å; I100-M104 VanDerWaalsContact O-CB 3.31Å; I100-M104 WeakPolarHBondContact O-CB 3.34Å; I100-M104 WeakPolarHBondContact O-CG 3.38Å; I100-M104 PolarHBondContact O-N 3Å; S101-M104 PolarHBondContact O-N 2.73Å; M104-K106 VanDerWaalsContact C-N 3.31Å; M104-K106 PolarHBondContact O-N 2.95Å; M104-D107 PolarHBondContact O-N 2.88Å; M104-G108 PolarHBondContact O-N 2.88Å
105	I	88.4	Confident	82	Confident	111 Å²	111	53.4 Å²	53.4	57%	0.569	28%	0.278	S	S	*	.	H	α-helix	trans	-57	-45.7	179.9	-71.2	162.2	0	0	0	110.9	S101 I102 G108 I109	S101-I105 WeakPolarHBondContact O-CD1 3.37Å; S101-I105 VanDerWaalsContact O-CG1 3.25Å; S101-I105 WeakPolarHBondContact O-CG1 3.21Å; S101-I105 PolarHBondContact O-N 3.28Å; I102-I105 PolarHBondContact O-N 3.24Å; I105-G108 PolarHBondContact O-N 2.87Å; I105-I109 HydrophobicContact CG2-CD1 4.02Å; I105-I109 WeakPolarHBondContact O-CG1 3.46Å; I105-I109 PolarHBondContact O-N 3.44Å
106	K	82.3	Confident	82.5	Confident	23 Å²	23	57.3 Å²	57.3	10%	0.1	29%	0.293	C	S	.	.	H	α-helix	trans	-56.9	-57.3	176.6	-178.4	-154.5	167.6	-172.1	0	111.9	I102 M104 G108 I109 D110 L418 S444	I102-K106 PolarHBondContact O-N 2.74Å; M104-K106 VanDerWaalsContact C-N 3.31Å; M104-K106 PolarHBondContact O-N 2.95Å; K106-G108 PolarHBondContact O-N 2.92Å; K106-I109 PolarHBondContact O-N 3.28Å; K106-D110 PolarHBondContact O-N 3.23Å; K106-D110 VanDerWaalsContact O-N 3.08Å; K106-L418 HydrophobicContact CG-CD1 4.36Å; K106-S444 WeakPolarHBondContact CE-OG 3.13Å; K106-S444 PolarHBondContact NZ-OG 3.39Å
107	D	81.5	Confident	82.3	Confident	11 Å²	11	59.3 Å²	59.3	6%	0.059	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-26.5	-179.6	-92.1	17.4	0	0	0	112	Y51 N60 T103 M104 D111 R335	Y51-D107 HydrophobicContact CE2-CB 4.34Å; Y51-D107 PolarHBondContact OH-OD2 2.94Å; Y51-D107 VanDerWaalsContact OH-OD2 3.12Å; N60-D107 VanDerWaalsContact ND2-CB 3.3Å; N60-D107 WeakPolarHBondContact ND2-CB 3.26Å; T103-D107 PolarHBondContact O-N 3.38Å; T103-D107 VanDerWaalsContact O-N 3.09Å; M104-D107 PolarHBondContact O-N 2.88Å; D107-D111 PolarHBondContact O-N 3.35Å; D107-R335 IonicContact OD1-CZ 2.66Å; D107-R335 IonicContact OD1-NH1 3.95Å; D107-R335 IonicContact OD1-NH2 3.56Å; D107-R335 PolarHBondContact OD1-NH2 2.81Å; D107-R335 IonicContact OD2-CZ 3.15Å; D107-R335 IonicContact OD2-NH1 2.69Å; D107-R335 PolarHBondContact OD2-NH1 3.18Å; D107-R335 IonicContact OD2-NH2 2.77Å; D107-R335 PolarHBondContact OD2-NH2 2.95Å
108	G	86	Confident	82.3	Confident	14 Å²	14	55.7 Å²	55.7	14%	0.144	29%	0.286	C	S	.	.	H	α-helix	trans	-70.5	-40.7	172.4	0	0	0	0	0	113.7	M104 I105 K106 D111 L112	M104-G108 PolarHBondContact O-N 2.88Å; I105-G108 PolarHBondContact O-N 2.87Å; K106-G108 PolarHBondContact O-N 2.92Å; G108-D111 PolarHBondContact O-N 2.99Å; G108-L112 WeakPolarHBondContact O-CG 3.49Å; G108-L112 PolarHBondContact O-N 3.1Å
109	I	86.2	Confident	82.5	Confident	90 Å²	90	57.9 Å²	57.9	46%	0.462	29%	0.293	S	S	.	.	H	α-helix	trans	-64.2	-45.8	174.9	-66.7	164	0	0	0	110.3	I105 K106 D111 L112 L113	I105-I109 HydrophobicContact CG2-CD1 4.02Å; I105-I109 WeakPolarHBondContact O-CG1 3.46Å; I105-I109 PolarHBondContact O-N 3.44Å; K106-I109 PolarHBondContact O-N 3.28Å; I109-D111 VanDerWaalsContact C-N 3.27Å; I109-D111 PolarHBondContact O-N 2.93Å; I109-L112 PolarHBondContact O-N 3.12Å; I109-L113 HydrophobicContact CG2-CD1 4.32Å; I109-L113 WeakPolarHBondContact O-CG 3.34Å; I109-L113 PolarHBondContact O-N 2.93Å
110	D	74.1	Confident	82.8	Confident	59 Å²	59	64.2 Å²	64.2	32%	0.316	32%	0.322	S	S	.	.	H	α-helix	trans	-59.5	-36.5	178.7	-75.2	-12.8	0	0	0	112	K106 R114	K106-D110 PolarHBondContact O-N 3.23Å; K106-D110 VanDerWaalsContact O-N 3.08Å; D110-R114 WeakPolarHBondContact O-CG 3.21Å; D110-R114 PolarHBondContact O-N 2.94Å
111	D	81.9	Confident	82.7	Confident	20 Å²	20	66 Å²	66	11%	0.107	33%	0.331	C	S	.	.	H	α-helix	trans	-78.9	-31.3	177.9	-147.7	45.7	0	0	0	113.2	T49 H50 Y51 D107 G108 I109 R114 Y115	T49-D111 WeakPolarHBondContact CA-OD1 3.25Å; T49-D111 VanDerWaalsContact CB-OD1 3.28Å; T49-D111 WeakPolarHBondContact CB-OD1 3.47Å; H50-D111 PolarHBondContact N-OD1 3.43Å; Y51-D111 WeakPolarHBondContact CA-OD2 3.45Å; Y51-D111 WeakPolarHBondContact CB-OD2 3.31Å; Y51-D111 HydrophobicContact CD2-CB 4.06Å; Y51-D111 PolarHBondContact N-OD2 3.26Å; Y51-D111 VanDerWaalsContact N-OD2 3.12Å; D107-D111 PolarHBondContact O-N 3.35Å; G108-D111 PolarHBondContact O-N 2.99Å; I109-D111 VanDerWaalsContact C-N 3.27Å; I109-D111 PolarHBondContact O-N 2.93Å; D111-R114 PolarHBondContact O-N 3.08Å; D111-Y115 PolarHBondContact O-N 3.08Å
112	L	84.1	Confident	82.7	Confident	100 Å²	100	64.1 Å²	64.1	52%	0.524	32%	0.317	S	S	.	.	H	α-helix	trans	-64.1	-43	171.8	-78	169.7	0	0	0	111.7	G108 I109 R114 Y115 H116	G108-L112 WeakPolarHBondContact O-CG 3.49Å; G108-L112 PolarHBondContact O-N 3.1Å; I109-L112 PolarHBondContact O-N 3.12Å; L112-R114 VanDerWaalsContact C-N 3.32Å; L112-R114 PolarHBondContact O-N 3.43Å; L112-Y115 WeakPolarHBondContact O-CB 3.43Å; L112-Y115 PolarHBondContact O-N 3.15Å; L112-Y115 VanDerWaalsContact O-N 3.16Å; L112-H116 PolarHBondContact O-CD2 3.11Å; L112-H116 PolarHBondContact O-N 3.06Å
113	L	81.2	Confident	82.9	Confident	107 Å²	107	63 Å²	63	56%	0.56	32%	0.317	S	S	*	.	H	α-helix	trans	-59.8	-42.8	176.6	-69.5	173.2	0	0	0	111.4	I109 H116 S117	I109-L113 HydrophobicContact CG2-CD1 4.32Å; I109-L113 WeakPolarHBondContact O-CG 3.34Å; I109-L113 PolarHBondContact O-N 2.93Å; L113-H116 PolarHBondContact O-N 3.48Å; L113-S117 PolarHBondContact O-N 3.21Å; L113-S117 PolarHBondContact O-OG 3.28Å
114	R	75.4	Confident	83.1	Confident	86 Å²	86	67 Å²	67	33%	0.325	34%	0.336	S	S	.	.	H	α-helix	trans	-61.6	-43.3	173.2	-67.2	171	-176.9	-144.4	7.5	112.4	S48 T49 H50 D110 D111 L112 H116 S117 D118	S48-R114 PolarHBondContact O-NH1 2.97Å; T49-R114 HydrophobicContact CG2-CB 4.28Å; H50-R114 PolarHBondContact CD2-NH1 3.41Å; D110-R114 WeakPolarHBondContact O-CG 3.21Å; D110-R114 PolarHBondContact O-N 2.94Å; D111-R114 PolarHBondContact O-N 3.08Å; L112-R114 VanDerWaalsContact C-N 3.32Å; L112-R114 PolarHBondContact O-N 3.43Å; R114-H116 VanDerWaalsContact C-N 3.29Å; R114-H116 PolarHBondContact O-N 3.49Å; R114-S117 PolarHBondContact O-N 2.92Å; R114-D118 PolarHBondContact O-N 2.8Å
115	Y	83	Confident	83.2	Confident	99 Å²	99	72 Å²	72	39%	0.388	36%	0.357	S	S	.	.	H	α-helix	trans	-60	-37.9	176.1	174.7	-107.3	0	0	0	112.5	D111 L112 D118 K119	D111-Y115 PolarHBondContact O-N 3.08Å; L112-Y115 WeakPolarHBondContact O-CB 3.43Å; L112-Y115 PolarHBondContact O-N 3.15Å; L112-Y115 VanDerWaalsContact O-N 3.16Å; Y115-D118 PolarHBondContact O-N 2.84Å; Y115-K119 WeakPolarHBondContact O-CB 3.31Å; Y115-K119 PolarHBondContact O-N 3.01Å
116	H	85.5	Confident	83.2	Confident	109 Å²	109	67 Å²	67	51%	0.505	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-43.7	173.9	-77.8	-73.5	0	0	0	112.3	L112 L113 R114 K119 Q120	L112-H116 PolarHBondContact O-CD2 3.11Å; L112-H116 PolarHBondContact O-N 3.06Å; L113-H116 PolarHBondContact O-N 3.48Å; R114-H116 VanDerWaalsContact C-N 3.29Å; R114-H116 PolarHBondContact O-N 3.49Å; H116-K119 PolarHBondContact O-N 3.07Å; H116-Q120 PolarHBondContact O-N 2.93Å
117	S	73.8	Confident	83.5	Confident	52 Å²	52	66 Å²	66	36%	0.364	33%	0.327	S	S	.	.	H	α-helix	trans	-63.8	-41.5	174.2	-57.1	0	0	0	0	112.8	L113 R114 K119 Q120 L121	L113-S117 PolarHBondContact O-N 3.21Å; L113-S117 PolarHBondContact O-OG 3.28Å; R114-S117 PolarHBondContact O-N 2.92Å; S117-K119 VanDerWaalsContact C-N 3.34Å; S117-K119 PolarHBondContact O-N 2.86Å; S117-Q120 PolarHBondContact O-N 3.2Å; S117-L121 PolarHBondContact O-N 3.36Å
118	D	82	Confident	83.9	Confident	4 Å²	4	66 Å²	66	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-62.7	-40.9	174.4	-75.9	-16.7	0	0	0	111.2	C47 S48 R114 Y115 Q120 L121 N122	C47-D118 VanDerWaalsContact CA-OD2 3.31Å; C47-D118 WeakPolarHBondContact CA-OD2 3.44Å; S48-D118 WeakPolarHBondContact CB-OD1 3.39Å; S48-D118 PolarHBondContact N-OD1 3.24Å; S48-D118 PolarHBondContact N-OD2 3.38Å; S48-D118 PolarHBondContact OG-OD1 3.23Å; S48-D118 PolarHBondContact OG-OD2 2.68Å; R114-D118 PolarHBondContact O-N 2.8Å; Y115-D118 PolarHBondContact O-N 2.84Å; D118-Q120 VanDerWaalsContact C-N 3.31Å; D118-Q120 PolarHBondContact O-N 3.41Å; D118-L121 PolarHBondContact O-N 2.68Å; D118-N122 VanDerWaalsContact O-CB 3.28Å; D118-N122 WeakPolarHBondContact O-CB 3.08Å; D118-N122 VanDerWaalsContact O-CG 3.29Å; D118-N122 PolarHBondContact O-N 2.88Å; D118-N122 PolarHBondContact O-ND2 3.05Å
119	K	86.9	Confident	83.8	Confident	124 Å²	124	65.7 Å²	65.7	54%	0.539	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-40.9	179.8	-173.4	-178.6	179.2	-173.9	0	111.3	Y115 H116 S117 S123	Y115-K119 WeakPolarHBondContact O-CB 3.31Å; Y115-K119 PolarHBondContact O-N 3.01Å; H116-K119 PolarHBondContact O-N 3.07Å; S117-K119 VanDerWaalsContact C-N 3.34Å; S117-K119 PolarHBondContact O-N 2.86Å; K119-S123 VanDerWaalsContact O-CB 3.24Å; K119-S123 WeakPolarHBondContact O-CB 3.16Å; K119-S123 PolarHBondContact O-N 2.85Å; K119-S123 VanDerWaalsContact O-N 3.11Å; K119-S123 PolarHBondContact O-OG 3.04Å
120	Q	85	Confident	83.7	Confident	137 Å²	137	64 Å²	64	64%	0.64	31%	0.314	S	S	*	.	H	α-helix	trans	-58.9	-55.8	175.6	-71.4	173	-15.4	0	0	111	H116 S117 D118 N122 S123	H116-Q120 PolarHBondContact O-N 2.93Å; S117-Q120 PolarHBondContact O-N 3.2Å; D118-Q120 VanDerWaalsContact C-N 3.31Å; D118-Q120 PolarHBondContact O-N 3.41Å; Q120-N122 PolarHBondContact O-N 2.92Å; Q120-S123 PolarHBondContact O-N 2.83Å; Q120-S123 VanDerWaalsContact O-N 3.09Å; Q120-S123 PolarHBondContact O-OG 3.07Å
121	L	80.1	Confident	83.9	Confident	61 Å²	61	61.6 Å²	61.6	32%	0.319	30%	0.301	S	S	.	.	H	α-helix	trans	-57.4	-46.4	178	-71.8	-178.8	0	0	0	113.2	I46 S117 D118 S123 M124 R1077	I46-L121 HydrophobicContact CD1-CB 4.19Å; I46-L121 HydrophobicContact CD1-CD1 4.05Å; S117-L121 PolarHBondContact O-N 3.36Å; D118-L121 PolarHBondContact O-N 2.68Å; L121-S123 PolarHBondContact O-N 3.12Å; L121-M124 WeakPolarHBondContact O-CG 3.47Å; L121-M124 PolarHBondContact O-N 3.24Å; L121-R1077 VanDerWaalsContact CD1-NH2 3.31Å
122	N	87.6	Confident	83.7	Confident	15 Å²	15	62.2 Å²	62.2	8%	0.08	30%	0.304	C	S	.	.	H	α-helix	trans	-66.5	-15.9	-179.1	-75.9	-54.2	0	0	0	113.4	R45 I46 D118 Q120 S146	R45-N122 WeakPolarHBondContact CA-OD1 3.27Å; I46-N122 PolarHBondContact N-OD1 3.45Å; I46-N122 PolarHBondContact O-ND2 3.28Å; D118-N122 VanDerWaalsContact O-CB 3.28Å; D118-N122 WeakPolarHBondContact O-CB 3.08Å; D118-N122 VanDerWaalsContact O-CG 3.29Å; D118-N122 PolarHBondContact O-N 2.88Å; D118-N122 PolarHBondContact O-ND2 3.05Å; Q120-N122 PolarHBondContact O-N 2.92Å; N122-S146 WeakPolarHBondContact O-CB 3.38Å; N122-S146 PolarHBondContact O-N 3.19Å; N122-S146 PolarHBondContact O-OG 3.05Å
123	S	88.5	Confident	83.2	Confident	61 Å²	61	59.6 Å²	59.6	43%	0.427	29%	0.289	S	S	.	.	H	α-helix	trans	-94.6	-10.5	-178.2	73	0	0	0	0	115.2	K119 Q120 L121 K125	K119-S123 VanDerWaalsContact O-CB 3.24Å; K119-S123 WeakPolarHBondContact O-CB 3.16Å; K119-S123 PolarHBondContact O-N 2.85Å; K119-S123 VanDerWaalsContact O-N 3.11Å; K119-S123 PolarHBondContact O-OG 3.04Å; Q120-S123 PolarHBondContact O-N 2.83Å; Q120-S123 VanDerWaalsContact O-N 3.09Å; Q120-S123 PolarHBondContact O-OG 3.07Å; L121-S123 PolarHBondContact O-N 3.12Å; S123-K125 PolarHBondContact O-N 2.91Å
124	M	85.6	Confident	82.8	Confident	93 Å²	93	62.2 Å²	62.2	46%	0.458	30%	0.303	S	S	.	.			trans	-53.2	133	175.5	-64.7	-62.7	-70.3	0	0	110.6	L121 Y126 K144 A145	L121-M124 WeakPolarHBondContact O-CG 3.47Å; L121-M124 PolarHBondContact O-N 3.24Å; M124-Y126 HydrophobicContact CB-CE2 3.94Å; M124-K144 CarbonylContact O-C 3.56Å; M124-K144 WeakPolarHBondContact O-CA 3.24Å; M124-A145 HydrophobicContact CB-CB 4.31Å; M124-A145 WeakPolarHBondContact O-CB 3.22Å; M124-A145 PolarHBondContact O-N 3.05Å
125	K	88.6	Confident	82.5	Confident	135 Å²	135	65 Å²	65	59%	0.587	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	142.5	-179.5	-64.5	-177.3	178.4	-175.1	0	111.1	S123 Y142 K143 Q160	S123-K125 PolarHBondContact O-N 2.91Å; K125-Y142 HydrophobicContact CB-CD1 4.14Å; K125-K143 WeakPolarHBondContact CA-O 3.48Å; K125-Q160 PolarHBondContact O-NE2 2.87Å
126	Y	88.8	Confident	81.9	Confident	6 Å²	6	63.2 Å²	63.2	2%	0.024	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.4	172.2	-68.6	-93.8	0	0	0	109.3	M124 Y142 K143 A145 L148 I154 Q160 S161 P163	M124-Y126 HydrophobicContact CB-CE2 3.94Å; Y126-Y142 WeakPolarHBondContact O-CA 3.32Å; Y126-K143 PolarHBondContact N-O 2.91Å; Y126-K143 PolarHBondContact O-N 3.49Å; Y126-A145 HydrophobicContact CD2-CB 4.07Å; Y126-A145 HydrophobicContact CE2-CB 3.89Å; Y126-L148 HydrophobicContact CD2-CD1 4.38Å; Y126-I154 HydrophobicContact CD1-CD1 4.39Å; Y126-Q160 HydrophobicContact CE1-CG 3.9Å; Y126-S161 WeakPolarHBondContact CE1-O 3.41Å; Y126-S161 PolarHBondContact OH-O 2.96Å; Y126-P163 HydrophobicContact CD1-CG 3.89Å; Y126-P163 HydrophobicContact CD2-CB 4.13Å; Y126-P163 HydrophobicContact CD2-CG 3.94Å; Y126-P163 HydrophobicContact CE1-CB 4.25Å; Y126-P163 VanDerWaalsContact CE1-CD 3.5Å; Y126-P163 HydrophobicContact CE1-CG 3.66Å; Y126-P163 HydrophobicContact CE2-CB 3.59Å; Y126-P163 HydrophobicContact CE2-CG 3.74Å; Y126-P163 HydrophobicContact CG-CG 4.02Å
127	L	88.4	Confident	81.3	Confident	4 Å²	4	58 Å²	58	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.4	179.8	-163.3	87	0	0	0	108.6	W140 Y142 I154 C155 M209	L127-W140 HydrophobicContact CB-CE3 4.35Å; L127-W140 HydrophobicContact CD1-CB 4.08Å; L127-W140 HydrophobicContact CD2-CB 3.91Å; L127-W140 HydrophobicContact CD2-CD2 3.58Å; L127-W140 HydrophobicContact CD2-CE3 3.46Å; L127-W140 VanDerWaalsContact CD2-CE3 3.46Å; L127-W140 HydrophobicContact CD2-CG 3.83Å; L127-W140 HydrophobicContact CD2-CZ3 4.13Å; L127-W140 HydrophobicContact CG-CB 3.9Å; L127-W140 HydrophobicContact CG-CD2 4.09Å; L127-W140 HydrophobicContact CG-CE3 3.64Å; L127-W140 HydrophobicContact CG-CG 4.26Å; L127-W140 HydrophobicContact CG-CZ3 4.44Å; L127-Y142 HydrophobicContact CB-CE1 4.42Å; L127-Y142 HydrophobicContact CD1-CD1 4.19Å; L127-Y142 HydrophobicContact CD1-CD2 4.22Å; L127-Y142 HydrophobicContact CD1-CE1 3.82Å; L127-Y142 HydrophobicContact CD1-CE2 3.84Å; L127-Y142 HydrophobicContact CD1-CG 4.38Å; L127-I154 CarbonylContact O-C 3.54Å; L127-I154 VanDerWaalsContact O-CA 3.23Å; L127-I154 WeakPolarHBondContact O-CA 3.36Å; L127-C155 HydrophobicContact CB-CB 4.18Å; L127-C155 HydrophobicContact CD2-CB 3.93Å; L127-C155 PolarHBondContact O-N 3.2Å; L127-M209 HydrophobicContact CD1-CE 4.28Å; L127-M209 HydrophobicContact CD2-CE 3.7Å; L127-M209 HydrophobicContact CD2-SD 4.17Å
128	L	88.8	Confident	81.3	Confident	9 Å²	9	56.7 Å²	56.7	5%	0.047	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	138.3	-179.6	171.6	145.3	0	0	0	110.9	N130 W140 I141 K143 L148 D152 I153 I154	L128-N130 HydrophobicContact CD2-CB 3.82Å; L128-N130 PolarHBondContact O-N 3.06Å; L128-W140 VanDerWaalsContact C-CE3 3.43Å; L128-W140 CarbonylContact O-C 3.48Å; L128-W140 WeakPolarHBondContact O-CA 3.15Å; L128-I141 PolarHBondContact N-O 3.05Å; L128-I141 PolarHBondContact O-N 2.92Å; L128-K143 HydrophobicContact CB-CB 4.25Å; L128-K143 HydrophobicContact CB-CD 4.46Å; L128-K143 HydrophobicContact CD1-CD 3.56Å; L128-K143 HydrophobicContact CG-CD 4.45Å; L128-L148 HydrophobicContact CD1-CD2 4.46Å; L128-D152 HydrophobicContact CD1-CB 3.59Å; L128-D152 VanDerWaalsContact CD1-OD2 3.3Å; L128-D152 WeakPolarHBondContact CD1-OD2 3.48Å; L128-I153 WeakPolarHBondContact CA-O 3.4Å; L128-I154 HydrophobicContact CB-CG2 4.39Å
129	L	85.2	Confident	81.2	Confident	9 Å²	9	58.9 Å²	58.9	5%	0.047	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	111.4	172.1	-170.6	62.6	0	0	0	109.7	I138 W140 I153 Y204	L129-I138 HydrophobicContact CD1-CG2 3.39Å; L129-I138 HydrophobicContact CG-CG2 4.12Å; L129-W140 HydrophobicContact CB-CD2 4.5Å; L129-W140 HydrophobicContact CB-CE3 4.01Å; L129-W140 HydrophobicContact CB-CH2 3.96Å; L129-W140 HydrophobicContact CB-CZ2 4.42Å; L129-W140 HydrophobicContact CB-CZ3 3.74Å; L129-W140 HydrophobicContact CD1-CD2 3.96Å; L129-W140 HydrophobicContact CD1-CE3 4.33Å; L129-W140 HydrophobicContact CD1-CG 4.46Å; L129-W140 HydrophobicContact CD1-CH2 4.34Å; L129-W140 HydrophobicContact CD1-CZ2 3.95Å; L129-I153 HydrophobicContact CB-CB 4.21Å; L129-I153 HydrophobicContact CB-CG2 4.31Å; L129-I153 HydrophobicContact CD2-CG2 4.45Å; L129-I153 PolarHBondContact N-O 2.95Å; L129-Y204 HydrophobicContact CD2-CE1 4.16Å
130	N	82.8	Confident	80.9	Confident	54 Å²	54	55.6 Å²	55.6	29%	0.289	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	118.8	179.7	-174.1	85.6	0	0	0	110.3	L128 K139 I141	L128-N130 HydrophobicContact CD2-CB 3.82Å; L128-N130 PolarHBondContact O-N 3.06Å; N130-K139 HydrophobicContact CB-CG 4.41Å; N130-K139 PolarHBondContact N-O 3.48Å; N130-K139 PolarHBondContact O-N 3.15Å; N130-I141 HydrophobicContact CB-CD1 3.52Å; N130-I141 HydrophobicContact CB-CG1 3.97Å
131	I	79.1	Confident	81	Confident	9 Å²	9	52.4 Å²	52.4	5%	0.046	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	118.3	171.3	-52.6	-177.7	0	0	0	108.2	H27 Y29 F133 I138 F239 L246	H27-I131 HydrophobicContact CB-CD1 4.41Å; Y29-I131 PolarHBondContact OH-O 2.72Å; I131-F133 HydrophobicContact CB-CD2 4.48Å; I131-F133 HydrophobicContact CB-CE2 4.13Å; I131-F133 HydrophobicContact CG2-CD2 3.79Å; I131-F133 HydrophobicContact CG2-CE2 3.48Å; I131-F133 VanDerWaalsContact CG2-CE2 3.48Å; I131-F133 HydrophobicContact CG2-CZ 4.4Å; I131-I138 HydrophobicContact CD1-CD1 4.2Å; I131-I138 HydrophobicContact CG1-CD1 4.01Å; I131-I138 HydrophobicContact CG1-CG1 4.12Å; I131-I138 HydrophobicContact CG2-CG1 4.24Å; I131-F239 HydrophobicContact CG2-CE2 3.99Å; I131-F239 HydrophobicContact CG2-CZ 3.8Å; I131-L246 HydrophobicContact CD1-CD1 4.03Å
132	D	76.5	Confident	81.3	Confident	32 Å²	32	56.2 Å²	56.2	17%	0.171	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	103.9	177.1	-165.5	-32.1	0	0	0	108.4	D134 R135 K136 S137 K139	D132-D134 PolarHBondContact OD1-N 3.41Å; D132-R135 HydrophobicContact CB-CB 4.17Å; D132-R135 PolarHBondContact OD1-N 3.44Å; D132-R135 VanDerWaalsContact OD1-N 3.14Å; D132-R135 WeakPolarHBondContact OD2-CD 3.34Å; D132-R135 IonicContact OD2-NE 3.83Å; D132-K136 WeakPolarHBondContact O-CA 3.5Å; D132-K136 PolarHBondContact O-N 3.28Å; D132-S137 PolarHBondContact N-O 2.92Å; D132-S137 PolarHBondContact O-N 2.86Å; D132-S137 VanDerWaalsContact O-N 3.11Å; D132-K139 IonicContact OD2-NZ 2.67Å
133	F	74.8	Confident	81.3	Confident	46 Å²	46	57.9 Å²	57.9	20%	0.202	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-33.1	-177.5	-83.9	-112.5	0	0	0	111.9	Y29 I131 F239 I243	Y29-F133 HydrophobicContact CD1-CE2 4.42Å; Y29-F133 HydrophobicContact CD1-CZ 4.47Å; Y29-F133 AromaticContact CD2-CE2 3.72Å; Y29-F133 HydrophobicContact CD2-CE2 3.72Å; Y29-F133 AromaticContact CD2-CZ 3.86Å; Y29-F133 HydrophobicContact CD2-CZ 3.86Å; Y29-F133 HydrophobicContact CE1-CD2 4.22Å; Y29-F133 AromaticContact CE1-CE2 3.94Å; Y29-F133 HydrophobicContact CE1-CE2 3.94Å; Y29-F133 HydrophobicContact CE1-CZ 4.41Å; Y29-F133 HydrophobicContact CE2-CD2 4.02Å; Y29-F133 AromaticContact CE2-CE2 3.19Å; Y29-F133 HydrophobicContact CE2-CE2 3.19Å; Y29-F133 AromaticContact CE2-CZ 3.84Å; Y29-F133 HydrophobicContact CE2-CZ 3.84Å; Y29-F133 HydrophobicContact CG-CE2 4.32Å; Y29-F133 HydrophobicContact CG-CZ 4.21Å; Y29-F133 AromaticContact CZ-CD2 3.68Å; Y29-F133 AromaticContact CZ-CE2 3.31Å; I131-F133 HydrophobicContact CB-CD2 4.48Å; I131-F133 HydrophobicContact CB-CE2 4.13Å; I131-F133 HydrophobicContact CG2-CD2 3.79Å; I131-F133 HydrophobicContact CG2-CE2 3.48Å; I131-F133 VanDerWaalsContact CG2-CE2 3.48Å; I131-F133 HydrophobicContact CG2-CZ 4.4Å; F133-F239 HydrophobicContact CD1-CE1 4.28Å; F133-F239 HydrophobicContact CG-CE1 4.46Å; F133-F239 HydrophobicContact CG-CZ 4.44Å; F133-I243 HydrophobicContact CD1-CD1 4.4Å; F133-I243 HydrophobicContact CE1-CD1 3.6Å; F133-I243 HydrophobicContact CE2-CD1 4.34Å; F133-I243 HydrophobicContact CZ-CD1 3.56Å; F133-I243 HydrophobicContact CZ-CG1 4.3Å; F133-I243 HydrophobicContact CZ-CG2 4.48Å
134	D	73	Confident	81.5	Confident	161 Å²	161	60.3 Å²	60.3	86%	0.861	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-37.7	-180	-57.9	-26.4	0	0	0	110.7	D132	D132-D134 PolarHBondContact OD1-N 3.41Å
135	R	68.9	Low	81.7	Confident	144 Å²	144	56.2 Å²	56.2	54%	0.543	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-5.9	177.4	-63.3	-171.9	177	-152.5	-3.2	115.2	D132 S137 E231	D132-R135 HydrophobicContact CB-CB 4.17Å; D132-R135 PolarHBondContact OD1-N 3.44Å; D132-R135 VanDerWaalsContact OD1-N 3.14Å; D132-R135 WeakPolarHBondContact OD2-CD 3.34Å; D132-R135 IonicContact OD2-NE 3.83Å; R135-S137 PolarHBondContact O-N 3.16Å; R135-E231 IonicContact NH1-OE1 2.71Å; R135-E231 IonicContact NH1-OE2 3.45Å; R135-E231 PolarHBondContact NH1-OE2 3.02Å; R135-E231 VanDerWaalsContact NH1-OE2 3.16Å
136	K	70.9	Confident	81.7	Confident	62 Å²	62	51.1 Å²	51.1	27%	0.27	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	41.1	-170.6	-63.3	173.4	174.6	165.8	0	112.5	D132 F234 E236 F239	D132-K136 WeakPolarHBondContact O-CA 3.5Å; D132-K136 PolarHBondContact O-N 3.28Å; K136-F234 PolarHBondContact O-N 3.28Å; K136-E236 IonicContact NZ-OE1 2.7Å; K136-E236 PolarHBondContact NZ-OE1 3.25Å; K136-E236 IonicContact NZ-OE2 3.12Å; K136-E236 PolarHBondContact NZ-OE2 3.49Å; K136-F239 VanDerWaalsContact C-CE2 3.46Å; K136-F239 HydrophobicContact CB-CB 4.42Å; K136-F239 HydrophobicContact CB-CD1 4.1Å; K136-F239 HydrophobicContact CB-CD2 3.96Å; K136-F239 HydrophobicContact CB-CE1 4.3Å; K136-F239 HydrophobicContact CB-CE2 4.21Å; K136-F239 HydrophobicContact CB-CG 3.91Å; K136-F239 HydrophobicContact CB-CZ 4.37Å; K136-F239 HydrophobicContact CG-CD1 3.83Å; K136-F239 HydrophobicContact CG-CE1 4Å; K136-F239 HydrophobicContact CG-CG 4.13Å; K136-F239 HydrophobicContact CG-CZ 4.49Å
137	S	72.5	Confident	81.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	147.8	-174.9	79.5	0	0	0	0	112.6	D132 R135 E231	D132-S137 PolarHBondContact N-O 2.92Å; D132-S137 PolarHBondContact O-N 2.86Å; D132-S137 VanDerWaalsContact O-N 3.11Å; R135-S137 PolarHBondContact O-N 3.16Å; S137-E231 PolarHBondContact OG-OE1 3.06Å
138	I	74.5	Confident	81.9	Confident	24 Å²	24	55.2 Å²	55.2	12%	0.123	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	123.9	174	-59.9	-166.3	0	0	0	108.7	L129 I131 M242 L246	L129-I138 HydrophobicContact CD1-CG2 3.39Å; L129-I138 HydrophobicContact CG-CG2 4.12Å; I131-I138 HydrophobicContact CD1-CD1 4.2Å; I131-I138 HydrophobicContact CG1-CD1 4.01Å; I131-I138 HydrophobicContact CG1-CG1 4.12Å; I131-I138 HydrophobicContact CG2-CG1 4.24Å; I138-M242 HydrophobicContact CD1-CE 3.49Å; I138-M242 VanDerWaalsContact CD1-CE 3.49Å; I138-M242 HydrophobicContact CD1-CG 4.04Å; I138-M242 HydrophobicContact CD1-SD 3.47Å; I138-M242 WeakPolarHBondContact CD1-SD 3.46Å; I138-M242 HydrophobicContact CG1-CE 3.89Å; I138-M242 HydrophobicContact CG1-SD 4.35Å; I138-L246 HydrophobicContact CD1-CD1 3.64Å
139	K	78.5	Confident	82	Confident	50 Å²	50	57.9 Å²	57.9	22%	0.217	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	146.5	-178.8	60.4	-171.2	165.4	-144.4	0	112.7	N130 D132 I141 E231	N130-K139 HydrophobicContact CB-CG 4.41Å; N130-K139 PolarHBondContact N-O 3.48Å; N130-K139 PolarHBondContact O-N 3.15Å; D132-K139 IonicContact OD2-NZ 2.67Å; K139-I141 HydrophobicContact CD-CD1 4.31Å; K139-I141 HydrophobicContact CD-CG1 4.47Å; K139-I141 HydrophobicContact CG-CD1 4.07Å; K139-I141 HydrophobicContact CG-CG1 3.98Å; K139-E231 IonicContact NZ-OE1 2.69Å; K139-E231 PolarHBondContact NZ-OE1 2.78Å
140	W	82.1	Confident	82.2	Confident	56 Å²	56	57.6 Å²	57.6	21%	0.212	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	122.7	173.2	-74.3	105.2	0	0	0	110	L127 L128 L129 C155 I313	L127-W140 HydrophobicContact CB-CE3 4.35Å; L127-W140 HydrophobicContact CD1-CB 4.08Å; L127-W140 HydrophobicContact CD2-CB 3.91Å; L127-W140 HydrophobicContact CD2-CD2 3.58Å; L127-W140 HydrophobicContact CD2-CE3 3.46Å; L127-W140 VanDerWaalsContact CD2-CE3 3.46Å; L127-W140 HydrophobicContact CD2-CG 3.83Å; L127-W140 HydrophobicContact CD2-CZ3 4.13Å; L127-W140 HydrophobicContact CG-CB 3.9Å; L127-W140 HydrophobicContact CG-CD2 4.09Å; L127-W140 HydrophobicContact CG-CE3 3.64Å; L127-W140 HydrophobicContact CG-CG 4.26Å; L127-W140 HydrophobicContact CG-CZ3 4.44Å; L128-W140 VanDerWaalsContact C-CE3 3.43Å; L128-W140 CarbonylContact O-C 3.48Å; L128-W140 WeakPolarHBondContact O-CA 3.15Å; L129-W140 HydrophobicContact CB-CD2 4.5Å; L129-W140 HydrophobicContact CB-CE3 4.01Å; L129-W140 HydrophobicContact CB-CH2 3.96Å; L129-W140 HydrophobicContact CB-CZ2 4.42Å; L129-W140 HydrophobicContact CB-CZ3 3.74Å; L129-W140 HydrophobicContact CD1-CD2 3.96Å; L129-W140 HydrophobicContact CD1-CE3 4.33Å; L129-W140 HydrophobicContact CD1-CG 4.46Å; L129-W140 HydrophobicContact CD1-CH2 4.34Å; L129-W140 HydrophobicContact CD1-CZ2 3.95Å; W140-C155 HydrophobicContact CE3-CB 4.45Å; W140-C155 HydrophobicContact CH2-CB 3.83Å; W140-C155 HydrophobicContact CZ3-CB 3.72Å; W140-I313 HydrophobicContact CH2-CD1 4.21Å; W140-I313 HydrophobicContact CH2-CG1 4.26Å; W140-I313 HydrophobicContact CH2-CG2 4.29Å; W140-I313 HydrophobicContact CZ2-CD1 4.11Å
141	I	85.2	Confident	82.4	Confident	70 Å²	70	55 Å²	55	36%	0.359	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	134.3	-176	-50	-179.5	0	0	0	110.2	L128 N130 K139 K143	L128-I141 PolarHBondContact N-O 3.05Å; L128-I141 PolarHBondContact O-N 2.92Å; N130-I141 HydrophobicContact CB-CD1 3.52Å; N130-I141 HydrophobicContact CB-CG1 3.97Å; K139-I141 HydrophobicContact CD-CD1 4.31Å; K139-I141 HydrophobicContact CD-CG1 4.47Å; K139-I141 HydrophobicContact CG-CD1 4.07Å; K139-I141 HydrophobicContact CG-CG1 3.98Å; I141-K143 PolarHBondContact O-N 2.8Å
142	Y	86.7	Confident	83	Confident	140 Å²	140	55.3 Å²	55.3	55%	0.549	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	114.7	171.5	-77.8	-73.6	0	0	0	112.1	K125 Y126 L127	K125-Y142 HydrophobicContact CB-CD1 4.14Å; Y126-Y142 WeakPolarHBondContact O-CA 3.32Å; L127-Y142 HydrophobicContact CB-CE1 4.42Å; L127-Y142 HydrophobicContact CD1-CD1 4.19Å; L127-Y142 HydrophobicContact CD1-CD2 4.22Å; L127-Y142 HydrophobicContact CD1-CE1 3.82Å; L127-Y142 HydrophobicContact CD1-CE2 3.84Å; L127-Y142 HydrophobicContact CD1-CG 4.38Å
143	K	89.1	Confident	83.6	Confident	51 Å²	51	53.8 Å²	53.8	22%	0.222	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	143.6	178.9	-160.5	171.6	179.6	-163.4	0	110.5	K125 Y126 L128 I141 L147 L148 D152	K125-K143 WeakPolarHBondContact CA-O 3.48Å; Y126-K143 PolarHBondContact N-O 2.91Å; Y126-K143 PolarHBondContact O-N 3.49Å; L128-K143 HydrophobicContact CB-CB 4.25Å; L128-K143 HydrophobicContact CB-CD 4.46Å; L128-K143 HydrophobicContact CD1-CD 3.56Å; L128-K143 HydrophobicContact CG-CD 4.45Å; I141-K143 PolarHBondContact O-N 2.8Å; K143-L147 HydrophobicContact CD-CB 4.49Å; K143-L147 WeakPolarHBondContact CE-O 3.48Å; K143-L147 HydrophobicContact CG-CB 3.97Å; K143-L147 PolarHBondContact NZ-O 2.98Å; K143-L147 VanDerWaalsContact NZ-O 3.16Å; K143-L148 HydrophobicContact CB-CD2 4.42Å; K143-L148 HydrophobicContact CD-CD2 4.27Å; K143-D152 IonicContact NZ-OD1 2.71Å; K143-D152 IonicContact NZ-OD2 3.35Å; K143-D152 PolarHBondContact NZ-OD2 2.78Å
144	K	91.8	Very high	84.4	Confident	112 Å²	112	51.7 Å²	51.7	49%	0.487	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	142.8	176.5	-66.2	173.6	-176.8	167.3	0	110	M124 S146 L147	M124-K144 CarbonylContact O-C 3.56Å; M124-K144 WeakPolarHBondContact O-CA 3.24Å; K144-S146 PolarHBondContact O-N 3.49Å; K144-S146 VanDerWaalsContact O-N 3.09Å; K144-L147 HydrophobicContact CB-CD1 4.2Å; K144-L147 HydrophobicContact CB-CG 4.35Å; K144-L147 WeakPolarHBondContact O-CB 3.43Å; K144-L147 PolarHBondContact O-N 2.53Å
145	A	88.8	Confident	85.3	Confident	7 Å²	7	44.2 Å²	44.2	6%	0.058	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-52.2	-37	-178.3	0	0	0	0	0	113.3	N44 M124 Y126 L147 L148 P163	N44-A145 WeakPolarHBondContact CB-O 3.25Å; N44-A145 PolarHBondContact ND2-O 3.3Å; M124-A145 HydrophobicContact CB-CB 4.31Å; M124-A145 WeakPolarHBondContact O-CB 3.22Å; M124-A145 PolarHBondContact O-N 3.05Å; Y126-A145 HydrophobicContact CD2-CB 4.07Å; Y126-A145 HydrophobicContact CE2-CB 3.89Å; A145-L147 VanDerWaalsContact C-N 3.28Å; A145-L147 PolarHBondContact O-N 3.48Å; A145-L148 PolarHBondContact O-N 3.12Å; A145-P163 HydrophobicContact CB-CB 4.2Å
146	S	89.9	Confident	86.2	Confident	28 Å²	28	37.4 Å²	37.4	20%	0.196	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-70.4	-16.2	178.1	49.1	0	0	0	0	115.3	N122 K144	N122-S146 WeakPolarHBondContact O-CB 3.38Å; N122-S146 PolarHBondContact O-N 3.19Å; N122-S146 PolarHBondContact O-OG 3.05Å; K144-S146 PolarHBondContact O-N 3.49Å; K144-S146 VanDerWaalsContact O-N 3.09Å
147	L	90.4	Very high	87.1	Confident	96 Å²	96	37.9 Å²	37.9	50%	0.503	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-98.5	-4.3	178.3	-62	174.7	0	0	0	112.8	K143 K144 A145 N149	K143-L147 HydrophobicContact CD-CB 4.49Å; K143-L147 WeakPolarHBondContact CE-O 3.48Å; K143-L147 HydrophobicContact CG-CB 3.97Å; K143-L147 PolarHBondContact NZ-O 2.98Å; K143-L147 VanDerWaalsContact NZ-O 3.16Å; K144-L147 HydrophobicContact CB-CD1 4.2Å; K144-L147 HydrophobicContact CB-CG 4.35Å; K144-L147 WeakPolarHBondContact O-CB 3.43Å; K144-L147 PolarHBondContact O-N 2.53Å; A145-L147 VanDerWaalsContact C-N 3.28Å; A145-L147 PolarHBondContact O-N 3.48Å; L147-N149 PolarHBondContact O-N 3.27Å
148	L	90.6	Very high	87.7	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.193	C	C	.	.			trans	-65.9	129.6	175.1	-62.7	177.7	0	0	0	110.1	N44 Y126 L128 K143 A145 D152 I154 P163	N44-L148 HydrophobicContact CB-CB 4.33Å; N44-L148 WeakPolarHBondContact CB-O 3.42Å; Y126-L148 HydrophobicContact CD2-CD1 4.38Å; L128-L148 HydrophobicContact CD1-CD2 4.46Å; K143-L148 HydrophobicContact CB-CD2 4.42Å; K143-L148 HydrophobicContact CD-CD2 4.27Å; A145-L148 PolarHBondContact O-N 3.12Å; L148-D152 WeakPolarHBondContact CA-OD2 3.41Å; L148-I154 HydrophobicContact CD1-CD1 4.19Å; L148-I154 HydrophobicContact CD2-CG2 3.76Å; L148-P163 HydrophobicContact CD1-CB 4Å; L148-P163 HydrophobicContact CD1-CG 3.53Å
149	N	90.3	Very high	88	Confident	65 Å²	65	44 Å²	44	35%	0.348	21%	0.21	S	C	.	.			trans	-109.3	161.1	176.2	-67.4	-30.8	0	0	0	110.1	L147 D152 V316	L147-N149 PolarHBondContact O-N 3.27Å; N149-D152 PolarHBondContact N-OD2 2.9Å; N149-D152 VanDerWaalsContact O-CB 3.27Å; N149-D152 WeakPolarHBondContact O-CB 3.48Å; N149-D152 PolarHBondContact O-N 3.2Å; N149-V316 WeakPolarHBondContact O-CB 3.32Å; N149-V316 WeakPolarHBondContact O-CG1 3.41Å
150	V	90.4	Very high	88.3	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.018	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	144.7	164.9	179.9	0	0	0	0	108.8	R22 V24 N28 Y41 D152 T319	R22-V150 VanDerWaalsContact NH2-CG2 3.32Å; V24-V150 HydrophobicContact CB-CG1 4.24Å; V24-V150 HydrophobicContact CG1-CG1 3.69Å; V24-V150 HydrophobicContact CG2-CG1 3.57Å; N28-V150 PolarHBondContact ND2-O 3.37Å; N28-V150 PolarHBondContact OD1-O 3.45Å; Y41-V150 HydrophobicContact CD1-CG2 4.44Å; Y41-V150 HydrophobicContact CD2-CB 3.59Å; Y41-V150 HydrophobicContact CD2-CG1 3.74Å; Y41-V150 HydrophobicContact CD2-CG2 3.9Å; Y41-V150 HydrophobicContact CE2-CB 4.29Å; Y41-V150 HydrophobicContact CE2-CG1 3.92Å; Y41-V150 HydrophobicContact CG-CB 3.96Å; Y41-V150 HydrophobicContact CG-CG1 4.27Å; Y41-V150 HydrophobicContact CG-CG2 3.7Å; V150-D152 PolarHBondContact O-N 2.87Å; V150-T319 HydrophobicContact CG2-CG2 3.9Å; V150-T319 WeakPolarHBondContact CG2-OG1 3.42Å
151	G	87.6	Confident	88.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	-19.2	-175.8	0	0	0	0	0	115	Y25 H27 L315 V316	Y25-G151 WeakPolarHBondContact O-CA 3.42Å; H27-G151 WeakPolarHBondContact CA-O 3.35Å; H27-G151 PolarHBondContact N-O 2.95Å; G151-L315 WeakPolarHBondContact O-CD1 3.37Å; G151-V316 PolarHBondContact N-O 3.44Å
152	D	90.1	Very high	88.7	Confident	15 Å²	15	40 Å²	40	8%	0.08	20%	0.199	C	C	.	.			trans	-61.8	142.2	172.2	-71.5	-5.2	0	0	0	110.1	L128 K143 L148 N149 V150 V316	L128-D152 HydrophobicContact CD1-CB 3.59Å; L128-D152 VanDerWaalsContact CD1-OD2 3.3Å; L128-D152 WeakPolarHBondContact CD1-OD2 3.48Å; K143-D152 IonicContact NZ-OD1 2.71Å; K143-D152 IonicContact NZ-OD2 3.35Å; K143-D152 PolarHBondContact NZ-OD2 2.78Å; L148-D152 WeakPolarHBondContact CA-OD2 3.41Å; N149-D152 PolarHBondContact N-OD2 2.9Å; N149-D152 VanDerWaalsContact O-CB 3.27Å; N149-D152 WeakPolarHBondContact O-CB 3.48Å; N149-D152 PolarHBondContact O-N 3.2Å; V150-D152 PolarHBondContact O-N 2.87Å; D152-V316 HydrophobicContact CB-CG2 4.16Å; D152-V316 WeakPolarHBondContact O-CB 3.28Å; D152-V316 VanDerWaalsContact O-CG2 3.29Å; D152-V316 WeakPolarHBondContact O-CG2 3.42Å; D152-V316 PolarHBondContact O-N 3.42Å
153	I	90.7	Very high	88.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	129.6	170.5	-61	-167.3	0	0	0	109	A26 H27 L128 L129 L169 Y204 I313 L315	A26-I153 HydrophobicContact CB-CD1 4.28Å; H27-I153 WeakPolarHBondContact CE1-CD1 3.33Å; H27-I153 WeakPolarHBondContact NE2-CD1 3.49Å; L128-I153 WeakPolarHBondContact CA-O 3.4Å; L129-I153 HydrophobicContact CB-CB 4.21Å; L129-I153 HydrophobicContact CB-CG2 4.31Å; L129-I153 HydrophobicContact CD2-CG2 4.45Å; L129-I153 PolarHBondContact N-O 2.95Å; I153-L169 HydrophobicContact CD1-CD1 3.82Å; I153-L169 HydrophobicContact CG2-CD1 4.46Å; I153-Y204 HydrophobicContact CD1-CE1 4.41Å; I153-Y204 WeakPolarHBondContact CD1-OH 3.41Å; I153-I313 HydrophobicContact CG2-CG2 3.42Å; I153-I313 VanDerWaalsContact CG2-CG2 3.42Å; I153-L315 HydrophobicContact CG1-CD1 3.91Å
154	I	91.6	Very high	88.9	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147.5	-178.6	68.5	174.2	0	0	0	112.8	Y126 L127 L128 L148 P163 L166 I313 G314 V316	Y126-I154 HydrophobicContact CD1-CD1 4.39Å; L127-I154 CarbonylContact O-C 3.54Å; L127-I154 VanDerWaalsContact O-CA 3.23Å; L127-I154 WeakPolarHBondContact O-CA 3.36Å; L128-I154 HydrophobicContact CB-CG2 4.39Å; L148-I154 HydrophobicContact CD1-CD1 4.19Å; L148-I154 HydrophobicContact CD2-CG2 3.76Å; I154-P163 HydrophobicContact CD1-CG 3.8Å; I154-L166 HydrophobicContact CD1-CD1 3.92Å; I154-L166 HydrophobicContact CD1-CD2 3.8Å; I154-L166 HydrophobicContact CD1-CG 4.5Å; I154-L166 HydrophobicContact CG1-CD1 4.11Å; I154-L166 HydrophobicContact CG1-CD2 3.98Å; I154-I313 WeakPolarHBondContact O-CA 3.35Å; I154-G314 PolarHBondContact N-O 3.25Å; I154-G314 PolarHBondContact O-N 2.93Å; I154-V316 HydrophobicContact CG2-CG2 4.45Å
155	C	90.6	Very high	89	Confident	4 Å²	4	26 Å²	26	3%	0.027	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	140.4	166.2	-172.9	0	0	0	0	109.9	L127 W140 I312	L127-C155 HydrophobicContact CB-CB 4.18Å; L127-C155 HydrophobicContact CD2-CB 3.93Å; L127-C155 PolarHBondContact O-N 3.2Å; W140-C155 HydrophobicContact CE3-CB 4.45Å; W140-C155 HydrophobicContact CH2-CB 3.83Å; W140-C155 HydrophobicContact CZ3-CB 3.72Å; C155-I312 VanDerWaalsContact CA-O 3.28Å; C155-I312 WeakPolarHBondContact CA-O 3.46Å; C155-I312 PolarHBondContact SG-O 2.9Å
156	C	89	Confident	89.3	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.007	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	133	177.4	-70.6	0	0	0	0	109.5	F162 Y311 I312	C156-F162 HydrophobicContact CB-CD1 4.11Å; C156-F162 HydrophobicContact CB-CE1 3.76Å; C156-Y311 VanDerWaalsContact O-CA 3.28Å; C156-Y311 WeakPolarHBondContact O-CA 3.44Å; C156-I312 HydrophobicContact CB-CG1 4.12Å; C156-I312 PolarHBondContact N-O 3.28Å; C156-I312 PolarHBondContact O-N 2.84Å
157	F	88.6	Confident	89.5	Confident	73 Å²	73	24.3 Å²	24.3	32%	0.32	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	165.5	-175.8	-63.5	-79.2	0	0	0	113	Q160 D310	F157-Q160 WeakPolarHBondContact O-CB 3.35Å; F157-Q160 PolarHBondContact O-N 2.81Å; F157-D310 CarbonylContact C-O 3.53Å; F157-D310 WeakPolarHBondContact CA-O 3.4Å
158	N	84.9	Confident	89.6	Confident	59 Å²	59	19.8 Å²	19.8	32%	0.316	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	141.3	175.7	-161.3	-9.4	0	0	0	110.8	Q160 T309 D310	N158-Q160 PolarHBondContact O-N 3.18Å; N158-T309 WeakPolarHBondContact CB-O 3.36Å; N158-T309 VanDerWaalsContact CG-O 3.31Å; N158-D310 PolarHBondContact N-O 3.38Å
159	N	81.9	Confident	89.5	Confident	93 Å²	93	19.8 Å²	19.8	50%	0.497	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	4.3	-172.1	-75.1	-73.3	0	0	0	117.3	K305 L306	N159-K305 WeakPolarHBondContact O-CE 3.34Å; N159-K305 WeakPolarHBondContact OD1-CE 3.46Å; N159-K305 PolarHBondContact OD1-NZ 3.43Å; N159-L306 VanDerWaalsContact CA-O 3.28Å; N159-L306 WeakPolarHBondContact CA-O 3.5Å; N159-L306 PolarHBondContact N-O 2.91Å
160	Q	83.5	Confident	89.5	Confident	37 Å²	37	17.5 Å²	17.5	17%	0.173	9%	0.093	C	C	.	.	P	Polyproline II helix	trans	-81.4	145.7	172.6	-157.6	169.8	9.5	0	0	111.2	K125 Y126 F157 N158 K305 L306	K125-Q160 PolarHBondContact O-NE2 2.87Å; Y126-Q160 HydrophobicContact CE1-CG 3.9Å; F157-Q160 WeakPolarHBondContact O-CB 3.35Å; F157-Q160 PolarHBondContact O-N 2.81Å; N158-Q160 PolarHBondContact O-N 3.18Å; Q160-K305 WeakPolarHBondContact O-CA 3.44Å; Q160-L306 PolarHBondContact O-N 2.84Å
161	S	85.2	Confident	89.4	Confident	51 Å²	51	17.3 Å²	17.3	36%	0.357	9%	0.092	S	C	.	.	B	Isolated β-bridge	trans	-90	147.9	172	55.9	0	0	0	0	111.4	Y126 S304	Y126-S161 WeakPolarHBondContact CE1-O 3.41Å; Y126-S161 PolarHBondContact OH-O 2.96Å; S161-S304 WeakPolarHBondContact CA-O 3.05Å
162	F	90.7	Very high	89.3	Confident	3 Å²	3	18.8 Å²	18.8	1%	0.013	10%	0.102	C	C	.	.	P	Polyproline II helix	trans	-81.1	131.2	-178.2	-56	-68.9	0	0	0	111.9	C156 L166 I180 V300 R302 G303 S304 L306 I312	C156-F162 HydrophobicContact CB-CD1 4.11Å; C156-F162 HydrophobicContact CB-CE1 3.76Å; F162-L166 HydrophobicContact CB-CD1 4.4Å; F162-L166 HydrophobicContact CD1-CD1 3.68Å; F162-L166 HydrophobicContact CE1-CD1 4.45Å; F162-L166 HydrophobicContact CG-CD1 4.34Å; F162-I180 HydrophobicContact CE2-CG2 4.24Å; F162-V300 HydrophobicContact CB-CG1 4.43Å; F162-V300 HydrophobicContact CD1-CG1 4.33Å; F162-V300 HydrophobicContact CD2-CG1 3.22Å; F162-V300 HydrophobicContact CE1-CG1 4.47Å; F162-V300 HydrophobicContact CE2-CG1 3.4Å; F162-V300 VanDerWaalsContact CE2-CG1 3.4Å; F162-V300 HydrophobicContact CG-CG1 3.72Å; F162-V300 HydrophobicContact CZ-CG1 4.03Å; F162-R302 WeakPolarHBondContact O-CA 3.34Å; F162-G303 PolarHBondContact O-N 3.05Å; F162-G303 VanDerWaalsContact O-N 3.08Å; F162-S304 VanDerWaalsContact CD2-C 3.49Å; F162-S304 WeakPolarHBondContact CD2-O 3.11Å; F162-S304 PolarHBondContact N-O 3.25Å; F162-L306 HydrophobicContact CE1-CB 4.43Å; F162-L306 HydrophobicContact CE2-CB 4.47Å; F162-L306 HydrophobicContact CZ-CB 3.75Å; F162-L306 HydrophobicContact CZ-CD1 3.97Å; F162-L306 HydrophobicContact CZ-CG 4.43Å; F162-I312 HydrophobicContact CE1-CD1 3.58Å; F162-I312 HydrophobicContact CE1-CG1 4.2Å; F162-I312 HydrophobicContact CZ-CD1 3.93Å
163	P	89.5	Confident	88.9	Confident	10 Å²	10	19.9 Å²	19.9	7%	0.065	11%	0.107	C	C	.	.	S	Bend	trans	-84.1	-14.4	-172.3	30.8	-31.2	0	0	0	113.9	N44 Y126 A145 L148 I154 R302	N44-P163 PolarHBondContact ND2-O 3.4Å; N44-P163 PolarHBondContact OD1-O 3.37Å; Y126-P163 HydrophobicContact CD1-CG 3.89Å; Y126-P163 HydrophobicContact CD2-CB 4.13Å; Y126-P163 HydrophobicContact CD2-CG 3.94Å; Y126-P163 HydrophobicContact CE1-CB 4.25Å; Y126-P163 VanDerWaalsContact CE1-CD 3.5Å; Y126-P163 HydrophobicContact CE1-CG 3.66Å; Y126-P163 HydrophobicContact CE2-CB 3.59Å; Y126-P163 HydrophobicContact CE2-CG 3.74Å; Y126-P163 HydrophobicContact CG-CG 4.02Å; A145-P163 HydrophobicContact CB-CB 4.2Å; L148-P163 HydrophobicContact CD1-CB 4Å; L148-P163 HydrophobicContact CD1-CG 3.53Å; I154-P163 HydrophobicContact CD1-CG 3.8Å; P163-R302 VanDerWaalsContact O-CD 3.32Å; P163-R302 WeakPolarHBondContact O-CD 3.38Å
164	C	92.3	Very high	88	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-160.1	177.9	-174.6	48.7	0	0	0	0	108.6	V316 Y318 T319 T323	C164-V316 HydrophobicContact CB-CG1 4.23Å; C164-Y318 VanDerWaalsContact CB-O 3.3Å; C164-Y318 WeakPolarHBondContact CB-O 3.19Å; C164-T319 HydrophobicContact CB-CG2 4.4Å; C164-T323 HydrophobicContact CB-CG2 4.48Å
165	D	93.5	Very high	87.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	123.4	179.9	-56.4	-15.1	0	0	0	109.3	L299 V300 L301 R302 I317 Y318 T323 K324	D165-L299 HydrophobicContact CB-CD1 4.47Å; D165-V300 CarbonylContact C-O 3.58Å; D165-V300 VanDerWaalsContact CA-O 3.25Å; D165-V300 WeakPolarHBondContact CA-O 3.49Å; D165-L301 HydrophobicContact CB-CD2 4.41Å; D165-R302 WeakPolarHBondContact OD1-CB 3.45Å; D165-R302 PolarHBondContact OD1-N 3.03Å; D165-I317 PolarHBondContact O-N 3.04Å; D165-Y318 HydrophobicContact CB-CD2 3.95Å; D165-Y318 HydrophobicContact CB-CG 4.47Å; D165-Y318 PolarHBondContact N-O 3.3Å; D165-Y318 PolarHBondContact O-N 3.37Å; D165-T323 VanDerWaalsContact OD2-CA 3.25Å; D165-T323 WeakPolarHBondContact OD2-CA 3.4Å; D165-K324 PolarHBondContact OD2-N 3.24Å
166	L	94	Very high	86.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.6	-166.8	-56	177.4	0	0	0	112.4	I154 F162 L299 V300 L315 V316	I154-L166 HydrophobicContact CD1-CD1 3.92Å; I154-L166 HydrophobicContact CD1-CD2 3.8Å; I154-L166 HydrophobicContact CD1-CG 4.5Å; I154-L166 HydrophobicContact CG1-CD1 4.11Å; I154-L166 HydrophobicContact CG1-CD2 3.98Å; F162-L166 HydrophobicContact CB-CD1 4.4Å; F162-L166 HydrophobicContact CD1-CD1 3.68Å; F162-L166 HydrophobicContact CE1-CD1 4.45Å; F162-L166 HydrophobicContact CG-CD1 4.34Å; L166-L299 CarbonylContact O-C 3.48Å; L166-L299 WeakPolarHBondContact O-CA 3.44Å; L166-V300 HydrophobicContact CB-CB 4.4Å; L166-V300 PolarHBondContact N-O 2.9Å; L166-V300 PolarHBondContact O-N 3.48Å; L166-L315 CarbonylContact C-O 3.46Å; L166-L315 WeakPolarHBondContact CA-O 3.37Å; L166-V316 HydrophobicContact CD2-CB 4.32Å; L166-V316 HydrophobicContact CD2-CG2 3.67Å
167	L	93.6	Very high	86.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	125.8	167.8	-176.4	70.3	0	0	0	110.2	L169 L197 V250 L294 N298 G314 L315 I317	L167-L169 PolarHBondContact O-N 3.44Å; L167-L197 HydrophobicContact CD2-CD1 4.17Å; L167-V250 HydrophobicContact CD2-CG1 4.47Å; L167-V250 HydrophobicContact CD2-CG2 3.69Å; L167-L294 HydrophobicContact CD1-CD1 4.14Å; L167-L294 HydrophobicContact CD1-CD2 3.9Å; L167-L294 HydrophobicContact CD2-CD1 4.08Å; L167-L294 HydrophobicContact CD2-CD2 4.41Å; L167-N298 HydrophobicContact CD1-CB 3.85Å; L167-G314 CarbonylContact O-C 3.47Å; L167-G314 WeakPolarHBondContact O-CA 3.42Å; L167-L315 HydrophobicContact CB-CB 4.34Å; L167-L315 HydrophobicContact CD2-CD2 4.5Å; L167-L315 PolarHBondContact N-O 3.18Å; L167-L315 PolarHBondContact O-N 3.19Å; L167-I317 HydrophobicContact CB-CD1 4.1Å; L167-I317 HydrophobicContact CB-CG1 3.84Å; L167-I317 HydrophobicContact CD2-CD1 4.49Å
168	L	92.6	Very high	86.4	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	115	-175.3	-69.7	176.8	0	0	0	113.2	V178 Y194 T196 L197 N298 V300 I312	L168-V178 HydrophobicContact CD1-CB 4.04Å; L168-V178 HydrophobicContact CD1-CG2 3.87Å; L168-V178 HydrophobicContact CD2-CG2 4.07Å; L168-Y194 HydrophobicContact CD1-CG 4.48Å; L168-T196 HydrophobicContact CB-CG2 4.13Å; L168-T196 WeakPolarHBondContact O-CA 3.34Å; L168-L197 PolarHBondContact O-N 3.12Å; L168-N298 PolarHBondContact N-O 3.36Å; L168-V300 HydrophobicContact CD1-CG2 3.96Å; L168-V300 HydrophobicContact CD2-CG2 3.42Å; L168-V300 VanDerWaalsContact CD2-CG2 3.42Å; L168-V300 HydrophobicContact CG-CG2 3.6Å; L168-I312 HydrophobicContact CD2-CD1 3.47Å; L168-I312 VanDerWaalsContact CD2-CD1 3.47Å
169	L	89.8	Confident	86.4	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-43.3	178.2	-56	-177.4	0	0	0	112.6	I153 L167 L197 Q201 Y204 L248 I313 L315	I153-L169 HydrophobicContact CD1-CD1 3.82Å; I153-L169 HydrophobicContact CG2-CD1 4.46Å; L167-L169 PolarHBondContact O-N 3.44Å; L169-L197 HydrophobicContact CD2-CD1 3.85Å; L169-L197 HydrophobicContact CD2-CG 4.41Å; L169-Q201 PolarHBondContact O-N 3Å; L169-Y204 HydrophobicContact CB-CD2 4.06Å; L169-Y204 HydrophobicContact CB-CE2 4.07Å; L169-Y204 HydrophobicContact CD1-CD2 4.5Å; L169-Y204 HydrophobicContact CD1-CE2 3.73Å; L169-Y204 HydrophobicContact CG-CE2 4.45Å; L169-L248 HydrophobicContact CD2-CD2 3.61Å; L169-I313 PolarHBondContact N-O 3.17Å; L169-L315 HydrophobicContact CD1-CB 4.13Å; L169-L315 HydrophobicContact CG-CB 4.43Å
170	Y	90.2	Very high	86.6	Confident	17 Å²	17	26.5 Å²	26.5	7%	0.067	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	150.9	-177.7	173.4	-86.5	0	0	0	112.6	T196 Q201 A205 Y311 I312 I313	Y170-T196 VanDerWaalsContact C-CG2 3.46Å; Y170-Q201 WeakPolarHBondContact CD2-O 3.35Å; Y170-A205 HydrophobicContact CD2-CB 4.5Å; Y170-A205 HydrophobicContact CE2-CB 3.87Å; Y170-Y311 HydrophobicContact CD1-CE2 4.14Å; Y170-Y311 HydrophobicContact CE1-CD2 4.26Å; Y170-Y311 AromaticContact CE1-CE2 3.47Å; Y170-Y311 HydrophobicContact CE1-CE2 3.47Å; Y170-Y311 VanDerWaalsContact CE1-CE2 3.47Å; Y170-Y311 AromaticContact CE1-CZ 3.93Å; Y170-Y311 PolarHBondContact OH-OH 2.89Å; Y170-I312 WeakPolarHBondContact O-CA 3.18Å; Y170-I312 WeakPolarHBondContact O-CB 3.47Å; Y170-I313 HydrophobicContact CD1-CD1 4.13Å; Y170-I313 HydrophobicContact CD1-CG1 4.24Å; Y170-I313 HydrophobicContact CG-CD1 4.44Å; Y170-I313 PolarHBondContact N-O 2.9Å; Y170-I313 PolarHBondContact O-N 3.16Å
171	S	88.4	Confident	86.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	144.8	174.5	-178.7	0	0	0	0	110.7	H173 Y177 Q201	S171-H173 PolarHBondContact O-N 2.85Å; S171-H173 PolarHBondContact OG-N 3.34Å; S171-Y177 WeakPolarHBondContact CB-O 3.36Å; S171-Y177 PolarHBondContact OG-O 2.71Å; S171-Q201 VanDerWaalsContact N-OE1 3.16Å; S171-Q201 PolarHBondContact O-NE2 2.77Å
172	S	84.6	Confident	85.9	Confident	30 Å²	30	23 Å²	23	21%	0.21	11%	0.109	C	C	.	.	S	Bend	trans	-63.8	-18.4	172.2	72.8	0	0	0	0	113.9	D310 Y311	S172-D310 PolarHBondContact OG-N 2.6Å; S172-D310 PolarHBondContact OG-OD2 3.02Å; S172-D310 VanDerWaalsContact OG-OD2 3.06Å; S172-Y311 PolarHBondContact N-O 3.05Å; S172-Y311 VanDerWaalsContact N-O 3.11Å
173	H	81	Confident	84.7	Confident	39 Å²	39	24.2 Å²	24.2	18%	0.181	12%	0.115	C	C	.	.	S	Bend	trans	-74.4	129.2	178.5	-167.4	-31.1	0	0	0	111.2	S171 N175 G176 Y177 Y179 T309	S171-H173 PolarHBondContact O-N 2.85Å; S171-H173 PolarHBondContact OG-N 3.34Å; H173-N175 PolarHBondContact O-N 3.11Å; H173-G176 PolarHBondContact O-N 3.3Å; H173-Y177 WeakPolarHBondContact CB-O 3.5Å; H173-Y179 AromaticContact CD2-CE2 3.66Å; H173-Y179 AromaticContact NE2-CE2 3.78Å; H173-T309 HydrophobicContact CB-CG2 4.25Å
174	F	72.8	Confident	83.5	Confident	175 Å²	175	25.4 Å²	25.4	77%	0.768	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.8	-20.6	-176.5	68.2	-91.3	0	0	0	117.3
175	N	75.2	Confident	82.3	Confident	85 Å²	85	25.7 Å²	25.7	46%	0.455	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	2.7	179.4	-80.9	-30.9	0	0	0	114.3	H173 Y177	H173-N175 PolarHBondContact O-N 3.11Å; N175-Y177 HydrophobicContact CB-CD2 3.36Å; N175-Y177 HydrophobicContact CB-CE2 3.31Å; N175-Y177 HydrophobicContact CB-CG 3.99Å; N175-Y177 WeakPolarHBondContact ND2-CE2 3.15Å; N175-Y177 PolarHBondContact O-N 2.86Å
176	G	79.5	Confident	80.8	Confident	3 Å²	3	27.3 Å²	27.3	3%	0.031	13%	0.131	C	C	.	.	S	Bend	trans	70.2	18	-172.3	0	0	0	0	0	114.2	H173 T196	H173-G176 PolarHBondContact O-N 3.3Å; G176-T196 WeakPolarHBondContact CA-OG1 3.48Å; G176-T196 PolarHBondContact O-N 3.28Å; G176-T196 PolarHBondContact O-OG1 2.86Å
177	Y	84.2	Confident	78.7	Confident	68 Å²	68	27.8 Å²	27.8	27%	0.267	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	143.9	175.5	-60.8	-40.1	0	0	0	111.1	S171 H173 N175 K193 N195	S171-Y177 WeakPolarHBondContact CB-O 3.36Å; S171-Y177 PolarHBondContact OG-O 2.71Å; H173-Y177 WeakPolarHBondContact CB-O 3.5Å; N175-Y177 HydrophobicContact CB-CD2 3.36Å; N175-Y177 HydrophobicContact CB-CE2 3.31Å; N175-Y177 HydrophobicContact CB-CG 3.99Å; N175-Y177 WeakPolarHBondContact ND2-CE2 3.15Å; N175-Y177 PolarHBondContact O-N 2.86Å; Y177-K193 HydrophobicContact CD1-CD 4.48Å; Y177-K193 HydrophobicContact CD1-CG 4.48Å; Y177-K193 VanDerWaalsContact CE1-CE 3.49Å; Y177-K193 HydrophobicContact CG-CD 4.47Å; Y177-N195 WeakPolarHBondContact CD1-OD1 3.15Å
178	V	86.2	Confident	76.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.4	173.9	-175.1	0	0	0	0	108.9	L168 I180 Y194 T196 L306 I312	L168-V178 HydrophobicContact CD1-CB 4.04Å; L168-V178 HydrophobicContact CD1-CG2 3.87Å; L168-V178 HydrophobicContact CD2-CG2 4.07Å; V178-I180 HydrophobicContact CB-CG1 4.39Å; V178-I180 HydrophobicContact CG1-CD1 3.83Å; V178-I180 HydrophobicContact CG1-CG1 3.59Å; V178-Y194 PolarHBondContact N-O 2.85Å; V178-Y194 PolarHBondContact O-N 3.33Å; V178-T196 HydrophobicContact CG2-CG2 4.07Å; V178-L306 HydrophobicContact CG1-CD1 3.5Å; V178-L306 VanDerWaalsContact CG1-CD1 3.5Å; V178-I312 HydrophobicContact CB-CG2 4.45Å; V178-I312 HydrophobicContact CG1-CG2 3.76Å; V178-I312 HydrophobicContact CG2-CG2 3.78Å
179	Y	86.1	Confident	75.1	Confident	38 Å²	38	35.1 Å²	35.1	15%	0.149	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	118.2	176.9	-69.2	-56.7	0	0	0	109.4	H173 I191 K193 I307 T309	H173-Y179 AromaticContact CD2-CE2 3.66Å; H173-Y179 AromaticContact NE2-CE2 3.78Å; Y179-I191 HydrophobicContact CD1-CG2 4.02Å; Y179-I191 HydrophobicContact CG-CG2 4.2Å; Y179-K193 HydrophobicContact CD1-CB 4.41Å; Y179-K193 HydrophobicContact CE1-CB 4.2Å; Y179-K193 HydrophobicContact CE1-CD 4.17Å; Y179-K193 HydrophobicContact CE1-CG 4.05Å; Y179-I307 VanDerWaalsContact CB-O 3.26Å; Y179-I307 WeakPolarHBondContact CB-O 3.5Å; Y179-I307 PolarHBondContact O-N 3Å; Y179-I307 VanDerWaalsContact O-N 3.15Å; Y179-T309 HydrophobicContact CD2-CG2 4.11Å
180	I	86.4	Confident	74	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	130.2	-170.1	-54.6	-170	0	0	0	109.3	F162 V178 T182 K192 Y194 V300	F162-I180 HydrophobicContact CE2-CG2 4.24Å; V178-I180 HydrophobicContact CB-CG1 4.39Å; V178-I180 HydrophobicContact CG1-CD1 3.83Å; V178-I180 HydrophobicContact CG1-CG1 3.59Å; I180-T182 HydrophobicContact CG2-CG2 4.21Å; I180-K192 PolarHBondContact N-O 3.41Å; I180-K192 PolarHBondContact O-N 3.14Å; I180-Y194 HydrophobicContact CB-CD2 3.83Å; I180-Y194 HydrophobicContact CB-CE2 3.94Å; I180-Y194 HydrophobicContact CD1-CD1 4.31Å; I180-Y194 HydrophobicContact CD1-CD2 3.59Å; I180-Y194 HydrophobicContact CD1-CE2 4.11Å; I180-Y194 HydrophobicContact CD1-CG 3.72Å; I180-Y194 HydrophobicContact CG1-CD2 3.78Å; I180-Y194 HydrophobicContact CG1-CE2 4.34Å; I180-Y194 HydrophobicContact CG1-CG 4.32Å; I180-Y194 HydrophobicContact CG2-CE2 4.41Å; I180-V300 HydrophobicContact CD1-CB 4.15Å; I180-V300 HydrophobicContact CD1-CG1 3.75Å; I180-V300 HydrophobicContact CD1-CG2 3.39Å; I180-V300 HydrophobicContact CG2-CG1 4.41Å
181	N	80	Confident	73.2	Confident	14 Å²	14	39.3 Å²	39.3	8%	0.075	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	120.4	169.4	-169.9	-6.6	0	0	0	110.2	M183 S304 K305 I307	N181-M183 VanDerWaalsContact ND2-CE 3.32Å; N181-M183 WeakPolarHBondContact ND2-CE 3.41Å; N181-M183 PolarHBondContact ND2-SD 2.67Å; N181-M183 VanDerWaalsContact ND2-SD 3.35Å; N181-M183 WeakPolarHBondContact OD1-CB 3.49Å; N181-M183 PolarHBondContact OD1-N 2.92Å; N181-M183 VanDerWaalsContact OD1-N 3.08Å; N181-S304 WeakPolarHBondContact O-CA 3.48Å; N181-S304 WeakPolarHBondContact O-CB 3.3Å; N181-K305 PolarHBondContact N-O 3.19Å; N181-K305 PolarHBondContact O-N 2.98Å; N181-I307 HydrophobicContact CB-CD1 3.44Å; N181-I307 VanDerWaalsContact CB-CD1 3.44Å; N181-I307 HydrophobicContact CB-CG1 3.92Å
182	T	73.9	Confident	72.7	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	21%	0.205	C	C	.	.			trans	-103.9	0.2	-178.3	58.5	0	0	0	0	114	I180 N184 L185 D186 K192 Y194	I180-T182 HydrophobicContact CG2-CG2 4.21Å; T182-N184 PolarHBondContact O-N 2.98Å; T182-L185 WeakPolarHBondContact O-CA 3.29Å; T182-L185 WeakPolarHBondContact O-CB 3.05Å; T182-L185 PolarHBondContact O-N 3.44Å; T182-D186 VanDerWaalsContact CB-OD1 3.27Å; T182-D186 WeakPolarHBondContact CB-OD1 3.34Å; T182-D186 WeakPolarHBondContact CB-OD2 3.46Å; T182-D186 PolarHBondContact O-N 2.89Å; T182-D186 PolarHBondContact OG1-OD1 3.5Å; T182-D186 PolarHBondContact OG1-OD2 3Å; T182-K192 HydrophobicContact CG2-CD 3.94Å; T182-K192 WeakPolarHBondContact OG1-CD 3.5Å; T182-K192 WeakPolarHBondContact OG1-CE 3.35Å; T182-K192 PolarHBondContact OG1-NZ 3.37Å; T182-Y194 HydrophobicContact CG2-CE2 4.45Å
183	M	64.9	Low	72.7	Confident	28 Å²	28	44.7 Å²	44.7	14%	0.138	22%	0.215	C	C	.	.	H	α-helix	trans	-33.9	-45.9	172.4	178.1	179.2	81.9	0	0	115.2	N181 L185 G187 E188 N189 E1071	N181-M183 VanDerWaalsContact ND2-CE 3.32Å; N181-M183 WeakPolarHBondContact ND2-CE 3.41Å; N181-M183 PolarHBondContact ND2-SD 2.67Å; N181-M183 VanDerWaalsContact ND2-SD 3.35Å; N181-M183 WeakPolarHBondContact OD1-CB 3.49Å; N181-M183 PolarHBondContact OD1-N 2.92Å; N181-M183 VanDerWaalsContact OD1-N 3.08Å; M183-L185 PolarHBondContact O-N 3.4Å; M183-G187 WeakPolarHBondContact O-CA 3.36Å; M183-G187 PolarHBondContact O-N 3.47Å; M183-E188 PolarHBondContact N-O 3.22Å; M183-N189 WeakPolarHBondContact CG-OD1 3.29Å; M183-N189 PolarHBondContact SD-OD1 2.89Å; M183-E1071 WeakPolarHBondContact CE-O 3.46Å; M183-E1071 VanDerWaalsContact CG-CA 3.48Å; M183-E1071 HydrophobicContact CG-CB 3.38Å; M183-E1071 HydrophobicContact CG-CG 3.59Å; M183-E1071 WeakPolarHBondContact CG-O 3.49Å; M183-E1071 VanDerWaalsContact SD-CA 3.57Å; M183-E1071 HydrophobicContact SD-CB 4.06Å; M183-E1071 HydrophobicContact SD-CG 4.01Å
184	N	65.1	Low	73.1	Confident	35 Å²	35	43.8 Å²	43.8	19%	0.187	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-19	174.3	-86.6	-35.4	0	0	0	115.8	T182 G303 G1052 E1071 G1072	T182-N184 PolarHBondContact O-N 2.98Å; N184-G303 VanDerWaalsContact CB-O 3.23Å; N184-G303 WeakPolarHBondContact CB-O 3.31Å; N184-G303 PolarHBondContact ND2-O 3.33Å; N184-G1052 VanDerWaalsContact O-CA 3.3Å; N184-G1052 WeakPolarHBondContact O-CA 3.31Å; N184-E1071 PolarHBondContact OD1-O 3.19Å; N184-G1072 WeakPolarHBondContact OD1-CA 3.23Å
185	L	67.1	Low	73.8	Confident	7 Å²	7	38.4 Å²	38.4	4%	0.037	19%	0.189	C	C	.	.	H	α-helix	trans	-107.7	-46.5	-176.8	-65.4	177.9	0	0	0	112.1	T182 M183 L259 L301 R302 S304 L325 N1053	T182-L185 WeakPolarHBondContact O-CA 3.29Å; T182-L185 WeakPolarHBondContact O-CB 3.05Å; T182-L185 PolarHBondContact O-N 3.44Å; M183-L185 PolarHBondContact O-N 3.4Å; L185-L259 HydrophobicContact CB-CD1 4.5Å; L185-L301 HydrophobicContact CD1-CB 3.44Å; L185-L301 VanDerWaalsContact CD1-CB 3.44Å; L185-L301 HydrophobicContact CD1-CD1 3.99Å; L185-L301 HydrophobicContact CD1-CG 4.33Å; L185-R302 WeakPolarHBondContact CD2-O 3.45Å; L185-S304 VanDerWaalsContact CD1-OG 3.25Å; L185-S304 WeakPolarHBondContact CD1-OG 3.33Å; L185-L325 HydrophobicContact CD2-CB 3.99Å; L185-L325 HydrophobicContact CD2-CD1 3.79Å; L185-L325 HydrophobicContact CD2-CD2 3.98Å; L185-L325 HydrophobicContact CD2-CG 4.12Å; L185-N1053 PolarHBondContact O-OD1 2.97Å
186	D	61.3	Low	74.5	Confident	33 Å²	33	34.7 Å²	34.7	18%	0.176	17%	0.17	C	C	.	.	H	α-helix	trans	-124.1	6.9	-169.4	57.7	26.3	0	0	0	114.9	T182 E188 K192 N1053	T182-D186 VanDerWaalsContact CB-OD1 3.27Å; T182-D186 WeakPolarHBondContact CB-OD1 3.34Å; T182-D186 WeakPolarHBondContact CB-OD2 3.46Å; T182-D186 PolarHBondContact O-N 2.89Å; T182-D186 PolarHBondContact OG1-OD1 3.5Å; T182-D186 PolarHBondContact OG1-OD2 3Å; D186-E188 PolarHBondContact O-N 2.95Å; D186-E188 PolarHBondContact OD1-N 3.02Å; D186-K192 VanDerWaalsContact CG-NZ 3.32Å; D186-K192 IonicContact OD1-NZ 3.2Å; D186-K192 IonicContact OD2-NZ 3.53Å; D186-K192 PolarHBondContact OD2-NZ 2.86Å; D186-N1053 VanDerWaalsContact C-CG 3.49Å; D186-N1053 WeakPolarHBondContact CA-OD1 3.36Å; D186-N1053 PolarHBondContact O-ND2 3.19Å
187	G	49.2	Very low	74.8	Confident	11 Å²	11	34.9 Å²	34.9	11%	0.113	17%	0.17	C	C	.	.			trans	58.6	17.4	176	0	0	0	0	0	114.1	M183 E1071	M183-G187 WeakPolarHBondContact O-CA 3.36Å; M183-G187 PolarHBondContact O-N 3.47Å; G187-E1071 WeakPolarHBondContact CA-OE2 3.44Å
188	E	57	Low	74.6	Confident	93 Å²	93	40.7 Å²	40.7	44%	0.435	20%	0.197	S	C	.	.			trans	-98	112.8	175.3	-68.3	-177.9	178.3	0	0	108.6	M183 D186 N190 K192	M183-E188 PolarHBondContact N-O 3.22Å; D186-E188 PolarHBondContact O-N 2.95Å; D186-E188 PolarHBondContact OD1-N 3.02Å; E188-N190 PolarHBondContact O-N 2.79Å; E188-K192 WeakPolarHBondContact OE2-CE 3.3Å; E188-K192 IonicContact OE2-NZ 2.82Å; E188-K192 PolarHBondContact OE2-NZ 3.16Å
189	N	55	Low	74.2	Confident	61 Å²	61	44.1 Å²	44.1	33%	0.326	21%	0.213	S	C	.	.			trans	-68.4	-7.3	174.3	-70.8	-47.5	0	0	0	114.2	M183 I191 N467 E1071	M183-N189 WeakPolarHBondContact CG-OD1 3.29Å; M183-N189 PolarHBondContact SD-OD1 2.89Å; N189-I191 PolarHBondContact O-N 3.02Å; N189-N467 WeakPolarHBondContact ND2-CB 3.45Å; N189-N467 PolarHBondContact ND2-ND2 3.25Å; N189-E1071 VanDerWaalsContact CG-OE1 3.31Å; N189-E1071 PolarHBondContact ND2-OE1 3.47Å; N189-E1071 PolarHBondContact OD1-OE1 2.99Å
190	N	66.1	Low	73.9	Confident	70 Å²	70	42.9 Å²	42.9	37%	0.374	21%	0.208	S	C	.	.	S	Bend	trans	-70.7	123.1	-179.3	-64.4	-11.6	0	0	0	109.4	E188 K192 T609	E188-N190 PolarHBondContact O-N 2.79Å; N190-K192 WeakPolarHBondContact O-CG 3.36Å; N190-K192 PolarHBondContact O-N 3.06Å; N190-T609 VanDerWaalsContact CG-O 3.31Å; N190-T609 PolarHBondContact OD1-O 3.22Å
191	I	73.5	Confident	73.6	Confident	35 Å²	35	44.4 Å²	44.4	18%	0.179	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-63.2	122.1	173.2	-60.2	174	0	0	0	108.4	Y179 N189 I307	Y179-I191 HydrophobicContact CD1-CG2 4.02Å; Y179-I191 HydrophobicContact CG-CG2 4.2Å; N189-I191 PolarHBondContact O-N 3.02Å; I191-I307 HydrophobicContact CD1-CG2 4.27Å
192	K	78.5	Confident	73.3	Confident	48 Å²	48	47.5 Å²	47.5	21%	0.209	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	135.3	-176.9	-63.9	-171.4	-173.5	179.2	0	110.6	I180 T182 D186 E188 N190 Y194	I180-K192 PolarHBondContact N-O 3.41Å; I180-K192 PolarHBondContact O-N 3.14Å; T182-K192 HydrophobicContact CG2-CD 3.94Å; T182-K192 WeakPolarHBondContact OG1-CD 3.5Å; T182-K192 WeakPolarHBondContact OG1-CE 3.35Å; T182-K192 PolarHBondContact OG1-NZ 3.37Å; D186-K192 VanDerWaalsContact CG-NZ 3.32Å; D186-K192 IonicContact OD1-NZ 3.2Å; D186-K192 IonicContact OD2-NZ 3.53Å; D186-K192 PolarHBondContact OD2-NZ 2.86Å; E188-K192 WeakPolarHBondContact OE2-CE 3.3Å; E188-K192 IonicContact OE2-NZ 2.82Å; E188-K192 PolarHBondContact OE2-NZ 3.16Å; N190-K192 WeakPolarHBondContact O-CG 3.36Å; N190-K192 PolarHBondContact O-N 3.06Å; K192-Y194 HydrophobicContact CB-CD2 4.2Å; K192-Y194 HydrophobicContact CB-CE2 3.67Å
193	K	83.8	Confident	73.3	Confident	95 Å²	95	48.4 Å²	48.4	41%	0.413	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	117	179.2	-172.3	173	-177.1	167.4	0	110.9	Y177 Y179	Y177-K193 HydrophobicContact CD1-CD 4.48Å; Y177-K193 HydrophobicContact CD1-CG 4.48Å; Y177-K193 VanDerWaalsContact CE1-CE 3.49Å; Y177-K193 HydrophobicContact CG-CD 4.47Å; Y179-K193 HydrophobicContact CD1-CB 4.41Å; Y179-K193 HydrophobicContact CE1-CB 4.2Å; Y179-K193 HydrophobicContact CE1-CD 4.17Å; Y179-K193 HydrophobicContact CE1-CG 4.05Å
194	Y	88.4	Confident	73.9	Confident	20 Å²	20	47.1 Å²	47.1	8%	0.078	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	162.5	174.5	-72.8	-107.1	0	0	0	110.1	L168 V178 I180 T182 K192 Y296 K297 L299	L168-Y194 HydrophobicContact CD1-CG 4.48Å; V178-Y194 PolarHBondContact N-O 2.85Å; V178-Y194 PolarHBondContact O-N 3.33Å; I180-Y194 HydrophobicContact CB-CD2 3.83Å; I180-Y194 HydrophobicContact CB-CE2 3.94Å; I180-Y194 HydrophobicContact CD1-CD1 4.31Å; I180-Y194 HydrophobicContact CD1-CD2 3.59Å; I180-Y194 HydrophobicContact CD1-CE2 4.11Å; I180-Y194 HydrophobicContact CD1-CG 3.72Å; I180-Y194 HydrophobicContact CG1-CD2 3.78Å; I180-Y194 HydrophobicContact CG1-CE2 4.34Å; I180-Y194 HydrophobicContact CG1-CG 4.32Å; I180-Y194 HydrophobicContact CG2-CE2 4.41Å; T182-Y194 HydrophobicContact CG2-CE2 4.45Å; K192-Y194 HydrophobicContact CB-CD2 4.2Å; K192-Y194 HydrophobicContact CB-CE2 3.67Å; Y194-Y296 WeakPolarHBondContact CE1-O 3.27Å; Y194-K297 WeakPolarHBondContact CB-O 3.42Å; Y194-K297 WeakPolarHBondContact CD1-O 3.4Å; Y194-L299 WeakPolarHBondContact CE1-O 3.23Å
195	N	87.9	Confident	74.2	Confident	61 Å²	61	47.2 Å²	47.2	33%	0.326	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	137.5	-175.1	-63.2	-9.5	0	0	0	110.9	Y177 K297 N298	Y177-N195 WeakPolarHBondContact CD1-OD1 3.15Å; N195-K297 PolarHBondContact N-O 2.8Å; N195-N298 PolarHBondContact O-ND2 2.92Å
196	T	89.9	Confident	74	Confident	8 Å²	8	53.1 Å²	53.1	5%	0.049	28%	0.275	C	S	.	.			trans	-73.8	168.1	171.2	58.9	0	0	0	0	112.4	L168 Y170 G176 V178 K198 Q201	L168-T196 HydrophobicContact CB-CG2 4.13Å; L168-T196 WeakPolarHBondContact O-CA 3.34Å; Y170-T196 VanDerWaalsContact C-CG2 3.46Å; G176-T196 WeakPolarHBondContact CA-OG1 3.48Å; G176-T196 PolarHBondContact O-N 3.28Å; G176-T196 PolarHBondContact O-OG1 2.86Å; V178-T196 HydrophobicContact CG2-CG2 4.07Å; T196-K198 PolarHBondContact O-N 2.98Å; T196-Q201 PolarHBondContact OG1-OE1 2.82Å
197	L	86.4	Confident	74	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.031	28%	0.278	C	S	.	.			trans	-71.9	110.1	169.5	-59.6	-172.4	0	0	0	110	L167 L168 L169 Q199 Y200 Q201 L248 Y266 L294 N298	L167-L197 HydrophobicContact CD2-CD1 4.17Å; L168-L197 PolarHBondContact O-N 3.12Å; L169-L197 HydrophobicContact CD2-CD1 3.85Å; L169-L197 HydrophobicContact CD2-CG 4.41Å; L197-Q199 PolarHBondContact O-N 3.09Å; L197-Q199 VanDerWaalsContact O-N 3.07Å; L197-Y200 HydrophobicContact CB-CD2 4.17Å; L197-Y200 HydrophobicContact CD1-CD2 4.09Å; L197-Y200 PolarHBondContact O-N 3.1Å; L197-Q201 PolarHBondContact O-N 2.86Å; L197-L248 HydrophobicContact CD1-CD2 4.27Å; L197-Y266 HydrophobicContact CD1-CD1 4.24Å; L197-Y266 HydrophobicContact CD1-CE1 4.03Å; L197-Y266 HydrophobicContact CD1-CE2 4.36Å; L197-Y266 HydrophobicContact CD1-CG 4.48Å; L197-Y266 HydrophobicContact CD2-CD1 4.4Å; L197-Y266 HydrophobicContact CD2-CE1 3.77Å; L197-Y266 HydrophobicContact CG-CE1 4.43Å; L197-L294 HydrophobicContact CD2-CD2 3.63Å; L197-N298 HydrophobicContact CD2-CB 4.49Å
198	K	79.8	Confident	74.3	Confident	191 Å²	191	57 Å²	57	83%	0.83	29%	0.288	S	S	*	.	H	α-helix	trans	-49.7	-39.3	-174.1	-68.4	-172.4	176.5	-173.7	0	114.8	T196	T196-K198 PolarHBondContact O-N 2.98Å
199	Q	77.9	Confident	74.2	Confident	72 Å²	72	55.3 Å²	55.3	34%	0.336	28%	0.281	S	S	.	.	H	α-helix	trans	-65.5	-48.4	179.4	-70.7	171.4	-13.3	0	0	111.4	L197 S202 S203 Y266 F292	L197-Q199 PolarHBondContact O-N 3.09Å; L197-Q199 VanDerWaalsContact O-N 3.07Å; Q199-S202 PolarHBondContact O-N 3.46Å; Q199-S202 PolarHBondContact O-OG 3.27Å; Q199-S203 PolarHBondContact O-OG 3.12Å; Q199-Y266 PolarHBondContact OE1-OH 3.16Å; Q199-F292 VanDerWaalsContact NE2-CE2 3.3Å
200	Y	80	Confident	73.4	Confident	11 Å²	11	56.9 Å²	56.9	4%	0.043	29%	0.293	C	S	.	.	H	α-helix	trans	-78.3	-18.6	-176.7	-71	-83.6	0	0	0	113.8	L197 S202 S203 Y204 H245 Y247 L248 Y266 T268	L197-Y200 HydrophobicContact CB-CD2 4.17Å; L197-Y200 HydrophobicContact CD1-CD2 4.09Å; L197-Y200 PolarHBondContact O-N 3.1Å; Y200-S202 PolarHBondContact O-N 3.41Å; Y200-S203 PolarHBondContact O-N 2.91Å; Y200-Y204 HydrophobicContact CD1-CD2 4.32Å; Y200-Y204 AromaticContact CD1-CE2 3.82Å; Y200-Y204 HydrophobicContact CD1-CE2 3.82Å; Y200-Y204 HydrophobicContact CG-CE2 4.38Å; Y200-Y204 WeakPolarHBondContact O-CD2 3.21Å; Y200-Y204 PolarHBondContact O-N 2.75Å; Y200-H245 WeakPolarHBondContact CE1-O 3.13Å; Y200-Y247 PolarHBondContact OH-O 2.97Å; Y200-L248 HydrophobicContact CE1-CB 4.32Å; Y200-L248 HydrophobicContact CE2-CD1 3.78Å; Y200-L248 HydrophobicContact CE2-CD2 4.49Å; Y200-Y266 HydrophobicContact CD2-CE2 4.34Å; Y200-Y266 HydrophobicContact CE2-CD2 4.14Å; Y200-Y266 AromaticContact CE2-CE2 3.83Å; Y200-Y266 HydrophobicContact CE2-CE2 3.83Å; Y200-T268 HydrophobicContact CE2-CG2 4.41Å
201	Q	79	Confident	72.1	Confident	33 Å²	33	56.6 Å²	56.6	15%	0.154	29%	0.294	C	S	.	.	H	α-helix	trans	-55.7	-36.1	171.8	-179.2	71.6	32.4	0	0	111.6	L169 Y170 S171 T196 L197 A205	L169-Q201 PolarHBondContact O-N 3Å; Y170-Q201 WeakPolarHBondContact CD2-O 3.35Å; S171-Q201 VanDerWaalsContact N-OE1 3.16Å; S171-Q201 PolarHBondContact O-NE2 2.77Å; T196-Q201 PolarHBondContact OG1-OE1 2.82Å; L197-Q201 PolarHBondContact O-N 2.86Å; Q201-A205 WeakPolarHBondContact O-CB 3.49Å; Q201-A205 PolarHBondContact O-N 3.04Å
202	S	75.6	Confident	70.3	Confident	79 Å²	79	60.6 Å²	60.6	55%	0.552	32%	0.32	S	S	*	.	H	α-helix	trans	-77	-44.7	174.9	64.9	0	0	0	0	112.5	Q199 Y200 Y204 A205	Q199-S202 PolarHBondContact O-N 3.46Å; Q199-S202 PolarHBondContact O-OG 3.27Å; Y200-S202 PolarHBondContact O-N 3.41Å; S202-Y204 PolarHBondContact O-N 3.07Å; S202-A205 WeakPolarHBondContact O-CB 3.35Å; S202-A205 PolarHBondContact O-N 2.86Å
203	S	73.9	Confident	68	Low	20 Å²	20	65.3 Å²	65.3	14%	0.14	35%	0.348	C	S	.	.	H	α-helix	trans	-59.4	-47	179.4	-45.3	0	0	0	0	112.3	Q199 Y200 A205 Y207	Q199-S203 PolarHBondContact O-OG 3.12Å; Y200-S203 PolarHBondContact O-N 2.91Å; S203-A205 VanDerWaalsContact C-N 3.34Å; S203-A205 PolarHBondContact O-N 3.46Å; S203-Y207 WeakPolarHBondContact O-CD2 3.38Å; S203-Y207 WeakPolarHBondContact O-CE2 3.46Å
204	Y	76.8	Confident	65.5	Low	1 Å²	1	68.3 Å²	68.3	0%	0.004	37%	0.368	C	S	.	.	H	α-helix	trans	-75.6	-17.2	-180	-78.1	-81.7	0	0	0	114.2	L129 I153 L169 Y200 S202 N206 Y207 L246 I313	L129-Y204 HydrophobicContact CD2-CE1 4.16Å; I153-Y204 HydrophobicContact CD1-CE1 4.41Å; I153-Y204 WeakPolarHBondContact CD1-OH 3.41Å; L169-Y204 HydrophobicContact CB-CD2 4.06Å; L169-Y204 HydrophobicContact CB-CE2 4.07Å; L169-Y204 HydrophobicContact CD1-CD2 4.5Å; L169-Y204 HydrophobicContact CD1-CE2 3.73Å; L169-Y204 HydrophobicContact CG-CE2 4.45Å; Y200-Y204 HydrophobicContact CD1-CD2 4.32Å; Y200-Y204 AromaticContact CD1-CE2 3.82Å; Y200-Y204 HydrophobicContact CD1-CE2 3.82Å; Y200-Y204 HydrophobicContact CG-CE2 4.38Å; Y200-Y204 WeakPolarHBondContact O-CD2 3.21Å; Y200-Y204 PolarHBondContact O-N 2.75Å; S202-Y204 PolarHBondContact O-N 3.07Å; Y204-N206 PolarHBondContact O-N 2.83Å; Y204-Y207 PolarHBondContact O-N 2.83Å; Y204-Y207 VanDerWaalsContact O-N 3.11Å; Y204-L246 HydrophobicContact CD1-CD2 4.25Å; Y204-L246 HydrophobicContact CE1-CD2 3.52Å; Y204-L246 HydrophobicContact CE2-CD2 4.3Å; Y204-L246 WeakPolarHBondContact OH-CD2 3.34Å; Y204-I313 HydrophobicContact CD1-CD1 4.16Å; Y204-I313 HydrophobicContact CD1-CG2 4.27Å; Y204-I313 HydrophobicContact CE1-CG2 4.41Å
205	A	70.3	Confident	62.8	Low	36 Å²	36	73.4 Å²	73.4	30%	0.298	40%	0.401	S	S	.	.	H	α-helix	trans	-63.6	-29.2	175	0	0	0	0	0	112.6	Y170 Q201 S202 S203 Y207 I208	Y170-A205 HydrophobicContact CD2-CB 4.5Å; Y170-A205 HydrophobicContact CE2-CB 3.87Å; Q201-A205 WeakPolarHBondContact O-CB 3.49Å; Q201-A205 PolarHBondContact O-N 3.04Å; S202-A205 WeakPolarHBondContact O-CB 3.35Å; S202-A205 PolarHBondContact O-N 2.86Å; S203-A205 VanDerWaalsContact C-N 3.34Å; S203-A205 PolarHBondContact O-N 3.46Å; A205-Y207 PolarHBondContact O-N 2.91Å; A205-I208 WeakPolarHBondContact O-CD1 3.35Å; A205-I208 WeakPolarHBondContact O-CG1 3.32Å
206	N	62.9	Low	59.9	Low	132 Å²	132	77 Å²	77	71%	0.706	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-13.8	176.8	-68	-15.5	0	0	0	113.2	Y204	Y204-N206 PolarHBondContact O-N 2.83Å
207	Y	61.1	Low	57	Low	59 Å²	59	84.8 Å²	84.8	23%	0.231	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	22.3	-177.1	-54.8	-68.1	0	0	0	113.1	S203 Y204 A205 M242 L246	S203-Y207 WeakPolarHBondContact O-CD2 3.38Å; S203-Y207 WeakPolarHBondContact O-CE2 3.46Å; Y204-Y207 PolarHBondContact O-N 2.83Å; Y204-Y207 VanDerWaalsContact O-N 3.11Å; A205-Y207 PolarHBondContact O-N 2.91Å; Y207-M242 HydrophobicContact CD1-SD 4.46Å; Y207-M242 HydrophobicContact CE1-CG 4.08Å; Y207-M242 HydrophobicContact CE1-SD 3.51Å; Y207-M242 VanDerWaalsContact CE1-SD 3.51Å; Y207-M242 WeakPolarHBondContact OH-CG 3.28Å; Y207-L246 HydrophobicContact CD2-CD2 4.24Å; Y207-L246 HydrophobicContact CE2-CD2 4.16Å
208	I	57.3	Low	54.4	Low	66 Å²	66	92 Å²	92	34%	0.338	49%	0.487	S	S	.	.	S	Bend	trans	-55.5	147.6	170.4	-70.6	167.7	0	0	0	110.5	A205 T210	A205-I208 WeakPolarHBondContact O-CD1 3.35Å; A205-I208 WeakPolarHBondContact O-CG1 3.32Å; I208-T210 VanDerWaalsContact C-N 3.3Å; I208-T210 PolarHBondContact O-N 2.8Å
209	M	53.3	Low	51.9	Low	58 Å²	58	89.3 Å²	89.3	29%	0.286	48%	0.481	S	S	.	.			trans	-61.1	86.9	170.8	-79.2	174.2	125.6	0	0	111.1	L127 T211	L127-M209 HydrophobicContact CD1-CE 4.28Å; L127-M209 HydrophobicContact CD2-CE 3.7Å; L127-M209 HydrophobicContact CD2-SD 4.17Å; M209-T211 PolarHBondContact O-N 3.5Å
210	T	38.6	Very low	49.6	Very low	94 Å²	94	91.6 Å²	91.6	58%	0.577	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	65.8	169	57.9	0	0	0	0	109.8	I208 K232	I208-T210 VanDerWaalsContact C-N 3.3Å; I208-T210 PolarHBondContact O-N 2.8Å; T210-K232 PolarHBondContact OG1-NZ 3.28Å; T210-K232 VanDerWaalsContact OG1-NZ 3.11Å
211	T	38.5	Very low	47.2	Very low	64 Å²	64	99.4 Å²	99.4	39%	0.393	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-157	15.1	-176.7	-21.3	0	0	0	0	114.4	M209 Y229	M209-T211 PolarHBondContact O-N 3.5Å; T211-Y229 HydrophobicContact CG2-CD1 4.22Å; T211-Y229 HydrophobicContact CG2-CE1 4.07Å
212	T	36.4	Very low	45	Very low	118 Å²	118	102.9 Å²	102.9	72%	0.724	57%	0.567	S	S	*	*			trans	-121.8	24.2	-178.1	58.6	0	0	0	0	115
213	N	31.1	Very low	42.8	Very low	148 Å²	148	104 Å²	104	79%	0.791	57%	0.574	S	S	*	*	S	Bend	trans	-101.1	127.9	155.8	-70.1	-0.9	0	0	0	106.8
214	N	29.8	Very low	40.7	Very low	157 Å²	157	111.5 Å²	111.5	84%	0.84	61%	0.611	S	S	*	*	S	Bend	trans	76.6	72	-173.4	-49.3	-19.6	0	0	0	116.4
215	T	32.8	Very low	38.6	Very low	127 Å²	127	114.2 Å²	114.2	78%	0.779	64%	0.639	S	S	*	*				-179.7	130	123	25.9	0	0	0	0	113.3	Y217	T215-Y217 HydrophobicContact CG2-CD2 4.45Å; T215-Y217 PolarHBondContact O-N 3.21Å
216	T	26.1	Very low	36.7	Very low	136 Å²	136	120.6 Å²	120.6	83%	0.834	67%	0.668	S	S	*	*			trans	-87.5	81.1	178.1	34.7	0	0	0	0	112.2
217	Y	29.7	Very low	35.4	Very low	172 Å²	172	120.8 Å²	120.8	68%	0.675	67%	0.669	S	S	*	*			trans	-128.4	105.7	179.2	-87.4	-102.4	0	0	0	111.5	T215	T215-Y217 HydrophobicContact CG2-CD2 4.45Å; T215-Y217 PolarHBondContact O-N 3.21Å
218	K	32.1	Very low	34.1	Very low	158 Å²	158	125.1 Å²	125.1	69%	0.687	70%	0.697	S	S	*	*				92.7	112.4	74.5	-87.1	-171.1	-163.2	159.6	0	112.5
219	N	27.5	Very low	33.5	Very low	135 Å²	135	129.9 Å²	129.9	72%	0.722	71%	0.711	S	S	*	*			trans	-3.8	137.6	150.2	-77.5	-16.1	0	0	0	119
220	N	28.6	Very low	33	Very low	120 Å²	120	133.1 Å²	133.1	64%	0.642	73%	0.73	S	S	*	*	S	Bend	trans	61.2	120.7	135.4	-57	-19.3	0	0	0	119.5	S222	N220-S222 PolarHBondContact O-N 2.86Å; N220-S222 VanDerWaalsContact O-N 3.1Å
221	N	29.6	Very low	33.3	Very low	174 Å²	174	131.7 Å²	131.7	93%	0.93	72%	0.717	S	S	*	*			trans	44.5	56.4	132.8	-59.6	-15.4	0	0	0	117
222	S	33.6	Very low	34.1	Very low	107 Å²	107	133.9 Å²	133.9	75%	0.748	72%	0.721	S	S	*	*			trans	-129.5	129.6	161.6	45.9	0	0	0	0	111	N220	N220-S222 PolarHBondContact O-N 2.86Å; N220-S222 VanDerWaalsContact O-N 3.1Å
223	S	27.9	Very low	34.8	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	72%	0.719	S	S	*	*			trans	-66.1	169.9	161.4	46.1	0	0	0	0	111.5
224	I	31	Very low	36.1	Very low	178 Å²	178	131 Å²	131	91%	0.913	69%	0.694	S	S	*	*			trans	100.8	137.2	169.8	-55.3	151.9	0	0	0	113.4
225	G	31.7	Very low	37.2	Very low	59 Å²	59	129.2 Å²	129.2	61%	0.608	68%	0.684	S	S	*	*			trans	105.6	82.1	169.2	0	0	0	0	0	115.1
226	D	31.6	Very low	38.4	Very low	169 Å²	169	129.5 Å²	129.5	90%	0.904	68%	0.677	S	S	*	*			trans	-84.8	93.7	153.5	-72	-56.2	0	0	0	106.9
227	D	34.9	Very low	40	Very low	136 Å²	136	130.2 Å²	130.2	73%	0.727	67%	0.674	S	S	*	*			trans	-147.6	133.3	175.4	-78.4	-56.4	0	0	0	112.6
228	D	33.5	Very low	41.8	Very low	151 Å²	151	125.6 Å²	125.6	81%	0.807	66%	0.662	S	S	*	*			trans	23	99.9	162.5	-65.5	-17.8	0	0	0	121.3
229	Y	45.2	Very low	43.5	Very low	165 Å²	165	118.4 Å²	118.4	65%	0.647	63%	0.63	S	S	*	*			trans	-107.8	108.1	147.6	-88.5	-96.7	0	0	0	110.1	T211 E231	T211-Y229 HydrophobicContact CG2-CD1 4.22Å; T211-Y229 HydrophobicContact CG2-CE1 4.07Å; Y229-E231 PolarHBondContact O-N 3.49Å
230	N	42.9	Very low	45.4	Very low	126 Å²	126	115.7 Å²	115.7	67%	0.674	61%	0.613	S	S	*	*			trans	-20.5	108.9	-179.4	-63.9	-38.1	0	0	0	116.4	K232	N230-K232 PolarHBondContact O-N 3.07Å
231	E	45.4	Very low	47.3	Very low	65 Å²	65	112.4 Å²	112.4	30%	0.304	60%	0.6	S	S	.	*			trans	-74.3	103.4	171.8	-171.1	159.6	-125.6	0	0	109.6	R135 S137 K139 Y229 Q233	R135-E231 IonicContact NH1-OE1 2.71Å; R135-E231 IonicContact NH1-OE2 3.45Å; R135-E231 PolarHBondContact NH1-OE2 3.02Å; R135-E231 VanDerWaalsContact NH1-OE2 3.16Å; S137-E231 PolarHBondContact OG-OE1 3.06Å; K139-E231 IonicContact NZ-OE1 2.69Å; K139-E231 PolarHBondContact NZ-OE1 2.78Å; Y229-E231 PolarHBondContact O-N 3.49Å; E231-Q233 PolarHBondContact O-N 2.98Å
232	K	54.9	Low	49.2	Very low	109 Å²	109	104.4 Å²	104.4	47%	0.474	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.9	106.3	168.5	-70.9	-176.1	-175.8	174.2	0	108.3	T210 N230 F234	T210-K232 PolarHBondContact OG1-NZ 3.28Å; T210-K232 VanDerWaalsContact OG1-NZ 3.11Å; N230-K232 PolarHBondContact O-N 3.07Å; K232-F234 HydrophobicContact CB-CD2 4.47Å; K232-F234 HydrophobicContact CB-CE2 3.69Å; K232-F234 HydrophobicContact CB-CZ 3.95Å; K232-F234 HydrophobicContact CD-CZ 4.42Å; K232-F234 VanDerWaalsContact O-CD2 3.3Å; K232-F234 WeakPolarHBondContact O-CD2 3.5Å; K232-F234 VanDerWaalsContact O-CE2 3.31Å; K232-F234 WeakPolarHBondContact O-CE2 3.29Å
233	Q	51.2	Low	51.2	Low	147 Å²	147	99.7 Å²	99.7	69%	0.687	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	136.2	166.6	-68.1	-179.7	-5.7	0	0	109	E231	E231-Q233 PolarHBondContact O-N 2.98Å
234	F	58.7	Low	53.3	Low	60 Å²	60	98.1 Å²	98.1	26%	0.263	50%	0.504	S	S	.	.			trans	-113.8	147.4	-179.1	-66.6	-93.7	0	0	0	110.5	K136 K232 D238 F239 M242	K136-F234 PolarHBondContact O-N 3.28Å; K232-F234 HydrophobicContact CB-CD2 4.47Å; K232-F234 HydrophobicContact CB-CE2 3.69Å; K232-F234 HydrophobicContact CB-CZ 3.95Å; K232-F234 HydrophobicContact CD-CZ 4.42Å; K232-F234 VanDerWaalsContact O-CD2 3.3Å; K232-F234 WeakPolarHBondContact O-CD2 3.5Å; K232-F234 VanDerWaalsContact O-CE2 3.31Å; K232-F234 WeakPolarHBondContact O-CE2 3.29Å; F234-D238 HydrophobicContact CB-CB 4.3Å; F234-D238 HydrophobicContact CD1-CB 4.35Å; F234-F239 HydrophobicContact CB-CB 4.08Å; F234-F239 HydrophobicContact CB-CD2 4.4Å; F234-M242 HydrophobicContact CB-CE 4.26Å; F234-M242 HydrophobicContact CD1-CE 3.88Å; F234-M242 HydrophobicContact CD1-SD 4.35Å; F234-M242 HydrophobicContact CD2-CE 3.42Å; F234-M242 VanDerWaalsContact CD2-CE 3.42Å; F234-M242 HydrophobicContact CD2-SD 4.42Å; F234-M242 HydrophobicContact CE1-CE 4.01Å; F234-M242 HydrophobicContact CE1-SD 3.94Å; F234-M242 HydrophobicContact CE2-CE 3.56Å; F234-M242 HydrophobicContact CE2-SD 4.02Å; F234-M242 HydrophobicContact CG-CE 3.58Å; F234-M242 HydrophobicContact CZ-CE 3.85Å; F234-M242 HydrophobicContact CZ-SD 3.75Å
235	N	52.8	Low	55.4	Low	119 Å²	119	94.7 Å²	94.7	64%	0.636	48%	0.484	S	S	*	.			trans	-65.2	159.3	169.1	-57.3	-54.6	0	0	0	109.9	L237 D238 F239	N235-L237 VanDerWaalsContact C-N 3.34Å; N235-L237 PolarHBondContact O-N 2.96Å; N235-D238 WeakPolarHBondContact CB-OD2 3.16Å; N235-D238 PolarHBondContact ND2-OD2 3.02Å; N235-D238 PolarHBondContact O-N 2.76Å; N235-D238 VanDerWaalsContact O-N 3.09Å; N235-F239 WeakPolarHBondContact O-CB 3.32Å; N235-F239 PolarHBondContact O-N 2.91Å
236	E	57.4	Low	57.6	Low	133 Å²	133	92 Å²	92	62%	0.621	46%	0.456	S	S	*	.	H	α-helix	trans	-58.8	-40.4	-173.5	-174	149.9	-130.2	0	0	114	K136 Q240	K136-E236 IonicContact NZ-OE1 2.7Å; K136-E236 PolarHBondContact NZ-OE1 3.25Å; K136-E236 IonicContact NZ-OE2 3.12Å; K136-E236 PolarHBondContact NZ-OE2 3.49Å; E236-Q240 WeakPolarHBondContact O-CB 3.42Å; E236-Q240 PolarHBondContact O-N 3.25Å
237	L	60.4	Low	59.9	Low	150 Å²	150	84.7 Å²	84.7	79%	0.785	42%	0.416	S	S	*	.	H	α-helix	trans	-68	-39.7	175.1	-74.3	152.5	0	0	0	112.6	N235 S241	N235-L237 VanDerWaalsContact C-N 3.34Å; N235-L237 PolarHBondContact O-N 2.96Å; L237-S241 WeakPolarHBondContact O-CB 3.35Å; L237-S241 PolarHBondContact O-N 2.95Å; L237-S241 VanDerWaalsContact O-N 3.17Å; L237-S241 PolarHBondContact O-OG 3.41Å
238	D	66.9	Low	62.3	Low	76 Å²	76	78.2 Å²	78.2	41%	0.406	38%	0.381	S	S	.	.	H	α-helix	trans	-69.5	-36.9	178.3	-57.4	-32.7	0	0	0	110.9	F234 N235 S241 M242	F234-D238 HydrophobicContact CB-CB 4.3Å; F234-D238 HydrophobicContact CD1-CB 4.35Å; N235-D238 WeakPolarHBondContact CB-OD2 3.16Å; N235-D238 PolarHBondContact ND2-OD2 3.02Å; N235-D238 PolarHBondContact O-N 2.76Å; N235-D238 VanDerWaalsContact O-N 3.09Å; D238-S241 PolarHBondContact O-OG 2.87Å; D238-M242 WeakPolarHBondContact O-CB 3.31Å; D238-M242 PolarHBondContact O-N 3.39Å
239	F	68.8	Low	64.8	Low	7 Å²	7	72.5 Å²	72.5	3%	0.031	35%	0.35	C	S	.	.	H	α-helix	trans	-69	-45.3	177.7	-171.3	-109.9	0	0	0	111.8	I131 F133 K136 F234 N235 M242 I243	I131-F239 HydrophobicContact CG2-CE2 3.99Å; I131-F239 HydrophobicContact CG2-CZ 3.8Å; F133-F239 HydrophobicContact CD1-CE1 4.28Å; F133-F239 HydrophobicContact CG-CE1 4.46Å; F133-F239 HydrophobicContact CG-CZ 4.44Å; K136-F239 VanDerWaalsContact C-CE2 3.46Å; K136-F239 HydrophobicContact CB-CB 4.42Å; K136-F239 HydrophobicContact CB-CD1 4.1Å; K136-F239 HydrophobicContact CB-CD2 3.96Å; K136-F239 HydrophobicContact CB-CE1 4.3Å; K136-F239 HydrophobicContact CB-CE2 4.21Å; K136-F239 HydrophobicContact CB-CG 3.91Å; K136-F239 HydrophobicContact CB-CZ 4.37Å; K136-F239 HydrophobicContact CG-CD1 3.83Å; K136-F239 HydrophobicContact CG-CE1 4Å; K136-F239 HydrophobicContact CG-CG 4.13Å; K136-F239 HydrophobicContact CG-CZ 4.49Å; F234-F239 HydrophobicContact CB-CB 4.08Å; F234-F239 HydrophobicContact CB-CD2 4.4Å; N235-F239 WeakPolarHBondContact O-CB 3.32Å; N235-F239 PolarHBondContact O-N 2.91Å; F239-M242 HydrophobicContact CD2-CE 3.71Å; F239-M242 HydrophobicContact CE2-CE 4.33Å; F239-M242 PolarHBondContact O-N 2.87Å; F239-I243 HydrophobicContact CD1-CD1 3.62Å; F239-I243 HydrophobicContact CE1-CD1 3.29Å; F239-I243 HydrophobicContact CE1-CG1 4.41Å; F239-I243 HydrophobicContact CE2-CD1 4.3Å; F239-I243 HydrophobicContact CG-CD1 4.28Å; F239-I243 HydrophobicContact CZ-CD1 3.66Å; F239-I243 HydrophobicContact CZ-CG1 4.43Å; F239-I243 WeakPolarHBondContact O-CG1 3.35Å; F239-I243 PolarHBondContact O-N 2.98Å
240	Q	65.8	Low	66.8	Low	77 Å²	77	64.6 Å²	64.6	36%	0.36	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-50.5	179	-164.9	73.8	1.4	0	0	111.4	E236 M242 I243 E244	E236-Q240 WeakPolarHBondContact O-CB 3.42Å; E236-Q240 PolarHBondContact O-N 3.25Å; Q240-M242 VanDerWaalsContact C-N 3.32Å; Q240-M242 PolarHBondContact O-N 3.19Å; Q240-I243 PolarHBondContact O-N 3.39Å; Q240-E244 PolarHBondContact O-N 2.97Å; Q240-E244 VanDerWaalsContact O-N 3.1Å
241	S	68.7	Low	68.8	Low	51 Å²	51	59.1 Å²	59.1	36%	0.357	29%	0.289	S	S	.	.	H	α-helix	trans	-63.9	-35.3	178	56.5	0	0	0	0	112.5	L237 D238 E244 H245	L237-S241 WeakPolarHBondContact O-CB 3.35Å; L237-S241 PolarHBondContact O-N 2.95Å; L237-S241 VanDerWaalsContact O-N 3.17Å; L237-S241 PolarHBondContact O-OG 3.41Å; D238-S241 PolarHBondContact O-OG 2.87Å; S241-E244 PolarHBondContact O-N 2.79Å; S241-H245 PolarHBondContact O-N 3.15Å; S241-H245 PolarHBondContact O-ND1 3.03Å
242	M	70.9	Confident	70.8	Confident	6 Å²	6	56.2 Å²	56.2	3%	0.03	28%	0.276	C	S	.	.	H	α-helix	trans	-65.1	-40.8	172.3	172.2	168.4	62.3	0	0	112.8	I138 Y207 F234 D238 F239 Q240 E244 H245 L246	I138-M242 HydrophobicContact CD1-CE 3.49Å; I138-M242 VanDerWaalsContact CD1-CE 3.49Å; I138-M242 HydrophobicContact CD1-CG 4.04Å; I138-M242 HydrophobicContact CD1-SD 3.47Å; I138-M242 WeakPolarHBondContact CD1-SD 3.46Å; I138-M242 HydrophobicContact CG1-CE 3.89Å; I138-M242 HydrophobicContact CG1-SD 4.35Å; Y207-M242 HydrophobicContact CD1-SD 4.46Å; Y207-M242 HydrophobicContact CE1-CG 4.08Å; Y207-M242 HydrophobicContact CE1-SD 3.51Å; Y207-M242 VanDerWaalsContact CE1-SD 3.51Å; Y207-M242 WeakPolarHBondContact OH-CG 3.28Å; F234-M242 HydrophobicContact CB-CE 4.26Å; F234-M242 HydrophobicContact CD1-CE 3.88Å; F234-M242 HydrophobicContact CD1-SD 4.35Å; F234-M242 HydrophobicContact CD2-CE 3.42Å; F234-M242 VanDerWaalsContact CD2-CE 3.42Å; F234-M242 HydrophobicContact CD2-SD 4.42Å; F234-M242 HydrophobicContact CE1-CE 4.01Å; F234-M242 HydrophobicContact CE1-SD 3.94Å; F234-M242 HydrophobicContact CE2-CE 3.56Å; F234-M242 HydrophobicContact CE2-SD 4.02Å; F234-M242 HydrophobicContact CG-CE 3.58Å; F234-M242 HydrophobicContact CZ-CE 3.85Å; F234-M242 HydrophobicContact CZ-SD 3.75Å; D238-M242 WeakPolarHBondContact O-CB 3.31Å; D238-M242 PolarHBondContact O-N 3.39Å; F239-M242 HydrophobicContact CD2-CE 3.71Å; F239-M242 HydrophobicContact CE2-CE 4.33Å; F239-M242 PolarHBondContact O-N 2.87Å; Q240-M242 VanDerWaalsContact C-N 3.32Å; Q240-M242 PolarHBondContact O-N 3.19Å; M242-E244 VanDerWaalsContact C-N 3.32Å; M242-E244 PolarHBondContact O-N 3.01Å; M242-H245 PolarHBondContact O-N 2.61Å; M242-L246 HydrophobicContact CG-CD1 3.88Å; M242-L246 WeakPolarHBondContact O-CG 3.41Å; M242-L246 PolarHBondContact O-N 3.12Å; M242-L246 VanDerWaalsContact O-N 3.13Å
243	I	74.3	Confident	72.3	Confident	8 Å²	8	53 Å²	53	4%	0.041	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-40.1	175.8	-69.4	165.2	0	0	0	110.6	L32 F133 F239 Q240 H245 L246 Y247	L32-I243 HydrophobicContact CD2-CG2 3.75Å; F133-I243 HydrophobicContact CD1-CD1 4.4Å; F133-I243 HydrophobicContact CE1-CD1 3.6Å; F133-I243 HydrophobicContact CE2-CD1 4.34Å; F133-I243 HydrophobicContact CZ-CD1 3.56Å; F133-I243 HydrophobicContact CZ-CG1 4.3Å; F133-I243 HydrophobicContact CZ-CG2 4.48Å; F239-I243 HydrophobicContact CD1-CD1 3.62Å; F239-I243 HydrophobicContact CE1-CD1 3.29Å; F239-I243 HydrophobicContact CE1-CG1 4.41Å; F239-I243 HydrophobicContact CE2-CD1 4.3Å; F239-I243 HydrophobicContact CG-CD1 4.28Å; F239-I243 HydrophobicContact CZ-CD1 3.66Å; F239-I243 HydrophobicContact CZ-CG1 4.43Å; F239-I243 WeakPolarHBondContact O-CG1 3.35Å; F239-I243 PolarHBondContact O-N 2.98Å; Q240-I243 PolarHBondContact O-N 3.39Å; I243-H245 VanDerWaalsContact C-N 3.28Å; I243-H245 PolarHBondContact O-N 3.46Å; I243-L246 CarbonylContact O-C 3.53Å; I243-L246 PolarHBondContact O-N 3.14Å; I243-Y247 WeakPolarHBondContact O-CB 3.44Å; I243-Y247 PolarHBondContact O-N 2.78Å
244	E	72.3	Confident	74	Confident	68 Å²	68	49.9 Å²	49.9	32%	0.318	25%	0.248	S	C	.	.	H	α-helix	trans	-58.3	-38.2	175.1	-70.2	178.7	168.3	0	0	112.6	L32 Q240 S241 M242 L246 A269	L32-E244 HydrophobicContact CD1-CG 3.8Å; L32-E244 HydrophobicContact CD2-CG 3.99Å; Q240-E244 PolarHBondContact O-N 2.97Å; Q240-E244 VanDerWaalsContact O-N 3.1Å; S241-E244 PolarHBondContact O-N 2.79Å; M242-E244 VanDerWaalsContact C-N 3.32Å; M242-E244 PolarHBondContact O-N 3.01Å; E244-L246 VanDerWaalsContact C-N 3.34Å; E244-A269 HydrophobicContact CB-CB 4.25Å; E244-A269 VanDerWaalsContact O-CB 3.28Å; E244-A269 WeakPolarHBondContact O-CB 3.1Å
245	H	75.7	Confident	75.3	Confident	106 Å²	106	48.6 Å²	48.6	49%	0.491	25%	0.246	S	C	.	.	H	α-helix	trans	-73.3	-22.7	175.6	-72.7	80.5	0	0	0	113.8	Y200 S241 M242 I243	Y200-H245 WeakPolarHBondContact CE1-O 3.13Å; S241-H245 PolarHBondContact O-N 3.15Å; S241-H245 PolarHBondContact O-ND1 3.03Å; M242-H245 PolarHBondContact O-N 2.61Å; I243-H245 VanDerWaalsContact C-N 3.28Å; I243-H245 PolarHBondContact O-N 3.46Å
246	L	77.6	Confident	76.8	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-97.1	-16	-180	-68	174.5	0	0	0	113.3	I131 I138 Y204 Y207 M242 I243 E244	I131-L246 HydrophobicContact CD1-CD1 4.03Å; I138-L246 HydrophobicContact CD1-CD1 3.64Å; Y204-L246 HydrophobicContact CD1-CD2 4.25Å; Y204-L246 HydrophobicContact CE1-CD2 3.52Å; Y204-L246 HydrophobicContact CE2-CD2 4.3Å; Y204-L246 WeakPolarHBondContact OH-CD2 3.34Å; Y207-L246 HydrophobicContact CD2-CD2 4.24Å; Y207-L246 HydrophobicContact CE2-CD2 4.16Å; M242-L246 HydrophobicContact CG-CD1 3.88Å; M242-L246 WeakPolarHBondContact O-CG 3.41Å; M242-L246 PolarHBondContact O-N 3.12Å; M242-L246 VanDerWaalsContact O-N 3.13Å; I243-L246 CarbonylContact O-C 3.53Å; I243-L246 PolarHBondContact O-N 3.14Å; E244-L246 VanDerWaalsContact C-N 3.34Å
247	Y	80.6	Confident	77.8	Confident	16 Å²	16	41.6 Å²	41.6	6%	0.063	21%	0.21	C	C	.	.			trans	-71.1	129.3	179.2	-179.9	-85.1	0	0	0	110.9	Y25 Y29 I30 L32 Y200 I243 Q249 A269 L272	Y25-Y247 HydrophobicContact CD1-CE2 4.43Å; Y29-Y247 WeakPolarHBondContact O-CE2 3.47Å; I30-Y247 WeakPolarHBondContact O-CE2 3.37Å; I30-Y247 PolarHBondContact O-OH 3.31Å; L32-Y247 HydrophobicContact CD2-CD2 4.34Å; L32-Y247 HydrophobicContact CD2-CG 4.31Å; Y200-Y247 PolarHBondContact OH-O 2.97Å; I243-Y247 WeakPolarHBondContact O-CB 3.44Å; I243-Y247 PolarHBondContact O-N 2.78Å; Y247-Q249 HydrophobicContact CE1-CB 4.43Å; Y247-A269 HydrophobicContact CD1-CB 3.84Å; Y247-A269 HydrophobicContact CG-CB 4.27Å; Y247-L272 HydrophobicContact CD1-CD1 4.35Å; Y247-L272 HydrophobicContact CE1-CD1 3.89Å; Y247-L272 HydrophobicContact CE2-CD1 4.14Å
248	L	83.6	Confident	78.6	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	118.6	-176.1	170.7	62.1	0	0	0	108.7	A26 L169 L197 Y200 V250 Y266 L315	A26-L248 HydrophobicContact CB-CB 3.91Å; A26-L248 PolarHBondContact N-O 3.35Å; L169-L248 HydrophobicContact CD2-CD2 3.61Å; L197-L248 HydrophobicContact CD1-CD2 4.27Å; Y200-L248 HydrophobicContact CE1-CB 4.32Å; Y200-L248 HydrophobicContact CE2-CD1 3.78Å; Y200-L248 HydrophobicContact CE2-CD2 4.49Å; L248-V250 HydrophobicContact CD1-CG2 4.28Å; L248-V250 HydrophobicContact CD2-CG2 4.27Å; L248-V250 HydrophobicContact CG-CG2 4Å; L248-Y266 HydrophobicContact CD1-CD2 3.49Å; L248-Y266 VanDerWaalsContact CD1-CD2 3.49Å; L248-Y266 HydrophobicContact CD1-CE2 4.43Å; L248-Y266 HydrophobicContact CD1-CG 3.81Å; L248-L315 HydrophobicContact CD2-CD2 4.05Å
249	Q	86.1	Confident	79.1	Confident	30 Å²	30	36.3 Å²	36.3	14%	0.14	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	121.1	172.5	-176	-167.6	46.7	0	0	109	Y25 Y247 I251 Y266 K267	Y25-Q249 HydrophobicContact CD1-CB 4.29Å; Y25-Q249 HydrophobicContact CD1-CG 4.06Å; Y25-Q249 HydrophobicContact CE1-CB 4.26Å; Y25-Q249 HydrophobicContact CE1-CG 3.66Å; Y25-Q249 PolarHBondContact OH-NE2 3.11Å; Y247-Q249 HydrophobicContact CE1-CB 4.43Å; Q249-I251 HydrophobicContact CG-CG1 4.44Å; Q249-Y266 CarbonylContact O-C 3.59Å; Q249-Y266 WeakPolarHBondContact O-CA 3.19Å; Q249-Y266 WeakPolarHBondContact O-CB 3.5Å; Q249-K267 HydrophobicContact CB-CB 4.42Å; Q249-K267 PolarHBondContact N-O 3.44Å; Q249-K267 VanDerWaalsContact N-O 3.12Å; Q249-K267 PolarHBondContact O-N 3.49Å
250	V	86.9	Confident	79.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.4	178.1	177.6	0	0	0	0	109.8	Q23 V24 L167 L248 C252 L294 L315 I317	Q23-V250 CarbonylContact C-O 3.52Å; Q23-V250 WeakPolarHBondContact CA-O 3.38Å; V24-V250 HydrophobicContact CB-CB 4.36Å; V24-V250 PolarHBondContact N-O 2.89Å; V24-V250 PolarHBondContact O-N 3.39Å; L167-V250 HydrophobicContact CD2-CG1 4.47Å; L167-V250 HydrophobicContact CD2-CG2 3.69Å; L248-V250 HydrophobicContact CD1-CG2 4.28Å; L248-V250 HydrophobicContact CD2-CG2 4.27Å; L248-V250 HydrophobicContact CG-CG2 4Å; V250-C252 HydrophobicContact CG1-CB 4.37Å; V250-L294 HydrophobicContact CG1-CD1 3.64Å; V250-L315 HydrophobicContact CG2-CD2 3.86Å; V250-I317 HydrophobicContact CB-CD1 4.4Å; V250-I317 HydrophobicContact CG1-CD1 4.1Å; V250-I317 HydrophobicContact CG2-CD1 4.48Å
251	I	86.2	Confident	80.2	Confident	11 Å²	11	38.6 Å²	38.6	6%	0.056	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	110.3	174.7	-53.7	-173.7	0	0	0	108.1	K21 R22 Q23 Q249 G264 Y265	K21-I251 HydrophobicContact CB-CG2 4.15Å; K21-I251 HydrophobicContact CD-CG2 3.79Å; K21-I251 HydrophobicContact CG-CG2 4.46Å; R22-I251 WeakPolarHBondContact O-CA 3.43Å; Q23-I251 HydrophobicContact CG-CG1 4.29Å; Q249-I251 HydrophobicContact CG-CG1 4.44Å; I251-G264 CarbonylContact O-C 3.59Å; I251-G264 WeakPolarHBondContact O-CA 3.41Å; I251-Y265 HydrophobicContact CB-CD1 4.41Å; I251-Y265 HydrophobicContact CB-CD2 4.42Å; I251-Y265 HydrophobicContact CB-CE1 3.98Å; I251-Y265 HydrophobicContact CB-CE2 4.02Å; I251-Y265 HydrophobicContact CD1-CE2 3.85Å; I251-Y265 HydrophobicContact CG1-CE2 4.27Å; I251-Y265 HydrophobicContact CG2-CE1 3.89Å; I251-Y265 PolarHBondContact N-O 3.09Å; I251-Y265 PolarHBondContact O-N 2.95Å
252	C	87.6	Confident	81	Confident	3 Å²	3	36.5 Å²	36.5	2%	0.02	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	171.9	-173.4	58.1	0	0	0	0	112.5	K21 R22 V250 F262	K21-C252 CarbonylContact C-O 3.53Å; K21-C252 WeakPolarHBondContact CA-O 3.24Å; R22-C252 PolarHBondContact N-O 3.32Å; R22-C252 PolarHBondContact O-N 3.42Å; V250-C252 HydrophobicContact CG1-CB 4.37Å; C252-F262 HydrophobicContact CB-CE2 3.75Å; C252-F262 HydrophobicContact CB-CZ 3.79Å
253	E	86.8	Confident	81.6	Confident	41 Å²	41	42.9 Å²	42.9	19%	0.192	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	166.5	169.9	61.9	178	-176.9	0	0	112.9	N256 S261 F262 Q263 Y318 K324	E253-N256 PolarHBondContact OE1-ND2 3.19Å; E253-N256 PolarHBondContact OE2-ND2 2.97Å; E253-S261 VanDerWaalsContact OE1-O 3.1Å; E253-F262 HydrophobicContact CG-CD2 4.26Å; E253-F262 WeakPolarHBondContact OE1-CA 3.5Å; E253-Q263 PolarHBondContact N-O 2.98Å; E253-Y318 PolarHBondContact O-OH 3.24Å; E253-K324 IonicContact OE1-NZ 3.81Å
254	Q	86.8	Confident	82.1	Confident	82 Å²	82	43.4 Å²	43.4	38%	0.383	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-74.5	152.3	167.2	-72.1	-67.5	-11.7	0	0	110.5	K21 N256	K21-Q254 PolarHBondContact O-NE2 3.16Å; Q254-N256 PolarHBondContact O-N 3.18Å
255	P	85.7	Confident	82.7	Confident	33 Å²	33	43 Å²	43	21%	0.214	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-61.2	124.4	-173.3	24.4	-33.2	0	0	0	111.7	Y318 D322 L327	P255-Y318 HydrophobicContact CB-CD1 3.78Å; P255-Y318 HydrophobicContact CB-CE1 3.63Å; P255-Y318 HydrophobicContact CB-CG 4.41Å; P255-Y318 HydrophobicContact CG-CD1 4.37Å; P255-Y318 HydrophobicContact CG-CE1 4.2Å; P255-D322 HydrophobicContact CB-CB 4.06Å; P255-D322 VanDerWaalsContact CB-O 3.27Å; P255-D322 WeakPolarHBondContact CB-O 3.32Å; P255-D322 HydrophobicContact CG-CB 4.04Å; P255-L327 HydrophobicContact CB-CD1 4.12Å
256	N	84.2	Confident	83.2	Confident	36 Å²	36	38.6 Å²	38.6	19%	0.193	20%	0.201	C	C	.	.			trans	-117.4	159.5	-175.6	63.5	21.3	0	0	0	112.1	E253 Q254 N258 S261 K324 L327	E253-N256 PolarHBondContact OE1-ND2 3.19Å; E253-N256 PolarHBondContact OE2-ND2 2.97Å; Q254-N256 PolarHBondContact O-N 3.18Å; N256-N258 VanDerWaalsContact C-N 3.3Å; N256-N258 PolarHBondContact OD1-O 2.83Å; N256-S261 PolarHBondContact ND2-OG 2.82Å; N256-K324 WeakPolarHBondContact O-CG 3.35Å; N256-K324 VanDerWaalsContact OD1-CE 3.23Å; N256-K324 WeakPolarHBondContact OD1-CE 3.36Å; N256-K324 PolarHBondContact OD1-NZ 3.42Å; N256-L327 WeakPolarHBondContact O-CD1 3.31Å
257	E	78.7	Confident	83.4	Confident	69 Å²	69	39.8 Å²	39.8	32%	0.322	21%	0.206	S	C	.	.	S	Bend	trans	-79.7	-11.3	179.9	64.2	-171.6	-168.6	0	0	113.6	L259 L327 N328 K331	E257-L259 PolarHBondContact O-N 3.08Å; E257-L327 HydrophobicContact CB-CB 4.39Å; E257-N328 PolarHBondContact O-ND2 2.8Å; E257-K331 IonicContact OE2-NZ 3.74Å; E257-K331 PolarHBondContact OE2-NZ 3.09Å
258	N	76	Confident	83.2	Confident	74 Å²	74	39.9 Å²	39.9	40%	0.396	21%	0.208	S	C	.	.			trans	-83.3	115.4	-177	-176.7	22.4	0	0	0	111.8	N256 T260 S261 K324	N256-N258 VanDerWaalsContact C-N 3.3Å; N256-N258 PolarHBondContact OD1-O 2.83Å; N258-T260 VanDerWaalsContact C-N 3.27Å; N258-T260 PolarHBondContact ND2-OG1 2.86Å; N258-T260 PolarHBondContact O-N 2.83Å; N258-T260 PolarHBondContact OD1-N 3.03Å; N258-T260 PolarHBondContact OD1-OG1 2.85Å; N258-S261 WeakPolarHBondContact CB-OG 3.1Å; N258-S261 WeakPolarHBondContact ND2-CB 3.36Å; N258-S261 PolarHBondContact ND2-OG 2.69Å; N258-K324 WeakPolarHBondContact O-CD 3.38Å; N258-K324 PolarHBondContact O-NZ 3.05Å
259	L	77.9	Confident	82.3	Confident	42 Å²	42	40.4 Å²	40.4	22%	0.22	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-30.5	-179	-58.4	174.2	0	0	0	112.9	L185 E257 L301 K324	L185-L259 HydrophobicContact CB-CD1 4.5Å; E257-L259 PolarHBondContact O-N 3.08Å; L259-L301 HydrophobicContact CB-CD1 4.2Å; L259-L301 HydrophobicContact CD2-CD1 3.88Å; L259-K324 HydrophobicContact CD2-CB 3.92Å
260	T	76.8	Confident	81.1	Confident	96 Å²	96	46.3 Å²	46.3	59%	0.589	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96	-12.8	-170.4	59.5	0	0	0	0	115.5	N258 Y296	N258-T260 VanDerWaalsContact C-N 3.27Å; N258-T260 PolarHBondContact ND2-OG1 2.86Å; N258-T260 PolarHBondContact O-N 2.83Å; N258-T260 PolarHBondContact OD1-N 3.03Å; N258-T260 PolarHBondContact OD1-OG1 2.85Å; T260-Y296 WeakPolarHBondContact O-CD1 3.35Å
261	S	79.8	Confident	79.5	Confident	36 Å²	36	49.7 Å²	49.7	25%	0.252	26%	0.256	S	S	.	.			trans	-101.8	120	176.5	56.4	0	0	0	0	110.8	E253 N256 N258 K324	E253-S261 VanDerWaalsContact OE1-O 3.1Å; N256-S261 PolarHBondContact ND2-OG 2.82Å; N258-S261 WeakPolarHBondContact CB-OG 3.1Å; N258-S261 WeakPolarHBondContact ND2-CB 3.36Å; N258-S261 PolarHBondContact ND2-OG 2.69Å; S261-K324 PolarHBondContact O-NZ 3.32Å
262	F	85.6	Confident	77.9	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.026	27%	0.27	C	S	.	.			trans	-140.3	128.2	161.9	177.3	-112.1	0	0	0	108.2	C252 E253 L294 Y296 L299 Y318	C252-F262 HydrophobicContact CB-CE2 3.75Å; C252-F262 HydrophobicContact CB-CZ 3.79Å; E253-F262 HydrophobicContact CG-CD2 4.26Å; E253-F262 WeakPolarHBondContact OE1-CA 3.5Å; F262-L294 HydrophobicContact CE1-CB 4.11Å; F262-L294 HydrophobicContact CE1-CD1 4.37Å; F262-Y296 PolarHBondContact O-N 2.69Å; F262-L299 HydrophobicContact CB-CD2 4.09Å; F262-L299 HydrophobicContact CD1-CB 3.77Å; F262-L299 HydrophobicContact CD1-CD2 4.12Å; F262-L299 HydrophobicContact CD1-CG 4.39Å; F262-L299 HydrophobicContact CD2-CD2 3.78Å; F262-L299 HydrophobicContact CE1-CB 4.09Å; F262-L299 HydrophobicContact CE1-CD1 4.28Å; F262-L299 HydrophobicContact CE1-CD2 4.49Å; F262-L299 HydrophobicContact CE2-CD2 4.17Å; F262-L299 HydrophobicContact CG-CB 4.2Å; F262-L299 HydrophobicContact CG-CD2 3.73Å; F262-L299 HydrophobicContact CG-CG 4.48Å; F262-L299 HydrophobicContact CZ-CD1 4.21Å; F262-Y318 HydrophobicContact CD2-CE2 4.41Å; F262-Y318 HydrophobicContact CE2-CE2 4.12Å
263	Q	84.3	Confident	76	Confident	140 Å²	140	58 Å²	58	65%	0.654	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	140.5	-178	-66.3	-175.6	-7	0	0	109.9	E253	E253-Q263 PolarHBondContact N-O 2.98Å
264	G	83.9	Confident	74	Confident	19 Å²	19	61.9 Å²	61.9	20%	0.196	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.8	-173.1	178.4	0	0	0	0	0	110.5	I251 L294	I251-G264 CarbonylContact O-C 3.59Å; I251-G264 WeakPolarHBondContact O-CA 3.41Å; G264-L294 PolarHBondContact O-N 3.1Å
265	Y	85.8	Confident	71.8	Confident	60 Å²	60	61.7 Å²	61.7	24%	0.235	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	165.2	171.9	55.6	-79.2	0	0	0	109.5	K21 I251 C291 F292	K21-Y265 PolarHBondContact NZ-OH 3.35Å; I251-Y265 HydrophobicContact CB-CD1 4.41Å; I251-Y265 HydrophobicContact CB-CD2 4.42Å; I251-Y265 HydrophobicContact CB-CE1 3.98Å; I251-Y265 HydrophobicContact CB-CE2 4.02Å; I251-Y265 HydrophobicContact CD1-CE2 3.85Å; I251-Y265 HydrophobicContact CG1-CE2 4.27Å; I251-Y265 HydrophobicContact CG2-CE1 3.89Å; I251-Y265 PolarHBondContact N-O 3.09Å; I251-Y265 PolarHBondContact O-N 2.95Å; Y265-C291 HydrophobicContact CD2-CB 3.87Å; Y265-C291 HydrophobicContact CG-CB 4.43Å; Y265-F292 CarbonylContact C-O 3.6Å; Y265-F292 WeakPolarHBondContact CA-O 3.11Å; Y265-F292 WeakPolarHBondContact CB-O 3.45Å
266	Y	87.2	Confident	69.7	Low	14 Å²	14	66.4 Å²	66.4	6%	0.055	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	152.9	171.7	67.7	-84.2	0	0	0	112.2	L197 Q199 Y200 L248 Q249 T268 F292 L294	L197-Y266 HydrophobicContact CD1-CD1 4.24Å; L197-Y266 HydrophobicContact CD1-CE1 4.03Å; L197-Y266 HydrophobicContact CD1-CE2 4.36Å; L197-Y266 HydrophobicContact CD1-CG 4.48Å; L197-Y266 HydrophobicContact CD2-CD1 4.4Å; L197-Y266 HydrophobicContact CD2-CE1 3.77Å; L197-Y266 HydrophobicContact CG-CE1 4.43Å; Q199-Y266 PolarHBondContact OE1-OH 3.16Å; Y200-Y266 HydrophobicContact CD2-CE2 4.34Å; Y200-Y266 HydrophobicContact CE2-CD2 4.14Å; Y200-Y266 AromaticContact CE2-CE2 3.83Å; Y200-Y266 HydrophobicContact CE2-CE2 3.83Å; L248-Y266 HydrophobicContact CD1-CD2 3.49Å; L248-Y266 VanDerWaalsContact CD1-CD2 3.49Å; L248-Y266 HydrophobicContact CD1-CE2 4.43Å; L248-Y266 HydrophobicContact CD1-CG 3.81Å; Q249-Y266 CarbonylContact O-C 3.59Å; Q249-Y266 WeakPolarHBondContact O-CA 3.19Å; Q249-Y266 WeakPolarHBondContact O-CB 3.5Å; Y266-T268 HydrophobicContact CE2-CG2 4.44Å; Y266-F292 HydrophobicContact CD1-CB 3.74Å; Y266-F292 WeakPolarHBondContact CD1-O 3.41Å; Y266-F292 HydrophobicContact CD2-CB 4.27Å; Y266-F292 HydrophobicContact CD2-CD2 4.36Å; Y266-F292 HydrophobicContact CE1-CB 3.26Å; Y266-F292 HydrophobicContact CE1-CG 4.27Å; Y266-F292 HydrophobicContact CE2-CB 3.84Å; Y266-F292 AromaticContact CE2-CD2 3.83Å; Y266-F292 HydrophobicContact CE2-CD2 3.83Å; Y266-F292 HydrophobicContact CE2-CG 4.09Å; Y266-F292 HydrophobicContact CG-CB 4.24Å; Y266-F292 AromaticContact CZ-CG 3.83Å; Y266-F292 PolarHBondContact N-O 2.91Å; Y266-F292 PolarHBondContact O-N 3.04Å; Y266-L294 HydrophobicContact CD1-CD1 4.47Å; Y266-L294 HydrophobicContact CD1-CD2 3.48Å; Y266-L294 VanDerWaalsContact CD1-CD2 3.48Å; Y266-L294 HydrophobicContact CD1-CG 3.91Å; Y266-L294 HydrophobicContact CE1-CD2 3.87Å
267	K	81.3	Confident	67.6	Low	28 Å²	28	71.2 Å²	71.2	12%	0.122	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	144.6	173.1	-62	-168.3	176.7	-175.5	0	109.8	Q249 E289 C291	Q249-K267 HydrophobicContact CB-CB 4.42Å; Q249-K267 PolarHBondContact N-O 3.44Å; Q249-K267 VanDerWaalsContact N-O 3.12Å; Q249-K267 PolarHBondContact O-N 3.49Å; K267-E289 VanDerWaalsContact CE-OE2 3.29Å; K267-E289 WeakPolarHBondContact CE-OE2 3.41Å; K267-E289 IonicContact NZ-OE1 2.74Å; K267-E289 PolarHBondContact NZ-OE1 2.85Å; K267-E289 IonicContact NZ-OE2 3.8Å; K267-E289 PolarHBondContact NZ-OE2 3.16Å; K267-C291 VanDerWaalsContact CE-SG 3.57Å
268	T	75.6	Confident	65.9	Low	17 Å²	17	71.4 Å²	71.4	10%	0.104	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	169.3	177.6	56.3	0	0	0	0	111.2	Y200 Y266 Q270 F292	Y200-T268 HydrophobicContact CE2-CG2 4.41Å; Y266-T268 HydrophobicContact CE2-CG2 4.44Å; T268-Q270 PolarHBondContact O-N 3.25Å; T268-F292 HydrophobicContact CG2-CE2 4.49Å
269	A	66.2	Low	64.3	Low	11 Å²	11	73.9 Å²	73.9	9%	0.091	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-64.1	-19.6	-176	0	0	0	0	0	115.5	E244 Y247 H271 L272	E244-A269 HydrophobicContact CB-CB 4.25Å; E244-A269 VanDerWaalsContact O-CB 3.28Å; E244-A269 WeakPolarHBondContact O-CB 3.1Å; Y247-A269 HydrophobicContact CD1-CB 3.84Å; Y247-A269 HydrophobicContact CG-CB 4.27Å; A269-H271 PolarHBondContact O-N 2.99Å; A269-L272 PolarHBondContact O-N 3.26Å
270	Q	60	Low	62.7	Low	154 Å²	154	79.2 Å²	79.2	72%	0.72	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-56.7	-19.4	-173.7	-69.4	174.7	-32.3	0	0	114.1	T268	T268-Q270 PolarHBondContact O-N 3.25Å
271	H	53.3	Low	61.1	Low	71 Å²	71	83.8 Å²	83.8	33%	0.329	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-81.3	-12.8	179.5	-65	-70.6	0	0	0	115.1	A269 T290	A269-H271 PolarHBondContact O-N 2.99Å; H271-T290 PolarHBondContact CE1-OG1 2.95Å; H271-T290 PolarHBondContact NE2-OG1 3.14Å
272	L	53.1	Low	59.4	Low	69 Å²	69	89.6 Å²	89.6	36%	0.361	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-81.7	-12.8	-175.7	-78.3	165.2	0	0	0	114.4	L32 Y247 A269	L32-L272 HydrophobicContact CD1-CD1 4.38Å; L32-L272 HydrophobicContact CD2-CD1 4.48Å; L32-L272 HydrophobicContact CG-CD1 3.99Å; Y247-L272 HydrophobicContact CD1-CD1 4.35Å; Y247-L272 HydrophobicContact CE1-CD1 3.89Å; Y247-L272 HydrophobicContact CE2-CD1 4.14Å; A269-L272 PolarHBondContact O-N 3.26Å
273	N	47.9	Very low	56.8	Low	121 Å²	121	93.6 Å²	93.6	65%	0.647	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-95.9	16.9	-173.7	-70.7	-15.6	0	0	0	114.4
274	V	44.9	Very low	54.5	Low	121 Å²	121	91.9 Å²	91.9	73%	0.733	55%	0.551	S	S	*	*			trans	-110.9	113.7	176.6	-174.1	0	0	0	0	109.9
275	A	39.3	Very low	52.3	Low	78 Å²	78	100.1 Å²	100.1	65%	0.645	58%	0.584	S	S	*	*			trans	-70.8	142.1	177.7	0	0	0	0	0	111.5	V277	A275-V277 PolarHBondContact O-N 3.02Å; A275-V277 VanDerWaalsContact O-N 3.17Å
276	P	41.1	Very low	49.9	Very low	132 Å²	132	105.1 Å²	105.1	86%	0.857	62%	0.615	S	S	*	*			trans	-73.5	109	179.5	29.5	-33.5	0	0	0	110.8
277	V	41.5	Very low	47.5	Very low	138 Å²	138	107.6 Å²	107.6	84%	0.836	65%	0.645	S	S	*	*			trans	-78.1	144.1	167.1	-178.1	0	0	0	0	108.8	A275	A275-V277 PolarHBondContact O-N 3.02Å; A275-V277 VanDerWaalsContact O-N 3.17Å
278	A	42.8	Very low	45.6	Very low	73 Å²	73	113.4 Å²	113.4	60%	0.603	68%	0.678	S	S	*	*			trans	-63.9	152	-177.3	0	0	0	0	0	112.3	D280	A278-D280 PolarHBondContact O-N 2.83Å; A278-D280 VanDerWaalsContact O-N 3.11Å
279	P	41.6	Very low	44.3	Very low	125 Å²	125	118.1 Å²	118.1	81%	0.812	70%	0.698	S	S	*	*			trans	-81.4	92.8	-175.8	33	-33.8	0	0	0	111.4
280	D	43.8	Very low	44	Very low	154 Å²	154	120.4 Å²	120.4	82%	0.824	71%	0.711	S	S	*	*			trans	-79.3	145.3	164.1	-72.4	-31	0	0	0	110.9	A278 D282	A278-D280 PolarHBondContact O-N 2.83Å; A278-D280 VanDerWaalsContact O-N 3.11Å; D280-D282 PolarHBondContact O-N 3.38Å
281	E	44.4	Very low	44.4	Very low	193 Å²	193	115.4 Å²	115.4	90%	0.902	69%	0.693	S	S	*	*	S	Bend	trans	-79.7	81.1	-166.3	-60.5	-178.2	142.2	0	0	113.2
282	D	43	Very low	45.7	Very low	157 Å²	157	115.1 Å²	115.1	84%	0.84	69%	0.69	S	S	*	*			trans	-156.5	102.8	156	-100.7	-34.3	0	0	0	111.5	D280 S284	D280-D282 PolarHBondContact O-N 3.38Å; D282-S284 PolarHBondContact O-N 3.33Å; D282-S284 VanDerWaalsContact O-N 3.13Å
283	G	32.7	Very low	47.3	Very low	91 Å²	91	116.8 Å²	116.8	94%	0.938	71%	0.705	S	S	*	*			trans	-87	77.7	-161.3	0	0	0	0	0	116.4
284	S	35.7	Very low	49.1	Very low	104 Å²	104	111.3 Å²	111.3	73%	0.727	68%	0.676	S	S	*	*			trans	-156.1	67	162.1	67.6	0	0	0	0	114.8	D282	D282-S284 PolarHBondContact O-N 3.33Å; D282-S284 VanDerWaalsContact O-N 3.13Å
285	H	37.2	Very low	51	Low	191 Å²	191	108.7 Å²	108.7	88%	0.884	66%	0.661	S	S	*	*			trans	-133.1	84.9	165.4	-82.3	-62.7	0	0	0	111.1	G287	H285-G287 PolarHBondContact O-N 3.33Å; H285-G287 VanDerWaalsContact O-N 3.16Å
286	D	36.1	Very low	53.3	Low	165 Å²	165	109.5 Å²	109.5	88%	0.882	65%	0.648	S	S	*	*			trans	-69.2	102.5	161.3	-86.3	-33.7	0	0	0	108.3	D288	D286-D288 PolarHBondContact O-N 3.05Å
287	G	36.3	Very low	55.5	Low	67 Å²	67	108 Å²	108	69%	0.691	63%	0.628	S	S	*	*			trans	-74.5	108.9	164.4	0	0	0	0	0	109.2	H285 E289	H285-G287 PolarHBondContact O-N 3.33Å; H285-G287 VanDerWaalsContact O-N 3.16Å; G287-E289 PolarHBondContact O-N 2.99Å
288	D	40.2	Very low	57.8	Low	150 Å²	150	102.4 Å²	102.4	80%	0.802	59%	0.593	S	S	*	*			trans	-55.7	94.8	-173.7	-88	-40.9	0	0	0	113.3	D286 T290	D286-D288 PolarHBondContact O-N 3.05Å; D288-T290 PolarHBondContact O-N 3.4Å
289	E	48.9	Very low	60.1	Low	115 Å²	115	99.1 Å²	99.1	54%	0.537	57%	0.566	S	S	.	*			trans	-65.3	104.9	171.7	-65.1	-159.4	139.1	0	0	110.3	K267 G287 C291	K267-E289 VanDerWaalsContact CE-OE2 3.29Å; K267-E289 WeakPolarHBondContact CE-OE2 3.41Å; K267-E289 IonicContact NZ-OE1 2.74Å; K267-E289 PolarHBondContact NZ-OE1 2.85Å; K267-E289 IonicContact NZ-OE2 3.8Å; K267-E289 PolarHBondContact NZ-OE2 3.16Å; G287-E289 PolarHBondContact O-N 2.99Å; E289-C291 VanDerWaalsContact C-N 3.25Å; E289-C291 PolarHBondContact O-N 3.41Å
290	T	60.9	Low	62.5	Low	59 Å²	59	93.2 Å²	93.2	36%	0.362	53%	0.527	S	S	.	.			trans	-68.3	76.2	177.8	50.6	0	0	0	0	112.9	H271 D288 F292	H271-T290 PolarHBondContact CE1-OG1 2.95Å; H271-T290 PolarHBondContact NE2-OG1 3.14Å; D288-T290 PolarHBondContact O-N 3.4Å; T290-F292 WeakPolarHBondContact O-CE2 3.42Å
291	C	68	Low	64.8	Low	49 Å²	49	86.4 Å²	86.4	33%	0.331	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-89.8	119	179	-67.5	0	0	0	0	111.4	Y265 K267 E289	Y265-C291 HydrophobicContact CD2-CB 3.87Å; Y265-C291 HydrophobicContact CG-CB 4.43Å; K267-C291 VanDerWaalsContact CE-SG 3.57Å; E289-C291 VanDerWaalsContact C-N 3.25Å; E289-C291 PolarHBondContact O-N 3.41Å
292	F	80.6	Confident	66.8	Low	65 Å²	65	78.7 Å²	78.7	29%	0.285	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	128.4	179.3	-65	-75.8	0	0	0	111.5	Q199 Y265 Y266 T268 T290	Q199-F292 VanDerWaalsContact NE2-CE2 3.3Å; Y265-F292 CarbonylContact C-O 3.6Å; Y265-F292 WeakPolarHBondContact CA-O 3.11Å; Y265-F292 WeakPolarHBondContact CB-O 3.45Å; Y266-F292 HydrophobicContact CD1-CB 3.74Å; Y266-F292 WeakPolarHBondContact CD1-O 3.41Å; Y266-F292 HydrophobicContact CD2-CB 4.27Å; Y266-F292 HydrophobicContact CD2-CD2 4.36Å; Y266-F292 HydrophobicContact CE1-CB 3.26Å; Y266-F292 HydrophobicContact CE1-CG 4.27Å; Y266-F292 HydrophobicContact CE2-CB 3.84Å; Y266-F292 AromaticContact CE2-CD2 3.83Å; Y266-F292 HydrophobicContact CE2-CD2 3.83Å; Y266-F292 HydrophobicContact CE2-CG 4.09Å; Y266-F292 HydrophobicContact CG-CB 4.24Å; Y266-F292 AromaticContact CZ-CG 3.83Å; Y266-F292 PolarHBondContact N-O 2.91Å; Y266-F292 PolarHBondContact O-N 3.04Å; T268-F292 HydrophobicContact CG2-CE2 4.49Å; T290-F292 WeakPolarHBondContact O-CE2 3.42Å
293	P	85.8	Confident	68.5	Low	104 Å²	104	72 Å²	72	68%	0.675	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	141.6	-174.7	29.2	-35.2	0	0	0	112.7
294	L	86.1	Confident	71	Confident	6 Å²	6	67.7 Å²	67.7	3%	0.031	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	134.4	172.9	-65.3	179.3	0	0	0	110.9	L167 L197 V250 F262 G264 Y266	L167-L294 HydrophobicContact CD1-CD1 4.14Å; L167-L294 HydrophobicContact CD1-CD2 3.9Å; L167-L294 HydrophobicContact CD2-CD1 4.08Å; L167-L294 HydrophobicContact CD2-CD2 4.41Å; L197-L294 HydrophobicContact CD2-CD2 3.63Å; V250-L294 HydrophobicContact CG1-CD1 3.64Å; F262-L294 HydrophobicContact CE1-CB 4.11Å; F262-L294 HydrophobicContact CE1-CD1 4.37Å; G264-L294 PolarHBondContact O-N 3.1Å; Y266-L294 HydrophobicContact CD1-CD1 4.47Å; Y266-L294 HydrophobicContact CD1-CD2 3.48Å; Y266-L294 VanDerWaalsContact CD1-CD2 3.48Å; Y266-L294 HydrophobicContact CD1-CG 3.91Å; Y266-L294 HydrophobicContact CE1-CD2 3.87Å
295	T	85.6	Confident	73.3	Confident	67 Å²	67	65.9 Å²	65.9	41%	0.411	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	160.8	176.2	-57.6	0	0	0	0	109.8	K297 N298	T295-K297 PolarHBondContact O-N 2.9Å; T295-N298 PolarHBondContact N-OD1 3.25Å; T295-N298 WeakPolarHBondContact O-CB 3.49Å; T295-N298 PolarHBondContact O-N 3.23Å; T295-N298 PolarHBondContact O-OD1 3Å
296	Y	86.6	Confident	75.7	Confident	95 Å²	95	56.8 Å²	56.8	37%	0.373	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-52.2	-26.8	174.3	80.4	-85.7	0	0	0	114.4	Y194 T260 F262 N298 L299	Y194-Y296 WeakPolarHBondContact CE1-O 3.27Å; T260-Y296 WeakPolarHBondContact O-CD1 3.35Å; F262-Y296 PolarHBondContact O-N 2.69Å; Y296-N298 PolarHBondContact O-N 2.82Å; Y296-N298 VanDerWaalsContact O-N 3.12Å; Y296-L299 PolarHBondContact O-N 3.26Å; Y296-L299 VanDerWaalsContact O-O 3.14Å
297	K	87.6	Confident	77.8	Confident	99 Å²	99	50.1 Å²	50.1	43%	0.43	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-65.2	-8.2	173.9	-67.5	-169.4	177	-175.8	0	114.9	Y194 N195 T295	Y194-K297 WeakPolarHBondContact CB-O 3.42Å; Y194-K297 WeakPolarHBondContact CD1-O 3.4Å; N195-K297 PolarHBondContact N-O 2.8Å; T295-K297 PolarHBondContact O-N 2.9Å
298	N	90.1	Very high	79.7	Confident	22 Å²	22	49.1 Å²	49.1	12%	0.118	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-103.1	-11.8	173.4	-51.3	108.7	0	0	0	112.6	L167 L168 N195 L197 T295 Y296	L167-N298 HydrophobicContact CD1-CB 3.85Å; L168-N298 PolarHBondContact N-O 3.36Å; N195-N298 PolarHBondContact O-ND2 2.92Å; L197-N298 HydrophobicContact CD2-CB 4.49Å; T295-N298 PolarHBondContact N-OD1 3.25Å; T295-N298 WeakPolarHBondContact O-CB 3.49Å; T295-N298 PolarHBondContact O-N 3.23Å; T295-N298 PolarHBondContact O-OD1 3Å; Y296-N298 PolarHBondContact O-N 2.82Å; Y296-N298 VanDerWaalsContact O-N 3.12Å
299	L	91.6	Very high	81.5	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	119.8	-176.8	-174.3	81	0	0	0	110.8	D165 L166 Y194 F262 Y296 L301 I317	D165-L299 HydrophobicContact CB-CD1 4.47Å; L166-L299 CarbonylContact O-C 3.48Å; L166-L299 WeakPolarHBondContact O-CA 3.44Å; Y194-L299 WeakPolarHBondContact CE1-O 3.23Å; F262-L299 HydrophobicContact CB-CD2 4.09Å; F262-L299 HydrophobicContact CD1-CB 3.77Å; F262-L299 HydrophobicContact CD1-CD2 4.12Å; F262-L299 HydrophobicContact CD1-CG 4.39Å; F262-L299 HydrophobicContact CD2-CD2 3.78Å; F262-L299 HydrophobicContact CE1-CB 4.09Å; F262-L299 HydrophobicContact CE1-CD1 4.28Å; F262-L299 HydrophobicContact CE1-CD2 4.49Å; F262-L299 HydrophobicContact CE2-CD2 4.17Å; F262-L299 HydrophobicContact CG-CB 4.2Å; F262-L299 HydrophobicContact CG-CD2 3.73Å; F262-L299 HydrophobicContact CG-CG 4.48Å; F262-L299 HydrophobicContact CZ-CD1 4.21Å; Y296-L299 PolarHBondContact O-N 3.26Å; Y296-L299 VanDerWaalsContact O-O 3.14Å; L299-L301 HydrophobicContact CD2-CD2 3.74Å; L299-L301 HydrophobicContact CG-CD2 4.26Å; L299-I317 HydrophobicContact CD1-CB 4.32Å; L299-I317 HydrophobicContact CD1-CG1 4.18Å
300	V	92.3	Very high	83.2	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	143	169	-168.6	0	0	0	0	109.8	F162 D165 L166 L168 I180	F162-V300 HydrophobicContact CB-CG1 4.43Å; F162-V300 HydrophobicContact CD1-CG1 4.33Å; F162-V300 HydrophobicContact CD2-CG1 3.22Å; F162-V300 HydrophobicContact CE1-CG1 4.47Å; F162-V300 HydrophobicContact CE2-CG1 3.4Å; F162-V300 VanDerWaalsContact CE2-CG1 3.4Å; F162-V300 HydrophobicContact CG-CG1 3.72Å; F162-V300 HydrophobicContact CZ-CG1 4.03Å; D165-V300 CarbonylContact C-O 3.58Å; D165-V300 VanDerWaalsContact CA-O 3.25Å; D165-V300 WeakPolarHBondContact CA-O 3.49Å; L166-V300 HydrophobicContact CB-CB 4.4Å; L166-V300 PolarHBondContact N-O 2.9Å; L166-V300 PolarHBondContact O-N 3.48Å; L168-V300 HydrophobicContact CD1-CG2 3.96Å; L168-V300 HydrophobicContact CD2-CG2 3.42Å; L168-V300 VanDerWaalsContact CD2-CG2 3.42Å; L168-V300 HydrophobicContact CG-CG2 3.6Å; I180-V300 HydrophobicContact CD1-CB 4.15Å; I180-V300 HydrophobicContact CD1-CG1 3.75Å; I180-V300 HydrophobicContact CD1-CG2 3.39Å; I180-V300 HydrophobicContact CG2-CG1 4.41Å
301	L	91	Very high	84.4	Confident	11 Å²	11	41.4 Å²	41.4	6%	0.058	22%	0.216	C	C	.	.			trans	-104.6	144.9	-177.8	-59.6	-178.6	0	0	0	111.4	D165 L185 L259 L299 G303 S304 K324	D165-L301 HydrophobicContact CB-CD2 4.41Å; L185-L301 HydrophobicContact CD1-CB 3.44Å; L185-L301 VanDerWaalsContact CD1-CB 3.44Å; L185-L301 HydrophobicContact CD1-CD1 3.99Å; L185-L301 HydrophobicContact CD1-CG 4.33Å; L259-L301 HydrophobicContact CB-CD1 4.2Å; L259-L301 HydrophobicContact CD2-CD1 3.88Å; L299-L301 HydrophobicContact CD2-CD2 3.74Å; L299-L301 HydrophobicContact CG-CD2 4.26Å; L301-G303 PolarHBondContact O-N 3.2Å; L301-S304 WeakPolarHBondContact O-CB 3.44Å; L301-S304 PolarHBondContact O-N 3.48Å; L301-S304 VanDerWaalsContact O-N 3.15Å; L301-S304 PolarHBondContact O-OG 2.96Å; L301-K324 HydrophobicContact CD1-CD 4.42Å; L301-K324 HydrophobicContact CD2-CB 4.43Å; L301-K324 HydrophobicContact CD2-CD 3.82Å; L301-K324 HydrophobicContact CD2-CG 4.05Å
302	R	87	Confident	85.5	Confident	31 Å²	31	39.1 Å²	39.1	12%	0.117	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	131.8	175.2	178.2	176.9	156.4	-151.9	-21.9	110.8	I46 F162 P163 D165 L185 G320 T323 L325 S326	I46-R302 VanDerWaalsContact CD1-NH2 3.28Å; F162-R302 WeakPolarHBondContact O-CA 3.34Å; P163-R302 VanDerWaalsContact O-CD 3.32Å; P163-R302 WeakPolarHBondContact O-CD 3.38Å; D165-R302 WeakPolarHBondContact OD1-CB 3.45Å; D165-R302 PolarHBondContact OD1-N 3.03Å; L185-R302 WeakPolarHBondContact CD2-O 3.45Å; R302-G320 PolarHBondContact NH1-O 3.13Å; R302-T323 HydrophobicContact CB-CG2 4.21Å; R302-T323 PolarHBondContact NH1-OG1 3.15Å; R302-L325 WeakPolarHBondContact O-CD2 3.48Å; R302-S326 PolarHBondContact NH1-OG 3.16Å
303	G	78.4	Confident	86	Confident	15 Å²	15	36.2 Å²	36.2	16%	0.155	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.8	-17.5	-179.1	0	0	0	0	0	114.6	F162 N184 L301	F162-G303 PolarHBondContact O-N 3.05Å; F162-G303 VanDerWaalsContact O-N 3.08Å; N184-G303 VanDerWaalsContact CB-O 3.23Å; N184-G303 WeakPolarHBondContact CB-O 3.31Å; N184-G303 PolarHBondContact ND2-O 3.33Å; L301-G303 PolarHBondContact O-N 3.2Å
304	S	86	Confident	86.2	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.007	16%	0.157	C	C	.	.			trans	-62.4	161.8	162.8	-60.7	0	0	0	0	111.1	S161 F162 N181 L185 L301	S161-S304 WeakPolarHBondContact CA-O 3.05Å; F162-S304 VanDerWaalsContact CD2-C 3.49Å; F162-S304 WeakPolarHBondContact CD2-O 3.11Å; F162-S304 PolarHBondContact N-O 3.25Å; N181-S304 WeakPolarHBondContact O-CA 3.48Å; N181-S304 WeakPolarHBondContact O-CB 3.3Å; L185-S304 VanDerWaalsContact CD1-OG 3.25Å; L185-S304 WeakPolarHBondContact CD1-OG 3.33Å; L301-S304 WeakPolarHBondContact O-CB 3.44Å; L301-S304 PolarHBondContact O-N 3.48Å; L301-S304 VanDerWaalsContact O-N 3.15Å; L301-S304 PolarHBondContact O-OG 2.96Å
305	K	83.6	Confident	86.6	Confident	66 Å²	66	31 Å²	31	29%	0.287	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.9	-177.3	-168.6	-176	179.1	-162	0	110.5	N159 Q160 N181	N159-K305 WeakPolarHBondContact O-CE 3.34Å; N159-K305 WeakPolarHBondContact OD1-CE 3.46Å; N159-K305 PolarHBondContact OD1-NZ 3.43Å; Q160-K305 WeakPolarHBondContact O-CA 3.44Å; N181-K305 PolarHBondContact N-O 3.19Å; N181-K305 PolarHBondContact O-N 2.98Å
306	L	86.4	Confident	87	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	131.2	172.3	-163.8	69	0	0	0	109.5	N159 Q160 F162 V178 T309 I312	N159-L306 VanDerWaalsContact CA-O 3.28Å; N159-L306 WeakPolarHBondContact CA-O 3.5Å; N159-L306 PolarHBondContact N-O 2.91Å; Q160-L306 PolarHBondContact O-N 2.84Å; F162-L306 HydrophobicContact CE1-CB 4.43Å; F162-L306 HydrophobicContact CE2-CB 4.47Å; F162-L306 HydrophobicContact CZ-CB 3.75Å; F162-L306 HydrophobicContact CZ-CD1 3.97Å; F162-L306 HydrophobicContact CZ-CG 4.43Å; V178-L306 HydrophobicContact CG1-CD1 3.5Å; V178-L306 VanDerWaalsContact CG1-CD1 3.5Å; L306-T309 VanDerWaalsContact CD1-OG1 3.24Å; L306-T309 WeakPolarHBondContact CD1-OG1 3.33Å; L306-T309 WeakPolarHBondContact CD2-O 3.35Å; L306-T309 WeakPolarHBondContact CG-OG1 3.39Å; L306-I312 HydrophobicContact CD1-CD1 4.27Å; L306-I312 HydrophobicContact CD1-CG1 4.23Å; L306-I312 HydrophobicContact CD1-CG2 3.75Å; L306-I312 HydrophobicContact CD2-CG1 4.24Å; L306-I312 HydrophobicContact CD2-CG2 4.14Å
307	I	81	Confident	87.3	Confident	25 Å²	25	23.3 Å²	23.3	13%	0.128	12%	0.118	C	C	.	.			trans	-137.4	153.3	176.9	-55.4	-164.2	0	0	0	108.4	Y179 N181 I191 T309	Y179-I307 VanDerWaalsContact CB-O 3.26Å; Y179-I307 WeakPolarHBondContact CB-O 3.5Å; Y179-I307 PolarHBondContact O-N 3Å; Y179-I307 VanDerWaalsContact O-N 3.15Å; N181-I307 HydrophobicContact CB-CD1 3.44Å; N181-I307 VanDerWaalsContact CB-CD1 3.44Å; N181-I307 HydrophobicContact CB-CG1 3.92Å; I191-I307 HydrophobicContact CD1-CG2 4.27Å; I307-T309 PolarHBondContact O-N 3.01Å; I307-T309 PolarHBondContact O-OG1 3.03Å
308	S	75.4	Confident	87.5	Confident	46 Å²	46	18.6 Å²	18.6	32%	0.322	10%	0.097	S	C	.	.	S	Bend	trans	50.9	20.7	175.8	-36.1	0	0	0	0	115.8	E607	S308-E607 PolarHBondContact OG-OE2 3.1Å
309	T	79.9	Confident	87.6	Confident	3 Å²	3	17.6 Å²	17.6	2%	0.018	9%	0.092	C	C	.	.			trans	-145.4	130	177	33.5	0	0	0	0	108.4	N158 H173 Y179 L306 I307	N158-T309 WeakPolarHBondContact CB-O 3.36Å; N158-T309 VanDerWaalsContact CG-O 3.31Å; H173-T309 HydrophobicContact CB-CG2 4.25Å; Y179-T309 HydrophobicContact CD2-CG2 4.11Å; L306-T309 VanDerWaalsContact CD1-OG1 3.24Å; L306-T309 WeakPolarHBondContact CD1-OG1 3.33Å; L306-T309 WeakPolarHBondContact CD2-O 3.35Å; L306-T309 WeakPolarHBondContact CG-OG1 3.39Å; I307-T309 PolarHBondContact O-N 3.01Å; I307-T309 PolarHBondContact O-OG1 3.03Å
310	D	82.6	Confident	87.4	Confident	102 Å²	102	17.6 Å²	17.6	55%	0.545	9%	0.093	S	C	.	.	S	Bend	trans	-71.4	-44.4	-165	-49.3	-62.6	0	0	0	112.6	F157 N158 S172	F157-D310 CarbonylContact C-O 3.53Å; F157-D310 WeakPolarHBondContact CA-O 3.4Å; N158-D310 PolarHBondContact N-O 3.38Å; S172-D310 PolarHBondContact OG-N 2.6Å; S172-D310 PolarHBondContact OG-OD2 3.02Å; S172-D310 VanDerWaalsContact OG-OD2 3.06Å
311	Y	87	Confident	87	Confident	57 Å²	57	25.1 Å²	25.1	22%	0.224	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	154.6	175.1	64.5	-81.1	0	0	0	111.8	C156 Y170 S172	C156-Y311 VanDerWaalsContact O-CA 3.28Å; C156-Y311 WeakPolarHBondContact O-CA 3.44Å; Y170-Y311 HydrophobicContact CD1-CE2 4.14Å; Y170-Y311 HydrophobicContact CE1-CD2 4.26Å; Y170-Y311 AromaticContact CE1-CE2 3.47Å; Y170-Y311 HydrophobicContact CE1-CE2 3.47Å; Y170-Y311 VanDerWaalsContact CE1-CE2 3.47Å; Y170-Y311 AromaticContact CE1-CZ 3.93Å; Y170-Y311 PolarHBondContact OH-OH 2.89Å; S172-Y311 PolarHBondContact N-O 3.05Å; S172-Y311 VanDerWaalsContact N-O 3.11Å
312	I	90.8	Very high	86.9	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	156.2	171.8	64.6	158.8	0	0	0	111.1	C155 C156 F162 L168 Y170 V178 L306	C155-I312 VanDerWaalsContact CA-O 3.28Å; C155-I312 WeakPolarHBondContact CA-O 3.46Å; C155-I312 PolarHBondContact SG-O 2.9Å; C156-I312 HydrophobicContact CB-CG1 4.12Å; C156-I312 PolarHBondContact N-O 3.28Å; C156-I312 PolarHBondContact O-N 2.84Å; F162-I312 HydrophobicContact CE1-CD1 3.58Å; F162-I312 HydrophobicContact CE1-CG1 4.2Å; F162-I312 HydrophobicContact CZ-CD1 3.93Å; L168-I312 HydrophobicContact CD2-CD1 3.47Å; L168-I312 VanDerWaalsContact CD2-CD1 3.47Å; Y170-I312 WeakPolarHBondContact O-CA 3.18Å; Y170-I312 WeakPolarHBondContact O-CB 3.47Å; V178-I312 HydrophobicContact CB-CG2 4.45Å; V178-I312 HydrophobicContact CG1-CG2 3.76Å; V178-I312 HydrophobicContact CG2-CG2 3.78Å; L306-I312 HydrophobicContact CD1-CD1 4.27Å; L306-I312 HydrophobicContact CD1-CG1 4.23Å; L306-I312 HydrophobicContact CD1-CG2 3.75Å; L306-I312 HydrophobicContact CD2-CG1 4.24Å; L306-I312 HydrophobicContact CD2-CG2 4.14Å
313	I	91	Very high	87	Confident	5 Å²	5	24.8 Å²	24.8	3%	0.026	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	132.1	170	-55.2	173.1	0	0	0	108.6	W140 I153 I154 L169 Y170 Y204	W140-I313 HydrophobicContact CH2-CD1 4.21Å; W140-I313 HydrophobicContact CH2-CG1 4.26Å; W140-I313 HydrophobicContact CH2-CG2 4.29Å; W140-I313 HydrophobicContact CZ2-CD1 4.11Å; I153-I313 HydrophobicContact CG2-CG2 3.42Å; I153-I313 VanDerWaalsContact CG2-CG2 3.42Å; I154-I313 WeakPolarHBondContact O-CA 3.35Å; L169-I313 PolarHBondContact N-O 3.17Å; Y170-I313 HydrophobicContact CD1-CD1 4.13Å; Y170-I313 HydrophobicContact CD1-CG1 4.24Å; Y170-I313 HydrophobicContact CG-CD1 4.44Å; Y170-I313 PolarHBondContact N-O 2.9Å; Y170-I313 PolarHBondContact O-N 3.16Å; Y204-I313 HydrophobicContact CD1-CD1 4.16Å; Y204-I313 HydrophobicContact CD1-CG2 4.27Å; Y204-I313 HydrophobicContact CE1-CG2 4.41Å
314	G	91.4	Very high	87.3	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.01	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	149.5	-179.5	0	0	0	0	0	114.8	I154 L167	I154-G314 PolarHBondContact N-O 3.25Å; I154-G314 PolarHBondContact O-N 2.93Å; L167-G314 CarbonylContact O-C 3.47Å; L167-G314 WeakPolarHBondContact O-CA 3.42Å
315	L	93.1	Very high	86.9	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	131.3	177.5	173.5	68.3	0	0	0	110.8	V24 A26 G151 I153 L166 L167 L169 L248 V250 I317	V24-L315 HydrophobicContact CG1-CD2 4.36Å; A26-L315 HydrophobicContact CB-CD1 4.14Å; G151-L315 WeakPolarHBondContact O-CD1 3.37Å; I153-L315 HydrophobicContact CG1-CD1 3.91Å; L166-L315 CarbonylContact C-O 3.46Å; L166-L315 WeakPolarHBondContact CA-O 3.37Å; L167-L315 HydrophobicContact CB-CB 4.34Å; L167-L315 HydrophobicContact CD2-CD2 4.5Å; L167-L315 PolarHBondContact N-O 3.18Å; L167-L315 PolarHBondContact O-N 3.19Å; L169-L315 HydrophobicContact CD1-CB 4.13Å; L169-L315 HydrophobicContact CG-CB 4.43Å; L248-L315 HydrophobicContact CD2-CD2 4.05Å; V250-L315 HydrophobicContact CG2-CD2 3.86Å; L315-I317 HydrophobicContact CD2-CD1 4.01Å; L315-I317 HydrophobicContact CG-CD1 4.17Å; L315-I317 PolarHBondContact O-N 3.49Å
316	V	94.1	Very high	86.7	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	117	179.1	-178.9	0	0	0	0	111.3	N149 G151 D152 I154 C164 L166 T319	N149-V316 WeakPolarHBondContact O-CB 3.32Å; N149-V316 WeakPolarHBondContact O-CG1 3.41Å; G151-V316 PolarHBondContact N-O 3.44Å; D152-V316 HydrophobicContact CB-CG2 4.16Å; D152-V316 WeakPolarHBondContact O-CB 3.28Å; D152-V316 VanDerWaalsContact O-CG2 3.29Å; D152-V316 WeakPolarHBondContact O-CG2 3.42Å; D152-V316 PolarHBondContact O-N 3.42Å; I154-V316 HydrophobicContact CG2-CG2 4.45Å; C164-V316 HydrophobicContact CB-CG1 4.23Å; L166-V316 HydrophobicContact CD2-CB 4.32Å; L166-V316 HydrophobicContact CD2-CG2 3.67Å; V316-T319 HydrophobicContact CG1-CG2 3.44Å; V316-T319 VanDerWaalsContact CG1-CG2 3.44Å
317	I	92.5	Very high	86.2	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-53.4	179.8	-58.3	-59.4	0	0	0	112	R22 V24 D165 L167 V250 L299 L315	R22-I317 PolarHBondContact NE-O 3.43Å; R22-I317 PolarHBondContact NH2-O 3.29Å; V24-I317 HydrophobicContact CB-CD1 4.27Å; V24-I317 HydrophobicContact CG1-CD1 4.16Å; V24-I317 HydrophobicContact CG2-CD1 4.38Å; D165-I317 PolarHBondContact O-N 3.04Å; L167-I317 HydrophobicContact CB-CD1 4.1Å; L167-I317 HydrophobicContact CB-CG1 3.84Å; L167-I317 HydrophobicContact CD2-CD1 4.49Å; V250-I317 HydrophobicContact CB-CD1 4.4Å; V250-I317 HydrophobicContact CG1-CD1 4.1Å; V250-I317 HydrophobicContact CG2-CD1 4.48Å; L299-I317 HydrophobicContact CD1-CB 4.32Å; L299-I317 HydrophobicContact CD1-CG1 4.18Å; L315-I317 HydrophobicContact CD2-CD1 4.01Å; L315-I317 HydrophobicContact CG-CD1 4.17Å; L315-I317 PolarHBondContact O-N 3.49Å
318	Y	92.9	Very high	85.7	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.9	178.7	-53.5	-62.9	0	0	0	111.1	R22 C164 D165 E253 P255 F262 D322 T323	R22-Y318 VanDerWaalsContact CD-CE1 3.49Å; C164-Y318 VanDerWaalsContact CB-O 3.3Å; C164-Y318 WeakPolarHBondContact CB-O 3.19Å; D165-Y318 HydrophobicContact CB-CD2 3.95Å; D165-Y318 HydrophobicContact CB-CG 4.47Å; D165-Y318 PolarHBondContact N-O 3.3Å; D165-Y318 PolarHBondContact O-N 3.37Å; E253-Y318 PolarHBondContact O-OH 3.24Å; P255-Y318 HydrophobicContact CB-CD1 3.78Å; P255-Y318 HydrophobicContact CB-CE1 3.63Å; P255-Y318 HydrophobicContact CB-CG 4.41Å; P255-Y318 HydrophobicContact CG-CD1 4.37Å; P255-Y318 HydrophobicContact CG-CE1 4.2Å; F262-Y318 HydrophobicContact CD2-CE2 4.41Å; F262-Y318 HydrophobicContact CE2-CE2 4.12Å; Y318-D322 HydrophobicContact CD1-CB 4.26Å; Y318-T323 WeakPolarHBondContact O-CG2 3.43Å
319	T	92.5	Very high	85.1	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.126	C	C	.	.			trans	-124.6	157.2	-176.1	43.4	0	0	0	0	111.1	C42 N44 V150 C164 V316 K321 D322	C42-T319 WeakPolarHBondContact O-CB 3.43Å; C42-T319 PolarHBondContact O-OG1 3.35Å; C42-T319 PolarHBondContact SG-O 3.36Å; N44-T319 HydrophobicContact CB-CG2 4.11Å; V150-T319 HydrophobicContact CG2-CG2 3.9Å; V150-T319 WeakPolarHBondContact CG2-OG1 3.42Å; C164-T319 HydrophobicContact CB-CG2 4.4Å; V316-T319 HydrophobicContact CG1-CG2 3.44Å; V316-T319 VanDerWaalsContact CG1-CG2 3.44Å; T319-K321 PolarHBondContact O-N 3.28Å; T319-D322 WeakPolarHBondContact O-CB 3.46Å; T319-D322 PolarHBondContact O-N 2.95Å
320	G	86.3	Confident	83.9	Confident	4 Å²	4	27.9 Å²	27.9	4%	0.041	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	-108.3	163.5	0	0	0	0	0	113.9	H43 N44 R302 T323 S326	H43-G320 WeakPolarHBondContact O-CA 3.34Å; N44-G320 PolarHBondContact OD1-N 2.91Å; R302-G320 PolarHBondContact NH1-O 3.13Å; G320-T323 PolarHBondContact O-OG1 2.98Å; G320-S326 WeakPolarHBondContact O-CB 3.16Å; G320-S326 PolarHBondContact O-OG 3.32Å
321	K	84.5	Confident	82.3	Confident	159 Å²	159	29.5 Å²	29.5	69%	0.691	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-22	-179.9	-67.7	-174.3	178.7	-176.2	0	113.7	T319 T323	T319-K321 PolarHBondContact O-N 3.28Å; K321-T323 VanDerWaalsContact C-N 3.28Å
322	D	89.1	Confident	80.6	Confident	35 Å²	35	28.9 Å²	28.9	19%	0.187	15%	0.15	C	C	.	.	S	Bend	trans	-76.1	-19.4	-179.2	-62.3	-0.4	0	0	0	111.7	R22 C42 P255 Y318 T319	R22-D322 IonicContact CZ-OD2 2.71Å; R22-D322 IonicContact NH1-OD2 3.43Å; R22-D322 PolarHBondContact NH1-OD2 3.47Å; R22-D322 IonicContact NH2-OD2 3.21Å; R22-D322 PolarHBondContact NH2-OD2 3.12Å; C42-D322 PolarHBondContact SG-OD1 2.67Å; P255-D322 HydrophobicContact CB-CB 4.06Å; P255-D322 VanDerWaalsContact CB-O 3.27Å; P255-D322 WeakPolarHBondContact CB-O 3.32Å; P255-D322 HydrophobicContact CG-CB 4.04Å; Y318-D322 HydrophobicContact CD1-CB 4.26Å; T319-D322 WeakPolarHBondContact O-CB 3.46Å; T319-D322 PolarHBondContact O-N 2.95Å
323	T	87.9	Confident	78.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-62.3	140.3	179.7	66.3	0	0	0	0	110.8	C164 D165 R302 Y318 G320 K321 L325 S326 L327	C164-T323 HydrophobicContact CB-CG2 4.48Å; D165-T323 VanDerWaalsContact OD2-CA 3.25Å; D165-T323 WeakPolarHBondContact OD2-CA 3.4Å; R302-T323 HydrophobicContact CB-CG2 4.21Å; R302-T323 PolarHBondContact NH1-OG1 3.15Å; Y318-T323 WeakPolarHBondContact O-CG2 3.43Å; G320-T323 PolarHBondContact O-OG1 2.98Å; K321-T323 VanDerWaalsContact C-N 3.28Å; T323-L325 PolarHBondContact O-N 3.15Å; T323-L325 VanDerWaalsContact O-N 3.11Å; T323-S326 WeakPolarHBondContact O-CA 3.33Å; T323-S326 WeakPolarHBondContact O-CB 3.38Å; T323-S326 PolarHBondContact O-N 3.32Å; T323-S326 WeakPolarHBondContact OG1-CB 3.32Å; T323-S326 PolarHBondContact OG1-OG 3.28Å; T323-L327 PolarHBondContact O-N 3.33Å; T323-L327 VanDerWaalsContact O-N 3.14Å
324	K	84.6	Confident	77.4	Confident	1 Å²	1	40.4 Å²	40.4	0%	0.004	20%	0.203	C	C	.	.	H	α-helix	trans	-57.4	-35.9	-173.2	-56.6	-160.1	177.1	-163.7	0	114	D165 E253 N256 N258 L259 S261 L301 S326 L327 N328	D165-K324 PolarHBondContact OD2-N 3.24Å; E253-K324 IonicContact OE1-NZ 3.81Å; N256-K324 WeakPolarHBondContact O-CG 3.35Å; N256-K324 VanDerWaalsContact OD1-CE 3.23Å; N256-K324 WeakPolarHBondContact OD1-CE 3.36Å; N256-K324 PolarHBondContact OD1-NZ 3.42Å; N258-K324 WeakPolarHBondContact O-CD 3.38Å; N258-K324 PolarHBondContact O-NZ 3.05Å; L259-K324 HydrophobicContact CD2-CB 3.92Å; S261-K324 PolarHBondContact O-NZ 3.32Å; L301-K324 HydrophobicContact CD1-CD 4.42Å; L301-K324 HydrophobicContact CD2-CB 4.43Å; L301-K324 HydrophobicContact CD2-CD 3.82Å; L301-K324 HydrophobicContact CD2-CG 4.05Å; K324-S326 VanDerWaalsContact C-N 3.35Å; K324-S326 PolarHBondContact O-N 3.15Å; K324-L327 PolarHBondContact O-N 3.36Å; K324-N328 PolarHBondContact O-N 2.78Å; K324-N328 PolarHBondContact O-ND2 2.9Å
325	L	79.1	Confident	76.1	Confident	24 Å²	24	43.1 Å²	43.1	13%	0.126	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-41.1	173.1	178.8	56.5	0	0	0	112.5	L185 R302 T323 N328 S329	L185-L325 HydrophobicContact CD2-CB 3.99Å; L185-L325 HydrophobicContact CD2-CD1 3.79Å; L185-L325 HydrophobicContact CD2-CD2 3.98Å; L185-L325 HydrophobicContact CD2-CG 4.12Å; R302-L325 WeakPolarHBondContact O-CD2 3.48Å; T323-L325 PolarHBondContact O-N 3.15Å; T323-L325 VanDerWaalsContact O-N 3.11Å; L325-N328 PolarHBondContact O-N 3.28Å; L325-S329 PolarHBondContact O-N 3.08Å; L325-S329 VanDerWaalsContact O-N 3.11Å; L325-S329 PolarHBondContact O-OG 2.71Å
326	S	78.6	Confident	75.1	Confident	17 Å²	17	44.7 Å²	44.7	12%	0.119	22%	0.22	C	C	.	.	H	α-helix	trans	-73.1	-34.7	-178.2	-58.3	0	0	0	0	112.1	R302 G320 T323 K324 N328 S329 S330	R302-S326 PolarHBondContact NH1-OG 3.16Å; G320-S326 WeakPolarHBondContact O-CB 3.16Å; G320-S326 PolarHBondContact O-OG 3.32Å; T323-S326 WeakPolarHBondContact O-CA 3.33Å; T323-S326 WeakPolarHBondContact O-CB 3.38Å; T323-S326 PolarHBondContact O-N 3.32Å; T323-S326 WeakPolarHBondContact OG1-CB 3.32Å; T323-S326 PolarHBondContact OG1-OG 3.28Å; K324-S326 VanDerWaalsContact C-N 3.35Å; K324-S326 PolarHBondContact O-N 3.15Å; S326-N328 VanDerWaalsContact C-N 3.32Å; S326-N328 PolarHBondContact O-N 3.23Å; S326-S329 PolarHBondContact O-N 3.17Å; S326-S330 WeakPolarHBondContact O-CB 3.45Å; S326-S330 PolarHBondContact O-N 3.05Å; S326-S330 PolarHBondContact O-OG 2.85Å
327	L	77	Confident	74	Confident	42 Å²	42	49.8 Å²	49.8	22%	0.22	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-39.3	173.4	-69.5	177.9	0	0	0	112	P255 N256 E257 T323 K324	P255-L327 HydrophobicContact CB-CD1 4.12Å; N256-L327 WeakPolarHBondContact O-CD1 3.31Å; E257-L327 HydrophobicContact CB-CB 4.39Å; T323-L327 PolarHBondContact O-N 3.33Å; T323-L327 VanDerWaalsContact O-N 3.14Å; K324-L327 PolarHBondContact O-N 3.36Å
328	N	68.6	Low	73.2	Confident	38 Å²	38	49.9 Å²	49.9	20%	0.203	24%	0.241	C	C	.	.	H	α-helix	trans	-70.1	-41.3	176.7	-78.5	-72.9	0	0	0	112.9	E257 K324 L325 S326	E257-N328 PolarHBondContact O-ND2 2.8Å; K324-N328 PolarHBondContact O-N 2.78Å; K324-N328 PolarHBondContact O-ND2 2.9Å; L325-N328 PolarHBondContact O-N 3.28Å; S326-N328 VanDerWaalsContact C-N 3.32Å; S326-N328 PolarHBondContact O-N 3.23Å
329	S	64.5	Low	72.5	Confident	33 Å²	33	50.7 Å²	50.7	23%	0.231	25%	0.246	C	C	.	.	H	α-helix	trans	-76.4	-40.8	179.8	-60.4	0	0	0	0	113.7	L325 S326 K331 N332 L333	L325-S329 PolarHBondContact O-N 3.08Å; L325-S329 VanDerWaalsContact O-N 3.11Å; L325-S329 PolarHBondContact O-OG 2.71Å; S326-S329 PolarHBondContact O-N 3.17Å; S329-K331 VanDerWaalsContact C-N 3.34Å; S329-K331 PolarHBondContact O-N 3.01Å; S329-N332 PolarHBondContact O-N 2.81Å; S329-L333 VanDerWaalsContact O-CD1 3.31Å; S329-L333 WeakPolarHBondContact O-CD1 3.24Å
330	S	54.8	Low	72.1	Confident	67 Å²	67	51.1 Å²	51.1	47%	0.469	25%	0.247	S	C	.	.	H	α-helix	trans	-66.3	-25	-164.7	58.4	0	0	0	0	115.8	S326 N332	S326-S330 WeakPolarHBondContact O-CB 3.45Å; S326-S330 PolarHBondContact O-N 3.05Å; S326-S330 PolarHBondContact O-OG 2.85Å; S330-N332 PolarHBondContact O-N 2.83Å
331	K	49.1	Very low	71.9	Confident	136 Å²	136	52.6 Å²	52.6	59%	0.591	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.8	-179.7	-73.3	176.7	179.3	172.5	0	113.8	E257 S329	E257-K331 IonicContact OE2-NZ 3.74Å; E257-K331 PolarHBondContact OE2-NZ 3.09Å; S329-K331 VanDerWaalsContact C-N 3.34Å; S329-K331 PolarHBondContact O-N 3.01Å
332	N	50.6	Low	71.8	Confident	43 Å²	43	49.8 Å²	49.8	23%	0.23	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.5	3.7	-166.1	-68.8	-19.4	0	0	0	116.6	S329 S330 K334 L1059	S329-N332 PolarHBondContact O-N 2.81Å; S330-N332 PolarHBondContact O-N 2.83Å; N332-K334 PolarHBondContact O-N 3.48Å; N332-L1059 HydrophobicContact CB-CB 3.75Å; N332-L1059 HydrophobicContact CB-CD1 4.06Å
333	L	54.5	Low	71.5	Confident	74 Å²	74	49.5 Å²	49.5	39%	0.387	24%	0.244	S	C	.	.			trans	-75.8	55.7	176.9	-71.9	93.5	0	0	0	113.6	H50 S329	H50-L333 PolarHBondContact NE2-O 3.1Å; S329-L333 VanDerWaalsContact O-CD1 3.31Å; S329-L333 WeakPolarHBondContact O-CD1 3.24Å
334	K	59.8	Low	71.4	Confident	174 Å²	174	50 Å²	50	76%	0.757	25%	0.247	S	C	*	.	P	Polyproline II helix	trans	-90.9	141.6	168.3	-67.4	-173.6	178.9	-176.3	0	109.9	N332 K336	N332-K334 PolarHBondContact O-N 3.48Å; K334-K336 PolarHBondContact O-N 3.05Å
335	R	64.9	Low	71.4	Confident	59 Å²	59	51 Å²	51	22%	0.223	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-56.1	126.9	170.3	-166.2	175.9	-163.7	137.9	4.7	108.9	Y51 E63 D107 Q445	Y51-R335 PolarHBondContact OH-NH1 3.07Å; E63-R335 IonicContact OE2-CZ 3.39Å; E63-R335 IonicContact OE2-NH1 3.1Å; E63-R335 PolarHBondContact OE2-NH1 3.35Å; D107-R335 IonicContact OD1-CZ 2.66Å; D107-R335 IonicContact OD1-NH1 3.95Å; D107-R335 IonicContact OD1-NH2 3.56Å; D107-R335 PolarHBondContact OD1-NH2 2.81Å; D107-R335 IonicContact OD2-CZ 3.15Å; D107-R335 IonicContact OD2-NH1 2.69Å; D107-R335 PolarHBondContact OD2-NH1 3.18Å; D107-R335 IonicContact OD2-NH2 2.77Å; D107-R335 PolarHBondContact OD2-NH2 2.95Å; R335-Q445 VanDerWaalsContact NE-OE1 3.12Å
336	K	71.5	Confident	71.8	Confident	33 Å²	33	54 Å²	54	14%	0.143	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-83.8	130.7	174.4	-58.8	-171.8	-174.7	-174.7	0	108.1	K334 L446 I1058 L1059 A1061 N1062 D1080	K334-K336 PolarHBondContact O-N 3.05Å; K336-L446 HydrophobicContact CB-CD1 4.27Å; K336-L446 HydrophobicContact CB-CD2 4.44Å; K336-L446 HydrophobicContact CD-CD1 4.23Å; K336-I1058 PolarHBondContact NZ-O 3.33Å; K336-L1059 WeakPolarHBondContact CE-O 2.98Å; K336-A1061 VanDerWaalsContact CE-O 3.31Å; K336-A1061 WeakPolarHBondContact CE-O 3.17Å; K336-A1061 PolarHBondContact NZ-O 3.17Å; K336-N1062 WeakPolarHBondContact CD-O 3.45Å; K336-D1080 WeakPolarHBondContact CE-OD2 3.38Å; K336-D1080 IonicContact NZ-OD2 3.69Å; K336-D1080 PolarHBondContact NZ-OD2 2.95Å
337	Y	71.4	Confident	72.2	Confident	106 Å²	106	53.9 Å²	53.9	42%	0.416	27%	0.266	S	S	.	.			trans	-106.2	142.6	175.2	-65.2	-81.8	0	0	0	109.5
338	S	75.6	Confident	72.7	Confident	2 Å²	2	52 Å²	52	1%	0.014	26%	0.256	C	S	.	.			trans	-70.6	145.3	177.5	163.5	0	0	0	0	111	R340 E341 N342 D448 E449	S338-R340 PolarHBondContact O-N 3.4Å; S338-R340 VanDerWaalsContact OG-CB 3.29Å; S338-R340 WeakPolarHBondContact OG-CB 3.32Å; S338-R340 PolarHBondContact OG-N 3.04Å; S338-R340 VanDerWaalsContact OG-N 3.07Å; S338-E341 PolarHBondContact N-OE2 2.82Å; S338-E341 WeakPolarHBondContact O-CB 3.35Å; S338-E341 PolarHBondContact O-N 3.13Å; S338-E341 VanDerWaalsContact O-N 3.1Å; S338-N342 PolarHBondContact O-N 3.23Å; S338-D448 PolarHBondContact OG-OD2 2.86Å; S338-E449 PolarHBondContact OG-OE1 3.05Å
339	T	78.3	Confident	73.6	Confident	17 Å²	17	54.2 Å²	54.2	10%	0.104	27%	0.267	C	S	.	.	H	α-helix	trans	-64.7	-25.9	173	66.6	0	0	0	0	111.8	L343 E449 V1044 Q1182	T339-L343 PolarHBondContact O-N 3.03Å; T339-E449 WeakPolarHBondContact CA-OE1 3.34Å; T339-E449 VanDerWaalsContact CB-OE1 3.29Å; T339-E449 WeakPolarHBondContact CB-OE1 3.25Å; T339-E449 VanDerWaalsContact N-CD 3.34Å; T339-E449 PolarHBondContact N-OE1 3.37Å; T339-E449 PolarHBondContact OG1-OE1 3.02Å; T339-V1044 HydrophobicContact CG2-CG2 3.85Å; T339-Q1182 VanDerWaalsContact C-NE2 3.34Å; T339-Q1182 PolarHBondContact O-NE2 3.18Å; T339-Q1182 PolarHBondContact OG1-NE2 2.95Å
340	R	84.2	Confident	74.9	Confident	9 Å²	9	57.9 Å²	57.9	3%	0.034	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-41.8	170.2	179	-163.1	54.6	73	1.4	111.3	S338 L343 S344 D448 M1108 L1185	S338-R340 PolarHBondContact O-N 3.4Å; S338-R340 VanDerWaalsContact OG-CB 3.29Å; S338-R340 WeakPolarHBondContact OG-CB 3.32Å; S338-R340 PolarHBondContact OG-N 3.04Å; S338-R340 VanDerWaalsContact OG-N 3.07Å; R340-L343 CarbonylContact O-C 3.57Å; R340-L343 PolarHBondContact O-N 2.9Å; R340-S344 WeakPolarHBondContact O-CB 3.46Å; R340-S344 PolarHBondContact O-N 3.46Å; R340-D448 VanDerWaalsContact CB-OD2 3.26Å; R340-D448 WeakPolarHBondContact CB-OD2 3.45Å; R340-D448 VanDerWaalsContact CD-OD2 3.32Å; R340-D448 WeakPolarHBondContact CD-OD2 3.46Å; R340-D448 IonicContact CZ-OD2 2.67Å; R340-D448 IonicContact NE-OD1 3.86Å; R340-D448 IonicContact NE-OD2 3.94Å; R340-D448 PolarHBondContact NE-OD2 3.06Å; R340-D448 IonicContact NH2-OD2 2.81Å; R340-M1108 HydrophobicContact CG-SD 4.02Å; R340-L1185 HydrophobicContact CG-CD1 4.05Å
341	E	81.8	Confident	76.6	Confident	35 Å²	35	55.5 Å²	55.5	16%	0.164	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-44.5	-177.7	-68.6	169.3	162.6	0	0	111.5	S338 L343 S344 N345	S338-E341 PolarHBondContact N-OE2 2.82Å; S338-E341 WeakPolarHBondContact O-CB 3.35Å; S338-E341 PolarHBondContact O-N 3.13Å; S338-E341 VanDerWaalsContact O-N 3.1Å; E341-L343 VanDerWaalsContact C-N 3.28Å; E341-L343 PolarHBondContact O-N 3.45Å; E341-S344 WeakPolarHBondContact O-CB 3.46Å; E341-S344 PolarHBondContact O-N 3.34Å; E341-S344 VanDerWaalsContact O-N 3.14Å; E341-N345 PolarHBondContact O-N 3.24Å
342	N	81.4	Confident	78.5	Confident	100 Å²	100	50 Å²	50	54%	0.535	24%	0.241	S	C	.	.	H	α-helix	trans	-60	-39.5	175	-176	47.2	0	0	0	111.9	S338 I346	S338-N342 PolarHBondContact O-N 3.23Å; N342-I346 WeakPolarHBondContact O-CG1 3.37Å; N342-I346 PolarHBondContact O-N 3Å
343	L	84.3	Confident	80.4	Confident	30 Å²	30	52 Å²	52	16%	0.157	26%	0.255	C	S	.	.	H	α-helix	trans	-74.2	-32.1	175	180	136.9	0	0	0	112.7	T339 R340 E341 N345 I346 I347 M1041 L1185	T339-L343 PolarHBondContact O-N 3.03Å; R340-L343 CarbonylContact O-C 3.57Å; R340-L343 PolarHBondContact O-N 2.9Å; E341-L343 VanDerWaalsContact C-N 3.28Å; E341-L343 PolarHBondContact O-N 3.45Å; L343-N345 VanDerWaalsContact C-N 3.34Å; L343-I346 PolarHBondContact O-N 3.19Å; L343-I347 HydrophobicContact CD2-CD1 3.42Å; L343-I347 VanDerWaalsContact CD2-CD1 3.42Å; L343-I347 HydrophobicContact CD2-CG1 4.19Å; L343-I347 HydrophobicContact CG-CD1 4.29Å; L343-I347 WeakPolarHBondContact O-CG1 3.47Å; L343-I347 PolarHBondContact O-N 2.92Å; L343-M1041 HydrophobicContact CB-CE 3.61Å; L343-M1041 HydrophobicContact CD1-CE 3.51Å; L343-M1041 HydrophobicContact CD1-SD 3.6Å; L343-M1041 VanDerWaalsContact CD1-SD 3.6Å; L343-M1041 HydrophobicContact CG-CE 4.16Å; L343-L1185 HydrophobicContact CD2-CB 3.65Å; L343-L1185 HydrophobicContact CD2-CD1 3.71Å; L343-L1185 HydrophobicContact CD2-CG 4.28Å
344	S	84.6	Confident	82.2	Confident	10 Å²	10	50.1 Å²	50.1	7%	0.07	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-44.6	171	-163.5	0	0	0	0	110.6	R340 E341 I346 I347 L348 M1108	R340-S344 WeakPolarHBondContact O-CB 3.46Å; R340-S344 PolarHBondContact O-N 3.46Å; E341-S344 WeakPolarHBondContact O-CB 3.46Å; E341-S344 PolarHBondContact O-N 3.34Å; E341-S344 VanDerWaalsContact O-N 3.14Å; S344-I346 VanDerWaalsContact C-N 3.29Å; S344-I346 PolarHBondContact O-N 2.83Å; S344-I347 PolarHBondContact O-N 3.41Å; S344-L348 VanDerWaalsContact O-CB 3.31Å; S344-L348 WeakPolarHBondContact O-CB 3.21Å; S344-L348 WeakPolarHBondContact O-CD1 3.45Å; S344-L348 WeakPolarHBondContact O-CG 3.41Å; S344-L348 PolarHBondContact O-N 3.17Å; S344-M1108 VanDerWaalsContact OG-CE 3.25Å; S344-M1108 WeakPolarHBondContact OG-CE 3.37Å
345	N	84.8	Confident	83.7	Confident	22 Å²	22	42.1 Å²	42.1	12%	0.118	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-38	175.1	-72	-11.4	0	0	0	111.9	N67 I68 E341 L343 L349	N67-N345 PolarHBondContact OD1-OD1 3.49Å; I68-N345 HydrophobicContact CD1-CB 3.93Å; I68-N345 HydrophobicContact CG1-CB 4.15Å; E341-N345 PolarHBondContact O-N 3.24Å; L343-N345 VanDerWaalsContact C-N 3.34Å; N345-L349 WeakPolarHBondContact O-CB 3.41Å; N345-L349 PolarHBondContact O-N 3.24Å
346	I	87.4	Confident	84.9	Confident	88 Å²	88	42.6 Å²	42.6	45%	0.451	22%	0.224	S	C	.	.	H	α-helix	trans	-67.8	-43.8	174.3	-66.1	165	0	0	0	111.5	N342 L343 S344 L349 I350	N342-I346 WeakPolarHBondContact O-CG1 3.37Å; N342-I346 PolarHBondContact O-N 3Å; L343-I346 PolarHBondContact O-N 3.19Å; S344-I346 VanDerWaalsContact C-N 3.29Å; S344-I346 PolarHBondContact O-N 2.83Å; I346-L349 PolarHBondContact O-N 2.77Å; I346-I350 HydrophobicContact CG2-CD1 4.27Å; I346-I350 WeakPolarHBondContact O-CG1 3.41Å; I346-I350 PolarHBondContact O-N 3.26Å
347	I	88.4	Confident	85.9	Confident	13 Å²	13	44.8 Å²	44.8	7%	0.067	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-46.7	176.3	-68.2	164.9	0	0	0	110.6	L343 S344 L349 I350 F351 Y1112 I1190	L343-I347 HydrophobicContact CD2-CD1 3.42Å; L343-I347 VanDerWaalsContact CD2-CD1 3.42Å; L343-I347 HydrophobicContact CD2-CG1 4.19Å; L343-I347 HydrophobicContact CG-CD1 4.29Å; L343-I347 WeakPolarHBondContact O-CG1 3.47Å; L343-I347 PolarHBondContact O-N 2.92Å; S344-I347 PolarHBondContact O-N 3.41Å; I347-L349 VanDerWaalsContact C-N 3.3Å; I347-L349 PolarHBondContact O-N 3.04Å; I347-I350 WeakPolarHBondContact O-CA 3.45Å; I347-I350 WeakPolarHBondContact O-CB 3.42Å; I347-I350 PolarHBondContact O-N 2.84Å; I347-F351 HydrophobicContact CG2-CD2 3.65Å; I347-F351 HydrophobicContact CG2-CE2 3.52Å; I347-F351 WeakPolarHBondContact O-CD2 3.31Å; I347-F351 PolarHBondContact O-N 3.3Å; I347-Y1112 HydrophobicContact CD1-CE2 4.41Å; I347-Y1112 HydrophobicContact CG2-CE1 4.09Å; I347-Y1112 HydrophobicContact CG2-CE2 3.82Å; I347-Y1112 WeakPolarHBondContact CG2-OH 3.05Å; I347-I1190 HydrophobicContact CD1-CD1 3.45Å; I347-I1190 VanDerWaalsContact CD1-CD1 3.45Å; I347-I1190 HydrophobicContact CG1-CD1 3.93Å
348	L	86.6	Confident	86.9	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-39.5	178.5	-70.1	164.1	0	0	0	110.9	A69 S344 I350 F351 M352 I405 Y1112	A69-L348 HydrophobicContact CB-CD1 4.33Å; S344-L348 VanDerWaalsContact O-CB 3.31Å; S344-L348 WeakPolarHBondContact O-CB 3.21Å; S344-L348 WeakPolarHBondContact O-CD1 3.45Å; S344-L348 WeakPolarHBondContact O-CG 3.41Å; S344-L348 PolarHBondContact O-N 3.17Å; L348-I350 VanDerWaalsContact C-N 3.34Å; L348-I350 PolarHBondContact O-N 2.94Å; L348-F351 PolarHBondContact O-N 3.04Å; L348-M352 HydrophobicContact CB-CE 4.3Å; L348-M352 VanDerWaalsContact O-CG 3.28Å; L348-M352 WeakPolarHBondContact O-CG 3.45Å; L348-M352 PolarHBondContact O-N 3.31Å; L348-I405 HydrophobicContact CD2-CG2 4.03Å; L348-Y1112 HydrophobicContact CD2-CE1 4.29Å
349	L	88.4	Confident	87.7	Confident	85 Å²	85	42.2 Å²	42.2	45%	0.445	23%	0.234	S	C	.	.	H	α-helix	trans	-61.6	-39.6	171.7	-177.6	71.3	0	0	0	112.2	N345 I346 I347 M352 V353	N345-L349 WeakPolarHBondContact O-CB 3.41Å; N345-L349 PolarHBondContact O-N 3.24Å; I346-L349 PolarHBondContact O-N 2.77Å; I347-L349 VanDerWaalsContact C-N 3.3Å; I347-L349 PolarHBondContact O-N 3.04Å; L349-M352 PolarHBondContact O-N 2.89Å; L349-V353 WeakPolarHBondContact O-CG2 3.48Å; L349-V353 PolarHBondContact O-N 2.93Å
350	I	90.5	Very high	88.4	Confident	110 Å²	110	44.8 Å²	44.8	56%	0.564	25%	0.246	S	C	*	.	H	α-helix	trans	-62.7	-42.3	173.9	-67.2	163.5	0	0	0	110.6	I346 I347 L348 V353 A354	I346-I350 HydrophobicContact CG2-CD1 4.27Å; I346-I350 WeakPolarHBondContact O-CG1 3.41Å; I346-I350 PolarHBondContact O-N 3.26Å; I347-I350 WeakPolarHBondContact O-CA 3.45Å; I347-I350 WeakPolarHBondContact O-CB 3.42Å; I347-I350 PolarHBondContact O-N 2.84Å; L348-I350 VanDerWaalsContact C-N 3.34Å; L348-I350 PolarHBondContact O-N 2.94Å; I350-V353 PolarHBondContact O-N 2.83Å; I350-A354 WeakPolarHBondContact O-CB 3.02Å; I350-A354 PolarHBondContact O-N 3.44Å
351	F	90.7	Very high	88.8	Confident	18 Å²	18	49.2 Å²	49.2	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-37.1	174	-80.2	-73.7	0	0	0	112.8	I347 L348 A354 M355 L404 I405 Y1112 V1116 V1194	I347-F351 HydrophobicContact CG2-CD2 3.65Å; I347-F351 HydrophobicContact CG2-CE2 3.52Å; I347-F351 WeakPolarHBondContact O-CD2 3.31Å; I347-F351 PolarHBondContact O-N 3.3Å; L348-F351 PolarHBondContact O-N 3.04Å; F351-A354 PolarHBondContact O-N 2.88Å; F351-M355 VanDerWaalsContact O-CB 3.27Å; F351-M355 WeakPolarHBondContact O-CB 3Å; F351-M355 PolarHBondContact O-N 2.86Å; F351-L404 HydrophobicContact CD1-CD1 4.26Å; F351-L404 HydrophobicContact CD1-CD2 4.01Å; F351-L404 HydrophobicContact CD1-CG 3.9Å; F351-L404 HydrophobicContact CE1-CD1 4.48Å; F351-I405 HydrophobicContact CB-CD1 4.45Å; F351-I405 HydrophobicContact CB-CG1 4.35Å; F351-Y1112 HydrophobicContact CD2-CD1 4.19Å; F351-Y1112 HydrophobicContact CD2-CE1 4.24Å; F351-Y1112 AromaticContact CE2-CD1 3.57Å; F351-Y1112 HydrophobicContact CE2-CD1 3.57Å; F351-Y1112 HydrophobicContact CE2-CD2 4.31Å; F351-Y1112 AromaticContact CE2-CE1 3.91Å; F351-Y1112 HydrophobicContact CE2-CE1 3.91Å; F351-Y1112 AromaticContact CE2-CG 3.81Å; F351-Y1112 HydrophobicContact CE2-CG 3.81Å; F351-Y1112 HydrophobicContact CZ-CD1 4.05Å; F351-Y1112 HydrophobicContact CZ-CG 4.03Å; F351-V1116 HydrophobicContact CE1-CG2 3.88Å; F351-V1194 HydrophobicContact CE1-CG2 4.31Å; F351-V1194 HydrophobicContact CZ-CG2 4.04Å
352	M	89	Confident	89.3	Confident	20 Å²	20	48.1 Å²	48.1	10%	0.099	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-46	173.8	-68.7	168.4	-165.4	0	0	111.6	I68 Y72 L348 L349 M355 V356 I405	I68-M352 HydrophobicContact CG2-CE 3.96Å; I68-M352 HydrophobicContact CG2-SD 3.82Å; Y72-M352 HydrophobicContact CD1-CE 4.25Å; Y72-M352 HydrophobicContact CD2-CE 4.18Å; Y72-M352 HydrophobicContact CD2-CG 3.82Å; Y72-M352 HydrophobicContact CD2-SD 4.1Å; Y72-M352 HydrophobicContact CE2-CG 4.21Å; Y72-M352 HydrophobicContact CG-CE 3.7Å; Y72-M352 HydrophobicContact CG-CG 4.27Å; Y72-M352 HydrophobicContact CG-SD 4.17Å; L348-M352 HydrophobicContact CB-CE 4.3Å; L348-M352 VanDerWaalsContact O-CG 3.28Å; L348-M352 WeakPolarHBondContact O-CG 3.45Å; L348-M352 PolarHBondContact O-N 3.31Å; L349-M352 PolarHBondContact O-N 2.89Å; M352-M355 PolarHBondContact O-N 2.84Å; M352-V356 WeakPolarHBondContact O-CG2 3.42Å; M352-V356 PolarHBondContact O-N 2.91Å; M352-I405 HydrophobicContact CB-CD1 4.23Å; M352-I405 HydrophobicContact CE-CD1 3.9Å; M352-I405 HydrophobicContact CG-CD1 3.23Å; M352-I405 HydrophobicContact SD-CD1 4.48Å
353	V	91.5	Very high	89.8	Confident	85 Å²	85	43.3 Å²	43.3	52%	0.515	24%	0.24	S	C	.	.	H	α-helix	trans	-63.4	-45.4	176.2	173.4	0	0	0	0	110.3	L349 I350 M355 V356 T357	L349-V353 WeakPolarHBondContact O-CG2 3.48Å; L349-V353 PolarHBondContact O-N 2.93Å; I350-V353 PolarHBondContact O-N 2.83Å; V353-M355 PolarHBondContact O-N 2.66Å; V353-V356 PolarHBondContact O-N 2.7Å; V353-T357 HydrophobicContact CG1-CG2 4.43Å; V353-T357 WeakPolarHBondContact O-CG2 3.2Å; V353-T357 PolarHBondContact O-N 2.65Å; V353-T357 PolarHBondContact O-OG1 2.93Å
354	A	91.3	Very high	90.2	Very high	34 Å²	34	46 Å²	46	28%	0.281	25%	0.253	S	S	.	.	H	α-helix	trans	-57.1	-48.9	176.5	0	0	0	0	0	111.5	I350 F351 V356 T357 I358	I350-A354 WeakPolarHBondContact O-CB 3.02Å; I350-A354 PolarHBondContact O-N 3.44Å; F351-A354 PolarHBondContact O-N 2.88Å; A354-V356 PolarHBondContact O-N 3.38Å; A354-T357 WeakPolarHBondContact CA-OG1 3.4Å; A354-T357 PolarHBondContact O-N 2.66Å; A354-T357 VanDerWaalsContact O-N 3.15Å; A354-T357 PolarHBondContact O-OG1 2.73Å; A354-I358 WeakPolarHBondContact O-CB 3.24Å; A354-I358 WeakPolarHBondContact O-CD1 3.48Å; A354-I358 WeakPolarHBondContact O-CG1 3.36Å; A354-I358 PolarHBondContact O-N 2.86Å
355	M	91.4	Very high	90.5	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.03	27%	0.268	C	S	.	.	H	α-helix	trans	-54.4	-49.8	175.5	179.8	-148.9	60.4	0	0	112	Y72 F351 M352 V353 T357 I358 T359 L398 I401 L404	Y72-M355 HydrophobicContact CE2-CE 3.73Å; Y72-M355 HydrophobicContact CE2-SD 3.69Å; Y72-M355 PolarHBondContact OH-SD 3.33Å; F351-M355 VanDerWaalsContact O-CB 3.27Å; F351-M355 WeakPolarHBondContact O-CB 3Å; F351-M355 PolarHBondContact O-N 2.86Å; M352-M355 PolarHBondContact O-N 2.84Å; V353-M355 PolarHBondContact O-N 2.66Å; M355-T357 PolarHBondContact O-N 3.25Å; M355-I358 PolarHBondContact O-N 3.31Å; M355-T359 WeakPolarHBondContact O-CG2 3.3Å; M355-T359 PolarHBondContact O-N 3.25Å; M355-T359 PolarHBondContact O-OG1 3.4Å; M355-L398 HydrophobicContact CE-CD1 3.38Å; M355-L398 HydrophobicContact CG-CD1 4.1Å; M355-L398 HydrophobicContact SD-CD1 3.49Å; M355-L398 WeakPolarHBondContact SD-CD1 3.35Å; M355-I401 HydrophobicContact CG-CG2 3.84Å; M355-L404 HydrophobicContact CB-CD2 3.96Å
356	V	90.4	Very high	90.7	Very high	69 Å²	69	48 Å²	48	42%	0.418	26%	0.263	S	S	.	.	H	α-helix	trans	-63.4	-38.5	177.1	175.8	0	0	0	0	112	M352 V353 A354 T359 L360	M352-V356 WeakPolarHBondContact O-CG2 3.42Å; M352-V356 PolarHBondContact O-N 2.91Å; V353-V356 PolarHBondContact O-N 2.7Å; A354-V356 PolarHBondContact O-N 3.38Å; V356-T359 WeakPolarHBondContact CA-OG1 3.42Å; V356-T359 PolarHBondContact O-OG1 3.46Å; V356-L360 HydrophobicContact CG1-CD1 4.04Å; V356-L360 WeakPolarHBondContact O-CB 3.47Å; V356-L360 VanDerWaalsContact O-CG 3.27Å; V356-L360 WeakPolarHBondContact O-CG 3.47Å; V356-L360 PolarHBondContact O-N 2.95Å; V356-L360 VanDerWaalsContact O-N 3.14Å
357	T	93.1	Very high	90.7	Very high	79 Å²	79	45.5 Å²	45.5	49%	0.485	25%	0.252	S	S	.	.	H	α-helix	trans	-69.3	-36.2	176.7	56.3	0	0	0	0	112.8	V353 A354 M355 L361	V353-T357 HydrophobicContact CG1-CG2 4.43Å; V353-T357 WeakPolarHBondContact O-CG2 3.2Å; V353-T357 PolarHBondContact O-N 2.65Å; V353-T357 PolarHBondContact O-OG1 2.93Å; A354-T357 WeakPolarHBondContact CA-OG1 3.4Å; A354-T357 PolarHBondContact O-N 2.66Å; A354-T357 VanDerWaalsContact O-N 3.15Å; A354-T357 PolarHBondContact O-OG1 2.73Å; M355-T357 PolarHBondContact O-N 3.25Å; T357-L361 VanDerWaalsContact O-CB 3.3Å; T357-L361 WeakPolarHBondContact O-CB 3.33Å; T357-L361 PolarHBondContact O-N 3.24Å
358	I	92.4	Very high	90.8	Very high	52 Å²	52	48.9 Å²	48.9	27%	0.267	27%	0.269	S	S	.	.	H	α-helix	trans	-70.5	-43.2	178.7	-68.1	163.9	0	0	0	110	A354 M355 L361 I362 I401 L1123	A354-I358 WeakPolarHBondContact O-CB 3.24Å; A354-I358 WeakPolarHBondContact O-CD1 3.48Å; A354-I358 WeakPolarHBondContact O-CG1 3.36Å; A354-I358 PolarHBondContact O-N 2.86Å; M355-I358 PolarHBondContact O-N 3.31Å; I358-L361 PolarHBondContact O-N 3.2Å; I358-I362 HydrophobicContact CG2-CD1 3.56Å; I358-I362 HydrophobicContact CG2-CG1 4.44Å; I358-I362 WeakPolarHBondContact O-CB 3.49Å; I358-I362 WeakPolarHBondContact O-CD1 3.48Å; I358-I362 VanDerWaalsContact O-CG1 3.26Å; I358-I362 WeakPolarHBondContact O-CG1 3.47Å; I358-I362 PolarHBondContact O-N 2.82Å; I358-I401 HydrophobicContact CG2-CD1 4.14Å; I358-L1123 HydrophobicContact CG2-CD1 4.14Å; I358-L1123 HydrophobicContact CG2-CD2 4.44Å
359	T	91.8	Very high	90.9	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.012	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-47.2	176.4	55.6	0	0	0	0	111.4	M355 V356 L361 I362 T363 L398 I401	M355-T359 WeakPolarHBondContact O-CG2 3.3Å; M355-T359 PolarHBondContact O-N 3.25Å; M355-T359 PolarHBondContact O-OG1 3.4Å; V356-T359 WeakPolarHBondContact CA-OG1 3.42Å; V356-T359 PolarHBondContact O-OG1 3.46Å; T359-L361 VanDerWaalsContact C-N 3.34Å; T359-L361 PolarHBondContact O-N 3.01Å; T359-I362 PolarHBondContact O-N 3.38Å; T359-T363 WeakPolarHBondContact O-CG2 3.26Å; T359-T363 PolarHBondContact O-N 3.1Å; T359-L398 HydrophobicContact CG2-CB 4.16Å; T359-L398 HydrophobicContact CG2-CD1 4.09Å; T359-I401 HydrophobicContact CG2-CB 4.12Å; T359-I401 HydrophobicContact CG2-CD1 3.69Å; T359-I401 HydrophobicContact CG2-CG1 4.49Å; T359-I401 HydrophobicContact CG2-CG2 4.43Å
360	L	92.4	Very high	90.7	Very high	72 Å²	72	50.8 Å²	50.8	38%	0.377	27%	0.273	S	S	.	.	H	α-helix	trans	-59.4	-42.1	175	-72.3	171.3	0	0	0	112.6	V356 T363 I364 I394	V356-L360 HydrophobicContact CG1-CD1 4.04Å; V356-L360 WeakPolarHBondContact O-CB 3.47Å; V356-L360 VanDerWaalsContact O-CG 3.27Å; V356-L360 WeakPolarHBondContact O-CG 3.47Å; V356-L360 PolarHBondContact O-N 2.95Å; V356-L360 VanDerWaalsContact O-N 3.14Å; L360-T363 PolarHBondContact O-N 2.94Å; L360-T363 PolarHBondContact O-OG1 2.89Å; L360-I364 WeakPolarHBondContact O-CD1 3.34Å; L360-I364 VanDerWaalsContact O-CG1 3.25Å; L360-I364 WeakPolarHBondContact O-CG1 3.41Å; L360-I364 PolarHBondContact O-N 3.06Å; L360-I364 VanDerWaalsContact O-N 3.11Å; L360-I394 HydrophobicContact CD2-CD1 3.89Å; L360-I394 HydrophobicContact CD2-CG1 4.3Å
361	L	93.8	Very high	90.4	Very high	102 Å²	102	53.1 Å²	53.1	53%	0.534	28%	0.279	S	S	.	.	H	α-helix	trans	-64.3	-41.9	177.8	-179.1	144.7	0	0	0	111.6	T357 I358 T359 I364 L365	T357-L361 VanDerWaalsContact O-CB 3.3Å; T357-L361 WeakPolarHBondContact O-CB 3.33Å; T357-L361 PolarHBondContact O-N 3.24Å; I358-L361 PolarHBondContact O-N 3.2Å; T359-L361 VanDerWaalsContact C-N 3.34Å; T359-L361 PolarHBondContact O-N 3.01Å; L361-I364 PolarHBondContact O-N 2.92Å; L361-L365 HydrophobicContact CD2-CD1 3.62Å; L361-L365 HydrophobicContact CD2-CG 4.36Å; L361-L365 WeakPolarHBondContact O-CG 3.48Å; L361-L365 PolarHBondContact O-N 3.19Å
362	I	92.3	Very high	90.3	Very high	11 Å²	11	57.9 Å²	57.9	6%	0.056	31%	0.305	C	S	.	.	H	α-helix	trans	-68.8	-37	178.4	-68.5	161.1	0	0	0	111.5	I358 T359 I364 L365 S366 F397 I401 L1123 I1126 Y1131	I358-I362 HydrophobicContact CG2-CD1 3.56Å; I358-I362 HydrophobicContact CG2-CG1 4.44Å; I358-I362 WeakPolarHBondContact O-CB 3.49Å; I358-I362 WeakPolarHBondContact O-CD1 3.48Å; I358-I362 VanDerWaalsContact O-CG1 3.26Å; I358-I362 WeakPolarHBondContact O-CG1 3.47Å; I358-I362 PolarHBondContact O-N 2.82Å; T359-I362 PolarHBondContact O-N 3.38Å; I362-I364 VanDerWaalsContact C-N 3.33Å; I362-I364 PolarHBondContact O-N 2.89Å; I362-L365 PolarHBondContact O-N 2.9Å; I362-S366 VanDerWaalsContact O-CB 3.24Å; I362-S366 WeakPolarHBondContact O-CB 3.47Å; I362-S366 PolarHBondContact O-N 3.49Å; I362-F397 HydrophobicContact CG2-CD1 3.74Å; I362-F397 HydrophobicContact CG2-CD2 4.1Å; I362-F397 HydrophobicContact CG2-CE1 3.69Å; I362-F397 HydrophobicContact CG2-CE2 4.02Å; I362-F397 HydrophobicContact CG2-CG 3.96Å; I362-F397 HydrophobicContact CG2-CZ 3.83Å; I362-I401 HydrophobicContact CD1-CD1 3.57Å; I362-L1123 HydrophobicContact CD1-CD2 3.33Å; I362-I1126 HydrophobicContact CG2-CG2 4.09Å; I362-Y1131 HydrophobicContact CG2-CD1 4.27Å
363	T	91	Very high	90.1	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-67.5	-37.1	177.1	69.5	0	0	0	0	111.4	T359 L360 T367 T393 I394 F397	T359-T363 WeakPolarHBondContact O-CG2 3.26Å; T359-T363 PolarHBondContact O-N 3.1Å; L360-T363 PolarHBondContact O-N 2.94Å; L360-T363 PolarHBondContact O-OG1 2.89Å; T363-T367 WeakPolarHBondContact O-CG2 3.37Å; T363-T367 PolarHBondContact O-N 3.44Å; T363-T367 PolarHBondContact O-OG1 3.21Å; T363-T393 HydrophobicContact CG2-CG2 4.14Å; T363-I394 HydrophobicContact CG2-CB 4.13Å; T363-I394 HydrophobicContact CG2-CG1 3.53Å; T363-F397 HydrophobicContact CG2-CD2 3.64Å; T363-F397 HydrophobicContact CG2-CE2 4.37Å; T363-F397 HydrophobicContact CG2-CG 4.49Å
364	I	91.8	Very high	89.6	Confident	86 Å²	86	57.9 Å²	57.9	44%	0.441	31%	0.306	S	S	.	.	H	α-helix	trans	-63.3	-47.8	172.1	-67.5	164.6	0	0	0	110.4	L360 L361 I362 S366 T367 I368	L360-I364 WeakPolarHBondContact O-CD1 3.34Å; L360-I364 VanDerWaalsContact O-CG1 3.25Å; L360-I364 WeakPolarHBondContact O-CG1 3.41Å; L360-I364 PolarHBondContact O-N 3.06Å; L360-I364 VanDerWaalsContact O-N 3.11Å; L361-I364 PolarHBondContact O-N 2.92Å; I362-I364 VanDerWaalsContact C-N 3.33Å; I362-I364 PolarHBondContact O-N 2.89Å; I364-S366 PolarHBondContact O-N 3.12Å; I364-T367 PolarHBondContact O-N 3.21Å; I364-T367 PolarHBondContact O-OG1 3.13Å; I364-I368 HydrophobicContact CG2-CD1 3.77Å; I364-I368 WeakPolarHBondContact O-CD1 3.39Å; I364-I368 VanDerWaalsContact O-CG1 3.24Å; I364-I368 WeakPolarHBondContact O-CG1 3.48Å; I364-I368 PolarHBondContact O-N 2.97Å
365	L	92.1	Very high	89.1	Confident	71 Å²	71	65.7 Å²	65.7	37%	0.372	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-42.1	177.4	-70.2	176.4	0	0	0	112.6	L361 I362 I368 W369 Y1131	L361-L365 HydrophobicContact CD2-CD1 3.62Å; L361-L365 HydrophobicContact CD2-CG 4.36Å; L361-L365 WeakPolarHBondContact O-CG 3.48Å; L361-L365 PolarHBondContact O-N 3.19Å; I362-L365 PolarHBondContact O-N 2.9Å; L365-I368 PolarHBondContact O-N 3.46Å; L365-W369 VanDerWaalsContact O-CB 3.3Å; L365-W369 WeakPolarHBondContact O-CB 3.37Å; L365-W369 PolarHBondContact O-N 2.94Å; L365-Y1131 HydrophobicContact CB-CD1 4.47Å; L365-Y1131 HydrophobicContact CB-CE1 3.72Å; L365-Y1131 HydrophobicContact CD1-CE1 4.39Å
366	S	89.1	Confident	88.6	Confident	3 Å²	3	72.7 Å²	72.7	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-59.8	-50.9	175.8	176.5	0	0	0	0	111.3	I362 I364 I368 W369 I370	I362-S366 VanDerWaalsContact O-CB 3.24Å; I362-S366 WeakPolarHBondContact O-CB 3.47Å; I362-S366 PolarHBondContact O-N 3.49Å; I364-S366 PolarHBondContact O-N 3.12Å; S366-I368 VanDerWaalsContact C-N 3.33Å; S366-I368 PolarHBondContact O-N 3.45Å; S366-W369 PolarHBondContact O-N 3.22Å; S366-W369 VanDerWaalsContact O-N 3.15Å; S366-I370 WeakPolarHBondContact O-CB 3.3Å; S366-I370 VanDerWaalsContact O-CG1 3.28Å; S366-I370 WeakPolarHBondContact O-CG1 3.31Å; S366-I370 PolarHBondContact O-N 3.25Å
367	T	87.1	Confident	88.3	Confident	35 Å²	35	69.9 Å²	69.9	22%	0.215	35%	0.346	C	S	.	.	H	α-helix	trans	-62.4	-37.3	178.2	51.3	0	0	0	0	113.1	T363 I364 K371 L385 F390	T363-T367 WeakPolarHBondContact O-CG2 3.37Å; T363-T367 PolarHBondContact O-N 3.44Å; T363-T367 PolarHBondContact O-OG1 3.21Å; I364-T367 PolarHBondContact O-N 3.21Å; I364-T367 PolarHBondContact O-OG1 3.13Å; T367-K371 VanDerWaalsContact O-CB 3.28Å; T367-K371 WeakPolarHBondContact O-CB 3.46Å; T367-K371 PolarHBondContact O-N 3.02Å; T367-L385 HydrophobicContact CG2-CD1 4.43Å; T367-F390 HydrophobicContact CG2-CD2 3.8Å; T367-F390 HydrophobicContact CG2-CE2 3.96Å
368	I	89.5	Confident	87.9	Confident	85 Å²	85	76.5 Å²	76.5	44%	0.436	36%	0.362	S	S	.	.	H	α-helix	trans	-65.8	-44.5	173.3	-67.2	165.9	0	0	0	110.8	I364 L365 S366 K371 N372	I364-I368 HydrophobicContact CG2-CD1 3.77Å; I364-I368 WeakPolarHBondContact O-CD1 3.39Å; I364-I368 VanDerWaalsContact O-CG1 3.24Å; I364-I368 WeakPolarHBondContact O-CG1 3.48Å; I364-I368 PolarHBondContact O-N 2.97Å; L365-I368 PolarHBondContact O-N 3.46Å; S366-I368 VanDerWaalsContact C-N 3.33Å; S366-I368 PolarHBondContact O-N 3.45Å; I368-K371 PolarHBondContact O-N 2.93Å; I368-N372 WeakPolarHBondContact O-CB 3.41Å; I368-N372 VanDerWaalsContact O-CG 3.25Å; I368-N372 PolarHBondContact O-N 2.85Å
369	W	89.8	Confident	87.5	Confident	86 Å²	86	81.6 Å²	81.6	33%	0.326	38%	0.38	S	S	.	.	H	α-helix	trans	-65.3	-44.6	-179.7	-174.6	97.5	0	0	0	112.1	L365 S366 N372 N373 I377 G1130 Y1131	L365-W369 VanDerWaalsContact O-CB 3.3Å; L365-W369 WeakPolarHBondContact O-CB 3.37Å; L365-W369 PolarHBondContact O-N 2.94Å; S366-W369 PolarHBondContact O-N 3.22Å; S366-W369 VanDerWaalsContact O-N 3.15Å; W369-N372 PolarHBondContact O-N 3.48Å; W369-N373 VanDerWaalsContact CE2-ND2 3.3Å; W369-N373 HydrophobicContact CH2-CB 4.41Å; W369-N373 HydrophobicContact CZ2-CB 4.46Å; W369-N373 HydrophobicContact CZ3-CB 4.44Å; W369-N373 PolarHBondContact NE1-ND2 3.23Å; W369-N373 WeakPolarHBondContact O-CB 3.37Å; W369-N373 PolarHBondContact O-N 2.97Å; W369-N373 PolarHBondContact O-ND2 3.47Å; W369-I377 HydrophobicContact CH2-CG2 4.28Å; W369-I377 HydrophobicContact CZ3-CD1 4.28Å; W369-G1130 VanDerWaalsContact CE3-O 3.24Å; W369-G1130 WeakPolarHBondContact CZ3-O 3.4Å; W369-Y1131 HydrophobicContact CB-CD2 3.68Å; W369-Y1131 HydrophobicContact CB-CE2 3.88Å; W369-Y1131 AromaticContact CD1-CD2 3.91Å; W369-Y1131 AromaticContact CD1-CE2 3.77Å; W369-Y1131 HydrophobicContact CD2-CD2 4.08Å; W369-Y1131 AromaticContact CG-CD2 3.61Å; W369-Y1131 HydrophobicContact CG-CD2 3.61Å; W369-Y1131 AromaticContact CG-CE2 3.86Å; W369-Y1131 HydrophobicContact CG-CE2 3.86Å
370	I	84.6	Confident	87	Confident	41 Å²	41	85 Å²	85	21%	0.21	40%	0.397	C	S	.	.	H	α-helix	trans	-59.3	-52	175.3	-68.4	165.7	0	0	0	109.2	S366 N372 N373 T374 F382	S366-I370 WeakPolarHBondContact O-CB 3.3Å; S366-I370 VanDerWaalsContact O-CG1 3.28Å; S366-I370 WeakPolarHBondContact O-CG1 3.31Å; S366-I370 PolarHBondContact O-N 3.25Å; I370-N372 VanDerWaalsContact C-N 3.3Å; I370-N372 PolarHBondContact O-N 3.38Å; I370-N373 PolarHBondContact O-N 3.18Å; I370-N373 VanDerWaalsContact O-N 3.17Å; I370-T374 VanDerWaalsContact O-CG2 3.3Å; I370-T374 WeakPolarHBondContact O-CG2 3.33Å; I370-T374 PolarHBondContact O-N 2.94Å; I370-F382 HydrophobicContact CD1-CE1 4.39Å; I370-F382 HydrophobicContact CG1-CE1 4.36Å; I370-F382 HydrophobicContact CG2-CD1 4.02Å; I370-F382 HydrophobicContact CG2-CE1 3.72Å; I370-F382 HydrophobicContact CG2-CZ 4.23Å
371	K	84.4	Confident	86	Confident	158 Å²	158	89.6 Å²	89.6	69%	0.687	42%	0.422	S	S	*	.	H	α-helix	trans	-53.4	-46.6	178.6	-176.2	178.9	-179.7	-179.5	0	112.1	T367 I368 T374	T367-K371 VanDerWaalsContact O-CB 3.28Å; T367-K371 WeakPolarHBondContact O-CB 3.46Å; T367-K371 PolarHBondContact O-N 3.02Å; I368-K371 PolarHBondContact O-N 2.93Å; K371-T374 PolarHBondContact O-OG1 3.31Å; K371-T374 VanDerWaalsContact O-OG1 3.06Å
372	N	87.2	Confident	84.8	Confident	118 Å²	118	89.6 Å²	89.6	63%	0.631	42%	0.418	S	S	*	.	H	α-helix	trans	-72.2	-31.3	-178.1	-71	-8.1	0	0	0	113.4	I368 W369 I370	I368-N372 WeakPolarHBondContact O-CB 3.41Å; I368-N372 VanDerWaalsContact O-CG 3.25Å; I368-N372 PolarHBondContact O-N 2.85Å; W369-N372 PolarHBondContact O-N 3.48Å; I370-N372 VanDerWaalsContact C-N 3.3Å; I370-N372 PolarHBondContact O-N 3.38Å
373	N	85.7	Confident	83.6	Confident	28 Å²	28	94.7 Å²	94.7	15%	0.15	44%	0.441	C	S	.	.	H	α-helix	trans	-101.6	-0.4	-176.2	-67.6	-70.5	0	0	0	114.8	W369 I370 K375 K376 I377	W369-N373 VanDerWaalsContact CE2-ND2 3.3Å; W369-N373 HydrophobicContact CH2-CB 4.41Å; W369-N373 HydrophobicContact CZ2-CB 4.46Å; W369-N373 HydrophobicContact CZ3-CB 4.44Å; W369-N373 PolarHBondContact NE1-ND2 3.23Å; W369-N373 WeakPolarHBondContact O-CB 3.37Å; W369-N373 PolarHBondContact O-N 2.97Å; W369-N373 PolarHBondContact O-ND2 3.47Å; I370-N373 PolarHBondContact O-N 3.18Å; I370-N373 VanDerWaalsContact O-N 3.17Å; N373-K375 PolarHBondContact O-N 2.87Å; N373-K376 WeakPolarHBondContact O-CB 3.14Å; N373-K376 PolarHBondContact O-N 2.81Å; N373-I377 HydrophobicContact CB-CD1 4.33Å; N373-I377 WeakPolarHBondContact O-CG1 3.44Å; N373-I377 PolarHBondContact O-N 3.29Å
374	T	80.5	Confident	82.5	Confident	78 Å²	78	102.3 Å²	102.3	48%	0.479	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-34.6	-46.7	175.6	43.6	0	0	0	0	114.7	I370 K371 K376	I370-T374 VanDerWaalsContact O-CG2 3.3Å; I370-T374 WeakPolarHBondContact O-CG2 3.33Å; I370-T374 PolarHBondContact O-N 2.94Å; K371-T374 PolarHBondContact O-OG1 3.31Å; K371-T374 VanDerWaalsContact O-OG1 3.06Å; T374-K376 PolarHBondContact O-N 3.02Å
375	K	80.1	Confident	81.6	Confident	197 Å²	197	104.5 Å²	104.5	86%	0.857	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-23.2	-179.9	-65.6	-173.5	177.2	-175.4	0	115.4	N373	N373-K375 PolarHBondContact O-N 2.87Å
376	K	82.4	Confident	81.1	Confident	153 Å²	153	104.5 Å²	104.5	67%	0.665	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-32.4	179.5	-65.2	-176.3	-178.3	172.1	0	112.4	N373 T374 W378	N373-K376 WeakPolarHBondContact O-CB 3.14Å; N373-K376 PolarHBondContact O-N 2.81Å; T374-K376 PolarHBondContact O-N 3.02Å; K376-W378 VanDerWaalsContact C-N 3.3Å; K376-W378 PolarHBondContact O-N 3.07Å
377	I	82.5	Confident	80.9	Confident	10 Å²	10	111.1 Å²	111.1	5%	0.051	53%	0.53	C	S	.	.			trans	-94.8	42.7	-172.8	59.8	-163.9	0	0	0	112.2	W369 N373 Y379 I380 F382	W369-I377 HydrophobicContact CH2-CG2 4.28Å; W369-I377 HydrophobicContact CZ3-CD1 4.28Å; N373-I377 HydrophobicContact CB-CD1 4.33Å; N373-I377 WeakPolarHBondContact O-CG1 3.44Å; N373-I377 PolarHBondContact O-N 3.29Å; I377-Y379 PolarHBondContact O-N 3.03Å; I377-I380 HydrophobicContact CB-CD1 4.28Å; I377-I380 PolarHBondContact O-N 3.44Å; I377-I380 VanDerWaalsContact O-N 3.11Å; I377-F382 HydrophobicContact CD1-CE2 3.74Å; I377-F382 HydrophobicContact CD1-CZ 3.5Å; I377-F382 HydrophobicContact CG1-CE2 3.77Å; I377-F382 HydrophobicContact CG1-CZ 4.02Å
378	W	84.5	Confident	80.8	Confident	218 Å²	218	115.3 Å²	115.3	83%	0.826	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.2	-175.1	67.5	-93.4	0	0	0	114.7	K376	K376-W378 VanDerWaalsContact C-N 3.3Å; K376-W378 PolarHBondContact O-N 3.07Å
379	Y	85.5	Confident	80.5	Confident	160 Å²	160	113 Å²	113	63%	0.627	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	6.3	179.7	61.3	-89.9	0	0	0	113.5	I377	I377-Y379 PolarHBondContact O-N 3.03Å
380	I	80.2	Confident	80.3	Confident	74 Å²	74	112.2 Å²	112.2	38%	0.379	53%	0.528	S	S	.	.	S	Bend	trans	-119.3	118.6	178.4	-53.2	-178.5	0	0	0	109	I377 F382	I377-I380 HydrophobicContact CB-CD1 4.28Å; I377-I380 PolarHBondContact O-N 3.44Å; I377-I380 VanDerWaalsContact O-N 3.11Å; I380-F382 HydrophobicContact CB-CE2 3.74Å; I380-F382 HydrophobicContact CB-CZ 3.97Å; I380-F382 HydrophobicContact CG2-CD2 4.38Å; I380-F382 HydrophobicContact CG2-CE1 4.21Å; I380-F382 HydrophobicContact CG2-CE2 3.75Å; I380-F382 HydrophobicContact CG2-CZ 3.63Å; I380-F382 WeakPolarHBondContact O-CD2 3.29Å; I380-F382 VanDerWaalsContact O-CE2 3.26Å; I380-F382 WeakPolarHBondContact O-CE2 3.49Å
381	D	71.2	Confident	80.5	Confident	168 Å²	168	113.3 Å²	113.3	90%	0.898	53%	0.534	S	S	*	.			trans	-75.7	125	171.7	-72	-38.2	0	0	0	110.6
382	F	69.8	Low	80.5	Confident	101 Å²	101	108.1 Å²	108.1	44%	0.443	51%	0.51	S	S	.	.			trans	-104.4	126.1	176.3	-68.1	-86.8	0	0	0	110.8	I370 I377 I380	I370-F382 HydrophobicContact CD1-CE1 4.39Å; I370-F382 HydrophobicContact CG1-CE1 4.36Å; I370-F382 HydrophobicContact CG2-CD1 4.02Å; I370-F382 HydrophobicContact CG2-CE1 3.72Å; I370-F382 HydrophobicContact CG2-CZ 4.23Å; I377-F382 HydrophobicContact CD1-CE2 3.74Å; I377-F382 HydrophobicContact CD1-CZ 3.5Å; I377-F382 HydrophobicContact CG1-CE2 3.77Å; I377-F382 HydrophobicContact CG1-CZ 4.02Å; I380-F382 HydrophobicContact CB-CE2 3.74Å; I380-F382 HydrophobicContact CB-CZ 3.97Å; I380-F382 HydrophobicContact CG2-CD2 4.38Å; I380-F382 HydrophobicContact CG2-CE1 4.21Å; I380-F382 HydrophobicContact CG2-CE2 3.75Å; I380-F382 HydrophobicContact CG2-CZ 3.63Å; I380-F382 WeakPolarHBondContact O-CD2 3.29Å; I380-F382 VanDerWaalsContact O-CE2 3.26Å; I380-F382 WeakPolarHBondContact O-CE2 3.49Å
383	E	67.3	Low	80.5	Confident	119 Å²	119	103.4 Å²	103.4	56%	0.556	49%	0.485	S	S	*	.			trans	-59	144.3	160.9	-68.1	-174	-168.7	0	0	110.2	L385 R392	E383-L385 PolarHBondContact O-N 3.15Å; E383-R392 IonicContact OE2-CZ 3.41Å; E383-R392 IonicContact OE2-NH2 3.48Å; E383-R392 PolarHBondContact OE2-NH2 3.36Å
384	L	67.3	Low	80.6	Confident	160 Å²	160	103.7 Å²	103.7	84%	0.838	49%	0.486	S	S	*	.			trans	-51.1	132.5	175.1	-104.5	142.6	0	0	0	110.7	T386	L384-T386 PolarHBondContact O-N 3.29Å
385	L	72.9	Confident	81	Confident	131 Å²	131	100.9 Å²	100.9	69%	0.686	47%	0.468	S	S	*	.			trans	-70.4	73.2	-173.9	-164.1	96.5	0	0	0	112	T367 E383	T367-L385 HydrophobicContact CG2-CD1 4.43Å; E383-L385 PolarHBondContact O-N 3.15Å
386	T	81.6	Confident	81.2	Confident	71 Å²	71	94.6 Å²	94.6	44%	0.436	44%	0.439	S	S	.	.			trans	-81.3	157.7	176.3	60.9	0	0	0	0	111.3	L384 W388 Q389 F390	L384-T386 PolarHBondContact O-N 3.29Å; T386-W388 PolarHBondContact O-N 3.42Å; T386-Q389 PolarHBondContact O-N 3.09Å; T386-Q389 WeakPolarHBondContact OG1-CB 3.13Å; T386-Q389 PolarHBondContact OG1-N 3.06Å; T386-Q389 VanDerWaalsContact OG1-N 3.14Å; T386-F390 PolarHBondContact O-N 3.04Å; T386-F390 VanDerWaalsContact O-N 3.08Å
387	I	85.1	Confident	81.5	Confident	142 Å²	142	87.3 Å²	87.3	73%	0.728	41%	0.407	S	S	*	.	H	α-helix	trans	-57.6	-36.8	173.7	-59.6	171.6	0	0	0	110.6	F390 I391	I387-F390 PolarHBondContact O-N 3.04Å; I387-I391 HydrophobicContact CG2-CD1 4.25Å; I387-I391 WeakPolarHBondContact O-CG1 3.18Å; I387-I391 PolarHBondContact O-N 2.88Å; I387-I391 VanDerWaalsContact O-N 3.12Å
388	W	85.7	Confident	81.7	Confident	124 Å²	124	87.9 Å²	87.9	47%	0.47	41%	0.41	S	S	.	.	H	α-helix	trans	-65.4	-40	175.4	-172.7	-115.8	0	0	0	112.4	F82 T386 F390 I391 R392	F82-W388 AromaticContact CD1-CH2 3.99Å; F82-W388 HydrophobicContact CD1-CH2 3.99Å; F82-W388 HydrophobicContact CD1-CZ2 4.36Å; T386-W388 PolarHBondContact O-N 3.42Å; W388-F390 VanDerWaalsContact C-N 3.33Å; W388-F390 PolarHBondContact O-N 3.02Å; W388-I391 HydrophobicContact CE3-CB 4.34Å; W388-I391 HydrophobicContact CE3-CD1 4.18Å; W388-I391 HydrophobicContact CE3-CG2 4.32Å; W388-I391 HydrophobicContact CZ3-CG2 4.08Å; W388-I391 PolarHBondContact O-N 2.98Å; W388-I391 VanDerWaalsContact O-N 3.16Å; W388-R392 PolarHBondContact O-N 3.02Å
389	Q	81.6	Confident	81.7	Confident	37 Å²	37	78 Å²	78	17%	0.173	37%	0.373	C	S	.	.	H	α-helix	trans	-63.2	-40.1	175.5	-174.2	64.1	-13.4	0	0	112.2	T386 I391 R392 T393	T386-Q389 PolarHBondContact O-N 3.09Å; T386-Q389 WeakPolarHBondContact OG1-CB 3.13Å; T386-Q389 PolarHBondContact OG1-N 3.06Å; T386-Q389 VanDerWaalsContact OG1-N 3.14Å; Q389-I391 VanDerWaalsContact C-N 3.31Å; Q389-I391 PolarHBondContact O-N 3.14Å; Q389-R392 PolarHBondContact O-N 3.06Å; Q389-T393 PolarHBondContact O-N 3.36Å; Q389-T393 PolarHBondContact O-OG1 2.68Å
390	F	86.4	Confident	81.6	Confident	69 Å²	69	70.6 Å²	70.6	30%	0.303	35%	0.345	S	S	.	.	H	α-helix	trans	-59.6	-40.7	173	-175.3	-107.4	0	0	0	112.3	T367 T386 I387 W388 T393 I394	T367-F390 HydrophobicContact CG2-CD2 3.8Å; T367-F390 HydrophobicContact CG2-CE2 3.96Å; T386-F390 PolarHBondContact O-N 3.04Å; T386-F390 VanDerWaalsContact O-N 3.08Å; I387-F390 PolarHBondContact O-N 3.04Å; W388-F390 VanDerWaalsContact C-N 3.33Å; W388-F390 PolarHBondContact O-N 3.02Å; F390-T393 PolarHBondContact O-N 2.77Å; F390-I394 HydrophobicContact CD1-CD1 3.78Å; F390-I394 HydrophobicContact CE1-CD1 3.55Å; F390-I394 HydrophobicContact CE1-CG1 4.39Å; F390-I394 HydrophobicContact CZ-CD1 4.18Å; F390-I394 WeakPolarHBondContact O-CG1 3.47Å; F390-I394 PolarHBondContact O-N 3.13Å
391	I	87.8	Confident	82	Confident	64 Å²	64	67.1 Å²	67.1	33%	0.328	33%	0.327	S	S	.	.	H	α-helix	trans	-65.9	-42.9	174.8	-66.5	166.1	0	0	0	111.4	I387 W388 Q389 T393 I394 I395	I387-I391 HydrophobicContact CG2-CD1 4.25Å; I387-I391 WeakPolarHBondContact O-CG1 3.18Å; I387-I391 PolarHBondContact O-N 2.88Å; I387-I391 VanDerWaalsContact O-N 3.12Å; W388-I391 HydrophobicContact CE3-CB 4.34Å; W388-I391 HydrophobicContact CE3-CD1 4.18Å; W388-I391 HydrophobicContact CE3-CG2 4.32Å; W388-I391 HydrophobicContact CZ3-CG2 4.08Å; W388-I391 PolarHBondContact O-N 2.98Å; W388-I391 VanDerWaalsContact O-N 3.16Å; Q389-I391 VanDerWaalsContact C-N 3.31Å; Q389-I391 PolarHBondContact O-N 3.14Å; I391-T393 PolarHBondContact O-N 3.48Å; I391-I394 WeakPolarHBondContact O-CB 3.43Å; I391-I394 PolarHBondContact O-N 2.82Å; I391-I395 HydrophobicContact CG2-CD1 4.04Å; I391-I395 WeakPolarHBondContact O-CG1 3.38Å; I391-I395 PolarHBondContact O-N 2.84Å; I391-I395 VanDerWaalsContact O-N 3.08Å
392	R	86	Confident	82.7	Confident	49 Å²	49	59.3 Å²	59.3	19%	0.185	29%	0.285	C	S	.	.	H	α-helix	trans	-58.7	-45.5	174.9	-72.1	-165	-67.8	-169.1	-3.2	111.3	E383 W388 Q389 I394 I395 R396	E383-R392 IonicContact OE2-CZ 3.41Å; E383-R392 IonicContact OE2-NH2 3.48Å; E383-R392 PolarHBondContact OE2-NH2 3.36Å; W388-R392 PolarHBondContact O-N 3.02Å; Q389-R392 PolarHBondContact O-N 3.06Å; R392-I394 PolarHBondContact O-N 2.81Å; R392-I395 PolarHBondContact O-N 3.25Å; R392-R396 WeakPolarHBondContact O-CG 3.3Å; R392-R396 PolarHBondContact O-N 3.45Å
393	T	85.8	Confident	83.4	Confident	18 Å²	18	55.5 Å²	55.5	11%	0.11	27%	0.268	C	S	.	.	H	α-helix	trans	-62.7	-37.8	175.5	-71.6	0	0	0	0	112.9	T363 Q389 F390 I391 I395 R396 F397 E1133	T363-T393 HydrophobicContact CG2-CG2 4.14Å; Q389-T393 PolarHBondContact O-N 3.36Å; Q389-T393 PolarHBondContact O-OG1 2.68Å; F390-T393 PolarHBondContact O-N 2.77Å; I391-T393 PolarHBondContact O-N 3.48Å; T393-I395 PolarHBondContact O-N 3.03Å; T393-R396 PolarHBondContact O-N 3.44Å; T393-F397 HydrophobicContact CG2-CD2 3.67Å; T393-F397 HydrophobicContact CG2-CE2 3.51Å; T393-F397 VanDerWaalsContact O-CD2 3.3Å; T393-F397 WeakPolarHBondContact O-CD2 3.47Å; T393-F397 PolarHBondContact O-N 3.11Å; T393-E1133 WeakPolarHBondContact CA-OE1 3.32Å; T393-E1133 WeakPolarHBondContact CB-OE1 3.47Å; T393-E1133 WeakPolarHBondContact CG2-OE1 3.43Å; T393-E1133 PolarHBondContact OG1-OE1 2.8Å
394	I	89.1	Confident	84.5	Confident	34 Å²	34	50.3 Å²	50.3	17%	0.174	24%	0.244	C	C	.	.	H	α-helix	trans	-57.8	-47.7	171.4	-70.1	162.3	0	0	0	111.2	L360 T363 F390 I391 R392 L398	L360-I394 HydrophobicContact CD2-CD1 3.89Å; L360-I394 HydrophobicContact CD2-CG1 4.3Å; T363-I394 HydrophobicContact CG2-CB 4.13Å; T363-I394 HydrophobicContact CG2-CG1 3.53Å; F390-I394 HydrophobicContact CD1-CD1 3.78Å; F390-I394 HydrophobicContact CE1-CD1 3.55Å; F390-I394 HydrophobicContact CE1-CG1 4.39Å; F390-I394 HydrophobicContact CZ-CD1 4.18Å; F390-I394 WeakPolarHBondContact O-CG1 3.47Å; F390-I394 PolarHBondContact O-N 3.13Å; I391-I394 WeakPolarHBondContact O-CB 3.43Å; I391-I394 PolarHBondContact O-N 2.82Å; R392-I394 PolarHBondContact O-N 2.81Å; I394-L398 VanDerWaalsContact O-CB 3.32Å; I394-L398 WeakPolarHBondContact O-CB 3.25Å; I394-L398 PolarHBondContact O-N 3.02Å
395	I	87.4	Confident	85.4	Confident	20 Å²	20	42.8 Å²	42.8	10%	0.103	21%	0.205	C	C	.	.	H	α-helix	trans	-69.4	-34.8	-178	-59.5	166.2	0	0	0	111	F82 V83 I391 R392 T393 L398 F399	F82-I395 HydrophobicContact CB-CD1 4.16Å; V83-I395 HydrophobicContact CB-CG2 4.38Å; V83-I395 HydrophobicContact CG2-CB 3.62Å; V83-I395 HydrophobicContact CG2-CD1 4.3Å; V83-I395 HydrophobicContact CG2-CG2 3.43Å; V83-I395 VanDerWaalsContact CG2-CG2 3.43Å; I391-I395 HydrophobicContact CG2-CD1 4.04Å; I391-I395 WeakPolarHBondContact O-CG1 3.38Å; I391-I395 PolarHBondContact O-N 2.84Å; I391-I395 VanDerWaalsContact O-N 3.08Å; R392-I395 PolarHBondContact O-N 3.25Å; T393-I395 PolarHBondContact O-N 3.03Å; I395-L398 WeakPolarHBondContact O-CB 3.44Å; I395-L398 PolarHBondContact O-N 3.46Å; I395-F399 HydrophobicContact CG2-CD2 4.41Å; I395-F399 HydrophobicContact CG2-CE1 4.45Å; I395-F399 HydrophobicContact CG2-CE2 3.63Å; I395-F399 HydrophobicContact CG2-CZ 3.64Å; I395-F399 VanDerWaalsContact O-CD2 3.3Å; I395-F399 WeakPolarHBondContact O-CD2 3.24Å; I395-F399 PolarHBondContact O-N 3.42Å; I395-F399 VanDerWaalsContact O-N 3.16Å
396	R	85.4	Confident	85.7	Confident	64 Å²	64	36.7 Å²	36.7	24%	0.242	17%	0.173	C	C	.	.	H	α-helix	trans	-62.7	-49.8	174.2	-73.6	-172.8	167.7	176.8	-3.1	112.7	V83 D84 V86 R392 T393 L398 F399 E1133	V83-R396 HydrophobicContact CG1-CG 3.52Å; D84-R396 PolarHBondContact O-NH2 3.23Å; V86-R396 HydrophobicContact CG2-CB 4.23Å; V86-R396 HydrophobicContact CG2-CG 3.7Å; R392-R396 WeakPolarHBondContact O-CG 3.3Å; R392-R396 PolarHBondContact O-N 3.45Å; T393-R396 PolarHBondContact O-N 3.44Å; R396-L398 VanDerWaalsContact C-N 3.27Å; R396-L398 PolarHBondContact O-N 3.36Å; R396-F399 PolarHBondContact O-N 3.43Å; R396-E1133 VanDerWaalsContact CD-CD 3.42Å; R396-E1133 WeakPolarHBondContact CD-OE2 3.25Å; R396-E1133 IonicContact CZ-OE2 2.66Å; R396-E1133 IonicContact NE-OE2 3.58Å; R396-E1133 IonicContact NH1-OE2 3.93Å; R396-E1133 PolarHBondContact NH1-OE2 3.2Å
397	F	88.3	Confident	85.5	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.6	-33.3	174.3	-76.5	-60.7	0	0	0	112.4	I362 T363 T393 F399 I400 I401 I1126 E1133	I362-F397 HydrophobicContact CG2-CD1 3.74Å; I362-F397 HydrophobicContact CG2-CD2 4.1Å; I362-F397 HydrophobicContact CG2-CE1 3.69Å; I362-F397 HydrophobicContact CG2-CE2 4.02Å; I362-F397 HydrophobicContact CG2-CG 3.96Å; I362-F397 HydrophobicContact CG2-CZ 3.83Å; T363-F397 HydrophobicContact CG2-CD2 3.64Å; T363-F397 HydrophobicContact CG2-CE2 4.37Å; T363-F397 HydrophobicContact CG2-CG 4.49Å; T393-F397 HydrophobicContact CG2-CD2 3.67Å; T393-F397 HydrophobicContact CG2-CE2 3.51Å; T393-F397 VanDerWaalsContact O-CD2 3.3Å; T393-F397 WeakPolarHBondContact O-CD2 3.47Å; T393-F397 PolarHBondContact O-N 3.11Å; F397-F399 VanDerWaalsContact C-N 3.32Å; F397-F399 PolarHBondContact O-N 2.86Å; F397-I400 HydrophobicContact CD1-CD1 4.47Å; F397-I400 PolarHBondContact O-N 3.31Å; F397-I401 WeakPolarHBondContact O-CG1 3.36Å; F397-I401 PolarHBondContact O-N 2.87Å; F397-I401 VanDerWaalsContact O-N 3.11Å; F397-I1126 HydrophobicContact CD1-CD1 4.05Å; F397-I1126 HydrophobicContact CE1-CD1 4.1Å; F397-I1126 HydrophobicContact CE1-CG1 4.35Å; F397-I1126 HydrophobicContact CE1-CG2 3.74Å; F397-I1126 HydrophobicContact CZ-CG2 4.41Å; F397-E1133 HydrophobicContact CE1-CG 4.46Å; F397-E1133 HydrophobicContact CE2-CG 4.37Å; F397-E1133 HydrophobicContact CZ-CG 4.11Å
398	L	87.9	Confident	85.3	Confident	22 Å²	22	28.8 Å²	28.8	12%	0.115	13%	0.13	C	C	.	.	H	α-helix	trans	-59	-39.2	174.6	-177.9	67.6	0	0	0	112.5	M355 T359 I394 I395 R396 I401 N402	M355-L398 HydrophobicContact CE-CD1 3.38Å; M355-L398 HydrophobicContact CG-CD1 4.1Å; M355-L398 HydrophobicContact SD-CD1 3.49Å; M355-L398 WeakPolarHBondContact SD-CD1 3.35Å; T359-L398 HydrophobicContact CG2-CB 4.16Å; T359-L398 HydrophobicContact CG2-CD1 4.09Å; I394-L398 VanDerWaalsContact O-CB 3.32Å; I394-L398 WeakPolarHBondContact O-CB 3.25Å; I394-L398 PolarHBondContact O-N 3.02Å; I395-L398 WeakPolarHBondContact O-CB 3.44Å; I395-L398 PolarHBondContact O-N 3.46Å; R396-L398 VanDerWaalsContact C-N 3.27Å; R396-L398 PolarHBondContact O-N 3.36Å; L398-I401 PolarHBondContact O-N 2.99Å; L398-N402 WeakPolarHBondContact O-CB 3.32Å; L398-N402 PolarHBondContact O-N 3.28Å
399	F	83	Confident	85.3	Confident	10 Å²	10	23 Å²	23	4%	0.044	11%	0.109	C	C	.	.	H	α-helix	trans	-66.2	-37.3	177	-65.7	-47.3	0	0	0	113.7	I76 T79 Y80 V83 I395 R396 F397 I401 N402	I76-F399 HydrophobicContact CG2-CD1 4.38Å; I76-F399 HydrophobicContact CG2-CE1 4.2Å; T79-F399 WeakPolarHBondContact OG1-CE1 3.4Å; Y80-F399 HydrophobicContact CD1-CD1 4.44Å; Y80-F399 AromaticContact CD1-CE1 3.83Å; Y80-F399 HydrophobicContact CD1-CE1 3.83Å; Y80-F399 HydrophobicContact CD1-CE2 4.1Å; Y80-F399 AromaticContact CD1-CZ 3.65Å; Y80-F399 HydrophobicContact CD1-CZ 3.65Å; Y80-F399 HydrophobicContact CD2-CD1 4.35Å; Y80-F399 AromaticContact CD2-CE1 3.57Å; Y80-F399 HydrophobicContact CD2-CE1 3.57Å; Y80-F399 HydrophobicContact CD2-CZ 4.06Å; Y80-F399 AromaticContact CE1-CD1 3.84Å; Y80-F399 HydrophobicContact CE1-CD1 3.84Å; Y80-F399 HydrophobicContact CE1-CD2 4.27Å; Y80-F399 AromaticContact CE1-CE1 3.68Å; Y80-F399 HydrophobicContact CE1-CE1 3.68Å; Y80-F399 HydrophobicContact CE1-CE2 4.11Å; Y80-F399 HydrophobicContact CE1-CG 4.15Å; Y80-F399 AromaticContact CE1-CZ 3.84Å; Y80-F399 HydrophobicContact CE1-CZ 3.84Å; Y80-F399 AromaticContact CE2-CD1 3.72Å; Y80-F399 HydrophobicContact CE2-CD1 3.72Å; Y80-F399 AromaticContact CE2-CE1 3.4Å; Y80-F399 HydrophobicContact CE2-CE1 3.4Å; Y80-F399 VanDerWaalsContact CE2-CE1 3.4Å; Y80-F399 HydrophobicContact CE2-CZ 4.22Å; Y80-F399 AromaticContact CG-CE1 3.77Å; Y80-F399 HydrophobicContact CG-CE1 3.77Å; Y80-F399 AromaticContact CG-CZ 3.76Å; Y80-F399 HydrophobicContact CG-CZ 3.76Å; Y80-F399 AromaticContact CZ-CD1 3.42Å; Y80-F399 VanDerWaalsContact CZ-CD1 3.42Å; Y80-F399 AromaticContact CZ-CE1 3.45Å; Y80-F399 VanDerWaalsContact CZ-CE1 3.45Å; Y80-F399 WeakPolarHBondContact OH-CD1 3.49Å; V83-F399 HydrophobicContact CB-CE2 3.98Å; V83-F399 HydrophobicContact CG1-CE2 4.06Å; V83-F399 HydrophobicContact CG2-CE2 4.34Å; I395-F399 HydrophobicContact CG2-CD2 4.41Å; I395-F399 HydrophobicContact CG2-CE1 4.45Å; I395-F399 HydrophobicContact CG2-CE2 3.63Å; I395-F399 HydrophobicContact CG2-CZ 3.64Å; I395-F399 VanDerWaalsContact O-CD2 3.3Å; I395-F399 WeakPolarHBondContact O-CD2 3.24Å; I395-F399 PolarHBondContact O-N 3.42Å; I395-F399 VanDerWaalsContact O-N 3.16Å; R396-F399 PolarHBondContact O-N 3.43Å; F397-F399 VanDerWaalsContact C-N 3.32Å; F397-F399 PolarHBondContact O-N 2.86Å; F399-I401 VanDerWaalsContact C-N 3.33Å; F399-N402 WeakPolarHBondContact O-CB 3.46Å
400	I	84.2	Confident	85.3	Confident	6 Å²	6	22 Å²	22	3%	0.031	10%	0.104	C	C	.	.	H	α-helix	trans	-67.3	-39.4	177.2	-55.6	172.9	0	0	0	110	F397 Q1122 I1126	F397-I400 HydrophobicContact CD1-CD1 4.47Å; F397-I400 PolarHBondContact O-N 3.31Å; I400-Q1122 HydrophobicContact CG2-CB 3.93Å; I400-Q1122 HydrophobicContact CG2-CG 4.26Å; I400-I1126 HydrophobicContact CD1-CD1 4.21Å; I400-I1126 HydrophobicContact CG2-CD1 4.14Å
401	I	88.3	Confident	85	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-89.3	-14	-173.5	-61.4	159.7	0	0	0	112.7	M355 I358 T359 I362 F397 L398 F399 Y403 L404 V1119 L1123	M355-I401 HydrophobicContact CG-CG2 3.84Å; I358-I401 HydrophobicContact CG2-CD1 4.14Å; T359-I401 HydrophobicContact CG2-CB 4.12Å; T359-I401 HydrophobicContact CG2-CD1 3.69Å; T359-I401 HydrophobicContact CG2-CG1 4.49Å; T359-I401 HydrophobicContact CG2-CG2 4.43Å; I362-I401 HydrophobicContact CD1-CD1 3.57Å; F397-I401 WeakPolarHBondContact O-CG1 3.36Å; F397-I401 PolarHBondContact O-N 2.87Å; F397-I401 VanDerWaalsContact O-N 3.11Å; L398-I401 PolarHBondContact O-N 2.99Å; F399-I401 VanDerWaalsContact C-N 3.33Å; I401-Y403 PolarHBondContact O-N 3.02Å; I401-L404 VanDerWaalsContact O-CB 3.26Å; I401-L404 WeakPolarHBondContact O-CB 3.47Å; I401-L404 PolarHBondContact O-N 3.04Å; I401-V1119 HydrophobicContact CG1-CG1 4.4Å; I401-V1119 HydrophobicContact CG2-CG1 3.94Å; I401-L1123 HydrophobicContact CD1-CD2 3.96Å; I401-L1123 HydrophobicContact CG1-CD2 4.1Å
402	N	86	Confident	85	Confident	4 Å²	4	17.3 Å²	17.3	2%	0.021	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-47	-37.2	175.2	173	23.4	0	0	0	113.4	Y72 I76 L398 F399 L404 I405	Y72-N402 PolarHBondContact OH-O 2.81Å; Y72-N402 PolarHBondContact OH-OD1 3.4Å; I76-N402 HydrophobicContact CD1-CB 3.97Å; I76-N402 VanDerWaalsContact CD1-CG 3.43Å; I76-N402 WeakPolarHBondContact CD1-OD1 3.26Å; L398-N402 WeakPolarHBondContact O-CB 3.32Å; L398-N402 PolarHBondContact O-N 3.28Å; F399-N402 WeakPolarHBondContact O-CB 3.46Å; N402-L404 PolarHBondContact O-N 2.88Å; N402-I405 PolarHBondContact O-N 2.98Å
403	Y	85.5	Confident	85.1	Confident	21 Å²	21	15.3 Å²	15.3	8%	0.082	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	-63.9	-3.6	179.9	-65.1	-87.6	0	0	0	114.6	I401 I405 F1118 F1142	I401-Y403 PolarHBondContact O-N 3.02Å; Y403-I405 PolarHBondContact O-N 3.32Å; Y403-F1118 HydrophobicContact CG-CE1 4.22Å; Y403-F1142 HydrophobicContact CD1-CB 4.32Å; Y403-F1142 HydrophobicContact CD1-CD1 4.45Å; Y403-F1142 AromaticContact CD2-CD1 3.57Å; Y403-F1142 HydrophobicContact CD2-CD1 3.57Å; Y403-F1142 HydrophobicContact CD2-CE1 4.21Å; Y403-F1142 HydrophobicContact CE1-CB 3.71Å; Y403-F1142 HydrophobicContact CE1-CD1 4.35Å; Y403-F1142 HydrophobicContact CE2-CB 4.1Å; Y403-F1142 AromaticContact CE2-CD1 3.45Å; Y403-F1142 HydrophobicContact CE2-CD1 3.45Å; Y403-F1142 VanDerWaalsContact CE2-CD1 3.45Å; Y403-F1142 HydrophobicContact CE2-CE1 4.26Å; Y403-F1142 HydrophobicContact CE2-CG 4.16Å; Y403-F1142 HydrophobicContact CG-CD1 4.08Å; Y403-F1142 AromaticContact CZ-CD1 3.86Å
404	L	89.5	Confident	84.9	Confident	10 Å²	10	16.2 Å²	16.2	5%	0.052	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-59.5	-26.8	165.1	-166	65.5	0	0	0	112.1	F351 M355 I401 N402 P406 A1115 V1116 V1119	F351-L404 HydrophobicContact CD1-CD1 4.26Å; F351-L404 HydrophobicContact CD1-CD2 4.01Å; F351-L404 HydrophobicContact CD1-CG 3.9Å; F351-L404 HydrophobicContact CE1-CD1 4.48Å; M355-L404 HydrophobicContact CB-CD2 3.96Å; I401-L404 VanDerWaalsContact O-CB 3.26Å; I401-L404 WeakPolarHBondContact O-CB 3.47Å; I401-L404 PolarHBondContact O-N 3.04Å; N402-L404 PolarHBondContact O-N 2.88Å; L404-P406 WeakPolarHBondContact O-CD 3.36Å; L404-A1115 WeakPolarHBondContact O-CB 3.25Å; L404-V1116 HydrophobicContact CD1-CG2 3.83Å; L404-V1119 HydrophobicContact CB-CG2 3.98Å; L404-V1119 HydrophobicContact CD1-CB 4.31Å; L404-V1119 HydrophobicContact CD1-CG2 4.3Å; L404-V1119 VanDerWaalsContact N-CG2 3.35Å
405	I	86.4	Confident	84.8	Confident	3 Å²	3	18.9 Å²	18.9	2%	0.015	9%	0.09	C	C	.	.	S	Bend	trans	-107.9	98.3	177.6	-54.1	-166.6	0	0	0	109.1	Y72 F73 L348 F351 M352 N402 Y403 I407	Y72-I405 HydrophobicContact CD1-CD1 4.17Å; Y72-I405 HydrophobicContact CD1-CG2 4.28Å; Y72-I405 HydrophobicContact CD2-CD1 4.29Å; Y72-I405 HydrophobicContact CE1-CB 3.81Å; Y72-I405 HydrophobicContact CE1-CD1 3.83Å; Y72-I405 HydrophobicContact CE1-CG1 4.2Å; Y72-I405 HydrophobicContact CE1-CG2 4.06Å; Y72-I405 HydrophobicContact CE2-CD1 3.93Å; Y72-I405 HydrophobicContact CG-CD1 4.38Å; F73-I405 HydrophobicContact CE1-CG2 4.36Å; F73-I405 HydrophobicContact CZ-CG2 3.85Å; L348-I405 HydrophobicContact CD2-CG2 4.03Å; F351-I405 HydrophobicContact CB-CD1 4.45Å; F351-I405 HydrophobicContact CB-CG1 4.35Å; M352-I405 HydrophobicContact CB-CD1 4.23Å; M352-I405 HydrophobicContact CE-CD1 3.9Å; M352-I405 HydrophobicContact CG-CD1 3.23Å; M352-I405 HydrophobicContact SD-CD1 4.48Å; N402-I405 PolarHBondContact O-N 2.98Å; Y403-I405 PolarHBondContact O-N 3.32Å; I405-I407 PolarHBondContact O-N 2.56Å
406	P	79.1	Confident	85	Confident	2 Å²	2	18 Å²	18	1%	0.013	9%	0.086	C	C	.	.			trans	-72.3	112.5	-174.5	26.6	-33.2	0	0	0	111.6	L404 S408 I409 F1111 A1115	L404-P406 WeakPolarHBondContact O-CD 3.36Å; P406-S408 PolarHBondContact O-N 3.27Å; P406-S408 VanDerWaalsContact O-N 3.12Å; P406-I409 HydrophobicContact CG-CB 4.18Å; P406-I409 HydrophobicContact CG-CG2 4.46Å; P406-I409 WeakPolarHBondContact O-CG2 3.35Å; P406-I409 PolarHBondContact O-N 3.09Å; P406-I409 VanDerWaalsContact O-N 3.13Å; P406-F1111 HydrophobicContact CB-CD1 3.91Å; P406-F1111 HydrophobicContact CG-CB 4.1Å; P406-F1111 HydrophobicContact CG-CD1 3.99Å; P406-A1115 HydrophobicContact CG-CB 4.24Å
407	I	76.6	Confident	85.2	Confident	32 Å²	32	15 Å²	15	16%	0.164	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-40.2	179.1	-59.3	160	0	0	0	112	F73 P95 L99 I405 I409	F73-I407 HydrophobicContact CD1-CG1 3.94Å; F73-I407 HydrophobicContact CE1-CB 4.38Å; F73-I407 HydrophobicContact CE1-CD1 4.33Å; F73-I407 HydrophobicContact CE1-CG1 3.34Å; F73-I407 HydrophobicContact CE2-CB 4.32Å; F73-I407 HydrophobicContact CE2-CG1 4.06Å; F73-I407 HydrophobicContact CE2-CG2 4.4Å; F73-I407 HydrophobicContact CZ-CB 3.98Å; F73-I407 HydrophobicContact CZ-CG1 3.43Å; F73-I407 VanDerWaalsContact CZ-CG1 3.43Å; P95-I407 HydrophobicContact CB-CD1 4.49Å; P95-I407 HydrophobicContact CB-CG2 4.36Å; L99-I407 HydrophobicContact CD1-CG2 3.94Å; L99-I407 WeakPolarHBondContact CD1-O 3.14Å; I405-I407 PolarHBondContact O-N 2.56Å; I407-I409 VanDerWaalsContact C-N 3.3Å; I407-I409 PolarHBondContact O-N 3.27Å
408	S	81.5	Confident	85.1	Confident	15 Å²	15	18.2 Å²	18.2	11%	0.105	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-8.1	-174.5	45.7	0	0	0	0	115.5	P406 I410 T412 N1146	P406-S408 PolarHBondContact O-N 3.27Å; P406-S408 VanDerWaalsContact O-N 3.12Å; S408-I410 PolarHBondContact O-N 3.12Å; S408-T412 WeakPolarHBondContact O-CB 3.39Å; S408-T412 PolarHBondContact O-N 2.96Å; S408-T412 PolarHBondContact O-OG1 3.06Å; S408-N1146 PolarHBondContact OG-O 2.95Å; S408-N1146 VanDerWaalsContact OG-O 3.11Å
409	I	85.2	Confident	85.2	Confident	4 Å²	4	18.6 Å²	18.6	2%	0.021	9%	0.093	C	C	.	.	H	α-helix	trans	-61.8	-39.6	-175.6	-165.3	175.7	0	0	0	112.9	P406 I407 I413 M1108 F1111 Y1112	P406-I409 HydrophobicContact CG-CB 4.18Å; P406-I409 HydrophobicContact CG-CG2 4.46Å; P406-I409 WeakPolarHBondContact O-CG2 3.35Å; P406-I409 PolarHBondContact O-N 3.09Å; P406-I409 VanDerWaalsContact O-N 3.13Å; I407-I409 VanDerWaalsContact C-N 3.3Å; I407-I409 PolarHBondContact O-N 3.27Å; I409-I413 HydrophobicContact CG1-CD1 3.88Å; I409-I413 WeakPolarHBondContact O-CD1 3.35Å; I409-I413 VanDerWaalsContact O-CG1 3.25Å; I409-I413 WeakPolarHBondContact O-CG1 3.32Å; I409-I413 PolarHBondContact O-N 3.43Å; I409-I413 VanDerWaalsContact O-N 3.14Å; I409-M1108 HydrophobicContact CD1-CG 4.45Å; I409-F1111 HydrophobicContact CB-CB 4.37Å; I409-F1111 HydrophobicContact CB-CD1 4.02Å; I409-F1111 HydrophobicContact CB-CG 4.1Å; I409-F1111 HydrophobicContact CD1-CB 3.71Å; I409-F1111 HydrophobicContact CD1-CG 4.25Å; I409-F1111 HydrophobicContact CG1-CB 3.89Å; I409-F1111 HydrophobicContact CG1-CD1 4.3Å; I409-F1111 HydrophobicContact CG1-CD2 4.11Å; I409-F1111 HydrophobicContact CG1-CG 3.85Å; I409-Y1112 HydrophobicContact CD1-CD1 4.43Å; I409-Y1112 HydrophobicContact CD1-CE1 3.82Å
410	I	82.1	Confident	85.7	Confident	16 Å²	16	18.3 Å²	18.3	8%	0.082	9%	0.092	C	C	.	.	H	α-helix	trans	-68.7	-52.1	-177.3	-67.4	161	0	0	0	110.5	N67 A69 S408 T412 I413 E414	N67-I410 WeakPolarHBondContact ND2-CD1 3.42Å; A69-I410 HydrophobicContact CB-CD1 3.61Å; S408-I410 PolarHBondContact O-N 3.12Å; I410-T412 VanDerWaalsContact C-N 3.29Å; I410-T412 PolarHBondContact O-N 3.31Å; I410-I413 PolarHBondContact O-N 2.84Å; I410-E414 PolarHBondContact O-N 3.03Å
411	V	80.4	Confident	85.9	Confident	32 Å²	32	18.4 Å²	18.4	19%	0.194	9%	0.094	C	C	.	.	H	α-helix	trans	-57.9	-43.1	178.2	-179.6	0	0	0	0	111.1	L99 I413 E414 F415	L99-V411 HydrophobicContact CB-CG2 3.95Å; L99-V411 HydrophobicContact CD1-CG2 3.59Å; L99-V411 HydrophobicContact CG-CG2 3.42Å; L99-V411 VanDerWaalsContact CG-CG2 3.42Å; V411-I413 VanDerWaalsContact C-N 3.33Å; V411-I413 PolarHBondContact O-N 3.07Å; V411-E414 PolarHBondContact O-N 3.22Å; V411-F415 WeakPolarHBondContact O-CB 3.27Å; V411-F415 PolarHBondContact O-N 3.44Å
412	T	86.4	Confident	86	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-61.8	-43.1	-179.9	-51.3	0	0	0	0	111.2	S408 I410 Q416 T1107 F1111 F1151 L1155	S408-T412 WeakPolarHBondContact O-CB 3.39Å; S408-T412 PolarHBondContact O-N 2.96Å; S408-T412 PolarHBondContact O-OG1 3.06Å; I410-T412 VanDerWaalsContact C-N 3.29Å; I410-T412 PolarHBondContact O-N 3.31Å; T412-Q416 WeakPolarHBondContact O-CB 3.14Å; T412-Q416 WeakPolarHBondContact O-CG 3.26Å; T412-Q416 PolarHBondContact O-N 3.29Å; T412-T1107 HydrophobicContact CG2-CG2 4.3Å; T412-F1111 HydrophobicContact CG2-CE2 3.8Å; T412-F1111 HydrophobicContact CG2-CZ 3.98Å; T412-F1111 VanDerWaalsContact OG1-CZ 3.29Å; T412-F1111 WeakPolarHBondContact OG1-CZ 3.35Å; T412-F1151 HydrophobicContact CG2-CE2 4.45Å; T412-F1151 WeakPolarHBondContact OG1-CE2 3.26Å; T412-L1155 HydrophobicContact CG2-CB 4.24Å; T412-L1155 HydrophobicContact CG2-CD1 4.03Å
413	I	88.1	Confident	86.3	Confident	7 Å²	7	26.6 Å²	26.6	4%	0.036	13%	0.13	C	C	.	.	H	α-helix	trans	-70.3	-43.8	179.6	-66.1	164.5	0	0	0	111.4	I409 I410 V411 F415 Q416 Q417 I1104 M1108	I409-I413 HydrophobicContact CG1-CD1 3.88Å; I409-I413 WeakPolarHBondContact O-CD1 3.35Å; I409-I413 VanDerWaalsContact O-CG1 3.25Å; I409-I413 WeakPolarHBondContact O-CG1 3.32Å; I409-I413 PolarHBondContact O-N 3.43Å; I409-I413 VanDerWaalsContact O-N 3.14Å; I410-I413 PolarHBondContact O-N 2.84Å; V411-I413 VanDerWaalsContact C-N 3.33Å; V411-I413 PolarHBondContact O-N 3.07Å; I413-F415 VanDerWaalsContact C-N 3.32Å; I413-F415 PolarHBondContact O-N 3.14Å; I413-Q416 PolarHBondContact O-N 3.12Å; I413-Q417 HydrophobicContact CG2-CG 4.4Å; I413-Q417 WeakPolarHBondContact O-CB 3.37Å; I413-Q417 WeakPolarHBondContact O-CG 3.49Å; I413-Q417 PolarHBondContact O-N 3.47Å; I413-I1104 HydrophobicContact CG1-CG2 4.41Å; I413-I1104 HydrophobicContact CG2-CG2 3.88Å; I413-M1108 HydrophobicContact CD1-CG 3.5Å; I413-M1108 VanDerWaalsContact CD1-CG 3.5Å; I413-M1108 HydrophobicContact CD1-SD 4.01Å; I413-M1108 HydrophobicContact CG1-CG 4.35Å
414	E	83.2	Confident	86.7	Confident	38 Å²	38	25.7 Å²	25.7	18%	0.178	13%	0.127	C	C	.	.	H	α-helix	trans	-64.3	-37.9	178.6	-73.8	-168.4	-151.1	0	0	112.3	I410 V411 Q417 L418	I410-E414 PolarHBondContact O-N 3.03Å; V411-E414 PolarHBondContact O-N 3.22Å; E414-Q417 PolarHBondContact O-N 3.21Å; E414-L418 PolarHBondContact O-N 2.67Å
415	F	86.3	Confident	86.8	Confident	90 Å²	90	26 Å²	26	40%	0.395	13%	0.13	S	C	.	.	H	α-helix	trans	-69.2	-41	174.4	-178.6	-105.6	0	0	0	112	V411 I413 L418 L419 L1155 M1159	V411-F415 WeakPolarHBondContact O-CB 3.27Å; V411-F415 PolarHBondContact O-N 3.44Å; I413-F415 VanDerWaalsContact C-N 3.32Å; I413-F415 PolarHBondContact O-N 3.14Å; F415-L418 PolarHBondContact O-N 3.48Å; F415-L419 HydrophobicContact CD1-CD1 3.87Å; F415-L419 HydrophobicContact CE1-CD1 3.37Å; F415-L419 HydrophobicContact CE1-CG 4.3Å; F415-L419 HydrophobicContact CE2-CD1 4.4Å; F415-L419 HydrophobicContact CZ-CD1 3.68Å; F415-L419 HydrophobicContact CZ-CG 4.25Å; F415-L419 WeakPolarHBondContact O-CG 3.49Å; F415-L419 PolarHBondContact O-N 3.23Å; F415-L1155 HydrophobicContact CD1-CD1 3.71Å; F415-L1155 HydrophobicContact CD1-CD2 4.29Å; F415-L1155 HydrophobicContact CE1-CD1 4.05Å; F415-L1155 HydrophobicContact CE1-CD2 4.07Å; F415-M1159 HydrophobicContact CE1-SD 4.28Å
416	Q	91	Very high	87	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-59.9	-45.6	171.3	-78.9	174.3	-8.2	0	0	111.7	T412 I413 L418 L419 L420 T1107 L1155 G1158 M1159	T412-Q416 WeakPolarHBondContact O-CB 3.14Å; T412-Q416 WeakPolarHBondContact O-CG 3.26Å; T412-Q416 PolarHBondContact O-N 3.29Å; I413-Q416 PolarHBondContact O-N 3.12Å; Q416-L418 PolarHBondContact O-N 2.64Å; Q416-L419 PolarHBondContact O-N 2.96Å; Q416-L420 WeakPolarHBondContact O-CB 3.35Å; Q416-L420 WeakPolarHBondContact O-CD1 3.35Å; Q416-L420 WeakPolarHBondContact O-CG 3.38Å; Q416-L420 PolarHBondContact O-N 3.44Å; Q416-T1107 PolarHBondContact NE2-OG1 3.42Å; Q416-L1155 HydrophobicContact CG-CD1 3.88Å; Q416-L1155 PolarHBondContact NE2-O 3.04Å; Q416-G1158 VanDerWaalsContact NE2-CA 3.32Å; Q416-M1159 HydrophobicContact CG-CG 4.46Å
417	Q	89.6	Confident	87.7	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58.3	-44.6	176.2	-81.4	-178.1	-28.5	0	0	112	I413 E414 L419 L420 S421 S444 Q445 D448 I1104	I413-Q417 HydrophobicContact CG2-CG 4.4Å; I413-Q417 WeakPolarHBondContact O-CB 3.37Å; I413-Q417 WeakPolarHBondContact O-CG 3.49Å; I413-Q417 PolarHBondContact O-N 3.47Å; E414-Q417 PolarHBondContact O-N 3.21Å; Q417-L419 PolarHBondContact O-N 2.84Å; Q417-L420 PolarHBondContact O-N 3.06Å; Q417-S421 WeakPolarHBondContact O-CB 3.41Å; Q417-S421 PolarHBondContact O-N 2.96Å; Q417-S444 CarbonylContact C-O 3.54Å; Q417-S444 WeakPolarHBondContact CB-O 3.48Å; Q417-Q445 PolarHBondContact NE2-O 3.5Å; Q417-D448 PolarHBondContact NE2-OD1 2.92Å; Q417-I1104 HydrophobicContact CG-CD1 3.73Å
418	L	87.6	Confident	88.4	Confident	68 Å²	68	36.6 Å²	36.6	36%	0.356	19%	0.185	S	C	.	.	H	α-helix	trans	-59	-45.8	174.7	-176.5	154.2	0	0	0	112.2	K106 E414 F415 Q416 S421 H422	K106-L418 HydrophobicContact CG-CD1 4.36Å; E414-L418 PolarHBondContact O-N 2.67Å; F415-L418 PolarHBondContact O-N 3.48Å; Q416-L418 PolarHBondContact O-N 2.64Å; L418-S421 WeakPolarHBondContact O-CB 3.36Å; L418-S421 PolarHBondContact O-N 3.18Å; L418-H422 PolarHBondContact O-N 2.98Å
419	L	89.8	Confident	88.9	Confident	30 Å²	30	41.2 Å²	41.2	16%	0.157	21%	0.205	C	C	.	.	H	α-helix	trans	-68.2	-39	178.4	-71.7	171.6	0	0	0	113.1	F415 Q416 Q417 S421 H422 F423 M1159	F415-L419 HydrophobicContact CD1-CD1 3.87Å; F415-L419 HydrophobicContact CE1-CD1 3.37Å; F415-L419 HydrophobicContact CE1-CG 4.3Å; F415-L419 HydrophobicContact CE2-CD1 4.4Å; F415-L419 HydrophobicContact CZ-CD1 3.68Å; F415-L419 HydrophobicContact CZ-CG 4.25Å; F415-L419 WeakPolarHBondContact O-CG 3.49Å; F415-L419 PolarHBondContact O-N 3.23Å; Q416-L419 PolarHBondContact O-N 2.96Å; Q417-L419 PolarHBondContact O-N 2.84Å; L419-S421 VanDerWaalsContact C-N 3.32Å; L419-S421 PolarHBondContact O-N 3.08Å; L419-H422 WeakPolarHBondContact O-CB 3.24Å; L419-H422 PolarHBondContact O-N 3.31Å; L419-F423 WeakPolarHBondContact O-CD2 3.38Å; L419-F423 WeakPolarHBondContact O-CG 3.37Å; L419-F423 PolarHBondContact O-N 3.11Å; L419-M1159 HydrophobicContact CD1-CE 3.4Å; L419-M1159 HydrophobicContact CD1-CG 3.77Å; L419-M1159 HydrophobicContact CD1-SD 3.62Å
420	L	92.2	Very high	89.2	Confident	4 Å²	4	41 Å²	41	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-63.6	-39.9	174.5	-67.8	164.4	0	0	0	110.8	Q416 Q417 H422 F423 I424 A447 I1104	Q416-L420 WeakPolarHBondContact O-CB 3.35Å; Q416-L420 WeakPolarHBondContact O-CD1 3.35Å; Q416-L420 WeakPolarHBondContact O-CG 3.38Å; Q416-L420 PolarHBondContact O-N 3.44Å; Q417-L420 PolarHBondContact O-N 3.06Å; L420-H422 VanDerWaalsContact C-N 3.31Å; L420-H422 PolarHBondContact O-N 3.29Å; L420-F423 PolarHBondContact O-N 3.38Å; L420-I424 VanDerWaalsContact O-CG1 3.28Å; L420-I424 WeakPolarHBondContact O-CG1 3.38Å; L420-I424 PolarHBondContact O-N 2.92Å; L420-A447 HydrophobicContact CB-CB 4.03Å; L420-I1104 HydrophobicContact CD1-CD1 3.75Å; L420-I1104 HydrophobicContact CD1-CG1 4.1Å
421	S	89.7	Confident	89.5	Confident	9 Å²	9	44.5 Å²	44.5	6%	0.063	22%	0.217	C	C	.	.	H	α-helix	trans	-59.3	-39.7	172	-165	0	0	0	0	112.4	Q417 L418 L419 S425 A441 S444	Q417-S421 WeakPolarHBondContact O-CB 3.41Å; Q417-S421 PolarHBondContact O-N 2.96Å; L418-S421 WeakPolarHBondContact O-CB 3.36Å; L418-S421 PolarHBondContact O-N 3.18Å; L419-S421 VanDerWaalsContact C-N 3.32Å; L419-S421 PolarHBondContact O-N 3.08Å; S421-S425 PolarHBondContact O-N 3.48Å; S421-S425 VanDerWaalsContact O-N 3.17Å; S421-S425 PolarHBondContact O-OG 2.81Å; S421-A441 WeakPolarHBondContact OG-CB 3.49Å; S421-S444 WeakPolarHBondContact OG-CA 3.43Å
422	H	90.4	Very high	89.6	Confident	99 Å²	99	43.5 Å²	43.5	46%	0.458	21%	0.21	S	C	.	.	H	α-helix	trans	-68.3	-44.3	175.2	-173.6	69.5	0	0	0	112.1	L418 L419 L420 I424 S425 N426	L418-H422 PolarHBondContact O-N 2.98Å; L419-H422 WeakPolarHBondContact O-CB 3.24Å; L419-H422 PolarHBondContact O-N 3.31Å; L420-H422 VanDerWaalsContact C-N 3.31Å; L420-H422 PolarHBondContact O-N 3.29Å; H422-I424 VanDerWaalsContact C-N 3.31Å; H422-I424 PolarHBondContact O-N 2.9Å; H422-S425 PolarHBondContact O-N 2.76Å; H422-S425 VanDerWaalsContact O-N 3.11Å; H422-N426 PolarHBondContact CE1-ND2 3.01Å; H422-N426 VanDerWaalsContact CE1-ND2 3.28Å; H422-N426 PolarHBondContact NE2-ND2 3.42Å; H422-N426 PolarHBondContact O-N 3.3Å
423	F	92.6	Very high	89.5	Confident	76 Å²	76	48 Å²	48	33%	0.333	24%	0.239	S	C	.	.	H	α-helix	trans	-63.5	-33.8	175.5	-63.4	-33.9	0	0	0	113.3	L419 L420 F1160	L419-F423 WeakPolarHBondContact O-CD2 3.38Å; L419-F423 WeakPolarHBondContact O-CG 3.37Å; L419-F423 PolarHBondContact O-N 3.11Å; L420-F423 PolarHBondContact O-N 3.38Å; F423-F1160 HydrophobicContact CZ-CE1 4.18Å
424	I	92.7	Very high	89	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.015	28%	0.275	C	S	.	.	H	α-helix	trans	-63.9	-41.3	172	-73.4	165.4	0	0	0	110.8	L420 H422 M430 A441 L450 Y1081 L1092 H1096	L420-I424 VanDerWaalsContact O-CG1 3.28Å; L420-I424 WeakPolarHBondContact O-CG1 3.38Å; L420-I424 PolarHBondContact O-N 2.92Å; H422-I424 VanDerWaalsContact C-N 3.31Å; H422-I424 PolarHBondContact O-N 2.9Å; I424-M430 HydrophobicContact CG2-CE 4.07Å; I424-M430 WeakPolarHBondContact O-CE 3.33Å; I424-A441 HydrophobicContact CG2-CB 4.19Å; I424-L450 HydrophobicContact CD1-CD1 4.04Å; I424-Y1081 HydrophobicContact CD1-CE1 4.08Å; I424-Y1081 HydrophobicContact CG2-CD1 4.19Å; I424-Y1081 HydrophobicContact CG2-CE1 4.29Å; I424-L1092 HydrophobicContact CD1-CD1 4.47Å; I424-L1092 HydrophobicContact CG2-CD1 3.78Å; I424-H1096 HydrophobicContact CD1-CB 4.13Å; I424-H1096 HydrophobicContact CG1-CB 3.84Å
425	S	91.6	Very high	88.7	Confident	15 Å²	15	57.2 Å²	57.2	11%	0.105	29%	0.286	C	S	.	.	H	α-helix	trans	-76	-23.6	-176	-52.8	0	0	0	0	113.7	S421 H422 S439 A441	S421-S425 PolarHBondContact O-N 3.48Å; S421-S425 VanDerWaalsContact O-N 3.17Å; S421-S425 PolarHBondContact O-OG 2.81Å; H422-S425 PolarHBondContact O-N 2.76Å; H422-S425 VanDerWaalsContact O-N 3.11Å; S425-S439 WeakPolarHBondContact CA-O 3.42Å; S425-A441 PolarHBondContact OG-N 2.97Å
426	N	90.8	Very high	88.5	Confident	97 Å²	97	58.9 Å²	58.9	52%	0.519	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	11.7	178.6	-64.4	-5.1	0	0	0	113.4	H422 I428	H422-N426 PolarHBondContact CE1-ND2 3.01Å; H422-N426 VanDerWaalsContact CE1-ND2 3.28Å; H422-N426 PolarHBondContact NE2-ND2 3.42Å; H422-N426 PolarHBondContact O-N 3.3Å; N426-I428 PolarHBondContact O-N 3.27Å
427	D	93.5	Very high	88.1	Confident	22 Å²	22	60 Å²	60	12%	0.118	30%	0.304	C	S	.	.			trans	-76.9	108.7	-177.6	-168.7	-13.6	0	0	0	111.9	H429 M430 R1091 H1096	D427-H429 PolarHBondContact O-N 2.85Å; D427-H429 VanDerWaalsContact O-N 3.17Å; D427-H429 IonicContact OD1-CD2 3.49Å; D427-H429 PolarHBondContact OD1-N 2.96Å; D427-H429 VanDerWaalsContact OD1-N 3.07Å; D427-M430 HydrophobicContact CB-CB 4.44Å; D427-M430 HydrophobicContact CB-CE 3.67Å; D427-M430 HydrophobicContact CB-CG 4.22Å; D427-M430 PolarHBondContact O-N 3.38Å; D427-R1091 IonicContact OD1-CZ 2.76Å; D427-R1091 IonicContact OD1-NE 2.67Å; D427-R1091 PolarHBondContact OD1-NE 3.12Å; D427-R1091 IonicContact OD1-NH2 3.31Å; D427-R1091 PolarHBondContact OD1-NH2 2.93Å; D427-R1091 IonicContact OD2-CZ 3.51Å; D427-R1091 IonicContact OD2-NE 3.83Å; D427-R1091 PolarHBondContact OD2-NE 3.34Å; D427-R1091 IonicContact OD2-NH2 3.58Å; D427-H1096 IonicContact OD2-CD2 2.64Å; D427-H1096 IonicContact OD2-CE1 3.48Å; D427-H1096 IonicContact OD2-NE2 2.67Å; D427-H1096 PolarHBondContact OD2-NE2 2.83Å
428	I	92.1	Very high	88	Confident	142 Å²	142	62.7 Å²	62.7	73%	0.728	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-57.2	-31.6	-179.1	-56.6	171.9	0	0	0	111.6	N426 M430 Y431	N426-I428 PolarHBondContact O-N 3.27Å; I428-M430 PolarHBondContact O-N 2.94Å; I428-Y431 PolarHBondContact O-N 2.95Å
429	H	90.6	Very high	88.1	Confident	111 Å²	111	59.6 Å²	59.6	51%	0.514	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-78.2	2.2	177.9	-66.7	-73.3	0	0	0	114	D427 H1088	D427-H429 PolarHBondContact O-N 2.85Å; D427-H429 VanDerWaalsContact O-N 3.17Å; D427-H429 IonicContact OD1-CD2 3.49Å; D427-H429 PolarHBondContact OD1-N 2.96Å; D427-H429 VanDerWaalsContact OD1-N 3.07Å; H429-H1088 PolarHBondContact O-CD2 3.43Å
430	M	91.4	Very high	87.9	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-119.6	15.9	172.7	-53.8	-162.7	-65.2	0	0	112.3	I424 D427 I428 S439 T1084 H1088 R1091 L1092	I424-M430 HydrophobicContact CG2-CE 4.07Å; I424-M430 WeakPolarHBondContact O-CE 3.33Å; D427-M430 HydrophobicContact CB-CB 4.44Å; D427-M430 HydrophobicContact CB-CE 3.67Å; D427-M430 HydrophobicContact CB-CG 4.22Å; D427-M430 PolarHBondContact O-N 3.38Å; I428-M430 PolarHBondContact O-N 2.94Å; M430-S439 WeakPolarHBondContact O-CB 3.5Å; M430-S439 PolarHBondContact O-N 2.78Å; M430-S439 PolarHBondContact O-OG 2.87Å; M430-T1084 PolarHBondContact O-OG1 3.48Å; M430-H1088 HydrophobicContact CB-CB 4.35Å; M430-H1088 HydrophobicContact CG-CB 4.16Å; M430-H1088 HydrophobicContact SD-CB 4.3Å; M430-R1091 HydrophobicContact CG-CG 4.46Å; M430-R1091 HydrophobicContact SD-CB 4.26Å; M430-R1091 HydrophobicContact SD-CG 4.33Å; M430-L1092 HydrophobicContact SD-CB 4.41Å
431	Y	88.7	Confident	87.7	Confident	89 Å²	89	62.5 Å²	62.5	35%	0.349	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	135.2	172.7	169.1	-104.6	0	0	0	110.8	I428 P433 N436 I437	I428-Y431 PolarHBondContact O-N 2.95Å; Y431-P433 HydrophobicContact CE1-CB 3.88Å; Y431-N436 PolarHBondContact OH-OD1 2.83Å; Y431-N436 VanDerWaalsContact OH-OD1 3.08Å; Y431-I437 VanDerWaalsContact CD2-O 3.24Å; Y431-I437 WeakPolarHBondContact CD2-O 3.42Å
432	N	83.6	Confident	87.4	Confident	11 Å²	11	65.2 Å²	65.2	6%	0.059	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	111.2	173.3	-177.5	-3	0	0	0	109.7	I434 N436 I437 T1084	N432-I434 VanDerWaalsContact C-N 3.29Å; N432-I434 PolarHBondContact O-N 2.96Å; N432-I434 WeakPolarHBondContact OD1-CB 3.44Å; N432-I434 PolarHBondContact OD1-N 3.38Å; N432-N436 PolarHBondContact O-N 3.14Å; N432-N436 VanDerWaalsContact O-N 3.16Å; N432-I437 PolarHBondContact N-O 3Å; N432-I437 PolarHBondContact O-N 3.11Å; N432-T1084 HydrophobicContact CB-CG2 4.02Å
433	P	83.3	Confident	87	Confident	94 Å²	94	62.1 Å²	62.1	61%	0.61	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-20.3	-178.2	29.7	-35.7	0	0	0	113.9	Y431	Y431-P433 HydrophobicContact CE1-CB 3.88Å
434	I	77.9	Confident	86.6	Confident	153 Å²	153	59.1 Å²	59.1	79%	0.785	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-41.9	-176.9	-59.5	173.6	0	0	0	110.8	N432	N432-I434 VanDerWaalsContact C-N 3.29Å; N432-I434 PolarHBondContact O-N 2.96Å; N432-I434 WeakPolarHBondContact OD1-CB 3.44Å; N432-I434 PolarHBondContact OD1-N 3.38Å
435	E	76.4	Confident	86.1	Confident	87 Å²	87	59.9 Å²	59.9	41%	0.407	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-5.4	-177.6	-60.2	-171.4	161.4	0	0	113.1	I437	E435-I437 HydrophobicContact CB-CD1 3.88Å; E435-I437 HydrophobicContact CB-CG1 3.87Å; E435-I437 WeakPolarHBondContact O-CG1 3.45Å
436	N	83.7	Confident	85.9	Confident	125 Å²	125	59.1 Å²	59.1	67%	0.668	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	52.8	-171.7	-170.1	11	0	0	0	112.2	Y431 N432	Y431-N436 PolarHBondContact OH-OD1 2.83Å; Y431-N436 VanDerWaalsContact OH-OD1 3.08Å; N432-N436 PolarHBondContact O-N 3.14Å; N432-N436 VanDerWaalsContact O-N 3.16Å
437	I	82.5	Confident	85.9	Confident	23 Å²	23	54.5 Å²	54.5	12%	0.118	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.9	179.4	-53.4	-178.3	0	0	0	108.8	Y431 N432 E435 Y1068 T1084	Y431-I437 VanDerWaalsContact CD2-O 3.24Å; Y431-I437 WeakPolarHBondContact CD2-O 3.42Å; N432-I437 PolarHBondContact N-O 3Å; N432-I437 PolarHBondContact O-N 3.11Å; E435-I437 HydrophobicContact CB-CD1 3.88Å; E435-I437 HydrophobicContact CB-CG1 3.87Å; E435-I437 WeakPolarHBondContact O-CG1 3.45Å; I437-Y1068 HydrophobicContact CD1-CD1 4.06Å; I437-Y1068 HydrophobicContact CD1-CG 4.48Å; I437-Y1068 HydrophobicContact CG2-CD1 3.87Å; I437-Y1068 HydrophobicContact CG2-CD2 4Å; I437-Y1068 HydrophobicContact CG2-CE1 3.62Å; I437-Y1068 HydrophobicContact CG2-CE2 3.76Å; I437-Y1068 HydrophobicContact CG2-CG 4.05Å; I437-T1084 HydrophobicContact CB-CG2 3.89Å; I437-T1084 HydrophobicContact CG2-CG2 3.71Å; I437-T1084 VanDerWaalsContact O-CG2 3.29Å; I437-T1084 WeakPolarHBondContact O-CG2 3.25Å
438	S	86.9	Confident	85.8	Confident	57 Å²	57	53.5 Å²	53.5	40%	0.399	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	152.3	167	56.9	0	0	0	0	111.4
439	S	88.6	Confident	85.7	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.021	24%	0.244	C	C	.	.			trans	-71	137.4	167.1	-59.2	0	0	0	0	109.4	S425 M430 S1082 V1083 T1084	S425-S439 WeakPolarHBondContact CA-O 3.42Å; M430-S439 WeakPolarHBondContact O-CB 3.5Å; M430-S439 PolarHBondContact O-N 2.78Å; M430-S439 PolarHBondContact O-OG 2.87Å; S439-S1082 CarbonylContact C-O 3.6Å; S439-S1082 VanDerWaalsContact CA-O 3.25Å; S439-S1082 WeakPolarHBondContact CA-O 3.36Å; S439-S1082 VanDerWaalsContact CB-O 3.25Å; S439-S1082 WeakPolarHBondContact CB-O 3.32Å; S439-V1083 WeakPolarHBondContact OG-CA 3.35Å; S439-T1084 PolarHBondContact OG-N 3.44Å
440	H	87.2	Confident	85.8	Confident	87 Å²	87	41.6 Å²	41.6	40%	0.403	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	142.1	-171.3	-173.9	-89.7	0	0	0	111.9	N442 S1082	H440-N442 PolarHBondContact ND1-OD1 3.11Å; H440-S1082 WeakPolarHBondContact CB-OG 3.21Å; H440-S1082 PolarHBondContact N-O 3.02Å; H440-S1082 PolarHBondContact N-OG 2.96Å; H440-S1082 VanDerWaalsContact N-OG 3.16Å; H440-S1082 PolarHBondContact O-N 3.03Å; H440-S1082 PolarHBondContact O-OG 2.98Å
441	A	88.2	Confident	85.8	Confident	8 Å²	8	41.5 Å²	41.5	7%	0.066	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	100.7	174.8	0	0	0	0	0	110.3	S421 I424 S425 N443 Y1081	S421-A441 WeakPolarHBondContact OG-CB 3.49Å; I424-A441 HydrophobicContact CG2-CB 4.19Å; S425-A441 PolarHBondContact OG-N 2.97Å; A441-N443 VanDerWaalsContact C-N 3.33Å; A441-Y1081 HydrophobicContact CB-CD1 3.65Å; A441-Y1081 HydrophobicContact CB-CE1 3.54Å
442	N	82.9	Confident	85.9	Confident	67 Å²	67	37.9 Å²	37.9	36%	0.358	21%	0.206	S	C	.	.	S	Bend	trans	-74.3	-24.2	-179.2	-60	-22.4	0	0	0	112.9	H440 V1076 A1079 D1080	H440-N442 PolarHBondContact ND1-OD1 3.11Å; N442-V1076 PolarHBondContact ND2-O 3.12Å; N442-A1079 WeakPolarHBondContact CB-O 3.49Å; N442-A1079 PolarHBondContact ND2-O 3.41Å; N442-D1080 PolarHBondContact N-O 3.31Å
443	N	82.5	Confident	86.2	Confident	33 Å²	33	37.5 Å²	37.5	18%	0.176	20%	0.204	C	C	.	.			trans	-123.2	113.6	178.4	-175.1	-9	0	0	0	110.5	A441 Q445 L446 D1080	A441-N443 VanDerWaalsContact C-N 3.33Å; N443-Q445 VanDerWaalsContact C-N 3.35Å; N443-Q445 PolarHBondContact O-N 2.6Å; N443-Q445 PolarHBondContact OD1-N 3.28Å; N443-Q445 VanDerWaalsContact OD1-N 3.08Å; N443-L446 VanDerWaalsContact ND2-CD1 3.31Å; N443-L446 WeakPolarHBondContact ND2-CD1 3.48Å; N443-D1080 HydrophobicContact CB-CB 3.88Å; N443-D1080 PolarHBondContact N-O 2.9Å; N443-D1080 PolarHBondContact ND2-OD1 3.4Å
444	S	82.8	Confident	86.5	Confident	13 Å²	13	34.5 Å²	34.5	9%	0.091	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-71.4	-24.4	-177.7	58.5	0	0	0	0	114.3	K106 Q417 S421 L446	K106-S444 WeakPolarHBondContact CE-OG 3.13Å; K106-S444 PolarHBondContact NZ-OG 3.39Å; Q417-S444 CarbonylContact C-O 3.54Å; Q417-S444 WeakPolarHBondContact CB-O 3.48Å; S421-S444 WeakPolarHBondContact OG-CA 3.43Å; S444-L446 PolarHBondContact O-N 3.48Å
445	Q	83.6	Confident	87.1	Confident	19 Å²	19	27.2 Å²	27.2	9%	0.089	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-86.1	0.1	-166.5	-65.2	-173.2	-58.1	0	0	115.3	R335 Q417 N443	R335-Q445 VanDerWaalsContact NE-OE1 3.12Å; Q417-Q445 PolarHBondContact NE2-O 3.5Å; N443-Q445 VanDerWaalsContact C-N 3.35Å; N443-Q445 PolarHBondContact O-N 2.6Å; N443-Q445 PolarHBondContact OD1-N 3.28Å; N443-Q445 VanDerWaalsContact OD1-N 3.08Å
446	L	87.6	Confident	88	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-112.7	10.4	-171.7	-60.1	-179.7	0	0	0	115	K336 N443 S444 D448 E449 L450 D1080 Y1081	K336-L446 HydrophobicContact CB-CD1 4.27Å; K336-L446 HydrophobicContact CB-CD2 4.44Å; K336-L446 HydrophobicContact CD-CD1 4.23Å; N443-L446 VanDerWaalsContact ND2-CD1 3.31Å; N443-L446 WeakPolarHBondContact ND2-CD1 3.48Å; S444-L446 PolarHBondContact O-N 3.48Å; L446-D448 VanDerWaalsContact C-N 3.27Å; L446-D448 PolarHBondContact O-N 3.48Å; L446-E449 HydrophobicContact CD2-CG 4.23Å; L446-E449 WeakPolarHBondContact O-CB 3.31Å; L446-E449 PolarHBondContact O-N 2.85Å; L446-L450 PolarHBondContact O-N 3.15Å; L446-D1080 HydrophobicContact CD1-CB 3.99Å; L446-D1080 VanDerWaalsContact CD1-CG 3.49Å; L446-D1080 WeakPolarHBondContact CD1-OD1 3.41Å; L446-Y1081 VanDerWaalsContact C-OH 3.28Å; L446-Y1081 HydrophobicContact CB-CE2 4.34Å
447	A	90.5	Very high	88.5	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-34.5	-175.2	0	0	0	0	0	113.8	L420 Y1081 S1100	L420-A447 HydrophobicContact CB-CB 4.03Å; A447-Y1081 WeakPolarHBondContact CA-OH 3.49Å; A447-Y1081 PolarHBondContact N-OH 3.36Å; A447-Y1081 VanDerWaalsContact N-OH 3.17Å; A447-S1100 WeakPolarHBondContact O-CB 3.39Å
448	D	90.1	Very high	89.1	Confident	1 Å²	1	16.1 Å²	16.1	1%	0.005	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-29	175.2	50.9	-61.7	0	0	0	114	S338 R340 Q417 L446 L450 G451 I1104	S338-D448 PolarHBondContact OG-OD2 2.86Å; R340-D448 VanDerWaalsContact CB-OD2 3.26Å; R340-D448 WeakPolarHBondContact CB-OD2 3.45Å; R340-D448 VanDerWaalsContact CD-OD2 3.32Å; R340-D448 WeakPolarHBondContact CD-OD2 3.46Å; R340-D448 IonicContact CZ-OD2 2.67Å; R340-D448 IonicContact NE-OD1 3.86Å; R340-D448 IonicContact NE-OD2 3.94Å; R340-D448 PolarHBondContact NE-OD2 3.06Å; R340-D448 IonicContact NH2-OD2 2.81Å; Q417-D448 PolarHBondContact NE2-OD1 2.92Å; L446-D448 VanDerWaalsContact C-N 3.27Å; L446-D448 PolarHBondContact O-N 3.48Å; D448-L450 VanDerWaalsContact C-N 3.26Å; D448-L450 PolarHBondContact O-N 3.39Å; D448-G451 PolarHBondContact O-N 3.35Å; D448-G451 VanDerWaalsContact O-N 3.15Å; D448-I1104 HydrophobicContact CB-CD1 3.9Å
449	E	90.8	Very high	89.3	Confident	2 Å²	2	13.7 Å²	13.7	1%	0.009	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-67	-30.8	178.1	-72.5	-79	111.9	0	0	111.3	S338 T339 L446 G451 Q452 V1044 I1063	S338-E449 PolarHBondContact OG-OE1 3.05Å; T339-E449 WeakPolarHBondContact CA-OE1 3.34Å; T339-E449 VanDerWaalsContact CB-OE1 3.29Å; T339-E449 WeakPolarHBondContact CB-OE1 3.25Å; T339-E449 VanDerWaalsContact N-CD 3.34Å; T339-E449 PolarHBondContact N-OE1 3.37Å; T339-E449 PolarHBondContact OG1-OE1 3.02Å; L446-E449 HydrophobicContact CD2-CG 4.23Å; L446-E449 WeakPolarHBondContact O-CB 3.31Å; L446-E449 PolarHBondContact O-N 2.85Å; E449-G451 PolarHBondContact O-N 3.18Å; E449-G451 VanDerWaalsContact O-N 3.08Å; E449-Q452 PolarHBondContact O-N 2.72Å; E449-V1044 HydrophobicContact CB-CG1 4.35Å; E449-V1044 WeakPolarHBondContact OE2-CG1 3.4Å; E449-V1044 VanDerWaalsContact OE2-CG2 3.31Å; E449-V1044 WeakPolarHBondContact OE2-CG2 3.37Å; E449-I1063 VanDerWaalsContact C-CD1 3.45Å; E449-I1063 HydrophobicContact CB-CD1 3.64Å; E449-I1063 HydrophobicContact CB-CG1 3.98Å
450	L	92.9	Very high	89.2	Confident	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-56.2	-24.1	173.4	-67.4	174.8	0	0	0	112.8	I424 L446 D448 I453 I1063 Y1081 L1092 F1093 G1097 Y1176	I424-L450 HydrophobicContact CD1-CD1 4.04Å; L446-L450 PolarHBondContact O-N 3.15Å; D448-L450 VanDerWaalsContact C-N 3.26Å; D448-L450 PolarHBondContact O-N 3.39Å; L450-I453 HydrophobicContact CD2-CD1 4.34Å; L450-I1063 HydrophobicContact CD2-CD1 3.91Å; L450-I1063 HydrophobicContact CD2-CG2 4.08Å; L450-I1063 HydrophobicContact CG-CD1 4.34Å; L450-Y1081 HydrophobicContact CD1-CE1 4.04Å; L450-Y1081 HydrophobicContact CD1-CE2 3.93Å; L450-Y1081 HydrophobicContact CD2-CD2 4.08Å; L450-Y1081 HydrophobicContact CD2-CE2 3.86Å; L450-Y1081 HydrophobicContact CG-CE2 3.96Å; L450-L1092 HydrophobicContact CD1-CD1 3.79Å; L450-L1092 HydrophobicContact CD1-CG 4.16Å; L450-L1092 HydrophobicContact CD2-CD2 4.36Å; L450-L1092 HydrophobicContact CD2-CG 4.19Å; L450-F1093 HydrophobicContact CD2-CD1 3.87Å; L450-F1093 HydrophobicContact CD2-CE1 3.81Å; L450-G1097 VanDerWaalsContact CB-CA 3.48Å; L450-Y1176 WeakPolarHBondContact O-CE2 3.48Å; L450-Y1176 PolarHBondContact O-OH 2.99Å
451	G	90.3	Very high	88.9	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-87.5	-0.9	175.6	0	0	0	0	0	115.4	D448 E449 G1097 Y1176 I1179	D448-G451 PolarHBondContact O-N 3.35Å; D448-G451 VanDerWaalsContact O-N 3.15Å; E449-G451 PolarHBondContact O-N 3.18Å; E449-G451 VanDerWaalsContact O-N 3.08Å; G451-G1097 WeakPolarHBondContact CA-O 3.34Å; G451-G1097 PolarHBondContact N-O 2.92Å; G451-Y1176 VanDerWaalsContact C-OH 3.27Å; G451-I1179 WeakPolarHBondContact O-CD1 3.32Å
452	Q	90.7	Very high	88.3	Confident	12 Å²	12	10.7 Å²	10.7	6%	0.056	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123	1.6	-173.6	-67.5	-58.5	-50.1	0	0	114.5	E449 K454 V1044 Y1101 Y1176 I1179 Q1182	E449-Q452 PolarHBondContact O-N 2.72Å; Q452-K454 PolarHBondContact O-N 3.15Å; Q452-V1044 HydrophobicContact CB-CB 4.27Å; Q452-V1044 HydrophobicContact CB-CG2 3.68Å; Q452-V1044 WeakPolarHBondContact O-CB 3.14Å; Q452-Y1101 HydrophobicContact CG-CD2 3.67Å; Q452-Y1101 HydrophobicContact CG-CE2 3.86Å; Q452-Y1101 HydrophobicContact CG-CG 4.46Å; Q452-Y1101 VanDerWaalsContact NE2-CZ 3.27Å; Q452-Y1176 PolarHBondContact N-OH 3.28Å; Q452-I1179 PolarHBondContact NE2-O 3.38Å; Q452-Q1182 HydrophobicContact CG-CG 4.3Å
453	I	91.5	Very high	88.5	Confident	4 Å²	4	7.5 Å²	7.5	2%	0.021	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	125.7	-178	-56.2	169.9	0	0	0	110.2	L450 F455 I813 V1044 A1046 I1063 F1093 Y1176	L450-I453 HydrophobicContact CD2-CD1 4.34Å; I453-F455 WeakPolarHBondContact CG2-O 3.4Å; I453-I813 HydrophobicContact CG2-CG2 4.31Å; I453-V1044 HydrophobicContact CG1-CG1 4.28Å; I453-A1046 HydrophobicContact CD1-CB 3.94Å; I453-A1046 HydrophobicContact CG1-CB 4.25Å; I453-A1046 HydrophobicContact CG2-CB 3.78Å; I453-I1063 HydrophobicContact CD1-CD1 3.9Å; I453-I1063 HydrophobicContact CG1-CD1 3.78Å; I453-F1093 HydrophobicContact CD1-CD1 3.54Å; I453-F1093 HydrophobicContact CD1-CD2 3.68Å; I453-F1093 HydrophobicContact CD1-CE1 3.44Å; I453-F1093 VanDerWaalsContact CD1-CE1 3.44Å; I453-F1093 HydrophobicContact CD1-CE2 3.58Å; I453-F1093 HydrophobicContact CD1-CG 3.68Å; I453-F1093 HydrophobicContact CD1-CZ 3.47Å; I453-F1093 VanDerWaalsContact CD1-CZ 3.47Å; I453-Y1176 WeakPolarHBondContact CB-OH 3.41Å; I453-Y1176 PolarHBondContact N-OH 2.85Å
454	K	88.3	Confident	88.8	Confident	31 Å²	31	5.9 Å²	5.9	14%	0.135	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-35.4	173.9	-179.2	177.9	172.3	176.6	0	112.5	Q452 Q814 H970 P1043 V1044 Y1181	Q452-K454 PolarHBondContact O-N 3.15Å; K454-Q814 PolarHBondContact O-N 2.66Å; K454-H970 PolarHBondContact NZ-CE1 3.32Å; K454-H970 PolarHBondContact NZ-NE2 3.14Å; K454-P1043 HydrophobicContact CB-CB 4.31Å; K454-P1043 HydrophobicContact CD-CB 4.06Å; K454-V1044 PolarHBondContact N-O 3.37Å; K454-Y1181 HydrophobicContact CD-CE1 4.43Å; K454-Y1181 VanDerWaalsContact CE-OH 3.27Å; K454-Y1181 WeakPolarHBondContact CE-OH 3.34Å; K454-Y1181 PolarHBondContact NZ-OH 2.94Å
455	F	91.5	Very high	89	Confident	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.028	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.3	178.4	-68.5	-88.7	0	0	0	110.2	I453 F457 Q814 W816 M1007 V1029 L1033 P1043 V1044 I1045 A1046	I453-F455 WeakPolarHBondContact CG2-O 3.4Å; F455-F457 HydrophobicContact CB-CE2 4.18Å; F455-Q814 WeakPolarHBondContact CA-O 3.49Å; F455-Q814 HydrophobicContact CD1-CB 3.8Å; F455-Q814 HydrophobicContact CE1-CB 3.87Å; F455-Q814 HydrophobicContact CE1-CG 4.39Å; F455-W816 HydrophobicContact CE1-CZ2 4.28Å; F455-M1007 HydrophobicContact CE1-SD 3.97Å; F455-M1007 HydrophobicContact CZ-CE 3.98Å; F455-M1007 HydrophobicContact CZ-SD 3.64Å; F455-V1029 HydrophobicContact CD1-CG1 4.37Å; F455-V1029 HydrophobicContact CD2-CG1 4.19Å; F455-V1029 HydrophobicContact CE1-CG1 4.44Å; F455-V1029 HydrophobicContact CE2-CG1 4.26Å; F455-V1029 HydrophobicContact CG-CG1 4.25Å; F455-V1029 HydrophobicContact CZ-CG1 4.39Å; F455-L1033 HydrophobicContact CD2-CD1 4.39Å; F455-L1033 HydrophobicContact CE2-CD1 3.44Å; F455-L1033 VanDerWaalsContact CE2-CD1 3.44Å; F455-L1033 HydrophobicContact CZ-CD1 3.66Å; F455-P1043 HydrophobicContact CD2-CB 4.15Å; F455-P1043 HydrophobicContact CD2-CG 4.49Å; F455-P1043 HydrophobicContact CE2-CB 4.12Å; F455-P1043 HydrophobicContact CE2-CG 4.32Å; F455-V1044 PolarHBondContact N-O 3.36Å; F455-I1045 HydrophobicContact CB-CG1 4.14Å; F455-A1046 PolarHBondContact O-N 3.1Å
456	L	94.6	Very high	88.8	Confident	1 Å²	1	8.3 Å²	8.3	1%	0.005	4%	0.042	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	117.5	174.9	-178.3	62.7	0	0	0	108.8	L808 I813 Q814 I815 W816 A1046 V1048 F1093	L456-L808 HydrophobicContact CD2-CD1 3.82Å; L456-I813 HydrophobicContact CB-CG2 3.75Å; L456-Q814 PolarHBondContact N-O 3.23Å; L456-I815 HydrophobicContact CB-CG1 4.35Å; L456-I815 HydrophobicContact CD2-CG1 4.31Å; L456-I815 CarbonylContact O-C 3.6Å; L456-I815 WeakPolarHBondContact O-CA 3.28Å; L456-W816 PolarHBondContact O-N 3.5Å; L456-A1046 WeakPolarHBondContact CA-O 3.16Å; L456-A1046 HydrophobicContact CD1-CB 3.77Å; L456-V1048 HydrophobicContact CD1-CG2 3.58Å; L456-V1048 HydrophobicContact CG-CG2 4.49Å; L456-F1093 HydrophobicContact CD1-CE2 3.85Å; L456-F1093 HydrophobicContact CD1-CZ 4.16Å; L456-F1093 HydrophobicContact CD2-CE2 4.26Å
457	F	95.5	Very high	88.2	Confident	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	122.2	170.9	-63.6	-81.8	0	0	0	108.9	F455 W816 L818 I1025 V1026 V1029 I1045 A1046 A1047 V1048 M1057	F455-F457 HydrophobicContact CB-CE2 4.18Å; F457-W816 WeakPolarHBondContact CA-O 3.31Å; F457-W816 HydrophobicContact CD1-CB 3.81Å; F457-W816 HydrophobicContact CD1-CE3 4.45Å; F457-W816 HydrophobicContact CD1-CG 4.47Å; F457-W816 HydrophobicContact CE1-CB 3.92Å; F457-W816 AromaticContact CE1-CD2 3.86Å; F457-W816 HydrophobicContact CE1-CD2 3.86Å; F457-W816 AromaticContact CE1-CE3 3.52Å; F457-W816 HydrophobicContact CE1-CE3 3.52Å; F457-W816 HydrophobicContact CE1-CG 4.1Å; F457-W816 HydrophobicContact CE1-CZ3 4.2Å; F457-W816 HydrophobicContact CZ-CD2 4.48Å; F457-W816 HydrophobicContact CZ-CE3 4.25Å; F457-L818 HydrophobicContact CB-CD1 4.17Å; F457-L818 HydrophobicContact CB-CG 4.47Å; F457-L818 HydrophobicContact CD1-CD1 3.5Å; F457-L818 VanDerWaalsContact CD1-CD1 3.5Å; F457-L818 HydrophobicContact CD1-CD2 4.25Å; F457-L818 HydrophobicContact CD1-CG 3.84Å; F457-L818 HydrophobicContact CE1-CD1 4.22Å; F457-L818 HydrophobicContact CG-CD1 4.12Å; F457-I1025 HydrophobicContact CD1-CG2 4.39Å; F457-I1025 HydrophobicContact CE1-CG2 3.66Å; F457-I1025 HydrophobicContact CZ-CG2 4.28Å; F457-V1026 HydrophobicContact CB-CG2 4.43Å; F457-V1026 HydrophobicContact CD2-CG2 3.82Å; F457-V1026 HydrophobicContact CE2-CG2 4.18Å; F457-V1026 HydrophobicContact CG-CG2 3.99Å; F457-V1029 HydrophobicContact CZ-CB 4.07Å; F457-V1029 HydrophobicContact CZ-CG1 4.37Å; F457-V1029 HydrophobicContact CZ-CG2 3.89Å; F457-I1045 HydrophobicContact CD2-CG2 3.5Å; F457-I1045 VanDerWaalsContact CD2-CG2 3.5Å; F457-I1045 HydrophobicContact CE2-CG1 4.45Å; F457-I1045 HydrophobicContact CE2-CG2 3.4Å; F457-A1046 PolarHBondContact N-O 3.22Å; F457-A1047 HydrophobicContact CB-CB 4.34Å; F457-A1047 CarbonylContact O-C 3.56Å; F457-A1047 VanDerWaalsContact O-CA 3.26Å; F457-A1047 WeakPolarHBondContact O-CA 3.44Å; F457-V1048 PolarHBondContact O-N 3.09Å; F457-M1057 HydrophobicContact CB-SD 4.05Å
458	C	93.9	Very high	87.7	Confident	1 Å²	1	14.3 Å²	14.3	1%	0.007	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	140.5	176.2	-59	0	0	0	0	110.3	W816 I817 L818 F1086	C458-W816 PolarHBondContact N-O 3.18Å; C458-I817 WeakPolarHBondContact O-CA 3.43Å; C458-L818 PolarHBondContact O-N 3.38Å; C458-F1086 HydrophobicContact CB-CE2 4.5Å
459	D	90.9	Very high	87.4	Confident	5 Å²	5	15 Å²	15	3%	0.027	7%	0.074	C	C	.	.			trans	-70.7	170.7	153.5	-164.6	61.8	0	0	0	111.1	T461 L464 T819 K1022 V1048 D1054	D459-T461 PolarHBondContact OD2-N 3.42Å; D459-L464 WeakPolarHBondContact O-CG 3.32Å; D459-T819 WeakPolarHBondContact OD1-CA 3.15Å; D459-K1022 VanDerWaalsContact CG-NZ 3.35Å; D459-K1022 IonicContact OD1-NZ 3.46Å; D459-K1022 PolarHBondContact OD1-NZ 2.95Å; D459-V1048 PolarHBondContact N-O 2.98Å; D459-D1054 WeakPolarHBondContact CB-OD2 3.23Å
460	K	87	Confident	87.1	Confident	3 Å²	3	15.6 Å²	15.6	1%	0.013	8%	0.077	C	C	.	.	S	Bend	trans	-103.6	-53.1	179.8	-172.1	-133.1	74	151.1	0	111.6	L464 T465 D795 I817 T819 D821 I829	K460-L464 WeakPolarHBondContact O-CB 3.38Å; K460-L464 PolarHBondContact O-N 2.69Å; K460-T465 PolarHBondContact O-N 3.36Å; K460-T465 VanDerWaalsContact O-N 3.15Å; K460-T465 PolarHBondContact O-OG1 2.71Å; K460-D795 IonicContact NZ-OD2 3.86Å; K460-D795 PolarHBondContact NZ-OD2 3.03Å; K460-I817 HydrophobicContact CB-CG2 4.33Å; K460-T819 HydrophobicContact CB-CG2 4.42Å; K460-D821 WeakPolarHBondContact CE-OD2 3.28Å; K460-D821 IonicContact NZ-OD2 2.72Å; K460-D821 PolarHBondContact NZ-OD2 3.29Å; K460-I829 HydrophobicContact CD-CB 4.19Å; K460-I829 HydrophobicContact CD-CG1 3.96Å; K460-I829 HydrophobicContact CD-CG2 4.34Å; K460-I829 HydrophobicContact CG-CB 4.15Å; K460-I829 HydrophobicContact CG-CG1 4.31Å; K460-I829 HydrophobicContact CG-CG2 3.77Å
461	T	80.4	Confident	86.8	Confident	26 Å²	26	15.7 Å²	15.7	16%	0.16	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	127.6	-172.2	-60.4	0	0	0	0	108.2	D459 T463 T465 N467	D459-T461 PolarHBondContact OD2-N 3.42Å; T461-T463 PolarHBondContact O-N 2.99Å; T461-T465 WeakPolarHBondContact CA-OG1 3.33Å; T461-N467 VanDerWaalsContact CG2-ND2 3.31Å; T461-N467 WeakPolarHBondContact CG2-ND2 3.06Å
462	G	76.2	Confident	86.5	Confident	6 Å²	6	18.7 Å²	18.7	6%	0.062	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	-29.5	177	0	0	0	0	0	114.7	T465 N467 Q798 D1050	G462-T465 CarbonylContact C-O 3.35Å; G462-T465 WeakPolarHBondContact CA-O 3.31Å; G462-T465 PolarHBondContact N-O 2.98Å; G462-T465 PolarHBondContact N-OG1 3.19Å; G462-N467 WeakPolarHBondContact CA-ND2 3.45Å; G462-N467 VanDerWaalsContact N-CG 3.32Å; G462-N467 PolarHBondContact N-ND2 3.46Å; G462-N467 PolarHBondContact N-OD1 3.35Å; G462-Q798 PolarHBondContact O-NE2 3.48Å; G462-D1050 VanDerWaalsContact CA-OD2 3.31Å; G462-D1050 WeakPolarHBondContact CA-OD2 3.26Å
463	T	86.5	Confident	86.3	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-46.6	176.4	-68	0	0	0	0	113.4	T461 V1048 G1049 D1050 V1067 F1086	T461-T463 PolarHBondContact O-N 2.99Å; T463-V1048 HydrophobicContact CG2-CB 4.37Å; T463-V1048 HydrophobicContact CG2-CG1 3.67Å; T463-G1049 VanDerWaalsContact OG1-CA 3.28Å; T463-G1049 WeakPolarHBondContact OG1-CA 3.17Å; T463-D1050 PolarHBondContact N-OD1 2.68Å; T463-D1050 PolarHBondContact OG1-N 3.04Å; T463-D1050 PolarHBondContact OG1-OD1 3.22Å; T463-V1067 HydrophobicContact CG2-CG2 4.33Å; T463-F1086 HydrophobicContact CG2-CD2 3.91Å; T463-F1086 HydrophobicContact CG2-CE2 4.16Å; T463-F1086 WeakPolarHBondContact O-CB 3.41Å; T463-F1086 WeakPolarHBondContact O-CD2 3.3Å
464	L	88.8	Confident	86	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-33.1	175.3	-62.7	176.9	0	0	0	111.8	D459 K460 L797 Q798 V801 I805 I817 I833 F1086	D459-L464 WeakPolarHBondContact O-CG 3.32Å; K460-L464 WeakPolarHBondContact O-CB 3.38Å; K460-L464 PolarHBondContact O-N 2.69Å; L464-L797 WeakPolarHBondContact O-CA 3.38Å; L464-Q798 PolarHBondContact O-N 3.28Å; L464-V801 HydrophobicContact CD2-CG1 3.83Å; L464-I805 HydrophobicContact CD2-CD1 4.08Å; L464-I817 HydrophobicContact CD1-CD1 4.11Å; L464-I817 HydrophobicContact CD1-CG1 4.48Å; L464-I833 HydrophobicContact CD1-CD1 3.97Å; L464-F1086 HydrophobicContact CD2-CD1 4.19Å; L464-F1086 HydrophobicContact CD2-CD2 3.81Å; L464-F1086 HydrophobicContact CD2-CE1 3.93Å; L464-F1086 HydrophobicContact CD2-CE2 3.51Å; L464-F1086 HydrophobicContact CD2-CG 4.15Å; L464-F1086 HydrophobicContact CD2-CZ 3.59Å
465	T	86.5	Confident	86	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	153	175.2	52	0	0	0	0	110.7	K460 T461 G462 N467 D795 K796 L797 I829	K460-T465 PolarHBondContact O-N 3.36Å; K460-T465 VanDerWaalsContact O-N 3.15Å; K460-T465 PolarHBondContact O-OG1 2.71Å; T461-T465 WeakPolarHBondContact CA-OG1 3.33Å; G462-T465 CarbonylContact C-O 3.35Å; G462-T465 WeakPolarHBondContact CA-O 3.31Å; G462-T465 PolarHBondContact N-O 2.98Å; G462-T465 PolarHBondContact N-OG1 3.19Å; T465-N467 PolarHBondContact OG1-OD1 2.79Å; T465-D795 WeakPolarHBondContact CB-OD1 3.47Å; T465-D795 VanDerWaalsContact CG2-OD1 3.31Å; T465-D795 WeakPolarHBondContact CG2-OD1 3.4Å; T465-K796 CarbonylContact C-O 3.6Å; T465-K796 WeakPolarHBondContact CA-O 3.32Å; T465-L797 HydrophobicContact CG2-CD2 4.31Å; T465-I829 HydrophobicContact CG2-CD1 3.6Å; T465-I829 HydrophobicContact CG2-CG1 4.11Å
466	Q	80.7	Confident	85.7	Confident	83 Å²	83	16.8 Å²	16.8	39%	0.388	8%	0.082	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-4.6	169.8	-58.3	-178.6	24.6	0	0	112.3	F468 K796 L797 Q798	Q466-F468 HydrophobicContact CB-CB 4.35Å; Q466-F468 PolarHBondContact O-N 3.31Å; Q466-K796 PolarHBondContact N-O 3.35Å; Q466-L797 PolarHBondContact NE2-O 2.76Å; Q466-Q798 HydrophobicContact CG-CG 4.1Å
467	N	75.5	Confident	85.2	Confident	40 Å²	40	17 Å²	17	21%	0.214	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.1	35.9	-169.7	-58.7	-21.5	0	0	0	113.2	N189 T461 G462 T465 E1071	N189-N467 WeakPolarHBondContact ND2-CB 3.45Å; N189-N467 PolarHBondContact ND2-ND2 3.25Å; T461-N467 VanDerWaalsContact CG2-ND2 3.31Å; T461-N467 WeakPolarHBondContact CG2-ND2 3.06Å; G462-N467 WeakPolarHBondContact CA-ND2 3.45Å; G462-N467 VanDerWaalsContact N-CG 3.32Å; G462-N467 PolarHBondContact N-ND2 3.46Å; G462-N467 PolarHBondContact N-OD1 3.35Å; T465-N467 PolarHBondContact OG1-OD1 2.79Å; N467-E1071 PolarHBondContact ND2-OE1 3.34Å
468	F	79.6	Confident	84.3	Confident	85 Å²	85	20.7 Å²	20.7	37%	0.373	10%	0.103	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	110.6	174.8	-172.4	-117.9	0	0	0	108.7	Q466 V470 K796	Q466-F468 HydrophobicContact CB-CB 4.35Å; Q466-F468 PolarHBondContact O-N 3.31Å; F468-V470 HydrophobicContact CD1-CG2 3.58Å; F468-V470 HydrophobicContact CE1-CG2 3.32Å; F468-V470 HydrophobicContact CZ-CG2 4.1Å; F468-K796 HydrophobicContact CD1-CD 4.36Å; F468-K796 WeakPolarHBondContact O-CB 3.39Å; F468-K796 PolarHBondContact O-N 3.12Å; F468-K796 VanDerWaalsContact O-N 3.07Å
469	M	84	Confident	83.3	Confident	17 Å²	17	25.1 Å²	25.1	8%	0.084	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	136.5	177.6	-63.1	-62.8	160.8	0	0	109.4	A615 R738 I793 E794 D795	M469-A615 HydrophobicContact CB-CB 3.54Å; M469-A615 VanDerWaalsContact O-CB 3.28Å; M469-A615 WeakPolarHBondContact O-CB 3.4Å; M469-R738 VanDerWaalsContact CE-CZ 3.44Å; M469-R738 VanDerWaalsContact CE-NH2 3.29Å; M469-I793 HydrophobicContact CB-CG2 3.94Å; M469-I793 HydrophobicContact SD-CG2 4.42Å; M469-E794 CarbonylContact C-O 3.49Å; M469-E794 VanDerWaalsContact CA-O 3.32Å; M469-E794 WeakPolarHBondContact CA-O 3.34Å; M469-D795 HydrophobicContact CE-CB 3.91Å; M469-D795 WeakPolarHBondContact CE-OD1 3.33Å; M469-D795 HydrophobicContact SD-CB 3.58Å; M469-D795 VanDerWaalsContact SD-CB 3.58Å
470	V	84.2	Confident	82.4	Confident	13 Å²	13	28.6 Å²	28.6	8%	0.079	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134.2	178.2	-180	0	0	0	0	110.1	F468 Y472 I793 E794 K796	F468-V470 HydrophobicContact CD1-CG2 3.58Å; F468-V470 HydrophobicContact CE1-CG2 3.32Å; F468-V470 HydrophobicContact CZ-CG2 4.1Å; V470-Y472 PolarHBondContact O-N 3.08Å; V470-I793 CarbonylContact O-C 3.54Å; V470-I793 WeakPolarHBondContact O-CA 3.29Å; V470-E794 PolarHBondContact N-O 2.98Å; V470-E794 PolarHBondContact O-N 3.25Å; V470-K796 HydrophobicContact CG2-CD 3.83Å; V470-K796 HydrophobicContact CG2-CG 4.23Å
471	L	87.1	Confident	81.8	Confident	3 Å²	3	29.9 Å²	29.9	2%	0.016	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	104.1	166	177.3	59.4	0	0	0	108.5	C485 I561 L616 T791	L471-C485 HydrophobicContact CD2-CB 4.42Å; L471-C485 HydrophobicContact CG-CB 4.04Å; L471-C485 WeakPolarHBondContact O-CB 3.34Å; L471-I561 HydrophobicContact CD2-CD1 4.41Å; L471-L616 HydrophobicContact CD1-CD2 4.12Å; L471-T791 HydrophobicContact CD1-CG2 4.38Å
472	Y	83.3	Confident	81.6	Confident	63 Å²	63	30.5 Å²	30.5	25%	0.247	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-45.9	-173.9	-179.6	-95.7	0	0	0	111.4	V470 L484 C485 D486 L737 A792	V470-Y472 PolarHBondContact O-N 3.08Å; Y472-L484 HydrophobicContact CD1-CD2 4.45Å; Y472-L484 HydrophobicContact CE1-CD2 3.87Å; Y472-C485 PolarHBondContact O-N 3.11Å; Y472-D486 HydrophobicContact CD2-CB 4.39Å; Y472-L737 HydrophobicContact CD1-CD1 3.73Å; Y472-L737 HydrophobicContact CD1-CD2 4.38Å; Y472-L737 HydrophobicContact CE1-CD1 4.23Å; Y472-L737 HydrophobicContact CG-CD1 4.48Å; Y472-L737 HydrophobicContact CG-CD2 4.39Å; Y472-A792 PolarHBondContact N-O 3.06Å
473	S	85.5	Confident	81.5	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	160.4	-179.6	-175.3	0	0	0	0	111.6	V482 Y483 Y732 A792	S473-V482 WeakPolarHBondContact OG-CG1 3.44Å; S473-Y483 CarbonylContact C-O 3.53Å; S473-Y483 WeakPolarHBondContact CA-O 3.38Å; S473-Y483 WeakPolarHBondContact CB-O 3.3Å; S473-Y483 PolarHBondContact OG-O 2.86Å; S473-Y732 PolarHBondContact OG-OH 2.93Å; S473-A792 PolarHBondContact N-O 2.75Å; S473-A792 PolarHBondContact O-N 2.9Å
474	C	86.6	Confident	80.9	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.007	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	148.7	169.2	55.4	0	0	0	0	110.9	Y483 F557 V790 T791	C474-Y483 PolarHBondContact N-O 3.34Å; C474-Y483 PolarHBondContact O-N 2.93Å; C474-F557 HydrophobicContact CB-CE1 3.8Å; C474-F557 HydrophobicContact CB-CE2 4.4Å; C474-F557 HydrophobicContact CB-CZ 3.55Å; C474-F557 WeakPolarHBondContact SG-CE1 3.37Å; C474-V790 CarbonylContact C-O 3.54Å; C474-V790 WeakPolarHBondContact CA-O 3.3Å; C474-T791 HydrophobicContact CB-CG2 4.21Å
475	C	86.7	Confident	79.9	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	131.6	176.2	178.4	0	0	0	0	110.3	E481 V482 Y728 Y789 V790	C475-E481 WeakPolarHBondContact CA-O 3.34Å; C475-V482 HydrophobicContact CB-CG2 4.14Å; C475-Y728 HydrophobicContact CB-CD2 4.35Å; C475-Y728 HydrophobicContact CB-CG 4.37Å; C475-Y728 WeakPolarHBondContact SG-CE2 3.28Å; C475-Y789 WeakPolarHBondContact O-CA 3.45Å; C475-V790 PolarHBondContact N-O 2.98Å; C475-V790 PolarHBondContact O-N 3.08Å
476	L	86.3	Confident	78.7	Confident	3 Å²	3	36 Å²	36	2%	0.016	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	112.7	170.2	165.6	55.8	0	0	0	109.5	N478 K479 E480 E481 D553 I788 Y789	L476-N478 VanDerWaalsContact C-N 3.28Å; L476-N478 HydrophobicContact CD1-CB 4.25Å; L476-N478 PolarHBondContact O-N 3.02Å; L476-K479 HydrophobicContact CD2-CB 3.83Å; L476-K479 HydrophobicContact CD2-CD 4Å; L476-K479 HydrophobicContact CD2-CG 4.17Å; L476-K479 HydrophobicContact CG-CB 4.13Å; L476-E480 PolarHBondContact O-N 3.22Å; L476-E480 VanDerWaalsContact O-N 3.13Å; L476-E481 PolarHBondContact N-O 3.35Å; L476-D553 HydrophobicContact CD2-CB 3.81Å; L476-I788 HydrophobicContact CD1-CG2 4.23Å; L476-Y789 HydrophobicContact CB-CD1 4.11Å; L476-Y789 HydrophobicContact CB-CE1 3.97Å; L476-Y789 HydrophobicContact CD1-CD1 4.07Å; L476-Y789 HydrophobicContact CD1-CE1 3.41Å; L476-Y789 VanDerWaalsContact CD1-CE1 3.41Å; L476-Y789 HydrophobicContact CG-CE1 4.15Å
477	L	83.7	Confident	77.1	Confident	5 Å²	5	35.3 Å²	35.3	3%	0.026	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-26	-171.5	-66.7	172.7	0	0	0	113.9	A725 Y728 P787 I788 V790	L477-A725 HydrophobicContact CD1-CB 3.81Å; L477-A725 HydrophobicContact CD2-CB 3.83Å; L477-Y728 HydrophobicContact CD2-CD2 4.44Å; L477-P787 HydrophobicContact CD1-CB 4.19Å; L477-I788 VanDerWaalsContact CB-O 3.31Å; L477-I788 WeakPolarHBondContact CB-O 3.31Å; L477-I788 WeakPolarHBondContact CG-O 3.41Å; L477-I788 PolarHBondContact N-O 2.95Å; L477-V790 HydrophobicContact CD1-CG2 4.34Å; L477-V790 HydrophobicContact CD2-CG2 4.05Å; L477-V790 HydrophobicContact CG-CG2 4.42Å
478	N	77.2	Confident	75.7	Confident	78 Å²	78	42 Å²	42	42%	0.417	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-28	-175.5	-70.4	-7.7	0	0	0	114.1	L476 Q721	L476-N478 VanDerWaalsContact C-N 3.28Å; L476-N478 HydrophobicContact CD1-CB 4.25Å; L476-N478 PolarHBondContact O-N 3.02Å; N478-Q721 PolarHBondContact OD1-NE2 2.67Å
479	K	73.2	Confident	73.6	Confident	94 Å²	94	41.2 Å²	41.2	41%	0.409	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-1.3	-178.6	-76.2	-179.4	170.3	154	0	114.3	L476 E481 N551 D553	L476-K479 HydrophobicContact CD2-CB 3.83Å; L476-K479 HydrophobicContact CD2-CD 4Å; L476-K479 HydrophobicContact CD2-CG 4.17Å; L476-K479 HydrophobicContact CG-CB 4.13Å; K479-E481 HydrophobicContact CB-CG 4.13Å; K479-E481 PolarHBondContact O-N 3.25Å; K479-E481 VanDerWaalsContact O-N 3.16Å; K479-N551 PolarHBondContact NZ-OD1 2.97Å; K479-N551 VanDerWaalsContact NZ-OD1 3.12Å; K479-D553 WeakPolarHBondContact CD-OD2 3.36Å; K479-D553 WeakPolarHBondContact CE-OD2 3.34Å; K479-D553 VanDerWaalsContact NZ-CG 3.33Å; K479-D553 IonicContact NZ-OD1 3.82Å; K479-D553 PolarHBondContact NZ-OD1 3.13Å; K479-D553 IonicContact NZ-OD2 2.87Å; K479-D553 PolarHBondContact NZ-OD2 3.31Å
480	E	71.4	Confident	71	Confident	78 Å²	78	44 Å²	44	36%	0.364	22%	0.22	S	C	.	.			trans	67.7	7	179.7	-45.9	-152	172.6	0	0	114.8	L476 Y720 R724	L476-E480 PolarHBondContact O-N 3.22Å; L476-E480 VanDerWaalsContact O-N 3.13Å; E480-Y720 PolarHBondContact OE1-OH 2.67Å; E480-Y720 VanDerWaalsContact OE1-OH 3.09Å; E480-R724 VanDerWaalsContact CB-NH2 3.26Å; E480-R724 VanDerWaalsContact CG-CZ 3.43Å; E480-R724 VanDerWaalsContact CG-NH2 3.35Å; E480-R724 IonicContact OE1-CZ 3.95Å; E480-R724 IonicContact OE1-NH1 3.07Å; E480-R724 PolarHBondContact OE1-NH1 3.4Å; E480-R724 IonicContact OE1-NH2 2.91Å; E480-R724 IonicContact OE2-CZ 3.25Å; E480-R724 IonicContact OE2-NH1 3.05Å; E480-R724 PolarHBondContact OE2-NH1 2.66Å; E480-R724 IonicContact OE2-NH2 2.88Å; E480-R724 PolarHBondContact OE2-NH2 2.98Å
481	E	73.8	Confident	68.5	Low	30 Å²	30	52.8 Å²	52.8	14%	0.14	25%	0.253	C	S	.	.			trans	-81.2	128.5	-176.6	-61.4	-175.6	122.5	0	0	111.5	C475 L476 K479 Y483 K543 N551	C475-E481 WeakPolarHBondContact CA-O 3.34Å; L476-E481 PolarHBondContact N-O 3.35Å; K479-E481 HydrophobicContact CB-CG 4.13Å; K479-E481 PolarHBondContact O-N 3.25Å; K479-E481 VanDerWaalsContact O-N 3.16Å; E481-Y483 HydrophobicContact CB-CD2 4.46Å; E481-Y483 HydrophobicContact CB-CE2 3.73Å; E481-Y483 PolarHBondContact OE2-OH 2.6Å; E481-K543 IonicContact OE1-NZ 3.16Å; E481-K543 PolarHBondContact OE1-NZ 3.27Å; E481-N551 PolarHBondContact OE2-ND2 3.2Å; E481-N551 VanDerWaalsContact OE2-ND2 3.07Å
482	V	76.5	Confident	65.8	Low	38 Å²	38	59.9 Å²	59.9	23%	0.23	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.4	172.8	179.5	0	0	0	0	108.9	S473 C475 Y728	S473-V482 WeakPolarHBondContact OG-CG1 3.44Å; C475-V482 HydrophobicContact CB-CG2 4.14Å; V482-Y728 HydrophobicContact CG2-CE1 3.98Å
483	Y	74.7	Confident	63.2	Low	19 Å²	19	61.7 Å²	61.7	8%	0.075	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	134	179.2	-63.1	-91.2	0	0	0	109.8	S473 C474 E481 L545 F554	S473-Y483 CarbonylContact C-O 3.53Å; S473-Y483 WeakPolarHBondContact CA-O 3.38Å; S473-Y483 WeakPolarHBondContact CB-O 3.3Å; S473-Y483 PolarHBondContact OG-O 2.86Å; C474-Y483 PolarHBondContact N-O 3.34Å; C474-Y483 PolarHBondContact O-N 2.93Å; E481-Y483 HydrophobicContact CB-CD2 4.46Å; E481-Y483 HydrophobicContact CB-CE2 3.73Å; E481-Y483 PolarHBondContact OE2-OH 2.6Å; Y483-L545 HydrophobicContact CD1-CD1 4.04Å; Y483-L545 HydrophobicContact CD1-CG 4.21Å; Y483-F554 HydrophobicContact CD1-CD2 4.06Å; Y483-F554 AromaticContact CD1-CE2 3.88Å; Y483-F554 HydrophobicContact CD1-CE2 3.88Å; Y483-F554 HydrophobicContact CD1-CG 4.5Å; Y483-F554 HydrophobicContact CD1-CZ 4.17Å; Y483-F554 AromaticContact CD2-CD2 3.62Å; Y483-F554 HydrophobicContact CD2-CD2 3.62Å; Y483-F554 AromaticContact CD2-CE2 3.66Å; Y483-F554 HydrophobicContact CD2-CE2 3.66Å; Y483-F554 HydrophobicContact CE1-CD2 4.06Å; Y483-F554 HydrophobicContact CE1-CE2 4.34Å; Y483-F554 HydrophobicContact CE1-CG 4.19Å; Y483-F554 AromaticContact CE2-CD2 3.61Å; Y483-F554 HydrophobicContact CE2-CD2 3.61Å; Y483-F554 HydrophobicContact CE2-CE2 4.14Å; Y483-F554 HydrophobicContact CE2-CG 4.3Å; Y483-F554 AromaticContact CG-CD2 3.85Å; Y483-F554 HydrophobicContact CG-CD2 3.85Å; Y483-F554 AromaticContact CG-CE2 3.5Å; Y483-F554 HydrophobicContact CG-CE2 3.5Å; Y483-F554 HydrophobicContact CG-CZ 4.12Å; Y483-F554 AromaticContact CZ-CD2 3.83Å
484	L	73.5	Confident	60.6	Low	64 Å²	64	67.6 Å²	67.6	34%	0.335	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	122.7	169.7	-78.8	159.7	0	0	0	108.6	Y472 I542 L545	Y472-L484 HydrophobicContact CD1-CD2 4.45Å; Y472-L484 HydrophobicContact CE1-CD2 3.87Å; L484-I542 HydrophobicContact CD1-CG2 4.39Å; L484-L545 WeakPolarHBondContact O-CD1 3.19Å
485	C	67.3	Low	58	Low	16 Å²	16	73.1 Å²	73.1	11%	0.108	38%	0.379	C	S	.	.			trans	-103.9	-13	-169	-61.1	0	0	0	0	113.7	L471 Y472 L623	L471-C485 HydrophobicContact CD2-CB 4.42Å; L471-C485 HydrophobicContact CG-CB 4.04Å; L471-C485 WeakPolarHBondContact O-CB 3.34Å; Y472-C485 PolarHBondContact O-N 3.11Å; C485-L623 HydrophobicContact CB-CD1 4.35Å
486	D	61.5	Low	55.3	Low	24 Å²	24	80.5 Å²	80.5	13%	0.128	42%	0.419	C	S	.	.			trans	-89.9	112.3	177.5	-160.1	-9.7	0	0	0	111.1	Y472 Y488 K796	Y472-D486 HydrophobicContact CD2-CB 4.39Å; D486-Y488 WeakPolarHBondContact OD1-CD2 3.32Å; D486-K796 IonicContact OD1-NZ 3.1Å; D486-K796 WeakPolarHBondContact OD2-CE 3.42Å; D486-K796 IonicContact OD2-NZ 3.29Å; D486-K796 PolarHBondContact OD2-NZ 2.87Å
487	T	47.9	Very low	52.5	Low	68 Å²	68	87.9 Å²	87.9	42%	0.417	46%	0.458	S	S	.	.			trans	-90.5	-6.8	-171.1	49.6	0	0	0	0	114.4	T489 T490	T487-T489 VanDerWaalsContact C-N 3.28Å; T487-T489 PolarHBondContact O-N 3.49Å; T487-T490 PolarHBondContact O-N 3.19Å
488	Y	44.6	Very low	49.8	Very low	181 Å²	181	96.3 Å²	96.3	71%	0.71	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-14.5	-173.8	-74.5	-77.8	0	0	0	114.9	D486	D486-Y488 WeakPolarHBondContact OD1-CD2 3.32Å
489	T	35.8	Very low	47.5	Very low	68 Å²	68	99.4 Å²	99.4	42%	0.417	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-10.6	179.6	45.5	0	0	0	0	114.9	T487	T487-T489 VanDerWaalsContact C-N 3.28Å; T487-T489 PolarHBondContact O-N 3.49Å
490	T	30.5	Very low	45.2	Very low	76 Å²	76	99.9 Å²	99.9	47%	0.466	53%	0.53	S	S	.	.	S	Bend	trans	-104.9	-9.9	-163.7	-22.1	0	0	0	0	115	T487	T487-T490 PolarHBondContact O-N 3.19Å
491	Y	31.8	Very low	43	Very low	196 Å²	196	105.4 Å²	105.4	77%	0.769	55%	0.549	S	S	*	.	S	Bend	trans	-91.9	-4.8	-174.8	-86.1	-81.9	0	0	0	115.5
492	N	30.5	Very low	40.7	Very low	153 Å²	153	110.6 Å²	110.6	82%	0.818	58%	0.577	S	S	*	*	S	Bend	trans	-118.2	17.4	-176.4	-72.8	-10.1	0	0	0	114
493	T	29	Very low	38.3	Very low	100 Å²	100	114.3 Å²	114.3	61%	0.613	60%	0.6	S	S	*	*	S	Bend	trans	-129.5	26.6	-169.6	57.2	0	0	0	0	114.8
494	T	29.8	Very low	36	Very low	127 Å²	127	119 Å²	119	78%	0.779	63%	0.631	S	S	*	*	S	Bend	trans	-134.6	40.8	178.5	62.2	0	0	0	0	114.1
495	T	32.1	Very low	33.8	Very low	118 Å²	118	121.5 Å²	121.5	72%	0.724	65%	0.649	S	S	*	*	S	Bend	trans	-136.5	157.3	152.8	48.3	0	0	0	0	107.4
496	D	29.4	Very low	32	Very low	155 Å²	155	126.8 Å²	126.8	83%	0.829	68%	0.676	S	S	*	*			trans	76.9	40.8	177.7	-46.9	-18.6	0	0	0	116.8	H498	D496-H498 PolarHBondContact O-N 3.16Å
497	N	27.3	Very low	30.4	Very low	158 Å²	158	131.7 Å²	131.7	85%	0.845	70%	0.703	S	S	*	*			trans	-72.1	100.3	145.4	-85.7	-24.1	0	0	0	108.7
498	H	29	Very low	29.5	Very low	181 Å²	181	134 Å²	134	84%	0.838	72%	0.718	S	S	*	*			trans	167.1	91.5	143	-90.8	-63.9	0	0	0	110.5	D496	D496-H498 PolarHBondContact O-N 3.16Å
499	T	27.9	Very low	28.7	Very low	144 Å²	144	131.8 Å²	131.8	88%	0.883	72%	0.724	S	S	*	*			trans	-170	116.3	135.9	12.7	0	0	0	0	110.6
500	T	25.5	Very low	28.2	Very low	104 Å²	104	133.3 Å²	133.3	64%	0.638	73%	0.733	S	S	*	*			trans	-68.2	-177.2	159.5	19.6	0	0	0	0	110.9
501	Y	25.4	Very low	28.1	Very low	194 Å²	194	139.4 Å²	139.4	76%	0.761	75%	0.749	S	S	*	*			trans	87	108.8	170.8	-49.1	-64.3	0	0	0	113.6
502	N	24.9	Very low	27.8	Very low	139 Å²	139	136.8 Å²	136.8	74%	0.743	75%	0.749	S	S	*	*				91.1	131	66.5	-79.6	1.2	0	0	0	112
503	T	26.5	Very low	27.5	Very low	115 Å²	115	135 Å²	135	71%	0.706	74%	0.744	S	S	*	*			trans	-2	145.2	150.3	50.1	0	0	0	0	120.2
504	T	26.5	Very low	27.3	Very low	119 Å²	119	136 Å²	136	73%	0.73	75%	0.75	S	S	*	*			trans	70.7	133.4	151.1	48.1	0	0	0	0	119.6
505	T	27.6	Very low	27.1	Very low	116 Å²	116	135.5 Å²	135.5	71%	0.712	75%	0.747	S	S	*	*			trans	61	147.8	151.3	51.5	0	0	0	0	117.5
506	D	28.7	Very low	26.7	Very low	126 Å²	126	136.3 Å²	136.3	67%	0.674	75%	0.747	S	S	*	*			cis	-159.2	163.1	-7.2	-101.9	-22.5	0	0	0	110.3
507	N	27.5	Very low	26.5	Very low	128 Å²	128	135.3 Å²	135.3	68%	0.684	74%	0.741	S	S	*	*			trans	40.9	136.1	155.8	-68.5	-45.9	0	0	0	123.8
508	P	29.4	Very low	26.5	Very low	115 Å²	115	137 Å²	137	75%	0.747	74%	0.743	S	S	*	*			trans	-105.8	126.3	178.2	37.9	-29.6	0	0	0	115.4
509	T	26.8	Very low	26.4	Very low	135 Å²	135	134.6 Å²	134.6	83%	0.828	74%	0.742	S	S	*	*			trans	-153.8	135	153.9	51.3	0	0	0	0	105.2
510	T	26.3	Very low	26.4	Very low	100 Å²	100	134.7 Å²	134.7	61%	0.613	74%	0.735	S	S	*	*				-170.3	177.3	50.1	-48.9	0	0	0	0	109
511	Y	28.5	Very low	26.6	Very low	204 Å²	204	139.4 Å²	139.4	80%	0.8	74%	0.743	S	S	*	*			trans	88.4	81.2	162	-53.8	-67	0	0	0	119.7
512	N	25.4	Very low	26.7	Very low	141 Å²	141	136.3 Å²	136.3	75%	0.754	74%	0.74	S	S	*	*				27.5	136.7	108.9	-71.2	0.3	0	0	0	121.6
513	T	25	Very low	27.1	Very low	117 Å²	117	135.8 Å²	135.8	72%	0.718	74%	0.737	S	S	*	*			trans	79.6	119.2	137.6	47.1	0	0	0	0	121.7
514	T	24.6	Very low	27.7	Very low	120 Å²	120	135.7 Å²	135.7	74%	0.736	73%	0.728	S	S	*	*			trans	77.6	133.2	140	49.2	0	0	0	0	120.4
515	T	24.8	Very low	28.2	Very low	117 Å²	117	133.3 Å²	133.3	72%	0.718	72%	0.716	S	S	*	*			trans	68.6	125.4	156.6	44.9	0	0	0	0	119
516	D	24.1	Very low	28.5	Very low	135 Å²	135	133.2 Å²	133.2	72%	0.722	71%	0.711	S	S	*	*			trans	88.4	137.5	145.2	-54.3	-15.4	0	0	0	121.9
517	N	25.6	Very low	29	Very low	133 Å²	133	131.9 Å²	131.9	71%	0.711	70%	0.704	S	S	*	*			trans	75	106.2	152.3	-59.8	-33	0	0	0	120.4	T519	N517-T519 PolarHBondContact O-N 3.38Å; N517-T519 VanDerWaalsContact O-N 3.09Å
518	H	26.7	Very low	29.6	Very low	193 Å²	193	128.9 Å²	128.9	89%	0.894	69%	0.688	S	S	*	*			trans	-2.4	95.6	138	-70.5	-82.1	0	0	0	116
519	T	26.2	Very low	29.8	Very low	131 Å²	131	125.6 Å²	125.6	80%	0.804	67%	0.668	S	S	*	*			trans	-109.6	109.3	162.4	35.7	0	0	0	0	109.7	N517	N517-T519 PolarHBondContact O-N 3.38Å; N517-T519 VanDerWaalsContact O-N 3.09Å
520	I	27.8	Very low	30.3	Very low	146 Å²	146	123.9 Å²	123.9	75%	0.749	65%	0.654	S	S	*	*			trans	-61.6	136.2	175.2	-69.1	158.6	0	0	0	108.8	N522	I520-N522 PolarHBondContact O-N 2.86Å
521	Y	30.4	Very low	31	Very low	203 Å²	203	124.4 Å²	124.4	80%	0.796	65%	0.645	S	S	*	*			trans	-65.6	91.6	175.5	-100.7	-96.8	0	0	0	110.9	D523	Y521-D523 VanDerWaalsContact C-N 3.28Å; Y521-D523 PolarHBondContact O-N 2.71Å
522	N	26.6	Very low	31.6	Very low	130 Å²	130	117.5 Å²	117.5	70%	0.695	62%	0.621	S	S	*	*			trans	-73.8	74.7	173.9	-84.4	-19.8	0	0	0	111.4	I520	I520-N522 PolarHBondContact O-N 2.86Å
523	D	34.1	Very low	32	Very low	128 Å²	128	114.5 Å²	114.5	68%	0.684	61%	0.605	S	S	*	*			trans	-101.5	7.6	172.1	-117.8	-2.8	0	0	0	112.7	Y521	Y521-D523 VanDerWaalsContact C-N 3.28Å; Y521-D523 PolarHBondContact O-N 2.71Å
524	H	39.7	Very low	32.6	Very low	113 Å²	113	114.8 Å²	114.8	52%	0.523	60%	0.601	S	S	.	*	S	Bend	trans	-97.6	-16.6	-175.6	-87.3	-81.2	0	0	0	115
525	S	36.1	Very low	33.2	Very low	69 Å²	69	111.8 Å²	111.8	48%	0.483	58%	0.58	S	S	.	*	H	α-helix	trans	-75.6	-26.9	-172.4	51.1	0	0	0	0	115.6	S529	S525-S529 WeakPolarHBondContact O-CB 3.31Å; S525-S529 PolarHBondContact O-OG 2.92Å
526	N	34.8	Very low	33.9	Very low	113 Å²	113	108.3 Å²	108.3	60%	0.604	56%	0.561	S	S	*	*	H	α-helix	trans	-88.2	-10.4	-166.5	-73.7	-22.8	0	0	0	115.8	N530	N526-N530 PolarHBondContact O-ND2 3.47Å
527	N	39	Very low	34.6	Very low	98 Å²	98	110 Å²	110	52%	0.524	56%	0.562	S	S	.	*	H	α-helix	trans	-102.8	-35.2	176.1	-81.7	-41.9	0	0	0	113	N530 R531	N527-N530 PolarHBondContact O-N 3.31Å; N527-R531 PolarHBondContact O-N 2.99Å
528	D	39.5	Very low	35.2	Very low	66 Å²	66	111.8 Å²	111.8	35%	0.353	57%	0.566	S	S	.	*	H	α-helix	trans	-73.4	-36.6	-178.5	-64.7	-25.7	0	0	0	111.3	N530 R531 I532	D528-N530 VanDerWaalsContact C-N 3.27Å; D528-N530 PolarHBondContact O-N 3.41Å; D528-R531 PolarHBondContact O-N 3.34Å; D528-R531 VanDerWaalsContact O-N 3.14Å; D528-I532 VanDerWaalsContact O-CG1 3.31Å; D528-I532 WeakPolarHBondContact O-CG1 3.49Å; D528-I532 PolarHBondContact O-N 3.38Å
529	S	33.9	Very low	35.7	Very low	46 Å²	46	106.6 Å²	106.6	32%	0.322	55%	0.545	S	S	.	.	H	α-helix	trans	-54.7	-38.9	169.2	47.2	0	0	0	0	113.1	S525 N533	S525-S529 WeakPolarHBondContact O-CB 3.31Å; S525-S529 PolarHBondContact O-OG 2.92Å; S529-N533 VanDerWaalsContact O-CB 3.25Å; S529-N533 WeakPolarHBondContact O-CB 3.45Å; S529-N533 VanDerWaalsContact O-CG 3.24Å; S529-N533 PolarHBondContact O-N 2.8Å; S529-N533 PolarHBondContact O-ND2 2.84Å; S529-N533 VanDerWaalsContact O-ND2 3.11Å
530	N	36.7	Very low	36.1	Very low	98 Å²	98	105.3 Å²	105.3	52%	0.524	54%	0.541	S	S	.	.	H	α-helix	trans	-73.5	-32.9	177.1	-80.2	-53.9	0	0	0	113.4	N526 N527 D528 L534	N526-N530 PolarHBondContact O-ND2 3.47Å; N527-N530 PolarHBondContact O-N 3.31Å; D528-N530 VanDerWaalsContact C-N 3.27Å; D528-N530 PolarHBondContact O-N 3.41Å; N530-L534 PolarHBondContact O-N 2.79Å; N530-L534 VanDerWaalsContact O-N 3.16Å
531	R	41	Very low	36.8	Very low	112 Å²	112	106.4 Å²	106.4	42%	0.423	54%	0.537	S	S	.	.	H	α-helix	trans	-70	-44	173.4	-90.6	179.1	148	-173.2	-11.9	112.1	N527 D528 N533 L534 L535	N527-R531 PolarHBondContact O-N 2.99Å; D528-R531 PolarHBondContact O-N 3.34Å; D528-R531 VanDerWaalsContact O-N 3.14Å; R531-N533 VanDerWaalsContact C-N 3.3Å; R531-N533 PolarHBondContact O-N 2.98Å; R531-L534 PolarHBondContact O-N 2.68Å; R531-L535 PolarHBondContact O-N 2.71Å; R531-L535 VanDerWaalsContact O-N 3.16Å
532	I	41.3	Very low	37.2	Very low	59 Å²	59	99 Å²	99	30%	0.303	51%	0.51	S	S	.	.	H	α-helix	trans	-62.6	-40.2	176	-65.2	164.3	0	0	0	110.2	D528 L534 L535 S536	D528-I532 VanDerWaalsContact O-CG1 3.31Å; D528-I532 WeakPolarHBondContact O-CG1 3.49Å; D528-I532 PolarHBondContact O-N 3.38Å; I532-L534 VanDerWaalsContact C-N 3.33Å; I532-L534 PolarHBondContact O-N 3.41Å; I532-L535 PolarHBondContact O-N 3.13Å; I532-S536 WeakPolarHBondContact O-CB 3.2Å; I532-S536 PolarHBondContact O-N 3.21Å; I532-S536 PolarHBondContact O-OG 3.37Å
533	N	34.8	Very low	37.7	Very low	77 Å²	77	99.1 Å²	99.1	41%	0.412	51%	0.505	S	S	.	.	H	α-helix	trans	-70.5	-19.6	176.1	-79.1	-31.1	0	0	0	115.3	S529 R531 S536 K537	S529-N533 VanDerWaalsContact O-CB 3.25Å; S529-N533 WeakPolarHBondContact O-CB 3.45Å; S529-N533 VanDerWaalsContact O-CG 3.24Å; S529-N533 PolarHBondContact O-N 2.8Å; S529-N533 PolarHBondContact O-ND2 2.84Å; S529-N533 VanDerWaalsContact O-ND2 3.11Å; R531-N533 VanDerWaalsContact C-N 3.3Å; R531-N533 PolarHBondContact O-N 2.98Å; N533-S536 WeakPolarHBondContact CA-OG 3.07Å; N533-K537 WeakPolarHBondContact O-CB 3.03Å; N533-K537 WeakPolarHBondContact O-CD 3.49Å; N533-K537 VanDerWaalsContact O-CG 3.24Å; N533-K537 WeakPolarHBondContact O-CG 3.37Å; N533-K537 PolarHBondContact O-N 3.32Å
534	L	37.6	Very low	38	Very low	124 Å²	124	99.7 Å²	99.7	65%	0.649	50%	0.498	S	S	*	.	H	α-helix	trans	-81.1	-40.2	172.1	-90.7	158.6	0	0	0	111.4	N530 R531 I532 S536	N530-L534 PolarHBondContact O-N 2.79Å; N530-L534 VanDerWaalsContact O-N 3.16Å; R531-L534 PolarHBondContact O-N 2.68Å; I532-L534 VanDerWaalsContact C-N 3.33Å; I532-L534 PolarHBondContact O-N 3.41Å; L534-S536 VanDerWaalsContact C-N 3.35Å
535	L	37.4	Very low	38.3	Very low	56 Å²	56	96.9 Å²	96.9	29%	0.293	49%	0.487	S	S	.	.	H	α-helix	trans	-66.4	-35.6	173.6	-72.7	164	0	0	0	112.2	R531 I532 I542	R531-L535 PolarHBondContact O-N 2.71Å; R531-L535 VanDerWaalsContact O-N 3.16Å; I532-L535 PolarHBondContact O-N 3.13Å; L535-I542 HydrophobicContact CB-CD1 4.07Å; L535-I542 WeakPolarHBondContact O-CD1 3.38Å
536	S	38.6	Very low	38.5	Very low	44 Å²	44	102.3 Å²	102.3	31%	0.308	50%	0.502	S	S	.	.	H	α-helix	trans	-81.6	-21.2	-177.1	70.8	0	0	0	0	115.3	I532 N533 L534	I532-S536 WeakPolarHBondContact O-CB 3.2Å; I532-S536 PolarHBondContact O-N 3.21Å; I532-S536 PolarHBondContact O-OG 3.37Å; N533-S536 WeakPolarHBondContact CA-OG 3.07Å; L534-S536 VanDerWaalsContact C-N 3.35Å
537	K	39.6	Very low	39.1	Very low	172 Å²	172	99.3 Å²	99.3	75%	0.748	49%	0.486	S	S	*	.	H	α-helix	trans	-83.9	-15	-175.8	-83.6	-178.7	176.1	-178.1	0	115.4	N533	N533-K537 WeakPolarHBondContact O-CB 3.03Å; N533-K537 WeakPolarHBondContact O-CD 3.49Å; N533-K537 VanDerWaalsContact O-CG 3.24Å; N533-K537 WeakPolarHBondContact O-CG 3.37Å; N533-K537 PolarHBondContact O-N 3.32Å
538	E	37.7	Very low	39.2	Very low	169 Å²	169	97.7 Å²	97.7	79%	0.79	48%	0.48	S	S	*	.	H	α-helix	trans	-118	-8.8	-178.7	-65.3	-173	161.7	0	0	114.1
539	N	36.9	Very low	39.7	Very low	85 Å²	85	102.4 Å²	102.4	46%	0.455	51%	0.505	S	S	.	.			trans	-129	107.8	-177.3	-77.1	-50	0	0	0	113.5	Y541	N539-Y541 PolarHBondContact O-N 2.96Å
540	S	35.5	Very low	40.7	Very low	103 Å²	103	102.1 Å²	102.1	72%	0.72	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	20.8	-179.3	55.3	0	0	0	0	115.9
541	Y	41.7	Very low	42.2	Very low	169 Å²	169	99.7 Å²	99.7	66%	0.663	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.8	7.7	-168	-63.2	-77.6	0	0	0	114.8	N539 K543	N539-Y541 PolarHBondContact O-N 2.96Å; Y541-K543 PolarHBondContact O-N 3.1Å; Y541-K543 VanDerWaalsContact O-N 3.11Å
542	I	38.7	Very low	43.9	Very low	47 Å²	47	102.6 Å²	102.6	24%	0.241	50%	0.502	C	S	.	.			trans	-78.2	97.1	177.8	-57.2	-179.1	0	0	0	110	L484 L535 Y544	L484-I542 HydrophobicContact CD1-CG2 4.39Å; L535-I542 HydrophobicContact CB-CD1 4.07Å; L535-I542 WeakPolarHBondContact O-CD1 3.38Å; I542-Y544 PolarHBondContact O-N 3.07Å
543	K	37.8	Very low	45.7	Very low	133 Å²	133	101.7 Å²	101.7	58%	0.578	50%	0.498	S	S	*	.			trans	-79.1	110.4	166.6	-76.4	178.3	-178.1	167.9	0	109.7	E481 Y541 L545	E481-K543 IonicContact OE1-NZ 3.16Å; E481-K543 PolarHBondContact OE1-NZ 3.27Å; Y541-K543 PolarHBondContact O-N 3.1Å; Y541-K543 VanDerWaalsContact O-N 3.11Å; K543-L545 PolarHBondContact O-N 3.27Å
544	Y	39.8	Very low	47.9	Very low	140 Å²	140	98.2 Å²	98.2	55%	0.549	48%	0.479	S	S	.	.			trans	-60.5	129	163.7	-61.7	-85.7	0	0	0	109.3	I542 K546	I542-Y544 PolarHBondContact O-N 3.07Å; Y544-K546 VanDerWaalsContact C-N 3.29Å; Y544-K546 PolarHBondContact O-N 3Å
545	L	46.9	Very low	50.1	Low	54 Å²	54	95.7 Å²	95.7	28%	0.283	46%	0.461	S	S	.	.			trans	-66.9	82.4	-180	-101.6	152.9	0	0	0	111.2	Y483 L484 K543 M550	Y483-L545 HydrophobicContact CD1-CD1 4.04Å; Y483-L545 HydrophobicContact CD1-CG 4.21Å; L484-L545 WeakPolarHBondContact O-CD1 3.19Å; K543-L545 PolarHBondContact O-N 3.27Å; L545-M550 HydrophobicContact CD2-CE 4.16Å
546	K	39.6	Very low	52.4	Low	183 Å²	183	95.4 Å²	95.4	80%	0.796	46%	0.458	S	S	*	.			trans	-69.4	127.1	149	-72.5	-174.9	175.7	-178.3	0	106.4	Y544 P548	Y544-K546 VanDerWaalsContact C-N 3.29Å; Y544-K546 PolarHBondContact O-N 3Å; K546-P548 WeakPolarHBondContact O-CD 3.38Å
547	L	46.5	Very low	54.7	Low	51 Å²	51	93.3 Å²	93.3	27%	0.267	44%	0.444	S	S	.	.			trans	-85.5	4.5	-167.4	-89	145.1	0	0	0	118.9	M550 Y649	L547-M550 HydrophobicContact CD2-CE 3.55Å; L547-Y649 HydrophobicContact CB-CD2 4.33Å; L547-Y649 HydrophobicContact CD2-CD2 3.87Å; L547-Y649 HydrophobicContact CD2-CE2 4.03Å; L547-Y649 HydrophobicContact CG-CD2 4.5Å
548	P	41.5	Very low	57	Low	64 Å²	64	85.1 Å²	85.1	42%	0.416	41%	0.408	S	S	.	.	S	Bend	trans	-82.2	142.7	165.5	33.8	-29	0	0	0	111	K546	K546-P548 WeakPolarHBondContact O-CD 3.38Å
549	D	49.3	Very low	59.5	Low	164 Å²	164	77.3 Å²	77.3	88%	0.877	37%	0.372	S	S	*	.	S	Bend	trans	61.2	73.1	-178.8	-63.2	-15.1	0	0	0	116.8	N551	D549-N551 PolarHBondContact O-N 2.95Å
550	M	56.7	Low	62.1	Low	40 Å²	40	73.3 Å²	73.3	20%	0.197	35%	0.35	C	S	.	.			trans	-51.5	102.3	160.4	-76.4	-82	143.3	0	0	111.5	L545 L547 K552 F554	L545-M550 HydrophobicContact CD2-CE 4.16Å; L547-M550 HydrophobicContact CD2-CE 3.55Å; M550-K552 PolarHBondContact O-N 2.82Å; M550-F554 HydrophobicContact CE-CD1 4.26Å; M550-F554 HydrophobicContact CE-CE1 4.07Å; M550-F554 HydrophobicContact SD-CD1 3.56Å; M550-F554 VanDerWaalsContact SD-CD1 3.56Å; M550-F554 HydrophobicContact SD-CE1 3.88Å
551	N	66.4	Low	64.7	Low	48 Å²	48	68.5 Å²	68.5	26%	0.257	32%	0.317	S	S	.	.			trans	-44.6	131.4	169.6	-175.4	4.9	0	0	0	109.7	K479 E481 D549 D553 F554 R555	K479-N551 PolarHBondContact NZ-OD1 2.97Å; K479-N551 VanDerWaalsContact NZ-OD1 3.12Å; E481-N551 PolarHBondContact OE2-ND2 3.2Å; E481-N551 VanDerWaalsContact OE2-ND2 3.07Å; D549-N551 PolarHBondContact O-N 2.95Å; N551-D553 PolarHBondContact O-N 2.87Å; N551-D553 VanDerWaalsContact O-N 3.16Å; N551-F554 HydrophobicContact CB-CB 4.27Å; N551-F554 WeakPolarHBondContact O-CA 3.36Å; N551-F554 WeakPolarHBondContact O-CB 3.49Å; N551-F554 PolarHBondContact O-N 2.9Å; N551-R555 PolarHBondContact O-N 2.82Å
552	K	76.9	Confident	67.1	Low	172 Å²	172	60.5 Å²	60.5	75%	0.748	29%	0.285	S	S	*	.	H	α-helix	trans	-52.5	-44.4	-170.6	-173.5	-179.1	177.3	-176.1	0	111.8	M550 F554 R555 E556	M550-K552 PolarHBondContact O-N 2.82Å; K552-F554 VanDerWaalsContact C-N 3.33Å; K552-F554 PolarHBondContact O-N 2.97Å; K552-R555 PolarHBondContact O-N 3.44Å; K552-E556 PolarHBondContact O-N 2.91Å
553	D	79.9	Confident	69.6	Low	40 Å²	40	58.3 Å²	58.3	21%	0.214	27%	0.274	C	S	.	.	H	α-helix	trans	-62.9	-37.8	178.7	-45.1	2.5	0	0	0	111.7	L476 K479 N551 E556 F557 Y789	L476-D553 HydrophobicContact CD2-CB 3.81Å; K479-D553 WeakPolarHBondContact CD-OD2 3.36Å; K479-D553 WeakPolarHBondContact CE-OD2 3.34Å; K479-D553 VanDerWaalsContact NZ-CG 3.33Å; K479-D553 IonicContact NZ-OD1 3.82Å; K479-D553 PolarHBondContact NZ-OD1 3.13Å; K479-D553 IonicContact NZ-OD2 2.87Å; K479-D553 PolarHBondContact NZ-OD2 3.31Å; N551-D553 PolarHBondContact O-N 2.87Å; N551-D553 VanDerWaalsContact O-N 3.16Å; D553-E556 WeakPolarHBondContact O-CB 3.3Å; D553-E556 PolarHBondContact O-N 3.4Å; D553-F557 PolarHBondContact O-N 3.01Å; D553-Y789 PolarHBondContact O-OH 3.18Å
554	F	80.5	Confident	72.2	Confident	4 Å²	4	52 Å²	52	2%	0.018	25%	0.247	C	C	.	.	H	α-helix	trans	-73	-32.8	177.8	-171.1	-105.2	0	0	0	112.2	Y483 M550 N551 K552 F557 L558 L623	Y483-F554 HydrophobicContact CD1-CD2 4.06Å; Y483-F554 AromaticContact CD1-CE2 3.88Å; Y483-F554 HydrophobicContact CD1-CE2 3.88Å; Y483-F554 HydrophobicContact CD1-CG 4.5Å; Y483-F554 HydrophobicContact CD1-CZ 4.17Å; Y483-F554 AromaticContact CD2-CD2 3.62Å; Y483-F554 HydrophobicContact CD2-CD2 3.62Å; Y483-F554 AromaticContact CD2-CE2 3.66Å; Y483-F554 HydrophobicContact CD2-CE2 3.66Å; Y483-F554 HydrophobicContact CE1-CD2 4.06Å; Y483-F554 HydrophobicContact CE1-CE2 4.34Å; Y483-F554 HydrophobicContact CE1-CG 4.19Å; Y483-F554 AromaticContact CE2-CD2 3.61Å; Y483-F554 HydrophobicContact CE2-CD2 3.61Å; Y483-F554 HydrophobicContact CE2-CE2 4.14Å; Y483-F554 HydrophobicContact CE2-CG 4.3Å; Y483-F554 AromaticContact CG-CD2 3.85Å; Y483-F554 HydrophobicContact CG-CD2 3.85Å; Y483-F554 AromaticContact CG-CE2 3.5Å; Y483-F554 HydrophobicContact CG-CE2 3.5Å; Y483-F554 HydrophobicContact CG-CZ 4.12Å; Y483-F554 AromaticContact CZ-CD2 3.83Å; M550-F554 HydrophobicContact CE-CD1 4.26Å; M550-F554 HydrophobicContact CE-CE1 4.07Å; M550-F554 HydrophobicContact SD-CD1 3.56Å; M550-F554 VanDerWaalsContact SD-CD1 3.56Å; M550-F554 HydrophobicContact SD-CE1 3.88Å; N551-F554 HydrophobicContact CB-CB 4.27Å; N551-F554 WeakPolarHBondContact O-CA 3.36Å; N551-F554 WeakPolarHBondContact O-CB 3.49Å; N551-F554 PolarHBondContact O-N 2.9Å; K552-F554 VanDerWaalsContact C-N 3.33Å; K552-F554 PolarHBondContact O-N 2.97Å; F554-F557 HydrophobicContact CD2-CD1 4Å; F554-F557 AromaticContact CE2-CD1 3.81Å; F554-F557 HydrophobicContact CE2-CD1 3.81Å; F554-F557 HydrophobicContact CE2-CE1 4.16Å; F554-F557 WeakPolarHBondContact O-CB 3.35Å; F554-F557 PolarHBondContact O-N 3.25Å; F554-L558 HydrophobicContact CD1-CD1 4.29Å; F554-L558 HydrophobicContact CE1-CD1 3.87Å; F554-L558 HydrophobicContact CE1-CG 4.35Å; F554-L558 HydrophobicContact CZ-CD1 4.42Å; F554-L558 HydrophobicContact CZ-CD2 4.4Å; F554-L558 WeakPolarHBondContact O-CG 3.38Å; F554-L558 PolarHBondContact O-N 3.21Å; F554-L623 HydrophobicContact CE1-CD1 4.49Å; F554-L623 HydrophobicContact CZ-CD1 4.15Å
555	R	83.6	Confident	74.6	Confident	72 Å²	72	46 Å²	46	27%	0.272	22%	0.224	S	C	.	.	H	α-helix	trans	-66.7	-38.6	168.5	-172.6	-173.1	-65.1	-105.9	-0.4	111.6	N551 K552 L558 T559 Y646	N551-R555 PolarHBondContact O-N 2.82Å; K552-R555 PolarHBondContact O-N 3.44Å; R555-L558 PolarHBondContact O-N 3.24Å; R555-T559 WeakPolarHBondContact O-CB 3.44Å; R555-T559 PolarHBondContact O-N 2.85Å; R555-T559 PolarHBondContact O-OG1 3.04Å; R555-Y646 HydrophobicContact CG-CD1 4.21Å; R555-Y646 HydrophobicContact CG-CE1 4.02Å
556	E	87	Confident	76.5	Confident	49 Å²	49	45.4 Å²	45.4	23%	0.229	22%	0.222	C	C	.	.	H	α-helix	trans	-62	-43.9	175	-166.9	-168.6	150.5	0	0	111.2	K552 D553 L558 T559 I560 K744	K552-E556 PolarHBondContact O-N 2.91Å; D553-E556 WeakPolarHBondContact O-CB 3.3Å; D553-E556 PolarHBondContact O-N 3.4Å; E556-L558 PolarHBondContact O-N 2.88Å; E556-T559 WeakPolarHBondContact O-CB 3.27Å; E556-T559 PolarHBondContact O-N 3.39Å; E556-I560 HydrophobicContact CG-CD1 4.07Å; E556-I560 WeakPolarHBondContact O-CG1 3.46Å; E556-I560 PolarHBondContact O-N 3.35Å; E556-K744 IonicContact OE1-NZ 3.69Å; E556-K744 PolarHBondContact OE1-NZ 3.37Å; E556-K744 IonicContact OE2-NZ 2.76Å
557	F	86.6	Confident	78.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-52.5	-53.9	173.1	168.3	-121.2	0	0	0	113.2	C474 D553 F554 T559 I560 I561 Y789 T791	C474-F557 HydrophobicContact CB-CE1 3.8Å; C474-F557 HydrophobicContact CB-CE2 4.4Å; C474-F557 HydrophobicContact CB-CZ 3.55Å; C474-F557 WeakPolarHBondContact SG-CE1 3.37Å; D553-F557 PolarHBondContact O-N 3.01Å; F554-F557 HydrophobicContact CD2-CD1 4Å; F554-F557 AromaticContact CE2-CD1 3.81Å; F554-F557 HydrophobicContact CE2-CD1 3.81Å; F554-F557 HydrophobicContact CE2-CE1 4.16Å; F554-F557 WeakPolarHBondContact O-CB 3.35Å; F554-F557 PolarHBondContact O-N 3.25Å; F557-T559 PolarHBondContact O-N 3.26Å; F557-I560 PolarHBondContact O-N 3.1Å; F557-I560 VanDerWaalsContact O-N 3.16Å; F557-I561 HydrophobicContact CD2-CD1 4.17Å; F557-I561 HydrophobicContact CE1-CD1 3.83Å; F557-I561 HydrophobicContact CE2-CD1 3.43Å; F557-I561 VanDerWaalsContact CE2-CD1 3.43Å; F557-I561 HydrophobicContact CE2-CG1 4.07Å; F557-I561 HydrophobicContact CZ-CD1 3.23Å; F557-I561 HydrophobicContact CZ-CG1 4.33Å; F557-I561 PolarHBondContact O-N 3.28Å; F557-Y789 HydrophobicContact CB-CD1 3.99Å; F557-Y789 HydrophobicContact CB-CD2 4.16Å; F557-Y789 HydrophobicContact CB-CE1 3.55Å; F557-Y789 HydrophobicContact CB-CE2 3.75Å; F557-Y789 HydrophobicContact CB-CG 4.31Å; F557-Y789 VanDerWaalsContact CB-CZ 3.47Å; F557-Y789 AromaticContact CD2-CD1 3.67Å; F557-Y789 HydrophobicContact CD2-CD1 3.67Å; F557-Y789 AromaticContact CD2-CD2 3.45Å; F557-Y789 HydrophobicContact CD2-CD2 3.45Å; F557-Y789 VanDerWaalsContact CD2-CD2 3.45Å; F557-Y789 HydrophobicContact CD2-CE1 4.13Å; F557-Y789 AromaticContact CD2-CE2 3.95Å; F557-Y789 HydrophobicContact CD2-CE2 3.95Å; F557-Y789 AromaticContact CD2-CG 3.34Å; F557-Y789 HydrophobicContact CD2-CG 3.34Å; F557-Y789 HydrophobicContact CE2-CD1 4.37Å; F557-Y789 HydrophobicContact CE2-CD2 4.31Å; F557-Y789 AromaticContact CE2-CG 3.94Å; F557-Y789 HydrophobicContact CE2-CG 3.94Å; F557-Y789 AromaticContact CG-CD1 3.91Å; F557-Y789 HydrophobicContact CG-CD1 3.91Å; F557-Y789 HydrophobicContact CG-CD2 4.2Å; F557-Y789 AromaticContact CG-CE1 4Å; F557-Y789 HydrophobicContact CG-CE1 4Å; F557-Y789 HydrophobicContact CG-CE2 4.29Å; F557-Y789 HydrophobicContact CG-CG 4.05Å; F557-T791 HydrophobicContact CE2-CG2 3.62Å; F557-T791 HydrophobicContact CZ-CG2 3.58Å
558	L	87.2	Confident	80.5	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.6	-34.6	-179.5	-61.5	179.3	0	0	0	111.2	F554 R555 E556 I561 T562 A620 L623 V625	F554-L558 HydrophobicContact CD1-CD1 4.29Å; F554-L558 HydrophobicContact CE1-CD1 3.87Å; F554-L558 HydrophobicContact CE1-CG 4.35Å; F554-L558 HydrophobicContact CZ-CD1 4.42Å; F554-L558 HydrophobicContact CZ-CD2 4.4Å; F554-L558 WeakPolarHBondContact O-CG 3.38Å; F554-L558 PolarHBondContact O-N 3.21Å; R555-L558 PolarHBondContact O-N 3.24Å; E556-L558 PolarHBondContact O-N 2.88Å; L558-I561 WeakPolarHBondContact O-CB 3.32Å; L558-I561 PolarHBondContact O-N 2.94Å; L558-T562 PolarHBondContact O-N 2.84Å; L558-T562 VanDerWaalsContact O-N 3.09Å; L558-T562 PolarHBondContact O-OG1 2.9Å; L558-T562 VanDerWaalsContact O-OG1 3.06Å; L558-A620 HydrophobicContact CB-CB 4.23Å; L558-A620 HydrophobicContact CD2-CB 4.2Å; L558-L623 HydrophobicContact CD1-CB 3.61Å; L558-L623 HydrophobicContact CD1-CD1 4.22Å; L558-L623 HydrophobicContact CD2-CB 4.49Å; L558-L623 HydrophobicContact CD2-CD1 3.82Å; L558-V625 HydrophobicContact CB-CB 3.92Å; L558-V625 HydrophobicContact CB-CG1 4.42Å; L558-V625 HydrophobicContact CB-CG2 3.65Å; L558-V625 HydrophobicContact CD1-CG2 4Å
559	T	90.6	Very high	82.3	Confident	6 Å²	6	37.3 Å²	37.3	4%	0.037	18%	0.181	C	C	.	.	H	α-helix	trans	-64.7	-44.4	172.9	-54.2	0	0	0	0	111.9	R555 E556 F557 I561 T562 L563 I644 Y646 Y671	R555-T559 WeakPolarHBondContact O-CB 3.44Å; R555-T559 PolarHBondContact O-N 2.85Å; R555-T559 PolarHBondContact O-OG1 3.04Å; E556-T559 WeakPolarHBondContact O-CB 3.27Å; E556-T559 PolarHBondContact O-N 3.39Å; F557-T559 PolarHBondContact O-N 3.26Å; T559-I561 VanDerWaalsContact C-N 3.29Å; T559-I561 PolarHBondContact O-N 3.13Å; T559-T562 WeakPolarHBondContact CA-OG1 3.28Å; T559-T562 CarbonylContact O-C 3.56Å; T559-T562 PolarHBondContact O-N 2.9Å; T559-T562 VanDerWaalsContact O-N 3.14Å; T559-T562 PolarHBondContact O-OG1 3.33Å; T559-L563 HydrophobicContact CG2-CD1 3.9Å; T559-L563 HydrophobicContact CG2-CG 4.43Å; T559-L563 VanDerWaalsContact O-CG 3.3Å; T559-L563 WeakPolarHBondContact O-CG 3.08Å; T559-L563 PolarHBondContact O-N 2.92Å; T559-I644 HydrophobicContact CG2-CD1 4.37Å; T559-Y646 WeakPolarHBondContact CG2-OH 3.23Å; T559-Y646 WeakPolarHBondContact OG1-CE1 3.36Å; T559-Y646 PolarHBondContact OG1-OH 3.24Å; T559-Y671 HydrophobicContact CG2-CE1 4.37Å; T559-Y671 HydrophobicContact CG2-CE2 4.36Å; T559-Y671 WeakPolarHBondContact CG2-OH 3.28Å
560	I	91.6	Very high	83.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.6	-37.4	177.1	-71.7	167.7	0	0	0	110.9	E556 F557 L563 C564 L700 F742 I788 Y789	E556-I560 HydrophobicContact CG-CD1 4.07Å; E556-I560 WeakPolarHBondContact O-CG1 3.46Å; E556-I560 PolarHBondContact O-N 3.35Å; F557-I560 PolarHBondContact O-N 3.1Å; F557-I560 VanDerWaalsContact O-N 3.16Å; I560-L563 PolarHBondContact O-N 3.24Å; I560-C564 WeakPolarHBondContact O-CB 3.45Å; I560-C564 PolarHBondContact O-N 3.21Å; I560-L700 HydrophobicContact CD1-CD2 4.4Å; I560-L700 HydrophobicContact CG1-CD1 4.33Å; I560-L700 HydrophobicContact CG1-CD2 4.07Å; I560-L700 HydrophobicContact CG2-CD1 4.35Å; I560-L700 HydrophobicContact CG2-CD2 4.34Å; I560-F742 HydrophobicContact CG2-CD1 3.82Å; I560-F742 HydrophobicContact CG2-CE1 4.41Å; I560-I788 HydrophobicContact CD1-CD1 3.8Å; I560-Y789 HydrophobicContact CD1-CE2 4.28Å
561	I	90.9	Very high	83.1	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-46.7	171.6	-83.8	173.9	0	0	0	111.6	L471 F557 L558 T559 L563 H565 L616 A620 F742	L471-I561 HydrophobicContact CD2-CD1 4.41Å; F557-I561 HydrophobicContact CD2-CD1 4.17Å; F557-I561 HydrophobicContact CE1-CD1 3.83Å; F557-I561 HydrophobicContact CE2-CD1 3.43Å; F557-I561 VanDerWaalsContact CE2-CD1 3.43Å; F557-I561 HydrophobicContact CE2-CG1 4.07Å; F557-I561 HydrophobicContact CZ-CD1 3.23Å; F557-I561 HydrophobicContact CZ-CG1 4.33Å; F557-I561 PolarHBondContact O-N 3.28Å; L558-I561 WeakPolarHBondContact O-CB 3.32Å; L558-I561 PolarHBondContact O-N 2.94Å; T559-I561 VanDerWaalsContact C-N 3.29Å; T559-I561 PolarHBondContact O-N 3.13Å; I561-L563 PolarHBondContact O-N 3.04Å; I561-H565 PolarHBondContact O-CD2 3.15Å; I561-L616 HydrophobicContact CD1-CD2 3.76Å; I561-L616 HydrophobicContact CG1-CD2 4.23Å; I561-L616 HydrophobicContact CG2-CB 3.83Å; I561-L616 VanDerWaalsContact CG2-O 3.32Å; I561-L616 WeakPolarHBondContact CG2-O 3.41Å; I561-A620 HydrophobicContact CG2-CB 3.85Å; I561-F742 HydrophobicContact CG1-CE1 4.05Å; I561-F742 HydrophobicContact CG1-CE2 4.46Å; I561-F742 HydrophobicContact CG1-CZ 3.83Å
562	T	91.1	Very high	82.1	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	2.1	179.6	50.4	0	0	0	0	114.5	L558 T559 H565 A620 V625 I644	L558-T562 PolarHBondContact O-N 2.84Å; L558-T562 VanDerWaalsContact O-N 3.09Å; L558-T562 PolarHBondContact O-OG1 2.9Å; L558-T562 VanDerWaalsContact O-OG1 3.06Å; T559-T562 WeakPolarHBondContact CA-OG1 3.28Å; T559-T562 CarbonylContact O-C 3.56Å; T559-T562 PolarHBondContact O-N 2.9Å; T559-T562 VanDerWaalsContact O-N 3.14Å; T559-T562 PolarHBondContact O-OG1 3.33Å; T562-H565 VanDerWaalsContact C-CD2 3.49Å; T562-H565 PolarHBondContact O-CD2 3.02Å; T562-H565 PolarHBondContact O-NE2 2.87Å; T562-H565 VanDerWaalsContact O-NE2 3.13Å; T562-A620 HydrophobicContact CG2-CB 3.73Å; T562-V625 HydrophobicContact CG2-CG1 4.23Å; T562-I644 WeakPolarHBondContact OG1-CD1 3.5Å
563	L	92.3	Very high	80.4	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-39.7	172.8	-70.5	172	0	0	0	112.4	T559 I560 I561 H565 I644 Y671 V690 Y692 L700	T559-L563 HydrophobicContact CG2-CD1 3.9Å; T559-L563 HydrophobicContact CG2-CG 4.43Å; T559-L563 VanDerWaalsContact O-CG 3.3Å; T559-L563 WeakPolarHBondContact O-CG 3.08Å; T559-L563 PolarHBondContact O-N 2.92Å; I560-L563 PolarHBondContact O-N 3.24Å; I561-L563 PolarHBondContact O-N 3.04Å; L563-H565 VanDerWaalsContact C-N 3.34Å; L563-H565 PolarHBondContact O-N 2.99Å; L563-H565 VanDerWaalsContact O-N 3.1Å; L563-I644 HydrophobicContact CD2-CD1 3.66Å; L563-I644 HydrophobicContact CG-CD1 3.88Å; L563-Y671 HydrophobicContact CD1-CD1 3.72Å; L563-Y671 HydrophobicContact CD1-CE1 3.84Å; L563-Y671 HydrophobicContact CD1-CG 4.24Å; L563-Y671 HydrophobicContact CD2-CD1 3.89Å; L563-Y671 HydrophobicContact CD2-CD2 4.04Å; L563-Y671 HydrophobicContact CD2-CG 3.56Å; L563-Y671 HydrophobicContact CG-CD1 4.44Å; L563-Y671 HydrophobicContact CG-CG 4.49Å; L563-V690 HydrophobicContact CD1-CG1 4.41Å; L563-V690 HydrophobicContact CD2-CG1 4.35Å; L563-Y692 HydrophobicContact CD1-CE2 3.77Å; L563-L700 HydrophobicContact CB-CD1 3.76Å; L563-L700 HydrophobicContact CD1-CD1 4.01Å
564	C	91.4	Very high	78.5	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	-87.3	67.6	-177.4	-164.7	0	0	0	0	110.7	I560 L700 K702	I560-C564 WeakPolarHBondContact O-CB 3.45Å; I560-C564 PolarHBondContact O-N 3.21Å; C564-L700 HydrophobicContact CB-CB 4.26Å; C564-K702 HydrophobicContact CB-CD 4.44Å; C564-K702 WeakPolarHBondContact O-CD 3.47Å; C564-K702 VanDerWaalsContact O-CE 3.23Å; C564-K702 WeakPolarHBondContact O-CE 3.36Å; C564-K702 PolarHBondContact O-NZ 3.42Å
565	H	90.7	Very high	76.5	Confident	15 Å²	15	50.7 Å²	50.7	7%	0.069	24%	0.242	C	C	.	.			trans	-153.5	170.6	179.6	69.4	64.1	0	0	0	115.8	I561 T562 L563 V567 V617 F627	I561-H565 PolarHBondContact O-CD2 3.15Å; T562-H565 VanDerWaalsContact C-CD2 3.49Å; T562-H565 PolarHBondContact O-CD2 3.02Å; T562-H565 PolarHBondContact O-NE2 2.87Å; T562-H565 VanDerWaalsContact O-NE2 3.13Å; L563-H565 VanDerWaalsContact C-N 3.34Å; L563-H565 PolarHBondContact O-N 2.99Å; L563-H565 VanDerWaalsContact O-N 3.1Å; H565-V567 HydrophobicContact CB-CG2 4.1Å; H565-V567 PolarHBondContact ND1-N 2.98Å; H565-V617 HydrophobicContact CB-CG2 4.23Å; H565-V617 WeakPolarHBondContact CD2-CG2 2.94Å; H565-F627 AromaticContact CE1-CD1 3.83Å; H565-F627 AromaticContact CE1-CE1 3.75Å; H565-F627 AromaticContact CE1-CZ 3.93Å; H565-F627 AromaticContact NE2-CD1 3.98Å; H565-F627 AromaticContact NE2-CG 3.9Å
566	T	86.5	Confident	74.1	Confident	41 Å²	41	52.2 Å²	52.2	25%	0.252	26%	0.256	S	S	.	.			trans	-116.8	14.9	170.5	53.4	0	0	0	0	113.7	E613 V676 M686	T566-E613 PolarHBondContact N-OE2 3.31Å; T566-E613 PolarHBondContact OG1-OE2 2.88Å; T566-V676 HydrophobicContact CG2-CG1 4.22Å; T566-M686 HydrophobicContact CG2-CE 3.48Å; T566-M686 VanDerWaalsContact CG2-CE 3.48Å; T566-M686 HydrophobicContact CG2-SD 4.42Å
567	V	86.9	Confident	71.6	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.012	28%	0.283	C	S	.	.			trans	-61.6	139.9	174.9	-177.6	0	0	0	0	111.5	H565 Y606 E607 A608 E613 V617	H565-V567 HydrophobicContact CB-CG2 4.1Å; H565-V567 PolarHBondContact ND1-N 2.98Å; V567-Y606 HydrophobicContact CG1-CD1 3.84Å; V567-Y606 HydrophobicContact CG1-CG 4.09Å; V567-E607 CarbonylContact C-O 3.54Å; V567-E607 WeakPolarHBondContact CA-O 3.5Å; V567-E607 WeakPolarHBondContact CG1-O 3.23Å; V567-A608 HydrophobicContact CG2-CB 3.91Å; V567-E613 HydrophobicContact CG2-CB 3.94Å; V567-V617 HydrophobicContact CB-CG2 4.31Å; V567-V617 HydrophobicContact CG1-CG1 4.42Å; V567-V617 HydrophobicContact CG2-CB 4.29Å; V567-V617 HydrophobicContact CG2-CG2 3.77Å
568	E	82.8	Confident	69.2	Low	93 Å²	93	62.4 Å²	62.4	44%	0.435	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	162.1	175.4	-62.1	-170.8	154.3	0	0	110.7	E607	E568-E607 PolarHBondContact N-O 3.43Å; E568-E607 PolarHBondContact O-N 3.11Å
569	L	79.9	Confident	66.6	Low	33 Å²	33	67.5 Å²	67.5	17%	0.173	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	130.1	-179.5	-74.4	158.8	0	0	0	110.5	Y572 Y604 Y606 F627 S628	L569-Y572 HydrophobicContact CD1-CD2 4.43Å; L569-Y572 HydrophobicContact CD1-CE2 4.24Å; L569-Y604 HydrophobicContact CD2-CD1 3.84Å; L569-Y604 HydrophobicContact CD2-CG 3.97Å; L569-Y606 HydrophobicContact CD2-CD1 3.92Å; L569-Y606 HydrophobicContact CD2-CE1 3.78Å; L569-F627 HydrophobicContact CD1-CD1 4.44Å; L569-F627 HydrophobicContact CD1-CE1 4.13Å; L569-F627 HydrophobicContact CD1-CZ 4.45Å; L569-F627 HydrophobicContact CG-CD1 4.26Å; L569-F627 HydrophobicContact CG-CE1 3.99Å; L569-S628 VanDerWaalsContact CD1-C 3.48Å; L569-S628 WeakPolarHBondContact CD1-O 3.13Å
570	K	66.4	Low	63.8	Low	86 Å²	86	75.8 Å²	75.8	37%	0.374	39%	0.386	S	S	.	.	S	Bend	trans	-83.5	124.5	-179.5	-167.5	-178.8	174.9	-162.8	0	110.5	E605 E607	K570-E605 HydrophobicContact CB-CB 4.01Å; K570-E605 VanDerWaalsContact CB-O 3.22Å; K570-E605 WeakPolarHBondContact CB-O 3.34Å; K570-E605 HydrophobicContact CD-CB 4.01Å; K570-E605 VanDerWaalsContact CD-OE2 3.24Å; K570-E605 WeakPolarHBondContact CD-OE2 3.48Å; K570-E605 WeakPolarHBondContact CE-OE2 3.37Å; K570-E605 PolarHBondContact N-O 3.35Å; K570-E605 IonicContact NZ-OE2 2.67Å; K570-E605 PolarHBondContact NZ-OE2 2.71Å; K570-E607 HydrophobicContact CB-CG 4.11Å; K570-E607 HydrophobicContact CD-CG 4.06Å; K570-E607 WeakPolarHBondContact CD-OE1 3.26Å; K570-E607 WeakPolarHBondContact CE-OE1 3.33Å; K570-E607 HydrophobicContact CG-CG 4.21Å; K570-E607 WeakPolarHBondContact CG-OE1 3.43Å
571	N	55.9	Low	60.8	Low	128 Å²	128	84 Å²	84	68%	0.684	43%	0.427	S	S	*	.			trans	61.2	69.7	-179.3	-59.3	-27.4	0	0	0	115.5	N573	N571-N573 VanDerWaalsContact C-N 3.27Å; N571-N573 PolarHBondContact O-N 2.87Å
572	Y	45.6	Very low	57.9	Low	94 Å²	94	91.7 Å²	91.7	37%	0.369	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-64.8	-29.6	171.1	-147.7	-110.3	0	0	0	113	L569 K574	L569-Y572 HydrophobicContact CD1-CD2 4.43Å; L569-Y572 HydrophobicContact CD1-CE2 4.24Å; Y572-K574 VanDerWaalsContact C-N 3.31Å; Y572-K574 PolarHBondContact O-N 3.07Å; Y572-K574 VanDerWaalsContact O-N 3.1Å
573	N	41.1	Very low	55.1	Low	134 Å²	134	100.7 Å²	100.7	72%	0.717	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-84.9	23.8	-165.3	-58.7	5.1	0	0	0	115.5	N571	N571-N573 VanDerWaalsContact C-N 3.27Å; N571-N573 PolarHBondContact O-N 2.87Å
574	K	39.9	Very low	52.4	Low	183 Å²	183	108.5 Å²	108.5	80%	0.796	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-118.5	3.3	-179.5	-116.2	-174.2	-178.9	-173	0	115.5	Y572	Y572-K574 VanDerWaalsContact C-N 3.31Å; Y572-K574 PolarHBondContact O-N 3.07Å; Y572-K574 VanDerWaalsContact O-N 3.1Å
575	L	38.1	Very low	49.5	Very low	124 Å²	124	115.9 Å²	115.9	65%	0.649	59%	0.585	S	S	*	*	S	Bend	trans	-118.1	-13.9	-178	-90	140.2	0	0	0	114.1
576	N	33.5	Very low	46.7	Very low	105 Å²	105	118.9 Å²	118.9	56%	0.561	62%	0.619	S	S	*	*	S	Bend	trans	-94.6	-21	-175.2	-67.2	8.3	0	0	0	113.6	T578	N576-T578 PolarHBondContact O-N 3.06Å
577	D	35.8	Very low	43.9	Very low	147 Å²	147	124.8 Å²	124.8	79%	0.786	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	8.8	-177	-65.1	-13.1	0	0	0	114.2
578	T	34.8	Very low	41.3	Very low	116 Å²	116	129.7 Å²	129.7	71%	0.712	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.1	8.1	-177.3	52.8	0	0	0	0	114.4	N576	N576-T578 PolarHBondContact O-N 3.06Å
579	T	32.6	Very low	38.7	Very low	107 Å²	107	132.5 Å²	132.5	66%	0.656	70%	0.702	S	S	*	*	S	Bend	trans	-141.4	38.9	-174.8	49.2	0	0	0	0	115
580	E	31.4	Very low	36.3	Very low	179 Å²	179	138.8 Å²	138.8	84%	0.836	73%	0.734	S	S	*	*	S	Bend	trans	-160.2	141.5	161.1	-110.2	157.3	-140.2	0	0	109.4
581	M	29.5	Very low	34.5	Very low	174 Å²	174	143.4 Å²	143.4	86%	0.857	76%	0.757	S	S	*	*			trans	68.5	96.8	-174	-47.2	-68.8	-168	0	0	116.5
582	D	30.6	Very low	33	Very low	163 Å²	163	146.7 Å²	146.7	87%	0.872	77%	0.768	S	S	*	*				175.2	75.6	126.5	-91.8	-10.1	0	0	0	112	H584	D582-H584 PolarHBondContact O-N 3.11Å
583	H	31.7	Very low	32.1	Very low	190 Å²	190	147.4 Å²	147.4	88%	0.88	79%	0.787	S	S	*	*			trans	-82.8	94.8	152.4	-90.6	-66.3	0	0	0	108.3
584	H	35	Very low	31.4	Very low	165 Å²	165	146.2 Å²	146.2	76%	0.764	79%	0.789	S	S	*	*			trans	172	127.9	134.9	-94.3	-63.2	0	0	0	113.8	D582	D582-H584 PolarHBondContact O-N 3.11Å
585	N	30.9	Very low	30.8	Very low	155 Å²	155	146.8 Å²	146.8	83%	0.829	80%	0.797	S	S	*	*			trans	47.2	122.9	146.3	-61.2	-7.8	0	0	0	121.3
586	G	31.2	Very low	30.3	Very low	77 Å²	77	147.9 Å²	147.9	79%	0.794	80%	0.804	S	S	*	*			trans	154.3	95.9	146.5	0	0	0	0	0	116.2
587	N	28.2	Very low	30	Very low	166 Å²	166	149 Å²	149	89%	0.888	81%	0.81	S	S	*	*			trans	-60.1	133.8	169.8	-70.3	-33.5	0	0	0	111.8
588	S	31.8	Very low	29.6	Very low	105 Å²	105	152.9 Å²	152.9	73%	0.734	82%	0.815	S	S	*	*				172.7	128.5	107.1	45.1	0	0	0	0	114.3
589	N	28.2	Very low	29.2	Very low	152 Å²	152	154.7 Å²	154.7	81%	0.813	82%	0.815	S	S	*	*			trans	28.1	112.1	143.5	-52.4	-19.3	0	0	0	119.6
590	I	30	Very low	29	Very low	165 Å²	165	155.1 Å²	155.1	85%	0.846	82%	0.82	S	S	*	*				-155.7	112.1	127.4	-96.5	141.3	0	0	0	110.7
591	Q	28.4	Very low	29.2	Very low	182 Å²	182	151.8 Å²	151.8	85%	0.85	82%	0.815	S	S	*	*			trans	32.2	116	151	-66	173.9	-15.5	0	0	121.2
592	Q	25.2	Very low	30.2	Very low	197 Å²	197	145.4 Å²	145.4	92%	0.921	78%	0.782	S	S	*	*			trans	-66.1	138.5	166.5	-63.4	158.1	-41.1	0	0	112.7
593	S	26.4	Very low	31.4	Very low	109 Å²	109	147.2 Å²	147.2	76%	0.762	78%	0.778	S	S	*	*			trans	-144.7	96.4	148	49	0	0	0	0	111.8
594	S	26.7	Very low	33.1	Very low	110 Å²	110	142.5 Å²	142.5	77%	0.769	75%	0.752	S	S	*	*			trans	47.8	89.7	152.6	61.4	0	0	0	0	119.7
595	M	26.8	Very low	34.9	Very low	195 Å²	195	140 Å²	140	96%	0.961	74%	0.741	S	S	*	*			trans	-154.5	107.5	134	-134.1	167.6	172.9	0	0	110.1
596	N	27.7	Very low	37.3	Very low	147 Å²	147	132.9 Å²	132.9	79%	0.786	70%	0.703	S	S	*	*			trans	-86.6	134.2	-175	-76.1	-12.7	0	0	0	112.1
597	N	26.2	Very low	39.5	Very low	129 Å²	129	131.3 Å²	131.3	69%	0.69	68%	0.675	S	S	*	*			trans	61.1	103	141.5	-57.1	-11.8	0	0	0	121
598	Y	27.3	Very low	41.9	Very low	227 Å²	227	124.4 Å²	124.4	89%	0.89	64%	0.641	S	S	*	*				45.1	91.4	128.5	-68.9	-83.1	0	0	0	120.1
599	E	27.1	Very low	43.8	Very low	154 Å²	154	123.1 Å²	123.1	72%	0.72	63%	0.629	S	S	*	*			trans	-138.9	132.6	144.4	-79	-168.4	153.9	0	0	109.9	C601	E599-C601 PolarHBondContact O-N 3.43Å
600	P	29.5	Very low	46.1	Very low	116 Å²	116	117.6 Å²	117.6	75%	0.753	60%	0.602	S	S	*	*			trans	-75.2	96.2	177.2	30.5	-32.6	0	0	0	110.3	R602	P600-R602 PolarHBondContact O-N 2.96Å
601	C	34.5	Very low	48.5	Very low	109 Å²	109	111.8 Å²	111.8	74%	0.736	58%	0.576	S	S	*	*			trans	-64.6	115.3	-170.4	-74.6	0	0	0	0	113.7	E599 Y603	E599-C601 PolarHBondContact O-N 3.43Å; C601-Y603 PolarHBondContact O-N 3.14Å
602	R	50.8	Low	51.2	Low	41 Å²	41	104.6 Å²	104.6	16%	0.155	54%	0.544	C	S	.	.			trans	-72	18.8	-173.5	-136	-174.4	-162.1	177.9	0.3	116.7	P600 Y649 E663	P600-R602 PolarHBondContact O-N 2.96Å; R602-Y649 VanDerWaalsContact NH1-CE1 3.31Å; R602-Y649 PolarHBondContact NH1-OH 3.09Å; R602-E663 WeakPolarHBondContact CD-OE2 3.12Å; R602-E663 IonicContact CZ-OE1 2.64Å; R602-E663 IonicContact CZ-OE2 2.69Å; R602-E663 IonicContact NE-OE2 3.47Å; R602-E663 PolarHBondContact NE-OE2 2.94Å; R602-E663 IonicContact NH1-OE1 3.76Å; R602-E663 PolarHBondContact NH1-OE1 2.9Å; R602-E663 IonicContact NH1-OE2 3.92Å; R602-E663 PolarHBondContact NH1-OE2 3.17Å; R602-E663 IonicContact NH2-OE2 3.49Å
603	Y	55.4	Low	54.1	Low	201 Å²	201	96 Å²	96	79%	0.788	50%	0.503	S	S	*	.			trans	-115.2	79.2	-162.6	-66.4	-78.5	0	0	0	112.8	C601	C601-Y603 PolarHBondContact O-N 3.14Å
604	Y	67.9	Low	57	Low	90 Å²	90	94.2 Å²	94.2	35%	0.353	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-71.2	126.7	160	-66.4	-74.7	0	0	0	109.6	L569 V626	L569-Y604 HydrophobicContact CD2-CD1 3.84Å; L569-Y604 HydrophobicContact CD2-CG 3.97Å; Y604-V626 HydrophobicContact CD2-CG1 3.47Å; Y604-V626 VanDerWaalsContact CD2-CG1 3.47Å; Y604-V626 HydrophobicContact CE2-CG1 3.67Å
605	E	73	Confident	59.9	Low	114 Å²	114	89.1 Å²	89.1	53%	0.533	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-85.1	120.2	169.3	-75.2	-165.3	178.4	0	0	110	K570	K570-E605 HydrophobicContact CB-CB 4.01Å; K570-E605 VanDerWaalsContact CB-O 3.22Å; K570-E605 WeakPolarHBondContact CB-O 3.34Å; K570-E605 HydrophobicContact CD-CB 4.01Å; K570-E605 VanDerWaalsContact CD-OE2 3.24Å; K570-E605 WeakPolarHBondContact CD-OE2 3.48Å; K570-E605 WeakPolarHBondContact CE-OE2 3.37Å; K570-E605 PolarHBondContact N-O 3.35Å; K570-E605 IonicContact NZ-OE2 2.67Å; K570-E605 PolarHBondContact NZ-OE2 2.71Å
606	Y	81.9	Confident	63	Low	4 Å²	4	80 Å²	80	2%	0.016	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	135.5	-179.7	-60.7	-71.9	0	0	0	111.8	V567 L569 K614 V617 E618 S621 F627	V567-Y606 HydrophobicContact CG1-CD1 3.84Å; V567-Y606 HydrophobicContact CG1-CG 4.09Å; L569-Y606 HydrophobicContact CD2-CD1 3.92Å; L569-Y606 HydrophobicContact CD2-CE1 3.78Å; Y606-K614 WeakPolarHBondContact O-CD 3.19Å; Y606-K614 WeakPolarHBondContact O-CE 3.3Å; Y606-K614 PolarHBondContact O-NZ 2.91Å; Y606-V617 HydrophobicContact CD1-CG1 3.93Å; Y606-V617 HydrophobicContact CD2-CG1 4.42Å; Y606-V617 HydrophobicContact CE1-CG1 3.78Å; Y606-V617 HydrophobicContact CE2-CG1 4.27Å; Y606-V617 HydrophobicContact CG-CG1 4.24Å; Y606-E618 HydrophobicContact CD2-CG 3.68Å; Y606-E618 HydrophobicContact CE2-CG 4.31Å; Y606-S621 WeakPolarHBondContact OH-CB 3.37Å; Y606-S621 PolarHBondContact OH-OG 3.37Å; Y606-F627 HydrophobicContact CD1-CD1 4.18Å; Y606-F627 HydrophobicContact CE1-CB 4.01Å; Y606-F627 AromaticContact CE1-CD1 3.86Å; Y606-F627 HydrophobicContact CE1-CD1 3.86Å; Y606-F627 HydrophobicContact CE1-CG 4.42Å; Y606-F627 PolarHBondContact OH-N 3.08Å; Y606-F627 PolarHBondContact OH-O 2.98Å
607	E	76.1	Confident	65.9	Low	44 Å²	44	73 Å²	73	21%	0.206	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	141	169.7	-76.4	-174.3	173.4	0	0	110.2	S308 V567 E568 K570	S308-E607 PolarHBondContact OG-OE2 3.1Å; V567-E607 CarbonylContact C-O 3.54Å; V567-E607 WeakPolarHBondContact CA-O 3.5Å; V567-E607 WeakPolarHBondContact CG1-O 3.23Å; E568-E607 PolarHBondContact N-O 3.43Å; E568-E607 PolarHBondContact O-N 3.11Å; K570-E607 HydrophobicContact CB-CG 4.11Å; K570-E607 HydrophobicContact CD-CG 4.06Å; K570-E607 WeakPolarHBondContact CD-OE1 3.26Å; K570-E607 WeakPolarHBondContact CE-OE1 3.33Å; K570-E607 HydrophobicContact CG-CG 4.21Å; K570-E607 WeakPolarHBondContact CG-OE1 3.43Å
608	A	79	Confident	68.8	Low	22 Å²	22	68.5 Å²	68.5	18%	0.182	34%	0.339	C	S	.	.			trans	-149.3	148.7	-176	0	0	0	0	0	111.3	V567 S610 K614	V567-A608 HydrophobicContact CG2-CB 3.91Å; A608-S610 WeakPolarHBondContact CB-O 3.39Å; A608-S610 PolarHBondContact O-N 3.25Å; A608-K614 HydrophobicContact CB-CB 3.86Å
609	T	71.2	Confident	71.5	Confident	77 Å²	77	58.2 Å²	58.2	47%	0.472	30%	0.302	S	S	.	.	S	Bend	trans	-70	-18	171	58.1	0	0	0	0	113	N190	N190-T609 VanDerWaalsContact CG-O 3.31Å; N190-T609 PolarHBondContact OD1-O 3.22Å
610	S	78	Confident	74.3	Confident	36 Å²	36	50.9 Å²	50.9	25%	0.252	27%	0.268	S	S	.	.	S	Bend	trans	-134.6	125.7	-178.2	172.6	0	0	0	0	110.7	A608 D612 E613 K614	A608-S610 WeakPolarHBondContact CB-O 3.39Å; A608-S610 PolarHBondContact O-N 3.25Å; S610-D612 PolarHBondContact O-N 3.02Å; S610-D612 PolarHBondContact OG-N 2.86Å; S610-E613 PolarHBondContact O-N 2.64Å; S610-K614 PolarHBondContact O-N 3.41Å
611	S	79.3	Confident	77	Confident	44 Å²	44	46 Å²	46	31%	0.308	24%	0.237	S	C	.	.	H	α-helix	trans	-55.7	-33.9	176.5	54.9	0	0	0	0	113.4	E613 K614 A615	S611-E613 VanDerWaalsContact C-N 3.35Å; S611-K614 PolarHBondContact O-N 2.88Å; S611-A615 WeakPolarHBondContact O-CB 3.25Å; S611-A615 PolarHBondContact O-N 3.21Å
612	D	84.5	Confident	79	Confident	31 Å²	31	45.9 Å²	45.9	17%	0.166	22%	0.223	C	C	.	.	H	α-helix	trans	-74	-31.9	-174.6	-58.1	7.6	0	0	0	109.9	S610 L616 R738 I793	S610-D612 PolarHBondContact O-N 3.02Å; S610-D612 PolarHBondContact OG-N 2.86Å; D612-L616 WeakPolarHBondContact O-CD1 3.32Å; D612-L616 VanDerWaalsContact O-CG 3.25Å; D612-L616 WeakPolarHBondContact O-CG 3.34Å; D612-L616 PolarHBondContact O-N 3.48Å; D612-R738 IonicContact OD1-CZ 3.73Å; D612-R738 IonicContact OD1-NH1 3.89Å; D612-R738 PolarHBondContact OD1-NH1 3.11Å; D612-R738 IonicContact OD2-NH1 2.86Å; D612-R738 PolarHBondContact OD2-NH1 3.3Å; D612-R738 VanDerWaalsContact OD2-NH1 3.15Å; D612-I793 HydrophobicContact CB-CD1 4.03Å
613	E	87.4	Confident	80.3	Confident	15 Å²	15	44.5 Å²	44.5	7%	0.07	22%	0.219	C	C	.	.	H	α-helix	trans	-71.2	-43.5	172.2	-58	-161.7	162.9	0	0	111.9	T566 V567 S610 S611 A615 L616 V617 M686 K702	T566-E613 PolarHBondContact N-OE2 3.31Å; T566-E613 PolarHBondContact OG1-OE2 2.88Å; V567-E613 HydrophobicContact CG2-CB 3.94Å; S610-E613 PolarHBondContact O-N 2.64Å; S611-E613 VanDerWaalsContact C-N 3.35Å; E613-A615 VanDerWaalsContact C-N 3.33Å; E613-A615 PolarHBondContact O-N 2.87Å; E613-L616 PolarHBondContact O-N 2.71Å; E613-V617 PolarHBondContact O-N 3.45Å; E613-M686 WeakPolarHBondContact OE1-CE 3.3Å; E613-K702 VanDerWaalsContact OE1-CE 3.31Å; E613-K702 WeakPolarHBondContact OE1-CE 3.37Å; E613-K702 IonicContact OE1-NZ 3.1Å; E613-K702 PolarHBondContact OE1-NZ 3.46Å; E613-K702 IonicContact OE2-NZ 2.74Å
614	K	86.7	Confident	81.2	Confident	72 Å²	72	35 Å²	35	31%	0.313	18%	0.182	S	C	.	.	H	α-helix	trans	-57.4	-46.4	175.8	179.6	166.1	176.8	161	0	111.3	Y606 A608 S610 S611 L616 V617 E618	Y606-K614 WeakPolarHBondContact O-CD 3.19Å; Y606-K614 WeakPolarHBondContact O-CE 3.3Å; Y606-K614 PolarHBondContact O-NZ 2.91Å; A608-K614 HydrophobicContact CB-CB 3.86Å; S610-K614 PolarHBondContact O-N 3.41Å; S611-K614 PolarHBondContact O-N 2.88Å; K614-L616 VanDerWaalsContact C-N 3.31Å; K614-L616 PolarHBondContact O-N 2.94Å; K614-V617 PolarHBondContact O-N 2.8Å; K614-E618 WeakPolarHBondContact CE-OE1 3.14Å; K614-E618 HydrophobicContact CG-CG 4.26Å; K614-E618 IonicContact NZ-OE1 3.98Å; K614-E618 VanDerWaalsContact O-CB 3.31Å; K614-E618 WeakPolarHBondContact O-CB 3.4Å; K614-E618 WeakPolarHBondContact O-CG 3.49Å; K614-E618 PolarHBondContact O-N 3.15Å
615	A	87.9	Confident	82.1	Confident	3 Å²	3	30.9 Å²	30.9	3%	0.025	17%	0.166	C	C	.	.	H	α-helix	trans	-62.5	-34.7	178.2	0	0	0	0	0	113.9	M469 S611 E613 G619 I793	M469-A615 HydrophobicContact CB-CB 3.54Å; M469-A615 VanDerWaalsContact O-CB 3.28Å; M469-A615 WeakPolarHBondContact O-CB 3.4Å; S611-A615 WeakPolarHBondContact O-CB 3.25Å; S611-A615 PolarHBondContact O-N 3.21Å; E613-A615 VanDerWaalsContact C-N 3.33Å; E613-A615 PolarHBondContact O-N 2.87Å; A615-G619 PolarHBondContact O-N 2.81Å; A615-I793 HydrophobicContact CB-CG2 4.17Å
616	L	90.9	Very high	82.7	Confident	4 Å²	4	25.6 Å²	25.6	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-68.5	-50.6	175.4	-72.3	163.4	0	0	0	110.9	L471 I561 D612 E613 K614 G619 A620 L740 F742 T791 I793	L471-L616 HydrophobicContact CD1-CD2 4.12Å; I561-L616 HydrophobicContact CD1-CD2 3.76Å; I561-L616 HydrophobicContact CG1-CD2 4.23Å; I561-L616 HydrophobicContact CG2-CB 3.83Å; I561-L616 VanDerWaalsContact CG2-O 3.32Å; I561-L616 WeakPolarHBondContact CG2-O 3.41Å; D612-L616 WeakPolarHBondContact O-CD1 3.32Å; D612-L616 VanDerWaalsContact O-CG 3.25Å; D612-L616 WeakPolarHBondContact O-CG 3.34Å; D612-L616 PolarHBondContact O-N 3.48Å; E613-L616 PolarHBondContact O-N 2.71Å; K614-L616 VanDerWaalsContact C-N 3.31Å; K614-L616 PolarHBondContact O-N 2.94Å; L616-G619 PolarHBondContact O-N 3.35Å; L616-A620 PolarHBondContact O-N 3Å; L616-L740 HydrophobicContact CD1-CD1 4.03Å; L616-F742 HydrophobicContact CD1-CE2 4.44Å; L616-F742 HydrophobicContact CD1-CZ 3.98Å; L616-F742 HydrophobicContact CD2-CE2 4.41Å; L616-F742 HydrophobicContact CD2-CZ 4.4Å; L616-T791 HydrophobicContact CD2-CG2 4.09Å; L616-I793 HydrophobicContact CD1-CD1 4.1Å; L616-I793 HydrophobicContact CD2-CD1 4.13Å; L616-I793 HydrophobicContact CD2-CG1 4.44Å; L616-I793 HydrophobicContact CG-CD1 3.86Å
617	V	90.1	Very high	83.1	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.006	14%	0.141	C	C	.	.	H	α-helix	trans	-66.7	-42.2	-179.5	176.5	0	0	0	0	111.7	H565 V567 Y606 E613 K614 G619 A620 S621 F627	H565-V617 HydrophobicContact CB-CG2 4.23Å; H565-V617 WeakPolarHBondContact CD2-CG2 2.94Å; V567-V617 HydrophobicContact CB-CG2 4.31Å; V567-V617 HydrophobicContact CG1-CG1 4.42Å; V567-V617 HydrophobicContact CG2-CB 4.29Å; V567-V617 HydrophobicContact CG2-CG2 3.77Å; Y606-V617 HydrophobicContact CD1-CG1 3.93Å; Y606-V617 HydrophobicContact CD2-CG1 4.42Å; Y606-V617 HydrophobicContact CE1-CG1 3.78Å; Y606-V617 HydrophobicContact CE2-CG1 4.27Å; Y606-V617 HydrophobicContact CG-CG1 4.24Å; E613-V617 PolarHBondContact O-N 3.45Å; K614-V617 PolarHBondContact O-N 2.8Å; V617-G619 VanDerWaalsContact C-N 3.3Å; V617-G619 PolarHBondContact O-N 2.85Å; V617-A620 PolarHBondContact O-N 2.76Å; V617-S621 WeakPolarHBondContact O-CB 3.39Å; V617-S621 PolarHBondContact O-N 3.03Å; V617-F627 HydrophobicContact CG1-CB 4.2Å
618	E	86.7	Confident	83.4	Confident	34 Å²	34	23.6 Å²	23.6	16%	0.159	13%	0.133	C	C	.	.	H	α-helix	trans	-61.8	-38.2	171.5	-77.8	-175.1	178	0	0	112.2	Y606 K614 S621 K622	Y606-E618 HydrophobicContact CD2-CG 3.68Å; Y606-E618 HydrophobicContact CE2-CG 4.31Å; K614-E618 WeakPolarHBondContact CE-OE1 3.14Å; K614-E618 HydrophobicContact CG-CG 4.26Å; K614-E618 IonicContact NZ-OE1 3.98Å; K614-E618 VanDerWaalsContact O-CB 3.31Å; K614-E618 WeakPolarHBondContact O-CB 3.4Å; K614-E618 WeakPolarHBondContact O-CG 3.49Å; K614-E618 PolarHBondContact O-N 3.15Å; E618-S621 PolarHBondContact O-N 3.3Å; E618-K622 WeakPolarHBondContact O-CB 3.32Å; E618-K622 VanDerWaalsContact O-CG 3.3Å; E618-K622 WeakPolarHBondContact O-CG 3.18Å; E618-K622 PolarHBondContact O-N 3.24Å
619	G	83.6	Confident	83.6	Confident	11 Å²	11	22.6 Å²	22.6	11%	0.113	13%	0.125	C	C	.	.	H	α-helix	trans	-61.6	-46	174.5	0	0	0	0	0	112.3	A615 L616 V617 K622 L623	A615-G619 PolarHBondContact O-N 2.81Å; L616-G619 PolarHBondContact O-N 3.35Å; V617-G619 VanDerWaalsContact C-N 3.3Å; V617-G619 PolarHBondContact O-N 2.85Å; G619-K622 PolarHBondContact O-N 3.21Å; G619-L623 VanDerWaalsContact O-CG 3.31Å; G619-L623 WeakPolarHBondContact O-CG 3.38Å; G619-L623 PolarHBondContact O-N 3.43Å
620	A	87.1	Confident	84.2	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.2	-42.4	174.5	0	0	0	0	0	112.3	L558 I561 T562 L616 V617 K622 L623 G624 V625	L558-A620 HydrophobicContact CB-CB 4.23Å; L558-A620 HydrophobicContact CD2-CB 4.2Å; I561-A620 HydrophobicContact CG2-CB 3.85Å; T562-A620 HydrophobicContact CG2-CB 3.73Å; L616-A620 PolarHBondContact O-N 3Å; V617-A620 PolarHBondContact O-N 2.76Å; A620-K622 VanDerWaalsContact C-N 3.33Å; A620-K622 PolarHBondContact O-N 2.76Å; A620-L623 CarbonylContact O-C 3.49Å; A620-L623 WeakPolarHBondContact O-CA 3.34Å; A620-L623 PolarHBondContact O-N 2.89Å; A620-G624 PolarHBondContact O-N 2.81Å; A620-G624 VanDerWaalsContact O-N 3.15Å; A620-V625 CarbonylContact C-O 3.55Å; A620-V625 PolarHBondContact O-N 3.46Å; A620-V625 VanDerWaalsContact O-O 3.13Å
621	S	84.4	Confident	84.5	Confident	14 Å²	14	24.9 Å²	24.9	10%	0.098	13%	0.125	C	C	.	.	H	α-helix	trans	-59.1	-42.5	177.2	-164.3	0	0	0	0	111.8	Y606 V617 E618 L623 G624 V625	Y606-S621 WeakPolarHBondContact OH-CB 3.37Å; Y606-S621 PolarHBondContact OH-OG 3.37Å; V617-S621 WeakPolarHBondContact O-CB 3.39Å; V617-S621 PolarHBondContact O-N 3.03Å; E618-S621 PolarHBondContact O-N 3.3Å; S621-L623 VanDerWaalsContact C-N 3.27Å; S621-L623 PolarHBondContact O-N 3Å; S621-G624 PolarHBondContact O-N 2.82Å; S621-V625 VanDerWaalsContact CA-O 3.31Å; S621-V625 WeakPolarHBondContact CA-O 3.44Å; S621-V625 PolarHBondContact N-O 3.4Å; S621-V625 VanDerWaalsContact N-O 3.13Å
622	K	77.6	Confident	84.5	Confident	105 Å²	105	27.3 Å²	27.3	46%	0.457	14%	0.139	S	C	.	.	H	α-helix	trans	-68.4	-22.6	175.2	-74	169.8	-178.7	171.1	0	113.9	E618 G619 A620 Y649	E618-K622 WeakPolarHBondContact O-CB 3.32Å; E618-K622 VanDerWaalsContact O-CG 3.3Å; E618-K622 WeakPolarHBondContact O-CG 3.18Å; E618-K622 PolarHBondContact O-N 3.24Å; G619-K622 PolarHBondContact O-N 3.21Å; A620-K622 VanDerWaalsContact C-N 3.33Å; A620-K622 PolarHBondContact O-N 2.76Å; K622-Y649 PolarHBondContact O-OH 2.88Å
623	L	77	Confident	84.3	Confident	12 Å²	12	26.3 Å²	26.3	6%	0.063	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	5.3	177.8	-66.5	170	0	0	0	113	C485 F554 L558 G619 A620 S621	C485-L623 HydrophobicContact CB-CD1 4.35Å; F554-L623 HydrophobicContact CE1-CD1 4.49Å; F554-L623 HydrophobicContact CZ-CD1 4.15Å; L558-L623 HydrophobicContact CD1-CB 3.61Å; L558-L623 HydrophobicContact CD1-CD1 4.22Å; L558-L623 HydrophobicContact CD2-CB 4.49Å; L558-L623 HydrophobicContact CD2-CD1 3.82Å; G619-L623 VanDerWaalsContact O-CG 3.31Å; G619-L623 WeakPolarHBondContact O-CG 3.38Å; G619-L623 PolarHBondContact O-N 3.43Å; A620-L623 CarbonylContact O-C 3.49Å; A620-L623 WeakPolarHBondContact O-CA 3.34Å; A620-L623 PolarHBondContact O-N 2.89Å; S621-L623 VanDerWaalsContact C-N 3.27Å; S621-L623 PolarHBondContact O-N 3Å
624	G	75.8	Confident	83.7	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.01	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	96	13.9	173.3	0	0	0	0	0	116	A620 S621 W647	A620-G624 PolarHBondContact O-N 2.81Å; A620-G624 VanDerWaalsContact O-N 3.15Å; S621-G624 PolarHBondContact O-N 2.82Å; G624-W647 PolarHBondContact O-N 3.48Å
625	V	85.7	Confident	83	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.024	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	100.5	170.7	-175.3	0	0	0	0	108.6	L558 T562 A620 S621 I644 Y646	L558-V625 HydrophobicContact CB-CB 3.92Å; L558-V625 HydrophobicContact CB-CG1 4.42Å; L558-V625 HydrophobicContact CB-CG2 3.65Å; L558-V625 HydrophobicContact CD1-CG2 4Å; T562-V625 HydrophobicContact CG2-CG1 4.23Å; A620-V625 CarbonylContact C-O 3.55Å; A620-V625 PolarHBondContact O-N 3.46Å; A620-V625 VanDerWaalsContact O-O 3.13Å; S621-V625 VanDerWaalsContact CA-O 3.31Å; S621-V625 WeakPolarHBondContact CA-O 3.44Å; S621-V625 PolarHBondContact N-O 3.4Å; S621-V625 VanDerWaalsContact N-O 3.13Å; V625-I644 HydrophobicContact CG1-CG2 3.6Å; V625-Y646 HydrophobicContact CB-CE1 4.47Å; V625-Y646 HydrophobicContact CG1-CD1 4.22Å; V625-Y646 HydrophobicContact CG1-CE1 3.78Å; V625-Y646 HydrophobicContact CG2-CD1 3.89Å; V625-Y646 HydrophobicContact CG2-CE1 3.94Å
626	V	86.4	Confident	82.1	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.6	-165.3	-179.3	0	0	0	0	109.8	Y604 I644 D645	Y604-V626 HydrophobicContact CD2-CG1 3.47Å; Y604-V626 VanDerWaalsContact CD2-CG1 3.47Å; Y604-V626 HydrophobicContact CE2-CG1 3.67Å; V626-I644 CarbonylContact O-C 3.59Å; V626-I644 WeakPolarHBondContact O-CA 3.17Å; V626-D645 HydrophobicContact CB-CB 4.22Å; V626-D645 PolarHBondContact N-O 3.11Å; V626-D645 PolarHBondContact O-N 3.32Å
627	F	89.3	Confident	80.8	Confident	1 Å²	1	44.9 Å²	44.9	0%	0.004	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	116	173.9	168	-121.4	0	0	0	109.1	H565 L569 Y606 V617 G629 K630 L642	H565-F627 AromaticContact CE1-CD1 3.83Å; H565-F627 AromaticContact CE1-CE1 3.75Å; H565-F627 AromaticContact CE1-CZ 3.93Å; H565-F627 AromaticContact NE2-CD1 3.98Å; H565-F627 AromaticContact NE2-CG 3.9Å; L569-F627 HydrophobicContact CD1-CD1 4.44Å; L569-F627 HydrophobicContact CD1-CE1 4.13Å; L569-F627 HydrophobicContact CD1-CZ 4.45Å; L569-F627 HydrophobicContact CG-CD1 4.26Å; L569-F627 HydrophobicContact CG-CE1 3.99Å; Y606-F627 HydrophobicContact CD1-CD1 4.18Å; Y606-F627 HydrophobicContact CE1-CB 4.01Å; Y606-F627 AromaticContact CE1-CD1 3.86Å; Y606-F627 HydrophobicContact CE1-CD1 3.86Å; Y606-F627 HydrophobicContact CE1-CG 4.42Å; Y606-F627 PolarHBondContact OH-N 3.08Å; Y606-F627 PolarHBondContact OH-O 2.98Å; V617-F627 HydrophobicContact CG1-CB 4.2Å; F627-G629 WeakPolarHBondContact CE2-O 3.24Å; F627-K630 HydrophobicContact CE2-CB 4.36Å; F627-K630 HydrophobicContact CZ-CB 3.94Å; F627-L642 HydrophobicContact CE2-CB 4.24Å; F627-L642 HydrophobicContact CE2-CD2 4.15Å; F627-L642 HydrophobicContact CE2-CG 3.94Å
628	S	84	Confident	79.7	Confident	6 Å²	6	47.8 Å²	47.8	4%	0.042	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-16.2	-165.1	55.9	0	0	0	0	115.4	L569 Y643 D645	L569-S628 VanDerWaalsContact CD1-C 3.48Å; L569-S628 WeakPolarHBondContact CD1-O 3.13Å; S628-Y643 PolarHBondContact N-O 3.14Å; S628-Y643 WeakPolarHBondContact OG-CB 3.49Å; S628-Y643 PolarHBondContact OG-O 3.04Å; S628-D645 VanDerWaalsContact CB-CG 3.46Å; S628-D645 WeakPolarHBondContact CB-OD1 3.14Å; S628-D645 WeakPolarHBondContact CB-OD2 3.33Å; S628-D645 VanDerWaalsContact OG-CG 3.26Å; S628-D645 PolarHBondContact OG-OD1 3.19Å
629	G	82.5	Confident	79.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.7	157.9	178.2	0	0	0	0	0	114.3	F627 L642 Y643	F627-G629 WeakPolarHBondContact CE2-O 3.24Å; G629-L642 WeakPolarHBondContact O-CA 3.22Å; G629-Y643 PolarHBondContact O-N 3.04Å
630	K	83.9	Confident	79.5	Confident	88 Å²	88	47.8 Å²	47.8	38%	0.383	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	126.7	171.6	173.4	-174.3	171.5	-164.6	0	110.2	F627 N640 R641 L642	F627-K630 HydrophobicContact CE2-CB 4.36Å; F627-K630 HydrophobicContact CZ-CB 3.94Å; K630-N640 WeakPolarHBondContact CE-OD1 3.3Å; K630-N640 HydrophobicContact CG-CB 4.36Å; K630-R641 CarbonylContact C-O 3.56Å; K630-R641 VanDerWaalsContact CA-O 3.29Å; K630-R641 WeakPolarHBondContact CA-O 3.46Å; K630-L642 HydrophobicContact CG-CD1 4.19Å
631	E	83.9	Confident	79.5	Confident	74 Å²	74	51.6 Å²	51.6	35%	0.346	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	146.8	-179.2	-70.2	169	179.2	0	0	110.2	N640 R641 Y643	E631-N640 CarbonylContact O-C 3.47Å; E631-N640 WeakPolarHBondContact O-CA 3.47Å; E631-R641 PolarHBondContact N-O 3Å; E631-R641 PolarHBondContact O-N 3.32Å; E631-Y643 HydrophobicContact CB-CE2 4.47Å; E631-Y643 HydrophobicContact CG-CE2 4.12Å; E631-Y643 WeakPolarHBondContact OE2-CE2 3.23Å; E631-Y643 PolarHBondContact OE2-OH 2.87Å
632	P	79	Confident	79.7	Confident	94 Å²	94	51.3 Å²	51.3	61%	0.61	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	137	169.7	29.8	-33.5	0	0	0	109.9	L634	P632-L634 PolarHBondContact O-N 3.41Å
633	D	79.6	Confident	80.3	Confident	10 Å²	10	48.5 Å²	48.5	5%	0.053	27%	0.267	C	S	.	.			trans	-78	108.9	175	-168.2	14.9	0	0	0	110	N635 E636 S639 R641	D633-N635 PolarHBondContact O-N 3.17Å; D633-E636 PolarHBondContact O-N 3.49Å; D633-E636 VanDerWaalsContact O-N 3.15Å; D633-S639 PolarHBondContact N-O 3.2Å; D633-R641 HydrophobicContact CB-CG 4.15Å; D633-R641 IonicContact OD1-CZ 2.69Å; D633-R641 IonicContact OD1-NE 2.73Å; D633-R641 PolarHBondContact OD1-NE 3.17Å; D633-R641 IonicContact OD1-NH2 3.74Å; D633-R641 PolarHBondContact OD1-NH2 3.01Å
634	L	76.2	Confident	80.9	Confident	165 Å²	165	47.9 Å²	47.9	86%	0.864	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-23.2	-177.4	-64.3	173.4	0	0	0	113.3	P632	P632-L634 PolarHBondContact O-N 3.41Å
635	N	71.5	Confident	81.5	Confident	134 Å²	134	48.1 Å²	48.1	72%	0.717	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-23.1	-177.9	-66.4	-10.9	0	0	0	113.6	D633	D633-N635 PolarHBondContact O-N 3.17Å
636	E	68.3	Low	81.4	Confident	55 Å²	55	48.1 Å²	48.1	26%	0.257	26%	0.264	S	S	.	.	S	Bend	trans	-139.8	112	-172.3	-76	-174.5	-154.3	0	0	112.4	D633 G638 S639 R691	D633-E636 PolarHBondContact O-N 3.49Å; D633-E636 VanDerWaalsContact O-N 3.15Å; E636-G638 PolarHBondContact O-N 3.41Å; E636-G638 VanDerWaalsContact O-N 3.12Å; E636-S639 PolarHBondContact O-N 3.39Å; E636-S639 PolarHBondContact OE2-OG 2.94Å; E636-S639 VanDerWaalsContact OE2-OG 3.11Å; E636-R691 IonicContact OE1-CZ 3.59Å; E636-R691 IonicContact OE1-NH1 3.24Å; E636-R691 PolarHBondContact OE1-NH1 2.86Å; E636-R691 IonicContact OE1-NH2 3.72Å; E636-R691 PolarHBondContact OE1-NH2 3.39Å; E636-R691 VanDerWaalsContact OE1-NH2 3.13Å; E636-R691 IonicContact OE2-CZ 2.72Å; E636-R691 IonicContact OE2-NH1 3.01Å; E636-R691 IonicContact OE2-NH2 2.66Å; E636-R691 PolarHBondContact OE2-NH2 2.79Å
637	T	64.6	Low	81	Confident	130 Å²	130	50.2 Å²	50.2	80%	0.798	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	117.7	-179.9	49.8	0	0	0	0	112.2	K760	T637-K760 PolarHBondContact O-NZ 3.37Å
638	G	67.2	Low	80	Confident	63 Å²	63	52 Å²	52	65%	0.649	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.5	-12.8	-179.6	0	0	0	0	0	115.3	E636 N640	E636-G638 PolarHBondContact O-N 3.41Å; E636-G638 VanDerWaalsContact O-N 3.12Å; G638-N640 PolarHBondContact O-ND2 2.9Å
639	S	80.1	Confident	78.9	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.014	29%	0.294	C	S	.	.			trans	-82.9	146.8	178.4	-55.9	0	0	0	0	110.8	D633 E636 V673	D633-S639 PolarHBondContact N-O 3.2Å; E636-S639 PolarHBondContact O-N 3.39Å; E636-S639 PolarHBondContact OE2-OG 2.94Å; E636-S639 VanDerWaalsContact OE2-OG 3.11Å; S639-V673 CarbonylContact C-O 3.05Å; S639-V673 WeakPolarHBondContact CA-O 3.34Å
640	N	84.5	Confident	77.3	Confident	43 Å²	43	58.2 Å²	58.2	23%	0.23	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136.6	177.6	-61	-95.3	0	0	0	110.6	K630 E631 G638 L642 V673	K630-N640 WeakPolarHBondContact CE-OD1 3.3Å; K630-N640 HydrophobicContact CG-CB 4.36Å; E631-N640 CarbonylContact O-C 3.47Å; E631-N640 WeakPolarHBondContact O-CA 3.47Å; G638-N640 PolarHBondContact O-ND2 2.9Å; N640-L642 HydrophobicContact CB-CD1 4.03Å; N640-V673 PolarHBondContact N-O 3.22Å; N640-V673 PolarHBondContact O-N 2.9Å
641	R	87.7	Confident	75.3	Confident	79 Å²	79	57.8 Å²	57.8	30%	0.298	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.1	169	-62.1	-177.2	-175.3	-165.1	2	109.1	K630 E631 D633 Y671	K630-R641 CarbonylContact C-O 3.56Å; K630-R641 VanDerWaalsContact CA-O 3.29Å; K630-R641 WeakPolarHBondContact CA-O 3.46Å; E631-R641 PolarHBondContact N-O 3Å; E631-R641 PolarHBondContact O-N 3.32Å; D633-R641 HydrophobicContact CB-CG 4.15Å; D633-R641 IonicContact OD1-CZ 2.69Å; D633-R641 IonicContact OD1-NE 2.73Å; D633-R641 PolarHBondContact OD1-NE 3.17Å; D633-R641 IonicContact OD1-NH2 3.74Å; D633-R641 PolarHBondContact OD1-NH2 3.01Å; R641-Y671 WeakPolarHBondContact CA-O 3.1Å
642	L	89.9	Confident	73.1	Confident	8 Å²	8	60.4 Å²	60.4	4%	0.042	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	133.2	173.8	-81.4	66.5	0	0	0	108.9	F627 G629 K630 N640 C670 Y671 V673	F627-L642 HydrophobicContact CE2-CB 4.24Å; F627-L642 HydrophobicContact CE2-CD2 4.15Å; F627-L642 HydrophobicContact CE2-CG 3.94Å; G629-L642 WeakPolarHBondContact O-CA 3.22Å; K630-L642 HydrophobicContact CG-CD1 4.19Å; N640-L642 HydrophobicContact CB-CD1 4.03Å; L642-C670 WeakPolarHBondContact O-CA 3.43Å; L642-Y671 PolarHBondContact N-O 3Å; L642-Y671 PolarHBondContact O-N 3.34Å; L642-V673 HydrophobicContact CD1-CB 4.05Å; L642-V673 HydrophobicContact CD1-CG2 3.67Å; L642-V673 HydrophobicContact CD2-CG2 4.02Å; L642-V673 HydrophobicContact CG-CG2 4.38Å
643	Y	89.4	Confident	70.8	Confident	46 Å²	46	62 Å²	62	18%	0.18	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	132.1	176.6	-58.5	-83.2	0	0	0	110.4	S628 G629 E631 R668 C670	S628-Y643 PolarHBondContact N-O 3.14Å; S628-Y643 WeakPolarHBondContact OG-CB 3.49Å; S628-Y643 PolarHBondContact OG-O 3.04Å; G629-Y643 PolarHBondContact O-N 3.04Å; E631-Y643 HydrophobicContact CB-CE2 4.47Å; E631-Y643 HydrophobicContact CG-CE2 4.12Å; E631-Y643 WeakPolarHBondContact OE2-CE2 3.23Å; E631-Y643 PolarHBondContact OE2-OH 2.87Å; Y643-R668 HydrophobicContact CD1-CG 4.39Å; Y643-C670 HydrophobicContact CD1-CB 4.07Å; Y643-C670 HydrophobicContact CE1-CB 4.05Å
644	I	89.6	Confident	68.6	Low	0 Å²	0	68 Å²	68	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	127.4	179.4	-62.4	173.7	0	0	0	109.1	T559 T562 L563 V625 V626 Y646 R668 Q669 Y671	T559-I644 HydrophobicContact CG2-CD1 4.37Å; T562-I644 WeakPolarHBondContact OG1-CD1 3.5Å; L563-I644 HydrophobicContact CD2-CD1 3.66Å; L563-I644 HydrophobicContact CG-CD1 3.88Å; V625-I644 HydrophobicContact CG1-CG2 3.6Å; V626-I644 CarbonylContact O-C 3.59Å; V626-I644 WeakPolarHBondContact O-CA 3.17Å; I644-Y646 HydrophobicContact CB-CE2 4.47Å; I644-Y646 HydrophobicContact CG2-CD2 4.48Å; I644-Y646 HydrophobicContact CG2-CE1 4.32Å; I644-Y646 HydrophobicContact CG2-CE2 3.9Å; I644-R668 CarbonylContact O-C 3.55Å; I644-R668 WeakPolarHBondContact O-CA 3.46Å; I644-Q669 PolarHBondContact N-O 3.01Å; I644-Q669 PolarHBondContact O-N 2.94Å; I644-Y671 HydrophobicContact CB-CE2 4.42Å; I644-Y671 HydrophobicContact CD1-CD2 3.82Å; I644-Y671 HydrophobicContact CD1-CE2 3.9Å; I644-Y671 HydrophobicContact CG1-CD2 4.35Å
645	D	87.3	Confident	66.4	Low	5 Å²	5	66 Å²	66	3%	0.027	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.1	-177	-69.5	11.4	0	0	0	109.8	V626 S628 F665 R668	V626-D645 HydrophobicContact CB-CB 4.22Å; V626-D645 PolarHBondContact N-O 3.11Å; V626-D645 PolarHBondContact O-N 3.32Å; S628-D645 VanDerWaalsContact CB-CG 3.46Å; S628-D645 WeakPolarHBondContact CB-OD1 3.14Å; S628-D645 WeakPolarHBondContact CB-OD2 3.33Å; S628-D645 VanDerWaalsContact OG-CG 3.26Å; S628-D645 PolarHBondContact OG-OD1 3.19Å; D645-F665 HydrophobicContact CB-CE2 3.92Å; D645-R668 WeakPolarHBondContact OD1-CG 3.37Å; D645-R668 IonicContact OD1-CZ 3.71Å; D645-R668 IonicContact OD1-NE 3.71Å; D645-R668 PolarHBondContact OD1-NE 3.08Å; D645-R668 IonicContact OD1-NH2 3.54Å; D645-R668 PolarHBondContact OD1-NH2 3.35Å; D645-R668 IonicContact OD2-CZ 3.83Å; D645-R668 IonicContact OD2-NE 3.62Å; D645-R668 IonicContact OD2-NH2 2.71Å; D645-R668 PolarHBondContact OD2-NH2 3.08Å
646	Y	85.7	Confident	64.5	Low	5 Å²	5	65.8 Å²	65.8	2%	0.02	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	138.5	179.8	-65.2	-84.6	0	0	0	111.7	R555 T559 V625 I644 L666 N667 Q669 Y671	R555-Y646 HydrophobicContact CG-CD1 4.21Å; R555-Y646 HydrophobicContact CG-CE1 4.02Å; T559-Y646 WeakPolarHBondContact CG2-OH 3.23Å; T559-Y646 WeakPolarHBondContact OG1-CE1 3.36Å; T559-Y646 PolarHBondContact OG1-OH 3.24Å; V625-Y646 HydrophobicContact CB-CE1 4.47Å; V625-Y646 HydrophobicContact CG1-CD1 4.22Å; V625-Y646 HydrophobicContact CG1-CE1 3.78Å; V625-Y646 HydrophobicContact CG2-CD1 3.89Å; V625-Y646 HydrophobicContact CG2-CE1 3.94Å; I644-Y646 HydrophobicContact CB-CE2 4.47Å; I644-Y646 HydrophobicContact CG2-CD2 4.48Å; I644-Y646 HydrophobicContact CG2-CE1 4.32Å; I644-Y646 HydrophobicContact CG2-CE2 3.9Å; Y646-L666 WeakPolarHBondContact O-CB 3.37Å; Y646-L666 PolarHBondContact O-N 3.49Å; Y646-N667 WeakPolarHBondContact CB-OD1 3.26Å; Y646-N667 WeakPolarHBondContact CD2-OD1 3.42Å; Y646-N667 PolarHBondContact N-O 2.92Å; Y646-Q669 HydrophobicContact CD2-CG 4.32Å; Y646-Q669 HydrophobicContact CE2-CB 4.08Å; Y646-Q669 HydrophobicContact CE2-CG 3.91Å; Y646-Y671 PolarHBondContact OH-OH 3.02Å
647	W	76.5	Confident	62.7	Low	47 Å²	47	72.3 Å²	72.3	18%	0.178	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	159.5	-179.4	-59.1	75.3	0	0	0	111.8	G624 E663 K664 F665	G624-W647 PolarHBondContact O-N 3.48Å; W647-E663 HydrophobicContact CE3-CB 4.42Å; W647-K664 CarbonylContact C-O 3.54Å; W647-K664 WeakPolarHBondContact CA-O 3.42Å; W647-F665 HydrophobicContact CD2-CB 4.33Å; W647-F665 HydrophobicContact CD2-CD2 4.28Å; W647-F665 AromaticContact CE2-CD2 3.81Å; W647-F665 HydrophobicContact CE3-CB 3.98Å; W647-F665 HydrophobicContact CH2-CB 4.08Å; W647-F665 HydrophobicContact CH2-CD2 4.27Å; W647-F665 HydrophobicContact CZ2-CB 4.42Å; W647-F665 AromaticContact CZ2-CD2 3.81Å; W647-F665 HydrophobicContact CZ2-CD2 3.81Å; W647-F665 HydrophobicContact CZ3-CB 3.85Å
648	S	68.5	Low	61.1	Low	37 Å²	37	76.5 Å²	76.5	26%	0.259	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	156.5	170.9	57.6	0	0	0	0	111.6	K664	S648-K664 PolarHBondContact N-O 2.98Å; S648-K664 PolarHBondContact O-N 3.42Å; S648-K664 PolarHBondContact OG-O 3.29Å
649	Y	60.2	Low	59.4	Low	63 Å²	63	82 Å²	82	25%	0.247	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.7	172	-61.1	-92.8	0	0	0	109.3	L547 R602 K622 E663	L547-Y649 HydrophobicContact CB-CD2 4.33Å; L547-Y649 HydrophobicContact CD2-CD2 3.87Å; L547-Y649 HydrophobicContact CD2-CE2 4.03Å; L547-Y649 HydrophobicContact CG-CD2 4.5Å; R602-Y649 VanDerWaalsContact NH1-CE1 3.31Å; R602-Y649 PolarHBondContact NH1-OH 3.09Å; K622-Y649 PolarHBondContact O-OH 2.88Å; Y649-E663 HydrophobicContact CD1-CG 4.27Å; Y649-E663 HydrophobicContact CE1-CG 4.21Å
650	S	49	Very low	57.3	Low	75 Å²	75	85.9 Å²	85.9	52%	0.524	46%	0.462	S	S	.	.			trans	-96.7	112.7	169.5	55.2	0	0	0	0	110.4	T652 N662	S650-T652 PolarHBondContact O-N 2.8Å; S650-N662 PolarHBondContact OG-O 3.37Å
651	S	43.3	Very low	55.4	Low	79 Å²	79	90.2 Å²	90.2	55%	0.552	49%	0.485	S	S	*	.			trans	-90.5	86.5	172.6	62	0	0	0	0	111	T653	S651-T653 PolarHBondContact O-N 3.33Å
652	T	36.6	Very low	53.5	Low	128 Å²	128	92.1 Å²	92.1	79%	0.785	50%	0.502	S	S	*	.			trans	-74.6	110.4	165.5	37	0	0	0	0	109.8	S650 T654	S650-T652 PolarHBondContact O-N 2.8Å; T652-T654 PolarHBondContact O-N 2.62Å
653	T	32.1	Very low	52.1	Low	129 Å²	129	95 Å²	95	79%	0.791	52%	0.515	S	S	*	.			trans	-72.5	103.6	175.3	45.8	0	0	0	0	111.6	S651	S651-T653 PolarHBondContact O-N 3.33Å
654	T	32.9	Very low	50.9	Low	135 Å²	135	99.6 Å²	99.6	83%	0.828	54%	0.536	S	S	*	.			trans	-158.3	150.5	147.4	14.8	0	0	0	0	111.3	T652	T652-T654 PolarHBondContact O-N 2.62Å
655	T	30.5	Very low	50.3	Low	123 Å²	123	103.8 Å²	103.8	76%	0.755	55%	0.554	S	S	*	*			trans	-66	154.1	179.4	44.3	0	0	0	0	113.5
656	T	29.9	Very low	49.8	Very low	130 Å²	130	107.1 Å²	107.1	80%	0.798	57%	0.571	S	S	*	*			trans	89.5	130.5	167.6	77.6	0	0	0	0	118
657	K	31.5	Very low	49.8	Very low	192 Å²	192	109.7 Å²	109.7	84%	0.835	59%	0.586	S	S	*	*			trans	65.1	119.5	163.2	-65	-179.8	-179.8	177.9	0	119	E659	K657-E659 PolarHBondContact O-N 3.18Å
658	K	31.6	Very low	50.2	Low	218 Å²	218	113.8 Å²	113.8	95%	0.948	60%	0.601	S	S	*	*			trans	-32.4	93	163	-60.2	170.4	173.1	-179.3	0	114.9
659	E	30.8	Very low	51.2	Low	179 Å²	179	114.9 Å²	114.9	84%	0.836	60%	0.602	S	S	*	*			trans	-136.1	156	163.9	-68.4	-170.5	169.9	0	0	110.8	K657	K657-E659 PolarHBondContact O-N 3.18Å
660	S	35.3	Very low	52.7	Low	82 Å²	82	114 Å²	114	57%	0.573	61%	0.605	S	S	*	*			trans	-49.4	138	-163.6	47.7	0	0	0	0	116.4	N662	S660-N662 PolarHBondContact O-N 2.71Å; S660-N662 VanDerWaalsContact O-N 3.08Å
661	N	44.6	Very low	54.7	Low	134 Å²	134	110.9 Å²	110.9	72%	0.717	58%	0.582	S	S	*	*			trans	-64.1	107.2	168.4	-73.4	-27.6	0	0	0	110.1	E663	N661-E663 VanDerWaalsContact C-N 3.35Å; N661-E663 HydrophobicContact CB-CG 4.23Å; N661-E663 PolarHBondContact O-N 2.73Å
662	N	48.8	Very low	57	Low	119 Å²	119	109 Å²	109	64%	0.636	57%	0.565	S	S	*	*			trans	-72.6	89.2	171.4	-79.5	-23.6	0	0	0	110.5	S650 S660	S650-N662 PolarHBondContact OG-O 3.37Å; S660-N662 PolarHBondContact O-N 2.71Å; S660-N662 VanDerWaalsContact O-N 3.08Å
663	E	59.2	Low	59.6	Low	69 Å²	69	103.3 Å²	103.3	32%	0.322	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	122.9	174.7	-60	-179.2	160.2	0	0	110	R602 W647 Y649 N661	R602-E663 WeakPolarHBondContact CD-OE2 3.12Å; R602-E663 IonicContact CZ-OE1 2.64Å; R602-E663 IonicContact CZ-OE2 2.69Å; R602-E663 IonicContact NE-OE2 3.47Å; R602-E663 PolarHBondContact NE-OE2 2.94Å; R602-E663 IonicContact NH1-OE1 3.76Å; R602-E663 PolarHBondContact NH1-OE1 2.9Å; R602-E663 IonicContact NH1-OE2 3.92Å; R602-E663 PolarHBondContact NH1-OE2 3.17Å; R602-E663 IonicContact NH2-OE2 3.49Å; W647-E663 HydrophobicContact CE3-CB 4.42Å; Y649-E663 HydrophobicContact CD1-CG 4.27Å; Y649-E663 HydrophobicContact CE1-CG 4.21Å; N661-E663 VanDerWaalsContact C-N 3.35Å; N661-E663 HydrophobicContact CB-CG 4.23Å; N661-E663 PolarHBondContact O-N 2.73Å
664	K	65.9	Low	62.3	Low	143 Å²	143	97.4 Å²	97.4	62%	0.622	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	117.3	-178.8	-172.6	174.3	-177	178.9	0	110.9	W647 S648	W647-K664 CarbonylContact C-O 3.54Å; W647-K664 WeakPolarHBondContact CA-O 3.42Å; S648-K664 PolarHBondContact N-O 2.98Å; S648-K664 PolarHBondContact O-N 3.42Å; S648-K664 PolarHBondContact OG-O 3.29Å
665	F	75.6	Confident	65	Low	88 Å²	88	91.5 Å²	91.5	39%	0.386	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	130.5	164.5	178.6	-99	0	0	0	109.4	D645 W647 R668	D645-F665 HydrophobicContact CB-CE2 3.92Å; W647-F665 HydrophobicContact CD2-CB 4.33Å; W647-F665 HydrophobicContact CD2-CD2 4.28Å; W647-F665 AromaticContact CE2-CD2 3.81Å; W647-F665 HydrophobicContact CE3-CB 3.98Å; W647-F665 HydrophobicContact CH2-CB 4.08Å; W647-F665 HydrophobicContact CH2-CD2 4.27Å; W647-F665 HydrophobicContact CZ2-CB 4.42Å; W647-F665 AromaticContact CZ2-CD2 3.81Å; W647-F665 HydrophobicContact CZ2-CD2 3.81Å; W647-F665 HydrophobicContact CZ3-CB 3.85Å; F665-R668 HydrophobicContact CZ-CB 3.94Å
666	L	76.9	Confident	67.7	Low	74 Å²	74	88.5 Å²	88.5	39%	0.387	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-60.1	-179	-66.3	169	0	0	0	110.6	Y646	Y646-L666 WeakPolarHBondContact O-CB 3.37Å; Y646-L666 PolarHBondContact O-N 3.49Å
667	N	85.5	Confident	70.6	Confident	60 Å²	60	82.4 Å²	82.4	32%	0.321	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	159.2	-179	59.2	-21.7	0	0	0	111.4	Y646 Q669	Y646-N667 WeakPolarHBondContact CB-OD1 3.26Å; Y646-N667 WeakPolarHBondContact CD2-OD1 3.42Å; Y646-N667 PolarHBondContact N-O 2.92Å; N667-Q669 PolarHBondContact ND2-NE2 2.85Å
668	R	86.3	Confident	73.2	Confident	132 Å²	132	80 Å²	80	50%	0.498	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	137.3	163.7	173.2	173.7	-67.5	175.6	-0.5	108.6	Y643 I644 D645 F665	Y643-R668 HydrophobicContact CD1-CG 4.39Å; I644-R668 CarbonylContact O-C 3.55Å; I644-R668 WeakPolarHBondContact O-CA 3.46Å; D645-R668 WeakPolarHBondContact OD1-CG 3.37Å; D645-R668 IonicContact OD1-CZ 3.71Å; D645-R668 IonicContact OD1-NE 3.71Å; D645-R668 PolarHBondContact OD1-NE 3.08Å; D645-R668 IonicContact OD1-NH2 3.54Å; D645-R668 PolarHBondContact OD1-NH2 3.35Å; D645-R668 IonicContact OD2-CZ 3.83Å; D645-R668 IonicContact OD2-NE 3.62Å; D645-R668 IonicContact OD2-NH2 2.71Å; D645-R668 PolarHBondContact OD2-NH2 3.08Å; F665-R668 HydrophobicContact CZ-CB 3.94Å
669	Q	89.7	Confident	75.8	Confident	60 Å²	60	74.4 Å²	74.4	28%	0.28	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	146.1	173.2	-65.5	-173.7	-25.4	0	0	110.1	I644 Y646 N667 Y671	I644-Q669 PolarHBondContact N-O 3.01Å; I644-Q669 PolarHBondContact O-N 2.94Å; Y646-Q669 HydrophobicContact CD2-CG 4.32Å; Y646-Q669 HydrophobicContact CE2-CB 4.08Å; Y646-Q669 HydrophobicContact CE2-CG 3.91Å; N667-Q669 PolarHBondContact ND2-NE2 2.85Å; Q669-Y671 HydrophobicContact CB-CD2 4.41Å; Q669-Y671 HydrophobicContact CB-CE2 3.78Å; Q669-Y671 PolarHBondContact OE1-OH 2.8Å
670	C	90.5	Very high	78.1	Confident	45 Å²	45	68.7 Å²	68.7	30%	0.304	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	132	176	-174.9	0	0	0	0	109.3	L642 Y643	L642-C670 WeakPolarHBondContact O-CA 3.43Å; Y643-C670 HydrophobicContact CD1-CB 4.07Å; Y643-C670 HydrophobicContact CE1-CB 4.05Å
671	Y	92.1	Very high	79.9	Confident	10 Å²	10	69.4 Å²	69.4	4%	0.039	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141.2	177.4	-69.5	-98.8	0	0	0	108.9	T559 L563 R641 L642 I644 Y646 Q669 V690 Y692 P693	T559-Y671 HydrophobicContact CG2-CE1 4.37Å; T559-Y671 HydrophobicContact CG2-CE2 4.36Å; T559-Y671 WeakPolarHBondContact CG2-OH 3.28Å; L563-Y671 HydrophobicContact CD1-CD1 3.72Å; L563-Y671 HydrophobicContact CD1-CE1 3.84Å; L563-Y671 HydrophobicContact CD1-CG 4.24Å; L563-Y671 HydrophobicContact CD2-CD1 3.89Å; L563-Y671 HydrophobicContact CD2-CD2 4.04Å; L563-Y671 HydrophobicContact CD2-CG 3.56Å; L563-Y671 HydrophobicContact CG-CD1 4.44Å; L563-Y671 HydrophobicContact CG-CG 4.49Å; R641-Y671 WeakPolarHBondContact CA-O 3.1Å; L642-Y671 PolarHBondContact N-O 3Å; L642-Y671 PolarHBondContact O-N 3.34Å; I644-Y671 HydrophobicContact CB-CE2 4.42Å; I644-Y671 HydrophobicContact CD1-CD2 3.82Å; I644-Y671 HydrophobicContact CD1-CE2 3.9Å; I644-Y671 HydrophobicContact CG1-CD2 4.35Å; Y646-Y671 PolarHBondContact OH-OH 3.02Å; Q669-Y671 HydrophobicContact CB-CD2 4.41Å; Q669-Y671 HydrophobicContact CB-CE2 3.78Å; Q669-Y671 PolarHBondContact OE1-OH 2.8Å; Y671-V690 HydrophobicContact CD1-CG1 4.24Å; Y671-Y692 AromaticContact CD1-CD2 3.89Å; Y671-Y692 HydrophobicContact CD1-CD2 3.89Å; Y671-Y692 HydrophobicContact CD1-CE2 4.23Å; Y671-Y692 HydrophobicContact CD1-CG 4.06Å; Y671-Y692 AromaticContact CE1-CD1 3.78Å; Y671-Y692 HydrophobicContact CE1-CD1 3.78Å; Y671-Y692 AromaticContact CE1-CD2 3.9Å; Y671-Y692 HydrophobicContact CE1-CD2 3.9Å; Y671-Y692 HydrophobicContact CE1-CE1 4Å; Y671-Y692 HydrophobicContact CE1-CE2 4.13Å; Y671-Y692 AromaticContact CE1-CG 3.72Å; Y671-Y692 HydrophobicContact CE1-CG 3.72Å; Y671-P693 HydrophobicContact CE1-CG 4.21Å
672	I	91.3	Very high	81.5	Confident	40 Å²	40	70.2 Å²	70.2	21%	0.205	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119.6	-180	-42.3	176	0	0	0	109.2	D674 V690 R691	I672-D674 WeakPolarHBondContact CG2-OD1 3.31Å; I672-V690 CarbonylContact O-C 3.59Å; I672-V690 WeakPolarHBondContact O-CA 3.42Å; I672-R691 HydrophobicContact CB-CB 4.25Å; I672-R691 PolarHBondContact N-O 2.66Å; I672-R691 PolarHBondContact O-N 3.25Å
673	V	91	Very high	83.2	Confident	7 Å²	7	65.4 Å²	65.4	4%	0.042	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	108.1	178.2	173.5	0	0	0	0	108.9	S639 N640 L642 V676 V688 V690	S639-V673 CarbonylContact C-O 3.05Å; S639-V673 WeakPolarHBondContact CA-O 3.34Å; N640-V673 PolarHBondContact N-O 3.22Å; N640-V673 PolarHBondContact O-N 2.9Å; L642-V673 HydrophobicContact CD1-CB 4.05Å; L642-V673 HydrophobicContact CD1-CG2 3.67Å; L642-V673 HydrophobicContact CD2-CG2 4.02Å; L642-V673 HydrophobicContact CG-CG2 4.38Å; V673-V676 HydrophobicContact CG1-CG2 3.71Å; V673-V688 HydrophobicContact CB-CG1 4.38Å; V673-V688 HydrophobicContact CG1-CG1 3.43Å; V673-V688 VanDerWaalsContact CG1-CG1 3.43Å; V673-V688 HydrophobicContact CG2-CG1 4.14Å; V673-V690 HydrophobicContact CG2-CG1 4.46Å; V673-V690 HydrophobicContact CG2-CG2 4.22Å
674	D	89.1	Confident	84.5	Confident	5 Å²	5	66.6 Å²	66.6	3%	0.027	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-24.9	-172.2	-53.3	-32.6	0	0	0	112.9	I672 M689 R691 Y752 L756	I672-D674 WeakPolarHBondContact CG2-OD1 3.31Å; D674-M689 PolarHBondContact N-O 3.05Å; D674-R691 IonicContact OD1-CZ 2.63Å; D674-R691 VanDerWaalsContact OD1-CZ 3.24Å; D674-R691 IonicContact OD1-NE 3.81Å; D674-R691 PolarHBondContact OD1-NE 3.32Å; D674-R691 IonicContact OD1-NH2 3.73Å; D674-R691 PolarHBondContact OD1-NH2 3.26Å; D674-R691 WeakPolarHBondContact OD2-CG 3.18Å; D674-R691 IonicContact OD2-CZ 2.73Å; D674-R691 IonicContact OD2-NE 3.39Å; D674-R691 PolarHBondContact OD2-NE 3.01Å; D674-R691 IonicContact OD2-NH2 2.73Å; D674-Y752 WeakPolarHBondContact OD2-CE1 2.76Å; D674-Y752 VanDerWaalsContact OD2-CZ 3.29Å; D674-Y752 PolarHBondContact OD2-OH 2.99Å; D674-L756 HydrophobicContact CB-CD1 4.17Å; D674-L756 HydrophobicContact CB-CD2 3.94Å
675	A	88.6	Confident	85.6	Confident	12 Å²	12	60.5 Å²	60.5	10%	0.099	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	137.6	176	0	0	0	0	0	111.9	L677 M689 L756 L759	A675-L677 HydrophobicContact CB-CD1 4.42Å; A675-M689 HydrophobicContact CB-CB 4.23Å; A675-M689 HydrophobicContact CB-CG 4.32Å; A675-M689 HydrophobicContact CB-SD 4.14Å; A675-M689 PolarHBondContact O-N 2.79Å; A675-L756 HydrophobicContact CB-CD1 3.92Å; A675-L759 HydrophobicContact CB-CD2 4.42Å
676	V	88.6	Confident	86.4	Confident	60 Å²	60	56.5 Å²	56.5	36%	0.364	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	115.8	170.5	179.4	0	0	0	0	108.5	T566 V673 E678 V688	T566-V676 HydrophobicContact CG2-CG1 4.22Å; V673-V676 HydrophobicContact CG1-CG2 3.71Å; V676-E678 PolarHBondContact O-N 2.66Å; V676-V688 HydrophobicContact CG1-CG2 4.43Å; V676-V688 HydrophobicContact CG2-CG1 4.28Å; V676-V688 HydrophobicContact CG2-CG2 4.49Å
677	L	90.6	Very high	87.2	Confident	1 Å²	1	53 Å²	53	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	86.4	171.7	-69.1	67.3	0	0	0	107.4	A675 R683 S687 M689 L759 Y778 I781 E782	A675-L677 HydrophobicContact CB-CD1 4.42Å; L677-R683 PolarHBondContact O-NH2 3.15Å; L677-S687 WeakPolarHBondContact CA-O 3.27Å; L677-S687 WeakPolarHBondContact CB-O 3.35Å; L677-S687 PolarHBondContact N-O 2.79Å; L677-S687 PolarHBondContact O-N 3.14Å; L677-S687 VanDerWaalsContact O-N 3.16Å; L677-M689 HydrophobicContact CD1-CG 4.45Å; L677-L759 HydrophobicContact CD1-CD1 3.88Å; L677-L759 HydrophobicContact CG-CD1 4.15Å; L677-Y778 HydrophobicContact CB-CE1 4.42Å; L677-Y778 HydrophobicContact CD2-CD1 3.4Å; L677-Y778 VanDerWaalsContact CD2-CD1 3.4Å; L677-Y778 HydrophobicContact CD2-CE1 3.96Å; L677-Y778 HydrophobicContact CD2-CG 3.96Å; L677-Y778 HydrophobicContact CG-CD1 3.79Å; L677-Y778 HydrophobicContact CG-CE1 3.78Å; L677-I781 HydrophobicContact CD1-CD1 4.41Å; L677-I781 HydrophobicContact CD2-CB 4.35Å; L677-I781 HydrophobicContact CD2-CD1 4.12Å; L677-I781 HydrophobicContact CD2-CG2 4.03Å; L677-E782 HydrophobicContact CD2-CG 4.45Å
678	E	86.2	Confident	87.6	Confident	143 Å²	143	50.2 Å²	50.2	67%	0.668	25%	0.25	S	C	*	.			trans	-45.4	153.3	-177.6	-67.1	-173.5	171.4	0	0	113.6	V676 D680 R683	V676-E678 PolarHBondContact O-N 2.66Å; E678-D680 PolarHBondContact O-N 2.99Å; E678-R683 PolarHBondContact O-NH1 2.93Å
679	F	85.6	Confident	87.9	Confident	100 Å²	100	43.9 Å²	43.9	44%	0.439	23%	0.226	S	C	.	.			trans	-65.6	121.5	178	177.6	-87.8	0	0	0	111.6	P681 M686	F679-P681 HydrophobicContact CE1-CG 4.25Å; F679-M686 HydrophobicContact CB-CB 4.4Å
680	D	77.9	Confident	88.1	Confident	58 Å²	58	41 Å²	41	31%	0.31	21%	0.213	S	C	.	.			trans	-106.6	127.8	170.8	162	22.9	0	0	0	109.7	E678 I682 R683 K684	E678-D680 PolarHBondContact O-N 2.99Å; D680-I682 PolarHBondContact O-N 3.43Å; D680-I682 VanDerWaalsContact O-N 3.11Å; D680-I682 WeakPolarHBondContact OD1-CB 3.4Å; D680-I682 PolarHBondContact OD1-N 2.91Å; D680-R683 HydrophobicContact CB-CB 3.79Å; D680-R683 CarbonylContact O-C 3.57Å; D680-R683 PolarHBondContact O-N 3.31Å; D680-R683 PolarHBondContact OD2-N 3.21Å; D680-R683 VanDerWaalsContact OD2-N 3.16Å; D680-K684 PolarHBondContact O-N 3.27Å
681	P	73.1	Confident	88.2	Confident	97 Å²	97	40.7 Å²	40.7	63%	0.63	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-24.8	175	-26.8	35.1	0	0	0	115.5	F679 K684	F679-P681 HydrophobicContact CE1-CG 4.25Å; P681-K684 WeakPolarHBondContact O-CG 3.34Å
682	I	78.8	Confident	88.2	Confident	151 Å²	151	41.5 Å²	41.5	77%	0.774	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-46	174.5	-54.7	175.5	0	0	0	109.9	D680	D680-I682 PolarHBondContact O-N 3.43Å; D680-I682 VanDerWaalsContact O-N 3.11Å; D680-I682 WeakPolarHBondContact OD1-CB 3.4Å; D680-I682 PolarHBondContact OD1-N 2.91Å
683	R	84.1	Confident	88	Confident	18 Å²	18	43 Å²	43	7%	0.068	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-29.7	177.6	-152.9	172.2	99.3	-111.7	2.7	114	L677 E678 D680 R685 E782	L677-R683 PolarHBondContact O-NH2 3.15Å; E678-R683 PolarHBondContact O-NH1 2.93Å; D680-R683 HydrophobicContact CB-CB 3.79Å; D680-R683 CarbonylContact O-C 3.57Å; D680-R683 PolarHBondContact O-N 3.31Å; D680-R683 PolarHBondContact OD2-N 3.21Å; D680-R683 VanDerWaalsContact OD2-N 3.16Å; R683-R685 HydrophobicContact CG-CG 3.98Å; R683-R685 VanDerWaalsContact CG-CZ 3.43Å; R683-R685 VanDerWaalsContact CZ-O 3.32Å; R683-R685 PolarHBondContact NH2-O 2.86Å; R683-R685 PolarHBondContact O-N 2.87Å; R683-R685 PolarHBondContact O-NH1 2.92Å; R683-E782 IonicContact CZ-OE1 2.66Å; R683-E782 VanDerWaalsContact CZ-OE1 3.25Å; R683-E782 IonicContact NE-OE1 3.13Å; R683-E782 PolarHBondContact NE-OE1 3.4Å; R683-E782 IonicContact NE-OE2 3.7Å; R683-E782 PolarHBondContact NE-OE2 3.33Å; R683-E782 VanDerWaalsContact NE-OE2 3.15Å; R683-E782 IonicContact NH2-OE1 4Å; R683-E782 PolarHBondContact NH2-OE1 3.01Å
684	K	86.5	Confident	87.8	Confident	95 Å²	95	47.8 Å²	47.8	41%	0.413	25%	0.246	S	C	.	.			trans	53.6	25.5	-177.8	-52.4	-178.1	-179.1	179.8	0	116.5	D680 P681 G703 A704 T707	D680-K684 PolarHBondContact O-N 3.27Å; P681-K684 WeakPolarHBondContact O-CG 3.34Å; K684-G703 WeakPolarHBondContact O-CA 3.31Å; K684-A704 HydrophobicContact CB-CB 4.19Å; K684-A704 HydrophobicContact CD-CB 4.48Å; K684-A704 PolarHBondContact O-N 3.21Å; K684-A704 VanDerWaalsContact O-N 3.12Å; K684-T707 HydrophobicContact CB-CG2 3.86Å; K684-T707 HydrophobicContact CD-CG2 4.11Å; K684-T707 HydrophobicContact CG-CG2 4.35Å
685	R	90	Very high	87.7	Confident	14 Å²	14	50 Å²	50	5%	0.053	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	157.1	177.5	61.7	-167.8	179.1	-91.6	1.4	110.7	R683 K702 E782	R683-R685 HydrophobicContact CG-CG 3.98Å; R683-R685 VanDerWaalsContact CG-CZ 3.43Å; R683-R685 VanDerWaalsContact CZ-O 3.32Å; R683-R685 PolarHBondContact NH2-O 2.86Å; R683-R685 PolarHBondContact O-N 2.87Å; R683-R685 PolarHBondContact O-NH1 2.92Å; R685-K702 CarbonylContact C-O 3.54Å; R685-K702 WeakPolarHBondContact CA-O 3.44Å; R685-K702 VanDerWaalsContact CB-O 3.31Å; R685-K702 WeakPolarHBondContact CB-O 3.03Å; R685-E782 IonicContact CZ-OE2 2.99Å; R685-E782 VanDerWaalsContact NE-CD 3.3Å; R685-E782 IonicContact NE-OE1 3.51Å; R685-E782 IonicContact NE-OE2 3.04Å; R685-E782 PolarHBondContact NE-OE2 3.28Å; R685-E782 IonicContact NH2-OE2 2.67Å; R685-E782 PolarHBondContact NH2-OE2 2.77Å
686	M	92.1	Very high	87.9	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.025	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	144.7	166.5	172.2	-171.7	-77.3	0	0	107.6	T566 E613 F679 S701 K702	T566-M686 HydrophobicContact CG2-CE 3.48Å; T566-M686 VanDerWaalsContact CG2-CE 3.48Å; T566-M686 HydrophobicContact CG2-SD 4.42Å; E613-M686 WeakPolarHBondContact OE1-CE 3.3Å; F679-M686 HydrophobicContact CB-CB 4.4Å; M686-S701 WeakPolarHBondContact O-CA 3.48Å; M686-S701 PolarHBondContact O-OG 3.07Å; M686-K702 HydrophobicContact CB-CG 4.26Å; M686-K702 PolarHBondContact N-O 3.34Å; M686-K702 PolarHBondContact O-N 2.96Å; M686-K702 VanDerWaalsContact SD-CE 3.51Å
687	S	93.1	Very high	88.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	147.9	174.7	-54.9	0	0	0	0	110.9	L677 L700 S701 E782	L677-S687 WeakPolarHBondContact CA-O 3.27Å; L677-S687 WeakPolarHBondContact CB-O 3.35Å; L677-S687 PolarHBondContact N-O 2.79Å; L677-S687 PolarHBondContact O-N 3.14Å; L677-S687 VanDerWaalsContact O-N 3.16Å; S687-L700 CarbonylContact C-O 3.47Å; S687-L700 WeakPolarHBondContact CA-O 3.47Å; S687-S701 WeakPolarHBondContact OG-CB 3.26Å; S687-S701 PolarHBondContact OG-OG 3.44Å; S687-E782 VanDerWaalsContact CB-OE1 3.31Å; S687-E782 WeakPolarHBondContact CB-OE1 3.37Å; S687-E782 PolarHBondContact OG-OE1 2.62Å
688	V	93.5	Very high	88.3	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	134.8	-177	-172.9	0	0	0	0	109.1	V673 V676 V690 V699 L700	V673-V688 HydrophobicContact CB-CG1 4.38Å; V673-V688 HydrophobicContact CG1-CG1 3.43Å; V673-V688 VanDerWaalsContact CG1-CG1 3.43Å; V673-V688 HydrophobicContact CG2-CG1 4.14Å; V676-V688 HydrophobicContact CG1-CG2 4.43Å; V676-V688 HydrophobicContact CG2-CG1 4.28Å; V676-V688 HydrophobicContact CG2-CG2 4.49Å; V688-V690 HydrophobicContact CB-CG2 4.25Å; V688-V690 HydrophobicContact CG1-CG2 3.64Å; V688-V699 WeakPolarHBondContact O-CA 3.43Å; V688-L700 PolarHBondContact N-O 3.39Å; V688-L700 PolarHBondContact O-N 3.31Å
689	M	94	Very high	88.6	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	120.4	173.1	-62.9	-175.1	64.4	0	0	108.6	D674 A675 L677 V699 Y752 L755 L756 I781	D674-M689 PolarHBondContact N-O 3.05Å; A675-M689 HydrophobicContact CB-CB 4.23Å; A675-M689 HydrophobicContact CB-CG 4.32Å; A675-M689 HydrophobicContact CB-SD 4.14Å; A675-M689 PolarHBondContact O-N 2.79Å; L677-M689 HydrophobicContact CD1-CG 4.45Å; M689-V699 HydrophobicContact CG-CG2 4.41Å; M689-Y752 HydrophobicContact CB-CE2 3.81Å; M689-Y752 WeakPolarHBondContact CB-OH 3.46Å; M689-Y752 HydrophobicContact CE-CD1 4.28Å; M689-Y752 HydrophobicContact CE-CD2 3.7Å; M689-Y752 HydrophobicContact CE-CE1 4.21Å; M689-Y752 HydrophobicContact CE-CE2 3.63Å; M689-Y752 HydrophobicContact CE-CG 4.05Å; M689-Y752 HydrophobicContact CG-CE2 4.48Å; M689-Y752 PolarHBondContact O-OH 3.32Å; M689-L755 HydrophobicContact CE-CB 4.29Å; M689-L756 HydrophobicContact CE-CB 4.23Å; M689-I781 HydrophobicContact CG-CG2 4.38Å; M689-I781 HydrophobicContact SD-CD1 3.92Å; M689-I781 HydrophobicContact SD-CG1 4.28Å; M689-I781 HydrophobicContact SD-CG2 4.31Å
690	V	93.8	Very high	89	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	134.9	-170.5	-167.5	0	0	0	0	111.7	L563 Y671 I672 V673 V688 Y692 Y698 L700 Y752	L563-V690 HydrophobicContact CD1-CG1 4.41Å; L563-V690 HydrophobicContact CD2-CG1 4.35Å; Y671-V690 HydrophobicContact CD1-CG1 4.24Å; I672-V690 CarbonylContact O-C 3.59Å; I672-V690 WeakPolarHBondContact O-CA 3.42Å; V673-V690 HydrophobicContact CG2-CG1 4.46Å; V673-V690 HydrophobicContact CG2-CG2 4.22Å; V688-V690 HydrophobicContact CB-CG2 4.25Å; V688-V690 HydrophobicContact CG1-CG2 3.64Å; V690-Y692 HydrophobicContact CB-CD2 4.36Å; V690-Y692 HydrophobicContact CB-CE2 4.27Å; V690-Y692 HydrophobicContact CG1-CD2 3.96Å; V690-Y692 HydrophobicContact CG1-CE2 4.06Å; V690-Y698 PolarHBondContact N-O 3.42Å; V690-Y698 PolarHBondContact O-N 3.48Å; V690-L700 HydrophobicContact CG2-CD1 4.15Å; V690-Y752 PolarHBondContact N-OH 3.14Å
691	R	92.7	Very high	89.8	Confident	38 Å²	38	36.6 Å²	36.6	14%	0.143	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	121.9	162.6	-67.4	-179.7	-80.9	-172.8	-7.1	109.5	E636 I672 D674 Y697	E636-R691 IonicContact OE1-CZ 3.59Å; E636-R691 IonicContact OE1-NH1 3.24Å; E636-R691 PolarHBondContact OE1-NH1 2.86Å; E636-R691 IonicContact OE1-NH2 3.72Å; E636-R691 PolarHBondContact OE1-NH2 3.39Å; E636-R691 VanDerWaalsContact OE1-NH2 3.13Å; E636-R691 IonicContact OE2-CZ 2.72Å; E636-R691 IonicContact OE2-NH1 3.01Å; E636-R691 IonicContact OE2-NH2 2.66Å; E636-R691 PolarHBondContact OE2-NH2 2.79Å; I672-R691 HydrophobicContact CB-CB 4.25Å; I672-R691 PolarHBondContact N-O 2.66Å; I672-R691 PolarHBondContact O-N 3.25Å; D674-R691 IonicContact OD1-CZ 2.63Å; D674-R691 VanDerWaalsContact OD1-CZ 3.24Å; D674-R691 IonicContact OD1-NE 3.81Å; D674-R691 PolarHBondContact OD1-NE 3.32Å; D674-R691 IonicContact OD1-NH2 3.73Å; D674-R691 PolarHBondContact OD1-NH2 3.26Å; D674-R691 WeakPolarHBondContact OD2-CG 3.18Å; D674-R691 IonicContact OD2-CZ 2.73Å; D674-R691 IonicContact OD2-NE 3.39Å; D674-R691 PolarHBondContact OD2-NE 3.01Å; D674-R691 IonicContact OD2-NH2 2.73Å; R691-Y697 HydrophobicContact CG-CD1 3.74Å; R691-Y697 HydrophobicContact CG-CE1 3.6Å
692	Y	91.4	Very high	90.7	Very high	26 Å²	26	32.7 Å²	32.7	10%	0.102	17%	0.174	C	C	.	.			trans	-84.7	154.6	176.8	-86.5	-138.6	0	0	0	110.7	L563 Y671 V690 D694 G695 T696 Y698 L700	L563-Y692 HydrophobicContact CD1-CE2 3.77Å; Y671-Y692 AromaticContact CD1-CD2 3.89Å; Y671-Y692 HydrophobicContact CD1-CD2 3.89Å; Y671-Y692 HydrophobicContact CD1-CE2 4.23Å; Y671-Y692 HydrophobicContact CD1-CG 4.06Å; Y671-Y692 AromaticContact CE1-CD1 3.78Å; Y671-Y692 HydrophobicContact CE1-CD1 3.78Å; Y671-Y692 AromaticContact CE1-CD2 3.9Å; Y671-Y692 HydrophobicContact CE1-CD2 3.9Å; Y671-Y692 HydrophobicContact CE1-CE1 4Å; Y671-Y692 HydrophobicContact CE1-CE2 4.13Å; Y671-Y692 AromaticContact CE1-CG 3.72Å; Y671-Y692 HydrophobicContact CE1-CG 3.72Å; V690-Y692 HydrophobicContact CB-CD2 4.36Å; V690-Y692 HydrophobicContact CB-CE2 4.27Å; V690-Y692 HydrophobicContact CG1-CD2 3.96Å; V690-Y692 HydrophobicContact CG1-CE2 4.06Å; Y692-D694 WeakPolarHBondContact CB-OD1 3.47Å; Y692-D694 PolarHBondContact O-N 2.76Å; Y692-D694 VanDerWaalsContact O-N 3.11Å; Y692-G695 PolarHBondContact O-N 3.21Å; Y692-T696 PolarHBondContact N-O 2.8Å; Y692-Y698 HydrophobicContact CD1-CD2 4.01Å; Y692-Y698 AromaticContact CD1-CE2 3.84Å; Y692-Y698 HydrophobicContact CD1-CE2 3.84Å; Y692-Y698 AromaticContact CD2-CD2 3.55Å; Y692-Y698 HydrophobicContact CD2-CD2 3.55Å; Y692-Y698 HydrophobicContact CD2-CE2 4.22Å; Y692-Y698 HydrophobicContact CE1-CD2 4.05Å; Y692-Y698 AromaticContact CE1-CE2 3.98Å; Y692-Y698 HydrophobicContact CE1-CE2 3.98Å; Y692-Y698 AromaticContact CE2-CD2 3.59Å; Y692-Y698 HydrophobicContact CE2-CD2 3.59Å; Y692-Y698 HydrophobicContact CE2-CE2 4.35Å; Y692-Y698 HydrophobicContact CE2-CG 4.24Å; Y692-Y698 AromaticContact CG-CD2 3.77Å; Y692-Y698 HydrophobicContact CG-CD2 3.77Å; Y692-Y698 AromaticContact CG-CE2 3.98Å; Y692-Y698 HydrophobicContact CG-CE2 3.98Å; Y692-Y698 AromaticContact CZ-CD2 3.85Å; Y692-L700 HydrophobicContact CE2-CD1 4.45Å
693	P	87.6	Confident	91.2	Very high	73 Å²	73	25.6 Å²	25.6	47%	0.474	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-11	-179.4	26.7	-35.7	0	0	0	114.2	Y671 G695	Y671-P693 HydrophobicContact CE1-CG 4.21Å; P693-G695 VanDerWaalsContact C-N 3.31Å
694	D	87.2	Confident	91.4	Very high	106 Å²	106	25.7 Å²	25.7	57%	0.567	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	1.5	172.7	64.5	3.2	0	0	0	113.6	Y692 T696	Y692-D694 WeakPolarHBondContact CB-OD1 3.47Å; Y692-D694 PolarHBondContact O-N 2.76Å; Y692-D694 VanDerWaalsContact O-N 3.11Å; D694-T696 VanDerWaalsContact CG-OG1 3.32Å; D694-T696 WeakPolarHBondContact OD1-CB 3.49Å; D694-T696 WeakPolarHBondContact OD1-CG2 3.39Å; D694-T696 PolarHBondContact OD1-N 2.66Å; D694-T696 PolarHBondContact OD1-OG1 3.38Å; D694-T696 PolarHBondContact OD2-OG1 3.16Å
695	G	86.2	Confident	91.4	Very high	51 Å²	51	23.5 Å²	23.5	53%	0.526	14%	0.135	S	C	.	.	S	Bend	trans	83.8	6.2	-177.9	0	0	0	0	0	114.6	Y692 P693 Y697	Y692-G695 PolarHBondContact O-N 3.21Å; P693-G695 VanDerWaalsContact C-N 3.31Å; G695-Y697 VanDerWaalsContact O-CE2 3.26Å; G695-Y697 WeakPolarHBondContact O-CE2 3.35Å
696	T	92.4	Very high	91	Very high	32 Å²	32	26 Å²	26	20%	0.196	15%	0.154	C	C	.	.			trans	-88.4	155.6	176	66.1	0	0	0	0	112.7	Y692 D694 Y698	Y692-T696 PolarHBondContact N-O 2.8Å; D694-T696 VanDerWaalsContact CG-OG1 3.32Å; D694-T696 WeakPolarHBondContact OD1-CB 3.49Å; D694-T696 WeakPolarHBondContact OD1-CG2 3.39Å; D694-T696 PolarHBondContact OD1-N 2.66Å; D694-T696 PolarHBondContact OD1-OG1 3.38Å; D694-T696 PolarHBondContact OD2-OG1 3.16Å; T696-Y698 WeakPolarHBondContact OG1-CE2 3.24Å
697	Y	93.8	Very high	90.7	Very high	34 Å²	34	26.5 Å²	26.5	13%	0.133	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	122.9	-174.4	-62.7	-102.2	0	0	0	109.6	R691 G695 L747 Q749 Y752	R691-Y697 HydrophobicContact CG-CD1 3.74Å; R691-Y697 HydrophobicContact CG-CE1 3.6Å; G695-Y697 VanDerWaalsContact O-CE2 3.26Å; G695-Y697 WeakPolarHBondContact O-CE2 3.35Å; Y697-L747 PolarHBondContact O-N 2.95Å; Y697-Q749 HydrophobicContact CD2-CB 4.15Å; Y697-Q749 HydrophobicContact CE1-CG 4.17Å; Y697-Q749 HydrophobicContact CE2-CB 3.72Å; Y697-Q749 HydrophobicContact CE2-CG 3.88Å; Y697-Q749 PolarHBondContact OH-NE2 3.29Å; Y697-Y752 AromaticContact CD1-CD1 3.47Å; Y697-Y752 HydrophobicContact CD1-CD1 3.47Å; Y697-Y752 VanDerWaalsContact CD1-CD1 3.47Å; Y697-Y752 HydrophobicContact CD1-CD2 4.01Å; Y697-Y752 AromaticContact CD1-CE1 3.73Å; Y697-Y752 HydrophobicContact CD1-CE1 3.73Å; Y697-Y752 HydrophobicContact CD1-CE2 4.23Å; Y697-Y752 AromaticContact CD1-CG 3.61Å; Y697-Y752 HydrophobicContact CD1-CG 3.61Å; Y697-Y752 HydrophobicContact CE1-CD1 4.02Å; Y697-Y752 HydrophobicContact CE1-CE1 4.24Å; Y697-Y752 HydrophobicContact CG-CD1 4.45Å; Y697-Y752 HydrophobicContact CG-CD2 4.36Å; Y697-Y752 HydrophobicContact CG-CG 4.17Å
698	Y	93.8	Very high	90.4	Very high	26 Å²	26	26.9 Å²	26.9	10%	0.102	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	146.2	-178.9	-70.4	-79.6	0	0	0	112.6	V690 Y692 T696 K744 R745 Q746	V690-Y698 PolarHBondContact N-O 3.42Å; V690-Y698 PolarHBondContact O-N 3.48Å; Y692-Y698 HydrophobicContact CD1-CD2 4.01Å; Y692-Y698 AromaticContact CD1-CE2 3.84Å; Y692-Y698 HydrophobicContact CD1-CE2 3.84Å; Y692-Y698 AromaticContact CD2-CD2 3.55Å; Y692-Y698 HydrophobicContact CD2-CD2 3.55Å; Y692-Y698 HydrophobicContact CD2-CE2 4.22Å; Y692-Y698 HydrophobicContact CE1-CD2 4.05Å; Y692-Y698 AromaticContact CE1-CE2 3.98Å; Y692-Y698 HydrophobicContact CE1-CE2 3.98Å; Y692-Y698 AromaticContact CE2-CD2 3.59Å; Y692-Y698 HydrophobicContact CE2-CD2 3.59Å; Y692-Y698 HydrophobicContact CE2-CE2 4.35Å; Y692-Y698 HydrophobicContact CE2-CG 4.24Å; Y692-Y698 AromaticContact CG-CD2 3.77Å; Y692-Y698 HydrophobicContact CG-CD2 3.77Å; Y692-Y698 AromaticContact CG-CE2 3.98Å; Y692-Y698 HydrophobicContact CG-CE2 3.98Å; Y692-Y698 AromaticContact CZ-CD2 3.85Å; T696-Y698 WeakPolarHBondContact OG1-CE2 3.24Å; Y698-K744 HydrophobicContact CE1-CD 4.33Å; Y698-R745 WeakPolarHBondContact CA-O 3.23Å; Y698-Q746 HydrophobicContact CD1-CB 3.96Å; Y698-Q746 HydrophobicContact CD1-CG 4.15Å; Y698-Q746 HydrophobicContact CE1-CB 3.65Å; Y698-Q746 HydrophobicContact CE1-CG 3.65Å
699	V	93.8	Very high	90.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.7	157.4	-175.7	0	0	0	0	107	V688 M689 K744 R745 L747 I781 M785	V688-V699 WeakPolarHBondContact O-CA 3.43Å; M689-V699 HydrophobicContact CG-CG2 4.41Å; V699-K744 CarbonylContact O-C 3.6Å; V699-K744 WeakPolarHBondContact O-CA 3.4Å; V699-R745 HydrophobicContact CB-CB 4.34Å; V699-R745 PolarHBondContact N-O 3.5Å; V699-R745 PolarHBondContact O-N 3.4Å; V699-L747 HydrophobicContact CG2-CD1 3.66Å; V699-L747 HydrophobicContact CG2-CG 4.42Å; V699-I781 HydrophobicContact CG1-CG2 3.79Å; V699-I781 HydrophobicContact CG2-CG2 4.17Å; V699-M785 HydrophobicContact CB-SD 4.48Å; V699-M785 HydrophobicContact CG1-CE 4.34Å; V699-M785 HydrophobicContact CG1-SD 4.22Å
700	L	94.2	Very high	89.6	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.2	175.9	-57.3	179.5	0	0	0	108.5	I560 L563 C564 S687 V688 V690 Y692 K744	I560-L700 HydrophobicContact CD1-CD2 4.4Å; I560-L700 HydrophobicContact CG1-CD1 4.33Å; I560-L700 HydrophobicContact CG1-CD2 4.07Å; I560-L700 HydrophobicContact CG2-CD1 4.35Å; I560-L700 HydrophobicContact CG2-CD2 4.34Å; L563-L700 HydrophobicContact CB-CD1 3.76Å; L563-L700 HydrophobicContact CD1-CD1 4.01Å; C564-L700 HydrophobicContact CB-CB 4.26Å; S687-L700 CarbonylContact C-O 3.47Å; S687-L700 WeakPolarHBondContact CA-O 3.47Å; V688-L700 PolarHBondContact N-O 3.39Å; V688-L700 PolarHBondContact O-N 3.31Å; V690-L700 HydrophobicContact CG2-CD1 4.15Å; Y692-L700 HydrophobicContact CE2-CD1 4.45Å; L700-K744 HydrophobicContact CD2-CB 3.88Å
701	S	93	Very high	88.8	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.014	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	143.5	179.4	-164	0	0	0	0	112	M686 S687 F742 A743	M686-S701 WeakPolarHBondContact O-CA 3.48Å; M686-S701 PolarHBondContact O-OG 3.07Å; S687-S701 WeakPolarHBondContact OG-CB 3.26Å; S687-S701 PolarHBondContact OG-OG 3.44Å; S701-F742 WeakPolarHBondContact O-CA 3.39Å; S701-A743 PolarHBondContact N-O 3.2Å; S701-A743 PolarHBondContact O-N 3.16Å
702	K	92.5	Very high	88.1	Confident	14 Å²	14	38 Å²	38	6%	0.061	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	142.9	175	72.3	-175.7	-179.6	-175.7	0	110.6	C564 E613 R685 M686 V741 F742	C564-K702 HydrophobicContact CB-CD 4.44Å; C564-K702 WeakPolarHBondContact O-CD 3.47Å; C564-K702 VanDerWaalsContact O-CE 3.23Å; C564-K702 WeakPolarHBondContact O-CE 3.36Å; C564-K702 PolarHBondContact O-NZ 3.42Å; E613-K702 VanDerWaalsContact OE1-CE 3.31Å; E613-K702 WeakPolarHBondContact OE1-CE 3.37Å; E613-K702 IonicContact OE1-NZ 3.1Å; E613-K702 PolarHBondContact OE1-NZ 3.46Å; E613-K702 IonicContact OE2-NZ 2.74Å; R685-K702 CarbonylContact C-O 3.54Å; R685-K702 WeakPolarHBondContact CA-O 3.44Å; R685-K702 VanDerWaalsContact CB-O 3.31Å; R685-K702 WeakPolarHBondContact CB-O 3.03Å; M686-K702 HydrophobicContact CB-CG 4.26Å; M686-K702 PolarHBondContact N-O 3.34Å; M686-K702 PolarHBondContact O-N 2.96Å; M686-K702 VanDerWaalsContact SD-CE 3.51Å; K702-V741 WeakPolarHBondContact CA-O 3.32Å; K702-F742 HydrophobicContact CB-CD1 3.82Å; K702-F742 HydrophobicContact CB-CE1 3.62Å; K702-F742 HydrophobicContact CB-CE2 4.34Å; K702-F742 HydrophobicContact CB-CG 4.28Å; K702-F742 HydrophobicContact CB-CZ 3.9Å; K702-F742 HydrophobicContact CD-CE1 4.06Å; K702-F742 HydrophobicContact CD-CZ 4.13Å; K702-F742 HydrophobicContact CG-CE1 4.45Å
703	G	90.4	Very high	87.4	Confident	2 Å²	2	38.2 Å²	38.2	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.9	-166.8	-176.9	0	0	0	0	0	115	K684 V741	K684-G703 WeakPolarHBondContact O-CA 3.31Å; G703-V741 PolarHBondContact N-O 3Å; G703-V741 VanDerWaalsContact N-O 3.17Å; G703-V741 PolarHBondContact O-N 2.97Å
704	A	87.6	Confident	87	Confident	21 Å²	21	34.8 Å²	34.8	17%	0.174	20%	0.199	C	C	.	.			trans	-71.2	142.6	-178.5	0	0	0	0	0	112.4	K684 S706 T707 I708	K684-A704 HydrophobicContact CB-CB 4.19Å; K684-A704 HydrophobicContact CD-CB 4.48Å; K684-A704 PolarHBondContact O-N 3.21Å; K684-A704 VanDerWaalsContact O-N 3.12Å; A704-S706 PolarHBondContact O-N 3.16Å; A704-T707 PolarHBondContact O-N 2.92Å; A704-T707 PolarHBondContact O-OG1 3.24Å; A704-I708 PolarHBondContact O-N 3.32Å; A704-I708 VanDerWaalsContact O-N 3.1Å
705	E	85.6	Confident	86.4	Confident	49 Å²	49	32.6 Å²	32.6	23%	0.229	19%	0.192	C	C	.	.	H	α-helix	trans	-52.9	-38.9	179.2	76.3	-53.8	128.1	0	0	112.6	T707 L709 V729 V741	E705-T707 PolarHBondContact O-N 2.73Å; E705-L709 HydrophobicContact CB-CD1 4.18Å; E705-L709 VanDerWaalsContact O-CB 3.29Å; E705-L709 WeakPolarHBondContact O-CB 3.39Å; E705-L709 PolarHBondContact O-N 3.44Å; E705-V729 HydrophobicContact CB-CG1 4.1Å; E705-V729 HydrophobicContact CB-CG2 4.24Å; E705-V729 HydrophobicContact CG-CG1 3.93Å; E705-V741 HydrophobicContact CB-CG2 3.98Å
706	S	83.3	Confident	85.9	Confident	65 Å²	65	35 Å²	35	46%	0.455	20%	0.197	S	C	.	.	H	α-helix	trans	-68.7	-11.7	179.6	38.6	0	0	0	0	114.2	A704	A704-S706 PolarHBondContact O-N 3.16Å
707	T	85.4	Confident	85.2	Confident	17 Å²	17	33.9 Å²	33.9	10%	0.104	19%	0.19	C	C	.	.	H	α-helix	trans	-115.8	-28.6	179.9	63.2	0	0	0	0	114.1	K684 A704 E705 K713	K684-T707 HydrophobicContact CB-CG2 3.86Å; K684-T707 HydrophobicContact CD-CG2 4.11Å; K684-T707 HydrophobicContact CG-CG2 4.35Å; A704-T707 PolarHBondContact O-N 2.92Å; A704-T707 PolarHBondContact O-OG1 3.24Å; E705-T707 PolarHBondContact O-N 2.73Å; T707-K713 PolarHBondContact O-NZ 2.83Å
708	I	87.4	Confident	84.6	Confident	8 Å²	8	34.5 Å²	34.5	4%	0.041	20%	0.2	C	C	.	.	H	α-helix	trans	-85.7	-51.3	175.7	-70.1	178.1	0	0	0	110.5	A704 D710 C714 V741 A743	A704-I708 PolarHBondContact O-N 3.32Å; A704-I708 VanDerWaalsContact O-N 3.1Å; I708-D710 PolarHBondContact O-N 3.16Å; I708-C714 PolarHBondContact O-SG 3.38Å; I708-V741 HydrophobicContact CB-CB 4.43Å; I708-V741 HydrophobicContact CD1-CB 4.34Å; I708-V741 WeakPolarHBondContact CD1-O 3.45Å; I708-V741 HydrophobicContact CG2-CB 4.28Å; I708-V741 HydrophobicContact CG2-CG1 3.84Å; I708-A743 HydrophobicContact CG2-CB 3.89Å
709	L	85.5	Confident	84	Confident	15 Å²	15	41.5 Å²	41.5	8%	0.079	23%	0.23	C	C	.	.	S	Bend	trans	-77.1	17.8	-179	-52.6	176	0	0	0	113.5	E705 R722 A725 I726 V741 P787	E705-L709 HydrophobicContact CB-CD1 4.18Å; E705-L709 VanDerWaalsContact O-CB 3.29Å; E705-L709 WeakPolarHBondContact O-CB 3.39Å; E705-L709 PolarHBondContact O-N 3.44Å; L709-R722 HydrophobicContact CD2-CG 4.46Å; L709-A725 HydrophobicContact CD1-CB 3.68Å; L709-A725 HydrophobicContact CD2-CB 4.05Å; L709-I726 HydrophobicContact CD1-CG1 3.81Å; L709-V741 HydrophobicContact CD1-CG2 4.41Å; L709-V741 HydrophobicContact CD2-CG1 4.12Å; L709-V741 HydrophobicContact CG-CG1 4.49Å; L709-P787 HydrophobicContact CD2-CB 3.77Å; L709-P787 HydrophobicContact CD2-CG 3.89Å
710	D	85	Confident	83.5	Confident	48 Å²	48	48.4 Å²	48.4	26%	0.257	26%	0.258	S	S	.	.			trans	-68.1	125.5	178.3	-172.9	5.9	0	0	0	109.7	I708 E712 K713 C714	I708-D710 PolarHBondContact O-N 3.16Å; D710-E712 PolarHBondContact O-N 3.39Å; D710-K713 HydrophobicContact CB-CG 4.46Å; D710-K713 PolarHBondContact O-N 2.87Å; D710-K713 IonicContact OD2-NZ 2.63Å; D710-K713 PolarHBondContact OD2-NZ 3.29Å; D710-C714 PolarHBondContact O-N 2.84Å; D710-C714 VanDerWaalsContact O-N 3.08Å
711	P	76.6	Confident	83	Confident	64 Å²	64	50.2 Å²	50.2	42%	0.416	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-27.3	-174.3	-28.7	36	0	0	0	115.5	K713	P711-K713 VanDerWaalsContact C-N 3.33Å
712	E	76.8	Confident	82.5	Confident	145 Å²	145	52.6 Å²	52.6	68%	0.678	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-22.1	177.1	-63.4	-177.2	177	0	0	113.2	D710	D710-E712 PolarHBondContact O-N 3.39Å
713	K	77	Confident	82.2	Confident	31 Å²	31	55.1 Å²	55.1	14%	0.135	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-16.4	-178.8	-54	-165.7	-154.7	73.1	0	114.3	T707 D710 P711 D784 M785	T707-K713 PolarHBondContact O-NZ 2.83Å; D710-K713 HydrophobicContact CB-CG 4.46Å; D710-K713 PolarHBondContact O-N 2.87Å; D710-K713 IonicContact OD2-NZ 2.63Å; D710-K713 PolarHBondContact OD2-NZ 3.29Å; P711-K713 VanDerWaalsContact C-N 3.33Å; K713-D784 CarbonylContact O-C 3.47Å; K713-D784 WeakPolarHBondContact O-CA 3.42Å; K713-D784 PolarHBondContact O-N 3.14Å; K713-D784 VanDerWaalsContact O-N 3.1Å; K713-M785 PolarHBondContact O-N 3.43Å
714	C	80	Confident	81.9	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.299	C	S	.	.			trans	-120.4	64.3	174.1	-71.9	0	0	0	0	109.1	I708 D710 T717 M785	I708-C714 PolarHBondContact O-SG 3.38Å; D710-C714 PolarHBondContact O-N 2.84Å; D710-C714 VanDerWaalsContact O-N 3.08Å; C714-T717 WeakPolarHBondContact CB-OG1 3.46Å; C714-M785 PolarHBondContact SG-O 2.91Å
715	S	73.9	Confident	81.9	Confident	60 Å²	60	55.7 Å²	55.7	42%	0.42	29%	0.291	S	S	.	.	S	Bend	trans	-76.6	-39.2	-171.4	78.8	0	0	0	0	111.9	D784	S715-D784 WeakPolarHBondContact CA-OD1 3.39Å; S715-D784 WeakPolarHBondContact CB-OD1 3.31Å; S715-D784 PolarHBondContact N-OD1 3.06Å; S715-D784 PolarHBondContact OG-OD1 2.83Å
716	T	75.1	Confident	81.9	Confident	102 Å²	102	55.3 Å²	55.3	63%	0.626	29%	0.29	S	S	*	.	S	Bend	trans	-81.7	-19.2	176.7	52.4	0	0	0	0	113.8	S718 D784	T716-S718 PolarHBondContact O-N 2.91Å; T716-D784 WeakPolarHBondContact CB-OD2 3.35Å; T716-D784 WeakPolarHBondContact CG2-OD2 3.24Å; T716-D784 PolarHBondContact N-OD1 2.74Å; T716-D784 PolarHBondContact OG1-OD1 3.14Å; T716-D784 VanDerWaalsContact OG1-OD1 3.05Å; T716-D784 PolarHBondContact OG1-OD2 3.22Å
717	T	78.5	Confident	82.1	Confident	8 Å²	8	57.6 Å²	57.6	5%	0.049	29%	0.294	C	S	.	.	S	Bend	trans	-68.6	131.7	-177	-45.3	0	0	0	0	112.6	C714 Q721 R722 M785 P787	C714-T717 WeakPolarHBondContact CB-OG1 3.46Å; T717-Q721 HydrophobicContact CG2-CB 4.06Å; T717-R722 HydrophobicContact CG2-CG 3.94Å; T717-R722 PolarHBondContact O-NE 2.8Å; T717-R722 PolarHBondContact O-NH2 3.1Å; T717-M785 PolarHBondContact OG1-O 3.37Å; T717-P787 HydrophobicContact CG2-CG 3.68Å; T717-P787 WeakPolarHBondContact OG1-CD 3.47Å
718	S	80.5	Confident	82.1	Confident	48 Å²	48	58.1 Å²	58.1	34%	0.336	29%	0.294	S	S	.	.			trans	-53.9	141.8	178	75.9	0	0	0	0	112.2	T716 Y720 Q721 R722	T716-S718 PolarHBondContact O-N 2.91Å; S718-Y720 PolarHBondContact O-N 3Å; S718-Q721 PolarHBondContact O-N 2.91Å; S718-Q721 WeakPolarHBondContact OG-CB 3.28Å; S718-Q721 WeakPolarHBondContact OG-CG 3.43Å; S718-Q721 PolarHBondContact OG-N 2.89Å; S718-Q721 PolarHBondContact OG-OE1 3.34Å; S718-R722 PolarHBondContact O-N 3.17Å
719	K	82.1	Confident	82	Confident	172 Å²	172	58.1 Å²	58.1	75%	0.748	29%	0.294	S	S	*	.	H	α-helix	trans	-60.2	-28.8	174.8	-171.9	178.8	177.8	-176.4	0	111.4	S723	K719-S723 WeakPolarHBondContact O-CB 2.94Å; K719-S723 PolarHBondContact O-N 3.27Å; K719-S723 PolarHBondContact O-OG 3.09Å
720	Y	83.6	Confident	81.9	Confident	145 Å²	145	61 Å²	61	57%	0.569	31%	0.31	S	S	*	.	H	α-helix	trans	-64.9	-57.4	175.5	179.3	-105.5	0	0	0	112	E480 S718 R722 S723 R724	E480-Y720 PolarHBondContact OE1-OH 2.67Å; E480-Y720 VanDerWaalsContact OE1-OH 3.09Å; S718-Y720 PolarHBondContact O-N 3Å; Y720-R722 VanDerWaalsContact C-N 3.29Å; Y720-R722 PolarHBondContact O-N 2.9Å; Y720-S723 PolarHBondContact O-N 2.86Å; Y720-R724 WeakPolarHBondContact O-CB 3.24Å; Y720-R724 PolarHBondContact O-N 2.72Å; Y720-R724 PolarHBondContact OH-NH1 2.87Å
721	Q	82.7	Confident	81.7	Confident	39 Å²	39	61.1 Å²	61.1	18%	0.182	31%	0.309	C	S	.	.	H	α-helix	trans	-55.8	-42.5	177.9	-76.3	159.3	-51.4	0	0	111.8	N478 T717 S718 R724 A725	N478-Q721 PolarHBondContact OD1-NE2 2.67Å; T717-Q721 HydrophobicContact CG2-CB 4.06Å; S718-Q721 PolarHBondContact O-N 2.91Å; S718-Q721 WeakPolarHBondContact OG-CB 3.28Å; S718-Q721 WeakPolarHBondContact OG-CG 3.43Å; S718-Q721 PolarHBondContact OG-N 2.89Å; S718-Q721 PolarHBondContact OG-OE1 3.34Å; Q721-R724 PolarHBondContact O-N 2.92Å; Q721-A725 WeakPolarHBondContact O-CB 3.49Å; Q721-A725 PolarHBondContact O-N 3.45Å
722	R	83.3	Confident	82	Confident	51 Å²	51	58.7 Å²	58.7	19%	0.192	29%	0.291	C	S	.	.	H	α-helix	trans	-63.1	-43.5	175.9	-73.1	-174	-76.9	166.6	-13.9	112.6	L709 T717 S718 Y720 R724 A725 I726	L709-R722 HydrophobicContact CD2-CG 4.46Å; T717-R722 HydrophobicContact CG2-CG 3.94Å; T717-R722 PolarHBondContact O-NE 2.8Å; T717-R722 PolarHBondContact O-NH2 3.1Å; S718-R722 PolarHBondContact O-N 3.17Å; Y720-R722 VanDerWaalsContact C-N 3.29Å; Y720-R722 PolarHBondContact O-N 2.9Å; R722-R724 VanDerWaalsContact C-N 3.32Å; R722-R724 PolarHBondContact O-N 2.83Å; R722-A725 PolarHBondContact O-N 2.74Å; R722-I726 WeakPolarHBondContact O-CD1 3.44Å; R722-I726 VanDerWaalsContact O-CG1 3.24Å; R722-I726 WeakPolarHBondContact O-CG1 3.49Å; R722-I726 PolarHBondContact O-N 3.22Å; R722-I726 VanDerWaalsContact O-N 3.11Å
723	S	85.3	Confident	81.8	Confident	67 Å²	67	53.3 Å²	53.3	47%	0.469	27%	0.272	S	S	.	.	H	α-helix	trans	-65.5	-36.9	177.1	-55.8	0	0	0	0	111.8	K719 Y720 I726 H727	K719-S723 WeakPolarHBondContact O-CB 2.94Å; K719-S723 PolarHBondContact O-N 3.27Å; K719-S723 PolarHBondContact O-OG 3.09Å; Y720-S723 PolarHBondContact O-N 2.86Å; S723-I726 WeakPolarHBondContact O-CB 3.37Å; S723-I726 PolarHBondContact O-N 3.22Å; S723-H727 PolarHBondContact O-N 3.25Å
724	R	84.8	Confident	81.5	Confident	35 Å²	35	57.9 Å²	57.9	13%	0.132	30%	0.297	C	S	.	.	H	α-helix	trans	-67.5	-44.8	176	-169.3	-171.9	-170.1	85.7	15.6	112.7	E480 Y720 Q721 R722 I726 H727 Y728	E480-R724 VanDerWaalsContact CB-NH2 3.26Å; E480-R724 VanDerWaalsContact CG-CZ 3.43Å; E480-R724 VanDerWaalsContact CG-NH2 3.35Å; E480-R724 IonicContact OE1-CZ 3.95Å; E480-R724 IonicContact OE1-NH1 3.07Å; E480-R724 PolarHBondContact OE1-NH1 3.4Å; E480-R724 IonicContact OE1-NH2 2.91Å; E480-R724 IonicContact OE2-CZ 3.25Å; E480-R724 IonicContact OE2-NH1 3.05Å; E480-R724 PolarHBondContact OE2-NH1 2.66Å; E480-R724 IonicContact OE2-NH2 2.88Å; E480-R724 PolarHBondContact OE2-NH2 2.98Å; Y720-R724 WeakPolarHBondContact O-CB 3.24Å; Y720-R724 PolarHBondContact O-N 2.72Å; Y720-R724 PolarHBondContact OH-NH1 2.87Å; Q721-R724 PolarHBondContact O-N 2.92Å; R722-R724 VanDerWaalsContact C-N 3.32Å; R722-R724 PolarHBondContact O-N 2.83Å; R724-I726 VanDerWaalsContact C-N 3.26Å; R724-I726 PolarHBondContact O-N 2.9Å; R724-H727 WeakPolarHBondContact O-CB 3.41Å; R724-H727 PolarHBondContact O-N 3.22Å; R724-Y728 HydrophobicContact CG-CD2 4.14Å; R724-Y728 HydrophobicContact CG-CE2 3.78Å; R724-Y728 PolarHBondContact NH2-OH 3.37Å; R724-Y728 WeakPolarHBondContact O-CD2 3.2Å; R724-Y728 PolarHBondContact O-N 3.05Å; R724-Y728 VanDerWaalsContact O-N 3.16Å
725	A	86.7	Confident	81	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-59.2	-40.8	174.1	0	0	0	0	0	111.1	L477 L709 Q721 R722 H727 V729 V790	L477-A725 HydrophobicContact CD1-CB 3.81Å; L477-A725 HydrophobicContact CD2-CB 3.83Å; L709-A725 HydrophobicContact CD1-CB 3.68Å; L709-A725 HydrophobicContact CD2-CB 4.05Å; Q721-A725 WeakPolarHBondContact O-CB 3.49Å; Q721-A725 PolarHBondContact O-N 3.45Å; R722-A725 PolarHBondContact O-N 2.74Å; A725-H727 VanDerWaalsContact C-N 3.34Å; A725-H727 PolarHBondContact O-N 2.93Å; A725-V729 WeakPolarHBondContact O-CB 3.39Å; A725-V729 WeakPolarHBondContact O-CG2 3.13Å; A725-V729 PolarHBondContact O-N 2.82Å; A725-V790 HydrophobicContact CB-CG2 4.17Å
726	I	86.7	Confident	80.9	Confident	42 Å²	42	58.4 Å²	58.4	22%	0.215	30%	0.296	C	S	.	.	H	α-helix	trans	-62.4	-38.5	173.6	-68.5	168.7	0	0	0	112	L709 R722 S723 R724 N730	L709-I726 HydrophobicContact CD1-CG1 3.81Å; R722-I726 WeakPolarHBondContact O-CD1 3.44Å; R722-I726 VanDerWaalsContact O-CG1 3.24Å; R722-I726 WeakPolarHBondContact O-CG1 3.49Å; R722-I726 PolarHBondContact O-N 3.22Å; R722-I726 VanDerWaalsContact O-N 3.11Å; S723-I726 WeakPolarHBondContact O-CB 3.37Å; S723-I726 PolarHBondContact O-N 3.22Å; R724-I726 VanDerWaalsContact C-N 3.26Å; R724-I726 PolarHBondContact O-N 2.9Å; I726-N730 PolarHBondContact O-N 2.94Å; I726-N730 PolarHBondContact O-ND2 2.85Å; I726-N730 PolarHBondContact O-OD1 2.88Å
727	H	86.5	Confident	81.2	Confident	113 Å²	113	54.2 Å²	54.2	52%	0.523	27%	0.27	S	S	.	.	H	α-helix	trans	-59.3	-57.6	176.6	-178	-81.7	0	0	0	111.7	S723 R724 A725 V729 N730 E731	S723-H727 PolarHBondContact O-N 3.25Å; R724-H727 WeakPolarHBondContact O-CB 3.41Å; R724-H727 PolarHBondContact O-N 3.22Å; A725-H727 VanDerWaalsContact C-N 3.34Å; A725-H727 PolarHBondContact O-N 2.93Å; H727-V729 VanDerWaalsContact C-N 3.33Å; H727-V729 PolarHBondContact O-N 2.9Å; H727-N730 WeakPolarHBondContact O-CB 3.3Å; H727-N730 PolarHBondContact O-N 3.2Å; H727-N730 VanDerWaalsContact O-N 3.1Å; H727-E731 IonicContact CE1-OE2 2.77Å; H727-E731 IonicContact ND1-OE2 3.64Å; H727-E731 PolarHBondContact O-N 2.83Å
728	Y	86	Confident	81.4	Confident	28 Å²	28	55.8 Å²	55.8	11%	0.11	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-35.6	-179.9	-68.4	-65.3	0	0	0	112.9	C475 L477 V482 R724 N730 E731 Y732	C475-Y728 HydrophobicContact CB-CD2 4.35Å; C475-Y728 HydrophobicContact CB-CG 4.37Å; C475-Y728 WeakPolarHBondContact SG-CE2 3.28Å; L477-Y728 HydrophobicContact CD2-CD2 4.44Å; V482-Y728 HydrophobicContact CG2-CE1 3.98Å; R724-Y728 HydrophobicContact CG-CD2 4.14Å; R724-Y728 HydrophobicContact CG-CE2 3.78Å; R724-Y728 PolarHBondContact NH2-OH 3.37Å; R724-Y728 WeakPolarHBondContact O-CD2 3.2Å; R724-Y728 PolarHBondContact O-N 3.05Å; R724-Y728 VanDerWaalsContact O-N 3.16Å; Y728-N730 VanDerWaalsContact C-N 3.31Å; Y728-N730 PolarHBondContact O-N 3.3Å; Y728-E731 PolarHBondContact O-N 3.01Å; Y728-Y732 WeakPolarHBondContact O-CB 3.47Å; Y728-Y732 WeakPolarHBondContact O-CD2 3.39Å; Y728-Y732 PolarHBondContact O-N 2.93Å
729	V	85.7	Confident	81.8	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.042	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-42.2	173.1	167.8	0	0	0	0	111.2	E705 A725 H727 A733 T739 V741 V790	E705-V729 HydrophobicContact CB-CG1 4.1Å; E705-V729 HydrophobicContact CB-CG2 4.24Å; E705-V729 HydrophobicContact CG-CG1 3.93Å; A725-V729 WeakPolarHBondContact O-CB 3.39Å; A725-V729 WeakPolarHBondContact O-CG2 3.13Å; A725-V729 PolarHBondContact O-N 2.82Å; H727-V729 VanDerWaalsContact C-N 3.33Å; H727-V729 PolarHBondContact O-N 2.9Å; V729-A733 WeakPolarHBondContact O-CB 3.32Å; V729-A733 PolarHBondContact O-N 2.76Å; V729-T739 HydrophobicContact CG1-CG2 4.42Å; V729-V741 HydrophobicContact CG2-CG2 4.13Å; V729-V790 HydrophobicContact CG2-CG1 3.59Å; V729-V790 HydrophobicContact CG2-CG2 4.22Å
730	N	82.4	Confident	82.2	Confident	77 Å²	77	48.3 Å²	48.3	41%	0.412	24%	0.24	S	C	.	.	H	α-helix	trans	-66.6	-42.4	175.9	-66	-23.5	0	0	0	111.7	I726 H727 Y728 A733 L734	I726-N730 PolarHBondContact O-N 2.94Å; I726-N730 PolarHBondContact O-ND2 2.85Å; I726-N730 PolarHBondContact O-OD1 2.88Å; H727-N730 WeakPolarHBondContact O-CB 3.3Å; H727-N730 PolarHBondContact O-N 3.2Å; H727-N730 VanDerWaalsContact O-N 3.1Å; Y728-N730 VanDerWaalsContact C-N 3.31Å; Y728-N730 PolarHBondContact O-N 3.3Å; N730-A733 PolarHBondContact O-N 3.28Å; N730-L734 WeakPolarHBondContact O-CB 3.28Å; N730-L734 VanDerWaalsContact O-CG 3.28Å; N730-L734 WeakPolarHBondContact O-CG 3.34Å; N730-L734 PolarHBondContact O-N 2.95Å
731	E	80.8	Confident	82.6	Confident	50 Å²	50	41.4 Å²	41.4	23%	0.234	21%	0.213	C	C	.	.	H	α-helix	trans	-62.9	-49.5	-179.7	-170.3	-170.6	157.9	0	0	112	H727 Y728 A733 L734 N735	H727-E731 IonicContact CE1-OE2 2.77Å; H727-E731 IonicContact ND1-OE2 3.64Å; H727-E731 PolarHBondContact O-N 2.83Å; Y728-E731 PolarHBondContact O-N 3.01Å; E731-A733 VanDerWaalsContact C-N 3.34Å; E731-A733 PolarHBondContact O-N 3.04Å; E731-L734 PolarHBondContact O-N 3.29Å; E731-N735 PolarHBondContact O-N 3.45Å; E731-N735 PolarHBondContact O-ND2 3.04Å
732	Y	83.8	Confident	83.1	Confident	12 Å²	12	39.6 Å²	39.6	5%	0.047	21%	0.205	C	C	.	.	H	α-helix	trans	-62.3	-40.5	174.5	-66.6	-37.9	0	0	0	111.8	S473 Y728 N735 G736 L737 T739 V790 A792	S473-Y732 PolarHBondContact OG-OH 2.93Å; Y728-Y732 WeakPolarHBondContact O-CB 3.47Å; Y728-Y732 WeakPolarHBondContact O-CD2 3.39Å; Y728-Y732 PolarHBondContact O-N 2.93Å; Y732-N735 PolarHBondContact O-N 3.47Å; Y732-G736 PolarHBondContact O-N 3.09Å; Y732-L737 HydrophobicContact CD1-CD1 4.14Å; Y732-L737 WeakPolarHBondContact O-CB 3.31Å; Y732-L737 PolarHBondContact O-N 3.33Å; Y732-T739 VanDerWaalsContact CB-CG2 3.48Å; Y732-T739 HydrophobicContact CD2-CG2 4.1Å; Y732-T739 HydrophobicContact CG-CG2 4.3Å; Y732-V790 HydrophobicContact CD2-CG1 3.87Å; Y732-V790 HydrophobicContact CE2-CB 4.44Å; Y732-V790 HydrophobicContact CE2-CG1 3.88Å; Y732-A792 HydrophobicContact CD1-CB 3.77Å; Y732-A792 HydrophobicContact CD2-CB 3.78Å; Y732-A792 HydrophobicContact CE1-CB 4.02Å; Y732-A792 HydrophobicContact CE2-CB 4.02Å; Y732-A792 HydrophobicContact CG-CB 3.64Å
733	A	73.4	Confident	83.5	Confident	33 Å²	33	37.2 Å²	37.2	27%	0.273	20%	0.196	S	C	.	.	H	α-helix	trans	-66.1	-36.4	176.8	0	0	0	0	0	113	V729 N730 E731 N735 G736	V729-A733 WeakPolarHBondContact O-CB 3.32Å; V729-A733 PolarHBondContact O-N 2.76Å; N730-A733 PolarHBondContact O-N 3.28Å; E731-A733 VanDerWaalsContact C-N 3.34Å; E731-A733 PolarHBondContact O-N 3.04Å; A733-N735 VanDerWaalsContact C-N 3.27Å; A733-N735 PolarHBondContact O-N 2.88Å; A733-G736 PolarHBondContact O-N 3.38Å
734	L	69.1	Low	83.9	Confident	126 Å²	126	35.6 Å²	35.6	66%	0.66	18%	0.18	S	C	*	.	H	α-helix	trans	-63.5	-33.3	173.8	-77.5	168.6	0	0	0	112.3	N730 E731 G736	N730-L734 WeakPolarHBondContact O-CB 3.28Å; N730-L734 VanDerWaalsContact O-CG 3.28Å; N730-L734 WeakPolarHBondContact O-CG 3.34Å; N730-L734 PolarHBondContact O-N 2.95Å; E731-L734 PolarHBondContact O-N 3.29Å; L734-G736 PolarHBondContact O-N 3.3Å
735	N	70.2	Confident	84.2	Confident	68 Å²	68	36 Å²	36	36%	0.364	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-1.2	173	-75.1	-45.7	0	0	0	113.8	E731 Y732 A733 L737	E731-N735 PolarHBondContact O-N 3.45Å; E731-N735 PolarHBondContact O-ND2 3.04Å; Y732-N735 PolarHBondContact O-N 3.47Å; A733-N735 VanDerWaalsContact C-N 3.27Å; A733-N735 PolarHBondContact O-N 2.88Å; N735-L737 HydrophobicContact CB-CD1 4.47Å; N735-L737 HydrophobicContact CB-CG 4.41Å
736	G	71	Confident	84.5	Confident	4 Å²	4	41.8 Å²	41.8	4%	0.041	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	15	178.3	0	0	0	0	0	114.8	Y732 A733 L734 T828	Y732-G736 PolarHBondContact O-N 3.09Å; A733-G736 PolarHBondContact O-N 3.38Å; L734-G736 PolarHBondContact O-N 3.3Å; G736-T828 WeakPolarHBondContact O-CB 3.37Å
737	L	82.1	Confident	84.7	Confident	13 Å²	13	40.6 Å²	40.6	7%	0.068	20%	0.203	C	C	.	.			trans	-85.3	144.2	178.1	-55.9	172.9	0	0	0	110.6	Y472 Y732 N735 A792 E794	Y472-L737 HydrophobicContact CD1-CD1 3.73Å; Y472-L737 HydrophobicContact CD1-CD2 4.38Å; Y472-L737 HydrophobicContact CE1-CD1 4.23Å; Y472-L737 HydrophobicContact CG-CD1 4.48Å; Y472-L737 HydrophobicContact CG-CD2 4.39Å; Y732-L737 HydrophobicContact CD1-CD1 4.14Å; Y732-L737 WeakPolarHBondContact O-CB 3.31Å; Y732-L737 PolarHBondContact O-N 3.33Å; N735-L737 HydrophobicContact CB-CD1 4.47Å; N735-L737 HydrophobicContact CB-CG 4.41Å; L737-A792 HydrophobicContact CB-CB 4.07Å; L737-A792 HydrophobicContact CD1-CB 3.79Å; L737-E794 HydrophobicContact CD2-CB 3.74Å; L737-E794 HydrophobicContact CD2-CG 4.02Å
738	R	82.9	Confident	85.1	Confident	41 Å²	41	39.1 Å²	39.1	16%	0.155	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	131.5	172.6	-62.1	-178.9	-177.5	-160	1.6	109.2	M469 D612 A792 I793 D795	M469-R738 VanDerWaalsContact CE-CZ 3.44Å; M469-R738 VanDerWaalsContact CE-NH2 3.29Å; D612-R738 IonicContact OD1-CZ 3.73Å; D612-R738 IonicContact OD1-NH1 3.89Å; D612-R738 PolarHBondContact OD1-NH1 3.11Å; D612-R738 IonicContact OD2-NH1 2.86Å; D612-R738 PolarHBondContact OD2-NH1 3.3Å; D612-R738 VanDerWaalsContact OD2-NH1 3.15Å; R738-A792 CarbonylContact O-C 3.59Å; R738-A792 WeakPolarHBondContact O-CA 3.44Å; R738-I793 HydrophobicContact CB-CB 4.31Å; R738-I793 PolarHBondContact N-O 3.43Å; R738-I793 PolarHBondContact O-N 3.19Å; R738-D795 IonicContact CZ-OD2 2.72Å; R738-D795 IonicContact NE-OD2 2.67Å; R738-D795 IonicContact NH2-OD2 3.73Å; R738-D795 PolarHBondContact NH2-OD2 2.73Å
739	T	88.3	Confident	85.3	Confident	26 Å²	26	43.1 Å²	43.1	16%	0.16	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	140.3	-176.9	48.9	0	0	0	0	112.2	V729 Y732 T791	V729-T739 HydrophobicContact CG1-CG2 4.42Å; Y732-T739 VanDerWaalsContact CB-CG2 3.48Å; Y732-T739 HydrophobicContact CD2-CG2 4.1Å; Y732-T739 HydrophobicContact CG-CG2 4.3Å; T739-T791 VanDerWaalsContact CA-O 3.32Å; T739-T791 WeakPolarHBondContact CA-O 3.44Å
740	L	91.4	Very high	85.6	Confident	37 Å²	37	47 Å²	47	19%	0.194	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	141.3	166.3	-65.4	169.7	0	0	0	109	L616 F742 T791 I793	L616-L740 HydrophobicContact CD1-CD1 4.03Å; L740-F742 HydrophobicContact CB-CE2 4.35Å; L740-T791 PolarHBondContact N-O 3.36Å; L740-T791 PolarHBondContact O-N 3.38Å; L740-T791 PolarHBondContact O-OG1 2.69Å; L740-I793 HydrophobicContact CD1-CD1 4.15Å
741	V	92.1	Very high	86.1	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	134.7	171.1	-174.1	0	0	0	0	107.8	K702 G703 E705 I708 L709 V729 P787	K702-V741 WeakPolarHBondContact CA-O 3.32Å; G703-V741 PolarHBondContact N-O 3Å; G703-V741 VanDerWaalsContact N-O 3.17Å; G703-V741 PolarHBondContact O-N 2.97Å; E705-V741 HydrophobicContact CB-CG2 3.98Å; I708-V741 HydrophobicContact CB-CB 4.43Å; I708-V741 HydrophobicContact CD1-CB 4.34Å; I708-V741 WeakPolarHBondContact CD1-O 3.45Å; I708-V741 HydrophobicContact CG2-CB 4.28Å; I708-V741 HydrophobicContact CG2-CG1 3.84Å; L709-V741 HydrophobicContact CD1-CG2 4.41Å; L709-V741 HydrophobicContact CD2-CG1 4.12Å; L709-V741 HydrophobicContact CG-CG1 4.49Å; V729-V741 HydrophobicContact CG2-CG2 4.13Å; V741-P787 HydrophobicContact CG1-CB 4.08Å
742	F	93.2	Very high	86.7	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.3	171.6	-77.6	-101.4	0	0	0	110	I560 I561 L616 S701 K702 L740 I788 Y789 T791	I560-F742 HydrophobicContact CG2-CD1 3.82Å; I560-F742 HydrophobicContact CG2-CE1 4.41Å; I561-F742 HydrophobicContact CG1-CE1 4.05Å; I561-F742 HydrophobicContact CG1-CE2 4.46Å; I561-F742 HydrophobicContact CG1-CZ 3.83Å; L616-F742 HydrophobicContact CD1-CE2 4.44Å; L616-F742 HydrophobicContact CD1-CZ 3.98Å; L616-F742 HydrophobicContact CD2-CE2 4.41Å; L616-F742 HydrophobicContact CD2-CZ 4.4Å; S701-F742 WeakPolarHBondContact O-CA 3.39Å; K702-F742 HydrophobicContact CB-CD1 3.82Å; K702-F742 HydrophobicContact CB-CE1 3.62Å; K702-F742 HydrophobicContact CB-CE2 4.34Å; K702-F742 HydrophobicContact CB-CG 4.28Å; K702-F742 HydrophobicContact CB-CZ 3.9Å; K702-F742 HydrophobicContact CD-CE1 4.06Å; K702-F742 HydrophobicContact CD-CZ 4.13Å; K702-F742 HydrophobicContact CG-CE1 4.45Å; L740-F742 HydrophobicContact CB-CE2 4.35Å; F742-I788 PolarHBondContact O-N 2.93Å; F742-Y789 HydrophobicContact CB-CD2 4.35Å; F742-Y789 PolarHBondContact N-O 2.9Å; F742-Y789 PolarHBondContact O-N 3.47Å; F742-T791 HydrophobicContact CD2-CG2 3.93Å; F742-T791 HydrophobicContact CE2-CG2 3.67Å
743	A	91.8	Very high	87.1	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	147.4	176.7	0	0	0	0	0	111.4	S701 I708 M785 E786	S701-A743 PolarHBondContact N-O 3.2Å; S701-A743 PolarHBondContact O-N 3.16Å; I708-A743 HydrophobicContact CG2-CB 3.89Å; A743-M785 HydrophobicContact CB-CB 3.91Å; A743-M785 HydrophobicContact CB-CE 4.16Å; A743-M785 WeakPolarHBondContact O-CE 3.39Å; A743-E786 CarbonylContact C-O 3.44Å; A743-E786 WeakPolarHBondContact CA-O 3.49Å; A743-E786 VanDerWaalsContact CB-O 3.29Å; A743-E786 WeakPolarHBondContact CB-O 3.38Å
744	K	92.4	Very high	88	Confident	34 Å²	34	53 Å²	53	15%	0.148	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	158.8	172.3	71.2	-176.8	167.2	177.8	0	111.3	E556 Y698 V699 L700 E786 I788	E556-K744 IonicContact OE1-NZ 3.69Å; E556-K744 PolarHBondContact OE1-NZ 3.37Å; E556-K744 IonicContact OE2-NZ 2.76Å; Y698-K744 HydrophobicContact CE1-CD 4.33Å; V699-K744 CarbonylContact O-C 3.6Å; V699-K744 WeakPolarHBondContact O-CA 3.4Å; L700-K744 HydrophobicContact CD2-CB 3.88Å; K744-E786 PolarHBondContact N-O 3.49Å; K744-E786 PolarHBondContact O-N 3.16Å; K744-I788 HydrophobicContact CB-CD1 3.87Å; K744-I788 HydrophobicContact CD-CD1 3.52Å; K744-I788 HydrophobicContact CD-CG1 4.39Å; K744-I788 HydrophobicContact CG-CD1 3.52Å; K744-I788 HydrophobicContact CG-CG1 4.06Å
745	R	91.9	Very high	89.1	Confident	42 Å²	42	47.9 Å²	47.9	16%	0.158	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	124.1	167.2	177.9	-170.1	-171	-170	3.9	108.1	Y698 V699 L747 D780 I781 Y783 M785	Y698-R745 WeakPolarHBondContact CA-O 3.23Å; V699-R745 HydrophobicContact CB-CB 4.34Å; V699-R745 PolarHBondContact N-O 3.5Å; V699-R745 PolarHBondContact O-N 3.4Å; R745-L747 HydrophobicContact CG-CD2 4.26Å; R745-L747 HydrophobicContact CG-CG 4.45Å; R745-D780 PolarHBondContact NH1-O 3.08Å; R745-I781 PolarHBondContact NH1-O 3.04Å; R745-Y783 WeakPolarHBondContact CD-O 3.48Å; R745-Y783 PolarHBondContact NE-O 3.23Å; R745-Y783 PolarHBondContact NH1-O 3.28Å; R745-M785 HydrophobicContact CB-CE 4.13Å; R745-M785 HydrophobicContact CB-SD 3.54Å; R745-M785 VanDerWaalsContact CB-SD 3.54Å; R745-M785 HydrophobicContact CG-SD 4.49Å
746	Q	92.1	Very high	90	Very high	122 Å²	122	45.1 Å²	45.1	57%	0.57	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	137.9	172.2	-162.9	173.8	2.6	0	0	109.2	Y698	Y698-Q746 HydrophobicContact CD1-CB 3.96Å; Y698-Q746 HydrophobicContact CD1-CG 4.15Å; Y698-Q746 HydrophobicContact CE1-CB 3.65Å; Y698-Q746 HydrophobicContact CE1-CG 3.65Å
747	L	92.3	Very high	90.9	Very high	18 Å²	18	51.7 Å²	51.7	9%	0.094	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	150.6	179.2	-71.5	179.7	0	0	0	111.2	Y697 V699 R745 I751 Y752 L755	Y697-L747 PolarHBondContact O-N 2.95Å; V699-L747 HydrophobicContact CG2-CD1 3.66Å; V699-L747 HydrophobicContact CG2-CG 4.42Å; R745-L747 HydrophobicContact CG-CD2 4.26Å; R745-L747 HydrophobicContact CG-CG 4.45Å; L747-I751 HydrophobicContact CD2-CG2 3.96Å; L747-Y752 HydrophobicContact CD1-CD2 4.16Å; L747-L755 HydrophobicContact CD1-CD1 3.79Å
748	T	93.7	Very high	91.3	Very high	81 Å²	81	53.8 Å²	53.8	50%	0.497	27%	0.267	S	S	.	.			trans	-75.1	146.3	163.7	56.9	0	0	0	0	109.7	S750 I751 Y752	T748-S750 PolarHBondContact O-N 3.01Å; T748-S750 VanDerWaalsContact O-N 3.14Å; T748-I751 PolarHBondContact O-N 3.28Å; T748-I751 WeakPolarHBondContact OG1-CD1 3.14Å; T748-I751 WeakPolarHBondContact OG1-CG1 3.45Å; T748-Y752 PolarHBondContact O-N 3.38Å
749	Q	91.5	Very high	91.5	Very high	113 Å²	113	53 Å²	53	53%	0.528	27%	0.266	S	S	.	.	H	α-helix	trans	-50.7	-40.7	-177.8	-176.7	178.4	15.3	0	0	113.2	Y697 Y752 M753	Y697-Q749 HydrophobicContact CD2-CB 4.15Å; Y697-Q749 HydrophobicContact CE1-CG 4.17Å; Y697-Q749 HydrophobicContact CE2-CB 3.72Å; Y697-Q749 HydrophobicContact CE2-CG 3.88Å; Y697-Q749 PolarHBondContact OH-NE2 3.29Å; Q749-Y752 PolarHBondContact O-N 3.24Å; Q749-M753 HydrophobicContact CG-CG 4.34Å; Q749-M753 WeakPolarHBondContact O-CB 3.49Å; Q749-M753 VanDerWaalsContact O-CG 3.28Å; Q749-M753 WeakPolarHBondContact O-CG 3.47Å; Q749-M753 PolarHBondContact O-N 3.3Å
750	S	92.1	Very high	91.4	Very high	89 Å²	89	55.2 Å²	55.2	62%	0.622	27%	0.273	S	S	*	.	H	α-helix	trans	-64.1	-41.1	179.6	55.3	0	0	0	0	113.2	T748 K754	T748-S750 PolarHBondContact O-N 3.01Å; T748-S750 VanDerWaalsContact O-N 3.14Å; S750-K754 WeakPolarHBondContact O-CB 3.37Å; S750-K754 PolarHBondContact O-N 3.31Å
751	I	92.8	Very high	91.1	Very high	79 Å²	79	58.3 Å²	58.3	41%	0.405	29%	0.289	S	S	.	.	H	α-helix	trans	-71.2	-44.7	176.6	-61.8	175.3	0	0	0	109.9	L747 T748 M753 K754 L755	L747-I751 HydrophobicContact CD2-CG2 3.96Å; T748-I751 PolarHBondContact O-N 3.28Å; T748-I751 WeakPolarHBondContact OG1-CD1 3.14Å; T748-I751 WeakPolarHBondContact OG1-CG1 3.45Å; I751-M753 PolarHBondContact O-N 3.49Å; I751-K754 PolarHBondContact O-N 2.93Å; I751-L755 HydrophobicContact CG2-CD1 4Å; I751-L755 HydrophobicContact CG2-CG 4.41Å; I751-L755 WeakPolarHBondContact O-CG 3.45Å; I751-L755 PolarHBondContact O-N 2.85Å
752	Y	92.6	Very high	90.7	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.6	-50.7	178.8	-176.8	-85.3	0	0	0	112	D674 M689 V690 Y697 L747 T748 Q749 K754 L755 L756	D674-Y752 WeakPolarHBondContact OD2-CE1 2.76Å; D674-Y752 VanDerWaalsContact OD2-CZ 3.29Å; D674-Y752 PolarHBondContact OD2-OH 2.99Å; M689-Y752 HydrophobicContact CB-CE2 3.81Å; M689-Y752 WeakPolarHBondContact CB-OH 3.46Å; M689-Y752 HydrophobicContact CE-CD1 4.28Å; M689-Y752 HydrophobicContact CE-CD2 3.7Å; M689-Y752 HydrophobicContact CE-CE1 4.21Å; M689-Y752 HydrophobicContact CE-CE2 3.63Å; M689-Y752 HydrophobicContact CE-CG 4.05Å; M689-Y752 HydrophobicContact CG-CE2 4.48Å; M689-Y752 PolarHBondContact O-OH 3.32Å; V690-Y752 PolarHBondContact N-OH 3.14Å; Y697-Y752 AromaticContact CD1-CD1 3.47Å; Y697-Y752 HydrophobicContact CD1-CD1 3.47Å; Y697-Y752 VanDerWaalsContact CD1-CD1 3.47Å; Y697-Y752 HydrophobicContact CD1-CD2 4.01Å; Y697-Y752 AromaticContact CD1-CE1 3.73Å; Y697-Y752 HydrophobicContact CD1-CE1 3.73Å; Y697-Y752 HydrophobicContact CD1-CE2 4.23Å; Y697-Y752 AromaticContact CD1-CG 3.61Å; Y697-Y752 HydrophobicContact CD1-CG 3.61Å; Y697-Y752 HydrophobicContact CE1-CD1 4.02Å; Y697-Y752 HydrophobicContact CE1-CE1 4.24Å; Y697-Y752 HydrophobicContact CG-CD1 4.45Å; Y697-Y752 HydrophobicContact CG-CD2 4.36Å; Y697-Y752 HydrophobicContact CG-CG 4.17Å; L747-Y752 HydrophobicContact CD1-CD2 4.16Å; T748-Y752 PolarHBondContact O-N 3.38Å; Q749-Y752 PolarHBondContact O-N 3.24Å; Y752-K754 VanDerWaalsContact C-N 3.33Å; Y752-K754 PolarHBondContact O-N 3.11Å; Y752-L755 PolarHBondContact O-N 2.74Å; Y752-L756 WeakPolarHBondContact O-CB 3.41Å; Y752-L756 PolarHBondContact O-N 3.38Å
753	M	91.7	Very high	89.9	Confident	79 Å²	79	60.2 Å²	60.2	39%	0.389	30%	0.303	S	S	.	.	H	α-helix	trans	-65.9	-33.6	179.1	-66.7	-60.2	-114.3	0	0	112.5	Q749 I751 L756 K757	Q749-M753 HydrophobicContact CG-CG 4.34Å; Q749-M753 WeakPolarHBondContact O-CB 3.49Å; Q749-M753 VanDerWaalsContact O-CG 3.28Å; Q749-M753 WeakPolarHBondContact O-CG 3.47Å; Q749-M753 PolarHBondContact O-N 3.3Å; I751-M753 PolarHBondContact O-N 3.49Å; M753-L756 HydrophobicContact SD-CD2 4.33Å; M753-K757 WeakPolarHBondContact O-CB 3.4Å; M753-K757 PolarHBondContact O-N 2.93Å
754	K	92.7	Very high	89.3	Confident	140 Å²	140	66.4 Å²	66.4	61%	0.609	34%	0.336	S	S	*	.	H	α-helix	trans	-63.4	-45.8	172.9	-177.8	-179.2	178.3	-177.9	0	111.7	S750 I751 Y752 K757 N758	S750-K754 WeakPolarHBondContact O-CB 3.37Å; S750-K754 PolarHBondContact O-N 3.31Å; I751-K754 PolarHBondContact O-N 2.93Å; Y752-K754 VanDerWaalsContact C-N 3.33Å; Y752-K754 PolarHBondContact O-N 3.11Å; K754-K757 PolarHBondContact O-N 3.17Å; K754-N758 VanDerWaalsContact O-CG 3.3Å; K754-N758 PolarHBondContact O-N 3.18Å; K754-N758 PolarHBondContact O-OD1 3.38Å
755	L	92	Very high	88.7	Confident	17 Å²	17	67.9 Å²	67.9	9%	0.089	35%	0.346	C	S	.	.	H	α-helix	trans	-64.9	-43.5	177.6	-69.6	170.8	0	0	0	111.7	M689 L747 I751 Y752 K757 N758 L759 D780 I781	M689-L755 HydrophobicContact CE-CB 4.29Å; L747-L755 HydrophobicContact CD1-CD1 3.79Å; I751-L755 HydrophobicContact CG2-CD1 4Å; I751-L755 HydrophobicContact CG2-CG 4.41Å; I751-L755 WeakPolarHBondContact O-CG 3.45Å; I751-L755 PolarHBondContact O-N 2.85Å; Y752-L755 PolarHBondContact O-N 2.74Å; L755-K757 PolarHBondContact O-N 2.87Å; L755-N758 PolarHBondContact O-N 3.11Å; L755-L759 WeakPolarHBondContact O-CB 3.42Å; L755-L759 PolarHBondContact O-N 3.41Å; L755-D780 HydrophobicContact CD2-CB 3.73Å; L755-I781 HydrophobicContact CB-CG1 3.99Å; L755-I781 HydrophobicContact CD1-CG1 4.27Å; L755-I781 HydrophobicContact CD2-CG1 4.17Å; L755-I781 HydrophobicContact CG-CG1 4.37Å
756	L	90.2	Very high	88	Confident	11 Å²	11	72.2 Å²	72.2	6%	0.058	37%	0.371	C	S	.	.	H	α-helix	trans	-61.2	-43.4	176	-175.7	63.1	0	0	0	111.7	D674 A675 M689 Y752 M753 L759 K760	D674-L756 HydrophobicContact CB-CD1 4.17Å; D674-L756 HydrophobicContact CB-CD2 3.94Å; A675-L756 HydrophobicContact CB-CD1 3.92Å; M689-L756 HydrophobicContact CE-CB 4.23Å; Y752-L756 WeakPolarHBondContact O-CB 3.41Å; Y752-L756 PolarHBondContact O-N 3.38Å; M753-L756 HydrophobicContact SD-CD2 4.33Å; L756-L759 PolarHBondContact O-N 2.73Å; L756-K760 WeakPolarHBondContact O-CG 3.41Å; L756-K760 PolarHBondContact O-N 2.92Å
757	K	89.6	Confident	87.4	Confident	142 Å²	142	72.9 Å²	72.9	62%	0.617	38%	0.379	S	S	*	.	H	α-helix	trans	-61.1	-45.6	174.9	-175.5	176.8	-179	177.4	0	111.7	M753 K754 L755 L759 K760 L761	M753-K757 WeakPolarHBondContact O-CB 3.4Å; M753-K757 PolarHBondContact O-N 2.93Å; K754-K757 PolarHBondContact O-N 3.17Å; L755-K757 PolarHBondContact O-N 2.87Å; K757-L759 VanDerWaalsContact C-N 3.34Å; K757-L759 PolarHBondContact O-N 2.77Å; K757-K760 PolarHBondContact O-N 3.09Å; K757-L761 HydrophobicContact CG-CD1 4.29Å; K757-L761 WeakPolarHBondContact O-CG 3.1Å; K757-L761 PolarHBondContact O-N 2.74Å
758	N	90.5	Very high	86.8	Confident	57 Å²	57	78.2 Å²	78.2	31%	0.305	41%	0.407	S	S	.	.	H	α-helix	trans	-61.6	-42	177.3	-72.6	1.6	0	0	0	111.7	K754 L755 L761 A762	K754-N758 VanDerWaalsContact O-CG 3.3Å; K754-N758 PolarHBondContact O-N 3.18Å; K754-N758 PolarHBondContact O-OD1 3.38Å; L755-N758 PolarHBondContact O-N 3.11Å; N758-L761 PolarHBondContact O-N 3.2Å; N758-A762 WeakPolarHBondContact O-CB 3.3Å; N758-A762 PolarHBondContact O-N 2.93Å
759	L	87.9	Confident	86.1	Confident	24 Å²	24	81 Å²	81	13%	0.126	41%	0.414	C	S	.	.	H	α-helix	trans	-63.9	-43.9	176.4	-176.6	149.1	0	0	0	112	A675 L677 L755 L756 K757 L761 A762 S763 Y778 I781	A675-L759 HydrophobicContact CB-CD2 4.42Å; L677-L759 HydrophobicContact CD1-CD1 3.88Å; L677-L759 HydrophobicContact CG-CD1 4.15Å; L755-L759 WeakPolarHBondContact O-CB 3.42Å; L755-L759 PolarHBondContact O-N 3.41Å; L756-L759 PolarHBondContact O-N 2.73Å; K757-L759 VanDerWaalsContact C-N 3.34Å; K757-L759 PolarHBondContact O-N 2.77Å; L759-L761 VanDerWaalsContact C-N 3.32Å; L759-L761 PolarHBondContact O-N 3.36Å; L759-A762 PolarHBondContact O-N 3.38Å; L759-S763 PolarHBondContact O-N 3.38Å; L759-S763 PolarHBondContact O-OG 3.5Å; L759-Y778 HydrophobicContact CD1-CD1 4.46Å; L759-Y778 HydrophobicContact CD1-CE1 4.16Å; L759-I781 HydrophobicContact CB-CD1 4.37Å; L759-I781 HydrophobicContact CD1-CD1 3.57Å
760	K	84.3	Confident	85.6	Confident	72 Å²	72	80.9 Å²	80.9	31%	0.313	41%	0.409	S	S	.	.	H	α-helix	trans	-64.8	-32.8	175.8	-70.2	-169.3	-176.4	-166.3	0	112.5	T637 L756 K757 S763 N764	T637-K760 PolarHBondContact O-NZ 3.37Å; L756-K760 WeakPolarHBondContact O-CG 3.41Å; L756-K760 PolarHBondContact O-N 2.92Å; K757-K760 PolarHBondContact O-N 3.09Å; K760-S763 WeakPolarHBondContact CA-OG 3.22Å; K760-S763 PolarHBondContact O-OG 2.68Å; K760-N764 VanDerWaalsContact O-CG 3.26Å; K760-N764 PolarHBondContact O-ND2 3.29Å; K760-N764 PolarHBondContact O-OD1 2.83Å
761	L	86	Confident	85	Confident	103 Å²	103	81.9 Å²	81.9	54%	0.539	41%	0.406	S	S	.	.	H	α-helix	trans	-68.8	-47.8	171.8	-71.2	169.6	0	0	0	111.4	K757 N758 L759 S763 N764	K757-L761 HydrophobicContact CG-CD1 4.29Å; K757-L761 WeakPolarHBondContact O-CG 3.1Å; K757-L761 PolarHBondContact O-N 2.74Å; N758-L761 PolarHBondContact O-N 3.2Å; L759-L761 VanDerWaalsContact C-N 3.32Å; L759-L761 PolarHBondContact O-N 3.36Å; L761-S763 VanDerWaalsContact C-N 3.3Å; L761-S763 PolarHBondContact O-N 2.86Å; L761-N764 PolarHBondContact O-N 2.79Å; L761-N764 VanDerWaalsContact O-N 3.16Å
762	A	83.5	Confident	84.7	Confident	5 Å²	5	84.6 Å²	84.6	4%	0.041	42%	0.417	C	S	.	.	H	α-helix	trans	-63.6	-31.7	179.4	0	0	0	0	0	113.3	N758 L759 N764 A773 L774	N758-A762 WeakPolarHBondContact O-CB 3.3Å; N758-A762 PolarHBondContact O-N 2.93Å; L759-A762 PolarHBondContact O-N 3.38Å; A762-N764 VanDerWaalsContact C-N 3.28Å; A762-N764 PolarHBondContact O-N 3.44Å; A762-A773 HydrophobicContact CB-CB 3.8Å; A762-L774 HydrophobicContact CB-CD2 3.83Å; A762-L774 HydrophobicContact CB-CG 4.16Å
763	S	77.2	Confident	84.4	Confident	37 Å²	37	85.7 Å²	85.7	26%	0.259	43%	0.426	S	S	.	.	H	α-helix	trans	-69.2	-23.2	176	57	0	0	0	0	114.2	L759 K760 L761 R770	L759-S763 PolarHBondContact O-N 3.38Å; L759-S763 PolarHBondContact O-OG 3.5Å; K760-S763 WeakPolarHBondContact CA-OG 3.22Å; K760-S763 PolarHBondContact O-OG 2.68Å; L761-S763 VanDerWaalsContact C-N 3.3Å; L761-S763 PolarHBondContact O-N 2.86Å; S763-R770 PolarHBondContact O-NH1 3.33Å
764	N	78.6	Confident	84.2	Confident	130 Å²	130	82.9 Å²	82.9	70%	0.695	41%	0.413	S	S	*	.	H	α-helix	trans	-87.6	-11	-177.7	-67.2	-2.7	0	0	0	113.3	K760 L761 A762	K760-N764 VanDerWaalsContact O-CG 3.26Å; K760-N764 PolarHBondContact O-ND2 3.29Å; K760-N764 PolarHBondContact O-OD1 2.83Å; L761-N764 PolarHBondContact O-N 2.79Å; L761-N764 VanDerWaalsContact O-N 3.16Å; A762-N764 VanDerWaalsContact C-N 3.28Å; A762-N764 PolarHBondContact O-N 3.44Å
765	L	80.8	Confident	83.9	Confident	65 Å²	65	83 Å²	83	34%	0.34	41%	0.413	S	S	.	.			trans	-68.6	164.7	172.5	-64.5	174.1	0	0	0	111.4	R770 A773	L765-R770 HydrophobicContact CB-CB 3.8Å; L765-R770 WeakPolarHBondContact O-CD 3.47Å; L765-A773 HydrophobicContact CD1-CB 3.62Å
766	L	77	Confident	83.8	Confident	132 Å²	132	87.4 Å²	87.4	69%	0.691	43%	0.433	S	S	*	.			trans	-113.2	162.9	177.4	-68.7	165.8	0	0	0	111.1	R770	L766-R770 PolarHBondContact O-N 3.13Å
767	N	78	Confident	83.8	Confident	137 Å²	137	87.6 Å²	87.6	73%	0.733	44%	0.435	S	S	*	.	H	α-helix	trans	50.5	-140.5	170.3	-54.3	-21.3	0	0	0	114.2	E769 R770	N767-E769 PolarHBondContact O-N 2.89Å; N767-R770 WeakPolarHBondContact O-CB 3.25Å; N767-R770 PolarHBondContact O-N 3.27Å
768	D	79.8	Confident	83.8	Confident	129 Å²	129	83.6 Å²	83.6	69%	0.69	42%	0.417	S	S	*	.	H	α-helix	trans	-69.8	-29.1	-173.2	-64.7	-48.7	0	0	0	113.6	R770 I771 H772	D768-R770 VanDerWaalsContact C-N 3.31Å; D768-R770 PolarHBondContact O-N 2.88Å; D768-I771 PolarHBondContact O-N 2.77Å; D768-I771 VanDerWaalsContact O-N 3.09Å; D768-H772 PolarHBondContact O-N 2.88Å
769	E	79.6	Confident	83.7	Confident	139 Å²	139	84.8 Å²	84.8	65%	0.65	42%	0.423	S	S	*	.	H	α-helix	trans	-60.1	-42.8	176	-64.3	-173.1	166.2	0	0	111.2	N767 I771 H772 A773	N767-E769 PolarHBondContact O-N 2.89Å; E769-I771 VanDerWaalsContact C-N 3.34Å; E769-I771 PolarHBondContact O-N 2.87Å; E769-H772 PolarHBondContact O-N 3.35Å; E769-A773 VanDerWaalsContact O-CB 3.24Å; E769-A773 WeakPolarHBondContact O-CB 3.31Å; E769-A773 PolarHBondContact O-N 3.3Å
770	R	80.9	Confident	83.9	Confident	112 Å²	112	86.8 Å²	86.8	42%	0.423	43%	0.434	S	S	.	.	H	α-helix	trans	-58	-44.8	172.2	171.7	169.9	166.8	161.2	1.6	112.1	S763 L765 L766 N767 D768 L774	S763-R770 PolarHBondContact O-NH1 3.33Å; L765-R770 HydrophobicContact CB-CB 3.8Å; L765-R770 WeakPolarHBondContact O-CD 3.47Å; L766-R770 PolarHBondContact O-N 3.13Å; N767-R770 WeakPolarHBondContact O-CB 3.25Å; N767-R770 PolarHBondContact O-N 3.27Å; D768-R770 VanDerWaalsContact C-N 3.31Å; D768-R770 PolarHBondContact O-N 2.88Å; R770-L774 HydrophobicContact CG-CD1 3.58Å; R770-L774 HydrophobicContact CG-CG 4.18Å; R770-L774 VanDerWaalsContact O-CB 3.25Å; R770-L774 WeakPolarHBondContact O-CB 3.44Å; R770-L774 VanDerWaalsContact O-CG 3.25Å; R770-L774 WeakPolarHBondContact O-CG 3.25Å; R770-L774 PolarHBondContact O-N 3.1Å
771	I	80	Confident	84.2	Confident	110 Å²	110	83.4 Å²	83.4	56%	0.564	42%	0.419	S	S	*	.	H	α-helix	trans	-64.9	-43.4	-178	-60.5	174	0	0	0	110	D768 E769 K775	D768-I771 PolarHBondContact O-N 2.77Å; D768-I771 VanDerWaalsContact O-N 3.09Å; E769-I771 VanDerWaalsContact C-N 3.34Å; E769-I771 PolarHBondContact O-N 2.87Å; I771-K775 VanDerWaalsContact O-CB 3.27Å; I771-K775 WeakPolarHBondContact O-CB 3.44Å; I771-K775 PolarHBondContact O-N 2.85Å; I771-K775 VanDerWaalsContact O-N 3.14Å
772	H	85.8	Confident	84.4	Confident	135 Å²	135	78.6 Å²	78.6	63%	0.625	39%	0.394	S	S	*	.	H	α-helix	trans	-67.1	-47.1	177.7	-166.3	-76.4	0	0	0	112.2	D768 E769 K775 Q776	D768-H772 PolarHBondContact O-N 2.88Å; E769-H772 PolarHBondContact O-N 3.35Å; H772-K775 PolarHBondContact O-N 3.43Å; H772-Q776 PolarHBondContact O-N 3.22Å; H772-Q776 VanDerWaalsContact O-N 3.07Å
773	A	87	Confident	84.6	Confident	23 Å²	23	84.1 Å²	84.1	19%	0.19	42%	0.415	C	S	.	.	H	α-helix	trans	-63.6	-46.6	-180	0	0	0	0	0	112.2	A762 L765 E769 K775 Q776 C777	A762-A773 HydrophobicContact CB-CB 3.8Å; L765-A773 HydrophobicContact CD1-CB 3.62Å; E769-A773 VanDerWaalsContact O-CB 3.24Å; E769-A773 WeakPolarHBondContact O-CB 3.31Å; E769-A773 PolarHBondContact O-N 3.3Å; A773-K775 VanDerWaalsContact C-N 3.32Å; A773-K775 PolarHBondContact O-N 2.79Å; A773-Q776 PolarHBondContact O-N 2.57Å; A773-C777 PolarHBondContact O-N 2.84Å; A773-C777 PolarHBondContact O-SG 3.03Å; A773-C777 VanDerWaalsContact O-SG 3.35Å
774	L	86.4	Confident	85.2	Confident	21 Å²	21	84 Å²	84	11%	0.11	41%	0.411	C	S	.	.	H	α-helix	trans	-60.5	-41.7	176.1	-74.2	173.2	0	0	0	111.5	A762 R770 Q776 C777 Y778	A762-L774 HydrophobicContact CB-CD2 3.83Å; A762-L774 HydrophobicContact CB-CG 4.16Å; R770-L774 HydrophobicContact CG-CD1 3.58Å; R770-L774 HydrophobicContact CG-CG 4.18Å; R770-L774 VanDerWaalsContact O-CB 3.25Å; R770-L774 WeakPolarHBondContact O-CB 3.44Å; R770-L774 VanDerWaalsContact O-CG 3.25Å; R770-L774 WeakPolarHBondContact O-CG 3.25Å; R770-L774 PolarHBondContact O-N 3.1Å; L774-Q776 VanDerWaalsContact C-N 3.3Å; L774-Q776 PolarHBondContact O-N 3.07Å; L774-C777 PolarHBondContact O-N 2.86Å; L774-Y778 HydrophobicContact CB-CE1 4.5Å; L774-Y778 HydrophobicContact CB-CE2 4.41Å; L774-Y778 HydrophobicContact CD2-CE1 4.27Å; L774-Y778 WeakPolarHBondContact O-CB 3.28Å; L774-Y778 VanDerWaalsContact O-CD1 3.31Å; L774-Y778 WeakPolarHBondContact O-CD1 3.48Å; L774-Y778 PolarHBondContact O-N 3.32Å
775	K	87.1	Confident	85.6	Confident	141 Å²	141	78.2 Å²	78.2	61%	0.613	38%	0.38	S	S	*	.	H	α-helix	trans	-61	-38.4	176.8	-175.4	-179.5	178.5	-174.2	0	112.3	I771 H772 A773 N779	I771-K775 VanDerWaalsContact O-CB 3.27Å; I771-K775 WeakPolarHBondContact O-CB 3.44Å; I771-K775 PolarHBondContact O-N 2.85Å; I771-K775 VanDerWaalsContact O-N 3.14Å; H772-K775 PolarHBondContact O-N 3.43Å; A773-K775 VanDerWaalsContact C-N 3.32Å; A773-K775 PolarHBondContact O-N 2.79Å; K775-N779 PolarHBondContact O-N 3.42Å
776	Q	89.1	Confident	86	Confident	110 Å²	110	78.5 Å²	78.5	51%	0.514	38%	0.38	S	S	.	.	H	α-helix	trans	-67.3	-50.8	173.9	-175.7	172.9	-9.2	0	0	111.3	H772 A773 L774 Y778 N779 D780	H772-Q776 PolarHBondContact O-N 3.22Å; H772-Q776 VanDerWaalsContact O-N 3.07Å; A773-Q776 PolarHBondContact O-N 2.57Å; L774-Q776 VanDerWaalsContact C-N 3.3Å; L774-Q776 PolarHBondContact O-N 3.07Å; Q776-Y778 VanDerWaalsContact C-N 3.27Å; Q776-Y778 PolarHBondContact O-N 3Å; Q776-N779 WeakPolarHBondContact O-CB 3.17Å; Q776-N779 PolarHBondContact O-N 3.12Å; Q776-D780 PolarHBondContact O-N 2.96Å
777	C	90.6	Very high	86.6	Confident	15 Å²	15	72.2 Å²	72.2	10%	0.101	35%	0.347	C	S	.	.	H	α-helix	trans	-58.4	-37.2	178.4	-64.5	0	0	0	0	112.9	A773 L774 D780 I781	A773-C777 PolarHBondContact O-N 2.84Å; A773-C777 PolarHBondContact O-SG 3.03Å; A773-C777 VanDerWaalsContact O-SG 3.35Å; L774-C777 PolarHBondContact O-N 2.86Å; C777-D780 PolarHBondContact O-N 2.91Å; C777-I781 WeakPolarHBondContact O-CB 3.46Å; C777-I781 WeakPolarHBondContact O-CD1 3.31Å; C777-I781 VanDerWaalsContact O-CG1 3.26Å; C777-I781 WeakPolarHBondContact O-CG1 3.4Å; C777-I781 PolarHBondContact O-N 3.4Å
778	Y	90.9	Very high	87.1	Confident	59 Å²	59	65.9 Å²	65.9	23%	0.231	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-40.2	175.8	-65.4	-10.9	0	0	0	112.1	L677 L759 L774 Q776 E782	L677-Y778 HydrophobicContact CB-CE1 4.42Å; L677-Y778 HydrophobicContact CD2-CD1 3.4Å; L677-Y778 VanDerWaalsContact CD2-CD1 3.4Å; L677-Y778 HydrophobicContact CD2-CE1 3.96Å; L677-Y778 HydrophobicContact CD2-CG 3.96Å; L677-Y778 HydrophobicContact CG-CD1 3.79Å; L677-Y778 HydrophobicContact CG-CE1 3.78Å; L759-Y778 HydrophobicContact CD1-CD1 4.46Å; L759-Y778 HydrophobicContact CD1-CE1 4.16Å; L774-Y778 HydrophobicContact CB-CE1 4.5Å; L774-Y778 HydrophobicContact CB-CE2 4.41Å; L774-Y778 HydrophobicContact CD2-CE1 4.27Å; L774-Y778 WeakPolarHBondContact O-CB 3.28Å; L774-Y778 VanDerWaalsContact O-CD1 3.31Å; L774-Y778 WeakPolarHBondContact O-CD1 3.48Å; L774-Y778 PolarHBondContact O-N 3.32Å; Q776-Y778 VanDerWaalsContact C-N 3.27Å; Q776-Y778 PolarHBondContact O-N 3Å; Y778-E782 VanDerWaalsContact O-CB 3.27Å; Y778-E782 WeakPolarHBondContact O-CB 3.41Å; Y778-E782 VanDerWaalsContact O-CG 3.23Å; Y778-E782 WeakPolarHBondContact O-CG 3.41Å; Y778-E782 PolarHBondContact O-N 3.33Å
779	N	88.5	Confident	87.5	Confident	82 Å²	82	60 Å²	60	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-65.7	-40.2	175.2	-72.1	-16.8	0	0	0	112	K775 Q776 E782 Y783	K775-N779 PolarHBondContact O-N 3.42Å; Q776-N779 WeakPolarHBondContact O-CB 3.17Å; Q776-N779 PolarHBondContact O-N 3.12Å; N779-E782 CarbonylContact O-C 3.53Å; N779-E782 PolarHBondContact O-N 3.23Å; N779-Y783 WeakPolarHBondContact O-CB 3.31Å; N779-Y783 PolarHBondContact O-N 3.11Å; N779-Y783 VanDerWaalsContact O-N 3.08Å
780	D	90.6	Very high	88.1	Confident	66 Å²	66	53.3 Å²	53.3	35%	0.353	25%	0.25	S	C	.	.	H	α-helix	trans	-65.3	-38.6	178.8	-63	-22.1	0	0	0	112.2	R745 L755 Q776 C777	R745-D780 PolarHBondContact NH1-O 3.08Å; L755-D780 HydrophobicContact CD2-CB 3.73Å; Q776-D780 PolarHBondContact O-N 2.96Å; C777-D780 PolarHBondContact O-N 2.91Å
781	I	91.7	Very high	88.6	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68.6	-45.2	176.3	-70.6	164.5	0	0	0	111	L677 M689 V699 R745 L755 L759 C777 Y783	L677-I781 HydrophobicContact CD1-CD1 4.41Å; L677-I781 HydrophobicContact CD2-CB 4.35Å; L677-I781 HydrophobicContact CD2-CD1 4.12Å; L677-I781 HydrophobicContact CD2-CG2 4.03Å; M689-I781 HydrophobicContact CG-CG2 4.38Å; M689-I781 HydrophobicContact SD-CD1 3.92Å; M689-I781 HydrophobicContact SD-CG1 4.28Å; M689-I781 HydrophobicContact SD-CG2 4.31Å; V699-I781 HydrophobicContact CG1-CG2 3.79Å; V699-I781 HydrophobicContact CG2-CG2 4.17Å; R745-I781 PolarHBondContact NH1-O 3.04Å; L755-I781 HydrophobicContact CB-CG1 3.99Å; L755-I781 HydrophobicContact CD1-CG1 4.27Å; L755-I781 HydrophobicContact CD2-CG1 4.17Å; L755-I781 HydrophobicContact CG-CG1 4.37Å; L759-I781 HydrophobicContact CB-CD1 4.37Å; L759-I781 HydrophobicContact CD1-CD1 3.57Å; C777-I781 WeakPolarHBondContact O-CB 3.46Å; C777-I781 WeakPolarHBondContact O-CD1 3.31Å; C777-I781 VanDerWaalsContact O-CG1 3.26Å; C777-I781 WeakPolarHBondContact O-CG1 3.4Å; C777-I781 PolarHBondContact O-N 3.4Å; I781-Y783 VanDerWaalsContact C-N 3.31Å; I781-Y783 PolarHBondContact O-N 3.21Å
782	E	89.6	Confident	89	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.009	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	15.6	-174	-57.9	173.7	145.7	0	0	113.4	L677 R683 R685 S687 Y778 N779 M785	L677-E782 HydrophobicContact CD2-CG 4.45Å; R683-E782 IonicContact CZ-OE1 2.66Å; R683-E782 VanDerWaalsContact CZ-OE1 3.25Å; R683-E782 IonicContact NE-OE1 3.13Å; R683-E782 PolarHBondContact NE-OE1 3.4Å; R683-E782 IonicContact NE-OE2 3.7Å; R683-E782 PolarHBondContact NE-OE2 3.33Å; R683-E782 VanDerWaalsContact NE-OE2 3.15Å; R683-E782 IonicContact NH2-OE1 4Å; R683-E782 PolarHBondContact NH2-OE1 3.01Å; R685-E782 IonicContact CZ-OE2 2.99Å; R685-E782 VanDerWaalsContact NE-CD 3.3Å; R685-E782 IonicContact NE-OE1 3.51Å; R685-E782 IonicContact NE-OE2 3.04Å; R685-E782 PolarHBondContact NE-OE2 3.28Å; R685-E782 IonicContact NH2-OE2 2.67Å; R685-E782 PolarHBondContact NH2-OE2 2.77Å; S687-E782 VanDerWaalsContact CB-OE1 3.31Å; S687-E782 WeakPolarHBondContact CB-OE1 3.37Å; S687-E782 PolarHBondContact OG-OE1 2.62Å; Y778-E782 VanDerWaalsContact O-CB 3.27Å; Y778-E782 WeakPolarHBondContact O-CB 3.41Å; Y778-E782 VanDerWaalsContact O-CG 3.23Å; Y778-E782 WeakPolarHBondContact O-CG 3.41Å; Y778-E782 PolarHBondContact O-N 3.33Å; N779-E782 CarbonylContact O-C 3.53Å; N779-E782 PolarHBondContact O-N 3.23Å; E782-M785 WeakPolarHBondContact O-CG 3.4Å
783	Y	88.7	Confident	89.1	Confident	122 Å²	122	36.3 Å²	36.3	48%	0.478	17%	0.173	S	C	.	.	S	Bend	trans	-75.3	139.8	173.6	-179.7	-93.8	0	0	0	111.7	R745 N779 I781	R745-Y783 WeakPolarHBondContact CD-O 3.48Å; R745-Y783 PolarHBondContact NE-O 3.23Å; R745-Y783 PolarHBondContact NH1-O 3.28Å; N779-Y783 WeakPolarHBondContact O-CB 3.31Å; N779-Y783 PolarHBondContact O-N 3.11Å; N779-Y783 VanDerWaalsContact O-N 3.08Å; I781-Y783 VanDerWaalsContact C-N 3.31Å; I781-Y783 PolarHBondContact O-N 3.21Å
784	D	88.4	Confident	88.9	Confident	33 Å²	33	37.6 Å²	37.6	18%	0.176	18%	0.175	C	C	.	.	S	Bend	trans	47.7	64.9	176.4	-150.7	55.4	0	0	0	115.8	K713 S715 T716	K713-D784 CarbonylContact O-C 3.47Å; K713-D784 WeakPolarHBondContact O-CA 3.42Å; K713-D784 PolarHBondContact O-N 3.14Å; K713-D784 VanDerWaalsContact O-N 3.1Å; S715-D784 WeakPolarHBondContact CA-OD1 3.39Å; S715-D784 WeakPolarHBondContact CB-OD1 3.31Å; S715-D784 PolarHBondContact N-OD1 3.06Å; S715-D784 PolarHBondContact OG-OD1 2.83Å; T716-D784 WeakPolarHBondContact CB-OD2 3.35Å; T716-D784 WeakPolarHBondContact CG2-OD2 3.24Å; T716-D784 PolarHBondContact N-OD1 2.74Å; T716-D784 PolarHBondContact OG1-OD1 3.14Å; T716-D784 VanDerWaalsContact OG1-OD1 3.05Å; T716-D784 PolarHBondContact OG1-OD2 3.22Å
785	M	88	Confident	88.8	Confident	9 Å²	9	37 Å²	37	4%	0.044	17%	0.172	C	C	.	.			trans	-91.3	140.2	176.2	-58.3	-70.9	-55.9	0	0	111.1	V699 K713 C714 T717 A743 R745 E782	V699-M785 HydrophobicContact CB-SD 4.48Å; V699-M785 HydrophobicContact CG1-CE 4.34Å; V699-M785 HydrophobicContact CG1-SD 4.22Å; K713-M785 PolarHBondContact O-N 3.43Å; C714-M785 PolarHBondContact SG-O 2.91Å; T717-M785 PolarHBondContact OG1-O 3.37Å; A743-M785 HydrophobicContact CB-CB 3.91Å; A743-M785 HydrophobicContact CB-CE 4.16Å; A743-M785 WeakPolarHBondContact O-CE 3.39Å; R745-M785 HydrophobicContact CB-CE 4.13Å; R745-M785 HydrophobicContact CB-SD 3.54Å; R745-M785 VanDerWaalsContact CB-SD 3.54Å; R745-M785 HydrophobicContact CG-SD 4.49Å; E782-M785 WeakPolarHBondContact O-CG 3.4Å
786	E	89	Confident	88.6	Confident	72 Å²	72	32.3 Å²	32.3	34%	0.336	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	115.8	173.5	-173	-165.1	174.5	0	0	110.6	A743 K744 I788	A743-E786 CarbonylContact C-O 3.44Å; A743-E786 WeakPolarHBondContact CA-O 3.49Å; A743-E786 VanDerWaalsContact CB-O 3.29Å; A743-E786 WeakPolarHBondContact CB-O 3.38Å; K744-E786 PolarHBondContact N-O 3.49Å; K744-E786 PolarHBondContact O-N 3.16Å; E786-I788 WeakPolarHBondContact O-CG1 3.29Å
787	P	89.1	Confident	88.4	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	126	176.1	31.4	-32.6	0	0	0	111.2	L477 L709 T717 V741	L477-P787 HydrophobicContact CD1-CB 4.19Å; L709-P787 HydrophobicContact CD2-CB 3.77Å; L709-P787 HydrophobicContact CD2-CG 3.89Å; T717-P787 HydrophobicContact CG2-CG 3.68Å; T717-P787 WeakPolarHBondContact OG1-CD 3.47Å; V741-P787 HydrophobicContact CG1-CB 4.08Å
788	I	87.8	Confident	88.2	Confident	4 Å²	4	29 Å²	29	2%	0.021	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	-41.1	-171.7	-28.1	162.2	0	0	0	112.3	L476 L477 I560 F742 K744 E786	L476-I788 HydrophobicContact CD1-CG2 4.23Å; L477-I788 VanDerWaalsContact CB-O 3.31Å; L477-I788 WeakPolarHBondContact CB-O 3.31Å; L477-I788 WeakPolarHBondContact CG-O 3.41Å; L477-I788 PolarHBondContact N-O 2.95Å; I560-I788 HydrophobicContact CD1-CD1 3.8Å; F742-I788 PolarHBondContact O-N 2.93Å; K744-I788 HydrophobicContact CB-CD1 3.87Å; K744-I788 HydrophobicContact CD-CD1 3.52Å; K744-I788 HydrophobicContact CD-CG1 4.39Å; K744-I788 HydrophobicContact CG-CD1 3.52Å; K744-I788 HydrophobicContact CG-CG1 4.06Å; E786-I788 WeakPolarHBondContact O-CG1 3.29Å
789	Y	89.2	Confident	87.9	Confident	4 Å²	4	27.7 Å²	27.7	2%	0.016	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	148.6	-172.5	-51	-79.4	0	0	0	112.4	C475 L476 D553 F557 I560 F742	C475-Y789 WeakPolarHBondContact O-CA 3.45Å; L476-Y789 HydrophobicContact CB-CD1 4.11Å; L476-Y789 HydrophobicContact CB-CE1 3.97Å; L476-Y789 HydrophobicContact CD1-CD1 4.07Å; L476-Y789 HydrophobicContact CD1-CE1 3.41Å; L476-Y789 VanDerWaalsContact CD1-CE1 3.41Å; L476-Y789 HydrophobicContact CG-CE1 4.15Å; D553-Y789 PolarHBondContact O-OH 3.18Å; F557-Y789 HydrophobicContact CB-CD1 3.99Å; F557-Y789 HydrophobicContact CB-CD2 4.16Å; F557-Y789 HydrophobicContact CB-CE1 3.55Å; F557-Y789 HydrophobicContact CB-CE2 3.75Å; F557-Y789 HydrophobicContact CB-CG 4.31Å; F557-Y789 VanDerWaalsContact CB-CZ 3.47Å; F557-Y789 AromaticContact CD2-CD1 3.67Å; F557-Y789 HydrophobicContact CD2-CD1 3.67Å; F557-Y789 AromaticContact CD2-CD2 3.45Å; F557-Y789 HydrophobicContact CD2-CD2 3.45Å; F557-Y789 VanDerWaalsContact CD2-CD2 3.45Å; F557-Y789 HydrophobicContact CD2-CE1 4.13Å; F557-Y789 AromaticContact CD2-CE2 3.95Å; F557-Y789 HydrophobicContact CD2-CE2 3.95Å; F557-Y789 AromaticContact CD2-CG 3.34Å; F557-Y789 HydrophobicContact CD2-CG 3.34Å; F557-Y789 HydrophobicContact CE2-CD1 4.37Å; F557-Y789 HydrophobicContact CE2-CD2 4.31Å; F557-Y789 AromaticContact CE2-CG 3.94Å; F557-Y789 HydrophobicContact CE2-CG 3.94Å; F557-Y789 AromaticContact CG-CD1 3.91Å; F557-Y789 HydrophobicContact CG-CD1 3.91Å; F557-Y789 HydrophobicContact CG-CD2 4.2Å; F557-Y789 AromaticContact CG-CE1 4Å; F557-Y789 HydrophobicContact CG-CE1 4Å; F557-Y789 HydrophobicContact CG-CE2 4.29Å; F557-Y789 HydrophobicContact CG-CG 4.05Å; I560-Y789 HydrophobicContact CD1-CE2 4.28Å; F742-Y789 HydrophobicContact CB-CD2 4.35Å; F742-Y789 PolarHBondContact N-O 2.9Å; F742-Y789 PolarHBondContact O-N 3.47Å
790	V	90.8	Very high	87.7	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	120.7	164.9	-179.7	0	0	0	0	107.9	C474 C475 L477 A725 V729 Y732	C474-V790 CarbonylContact C-O 3.54Å; C474-V790 WeakPolarHBondContact CA-O 3.3Å; C475-V790 PolarHBondContact N-O 2.98Å; C475-V790 PolarHBondContact O-N 3.08Å; L477-V790 HydrophobicContact CD1-CG2 4.34Å; L477-V790 HydrophobicContact CD2-CG2 4.05Å; L477-V790 HydrophobicContact CG-CG2 4.42Å; A725-V790 HydrophobicContact CB-CG2 4.17Å; V729-V790 HydrophobicContact CG2-CG1 3.59Å; V729-V790 HydrophobicContact CG2-CG2 4.22Å; Y732-V790 HydrophobicContact CD2-CG1 3.87Å; Y732-V790 HydrophobicContact CE2-CB 4.44Å; Y732-V790 HydrophobicContact CE2-CG1 3.88Å
791	T	91.5	Very high	87.7	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	150.3	175.4	59.4	0	0	0	0	111.4	L471 C474 F557 L616 T739 L740 F742	L471-T791 HydrophobicContact CD1-CG2 4.38Å; C474-T791 HydrophobicContact CB-CG2 4.21Å; F557-T791 HydrophobicContact CE2-CG2 3.62Å; F557-T791 HydrophobicContact CZ-CG2 3.58Å; L616-T791 HydrophobicContact CD2-CG2 4.09Å; T739-T791 VanDerWaalsContact CA-O 3.32Å; T739-T791 WeakPolarHBondContact CA-O 3.44Å; L740-T791 PolarHBondContact N-O 3.36Å; L740-T791 PolarHBondContact O-N 3.38Å; L740-T791 PolarHBondContact O-OG1 2.69Å; F742-T791 HydrophobicContact CD2-CG2 3.93Å; F742-T791 HydrophobicContact CE2-CG2 3.67Å
792	A	88.7	Confident	87.6	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	114	174.2	0	0	0	0	0	109.3	Y472 S473 Y732 L737 R738	Y472-A792 PolarHBondContact N-O 3.06Å; S473-A792 PolarHBondContact N-O 2.75Å; S473-A792 PolarHBondContact O-N 2.9Å; Y732-A792 HydrophobicContact CD1-CB 3.77Å; Y732-A792 HydrophobicContact CD2-CB 3.78Å; Y732-A792 HydrophobicContact CE1-CB 4.02Å; Y732-A792 HydrophobicContact CE2-CB 4.02Å; Y732-A792 HydrophobicContact CG-CB 3.64Å; L737-A792 HydrophobicContact CB-CB 4.07Å; L737-A792 HydrophobicContact CD1-CB 3.79Å; R738-A792 CarbonylContact O-C 3.59Å; R738-A792 WeakPolarHBondContact O-CA 3.44Å
793	I	88	Confident	87.6	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.3	179.7	-56.6	172.3	0	0	0	108.1	M469 V470 D612 A615 L616 R738 L740	M469-I793 HydrophobicContact CB-CG2 3.94Å; M469-I793 HydrophobicContact SD-CG2 4.42Å; V470-I793 CarbonylContact O-C 3.54Å; V470-I793 WeakPolarHBondContact O-CA 3.29Å; D612-I793 HydrophobicContact CB-CD1 4.03Å; A615-I793 HydrophobicContact CB-CG2 4.17Å; L616-I793 HydrophobicContact CD1-CD1 4.1Å; L616-I793 HydrophobicContact CD2-CD1 4.13Å; L616-I793 HydrophobicContact CD2-CG1 4.44Å; L616-I793 HydrophobicContact CG-CD1 3.86Å; R738-I793 HydrophobicContact CB-CB 4.31Å; R738-I793 PolarHBondContact N-O 3.43Å; R738-I793 PolarHBondContact O-N 3.19Å; L740-I793 HydrophobicContact CD1-CD1 4.15Å
794	E	84.2	Confident	87.8	Confident	50 Å²	50	23.4 Å²	23.4	23%	0.234	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	130.8	173.8	-171.3	-179.6	-155.1	0	0	110.5	M469 V470 L737 K796	M469-E794 CarbonylContact C-O 3.49Å; M469-E794 VanDerWaalsContact CA-O 3.32Å; M469-E794 WeakPolarHBondContact CA-O 3.34Å; V470-E794 PolarHBondContact N-O 2.98Å; V470-E794 PolarHBondContact O-N 3.25Å; L737-E794 HydrophobicContact CD2-CB 3.74Å; L737-E794 HydrophobicContact CD2-CG 4.02Å; E794-K796 HydrophobicContact CG-CG 4.11Å; E794-K796 VanDerWaalsContact OE2-CE 3.26Å; E794-K796 WeakPolarHBondContact OE2-CE 3.3Å
795	D	82.7	Confident	87.9	Confident	8 Å²	8	22 Å²	22	4%	0.043	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	91.5	168.2	-175.1	-3.5	0	0	0	107.2	K460 T465 M469 R738 L797 I829	K460-D795 IonicContact NZ-OD2 3.86Å; K460-D795 PolarHBondContact NZ-OD2 3.03Å; T465-D795 WeakPolarHBondContact CB-OD1 3.47Å; T465-D795 VanDerWaalsContact CG2-OD1 3.31Å; T465-D795 WeakPolarHBondContact CG2-OD1 3.4Å; M469-D795 HydrophobicContact CE-CB 3.91Å; M469-D795 WeakPolarHBondContact CE-OD1 3.33Å; M469-D795 HydrophobicContact SD-CB 3.58Å; M469-D795 VanDerWaalsContact SD-CB 3.58Å; R738-D795 IonicContact CZ-OD2 2.72Å; R738-D795 IonicContact NE-OD2 2.67Å; R738-D795 IonicContact NH2-OD2 3.73Å; R738-D795 PolarHBondContact NH2-OD2 2.73Å; D795-L797 PolarHBondContact O-N 3.39Å; D795-I829 HydrophobicContact CB-CD1 3.95Å
796	K	82.7	Confident	88	Confident	42 Å²	42	27 Å²	27	18%	0.183	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	128.8	-162.6	-74.2	-162.1	168.4	-175.2	0	112.3	T465 Q466 F468 V470 D486 E794	T465-K796 CarbonylContact C-O 3.6Å; T465-K796 WeakPolarHBondContact CA-O 3.32Å; Q466-K796 PolarHBondContact N-O 3.35Å; F468-K796 HydrophobicContact CD1-CD 4.36Å; F468-K796 WeakPolarHBondContact O-CB 3.39Å; F468-K796 PolarHBondContact O-N 3.12Å; F468-K796 VanDerWaalsContact O-N 3.07Å; V470-K796 HydrophobicContact CG2-CD 3.83Å; V470-K796 HydrophobicContact CG2-CG 4.23Å; D486-K796 IonicContact OD1-NZ 3.1Å; D486-K796 WeakPolarHBondContact OD2-CE 3.42Å; D486-K796 IonicContact OD2-NZ 3.29Å; D486-K796 PolarHBondContact OD2-NZ 2.87Å; E794-K796 HydrophobicContact CG-CG 4.11Å; E794-K796 VanDerWaalsContact OE2-CE 3.26Å; E794-K796 WeakPolarHBondContact OE2-CE 3.3Å
797	L	86.7	Confident	88	Confident	38 Å²	38	23.9 Å²	23.9	20%	0.199	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	150.9	177	-63	172.4	0	0	0	111.7	L464 T465 Q466 D795 I829 I833	L464-L797 WeakPolarHBondContact O-CA 3.38Å; T465-L797 HydrophobicContact CG2-CD2 4.31Å; Q466-L797 PolarHBondContact NE2-O 2.76Å; D795-L797 PolarHBondContact O-N 3.39Å; L797-I829 HydrophobicContact CD2-CD1 4.1Å; L797-I829 HydrophobicContact CD2-CG2 4.2Å; L797-I833 HydrophobicContact CD1-CG2 3.62Å; L797-I833 HydrophobicContact CD2-CG2 3.51Å; L797-I833 HydrophobicContact CG-CG2 4.21Å
798	Q	85.8	Confident	88.1	Confident	19 Å²	19	23.9 Å²	23.9	9%	0.089	12%	0.123	C	C	.	.	P	Polyproline II helix	trans	-61.5	148	167.8	-70.8	-162.8	11.5	0	0	110.9	G462 L464 Q466 G800 V801	G462-Q798 PolarHBondContact O-NE2 3.48Å; L464-Q798 PolarHBondContact O-N 3.28Å; Q466-Q798 HydrophobicContact CG-CG 4.1Å; Q798-G800 PolarHBondContact O-N 3.42Å; Q798-V801 HydrophobicContact CB-CG2 3.6Å; Q798-V801 VanDerWaalsContact O-CG2 3.23Å; Q798-V801 WeakPolarHBondContact O-CG2 3.44Å; Q798-V801 PolarHBondContact O-N 3.2Å
799	P	84.3	Confident	88.1	Confident	31 Å²	31	27.2 Å²	27.2	20%	0.201	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	133.6	-178.7	24.6	-34.6	0	0	0	111.4	V801 E1085 R1087	P799-V801 VanDerWaalsContact C-N 3.31Å; P799-V801 PolarHBondContact O-N 3.16Å; P799-E1085 WeakPolarHBondContact CG-OE1 3.46Å; P799-R1087 WeakPolarHBondContact O-CB 3.24Å
800	G	85.1	Confident	87.9	Confident	25 Å²	25	31.6 Å²	31.6	26%	0.258	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	0.6	176.1	0	0	0	0	0	117	Q798 K802 N803 C804	Q798-G800 PolarHBondContact O-N 3.42Å; G800-K802 VanDerWaalsContact C-N 3.34Å; G800-K802 PolarHBondContact O-N 3.42Å; G800-N803 PolarHBondContact O-N 3.2Å; G800-C804 PolarHBondContact O-N 3.38Å
801	V	90.3	Very high	87.7	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.012	16%	0.158	C	C	.	.	H	α-helix	trans	-52.2	-48	-179.8	167	0	0	0	0	112.7	L464 Q798 P799 N803 C804 I805 I833 F1086	L464-V801 HydrophobicContact CD2-CG1 3.83Å; Q798-V801 HydrophobicContact CB-CG2 3.6Å; Q798-V801 VanDerWaalsContact O-CG2 3.23Å; Q798-V801 WeakPolarHBondContact O-CG2 3.44Å; Q798-V801 PolarHBondContact O-N 3.2Å; P799-V801 VanDerWaalsContact C-N 3.31Å; P799-V801 PolarHBondContact O-N 3.16Å; V801-N803 PolarHBondContact O-N 3.32Å; V801-C804 WeakPolarHBondContact O-CB 3.43Å; V801-C804 PolarHBondContact O-N 2.96Å; V801-I805 HydrophobicContact CG1-CD1 3.78Å; V801-I805 HydrophobicContact CG1-CG1 4.41Å; V801-I805 PolarHBondContact O-N 2.79Å; V801-I833 HydrophobicContact CG1-CB 4.38Å; V801-I833 HydrophobicContact CG1-CG2 3.77Å; V801-F1086 HydrophobicContact CB-CD1 4.35Å; V801-F1086 HydrophobicContact CG1-CD1 4.29Å; V801-F1086 HydrophobicContact CG1-CE1 4.46Å; V801-F1086 HydrophobicContact CG2-CB 3.97Å; V801-F1086 HydrophobicContact CG2-CD1 3.84Å; V801-F1086 HydrophobicContact CG2-CG 4.11Å
802	K	89	Confident	87.3	Confident	66 Å²	66	33.5 Å²	33.5	29%	0.287	18%	0.177	S	C	.	.	H	α-helix	trans	-57	-47.8	179.3	-179.6	174.3	176.4	165.7	0	112.1	G800 C804 I805 K806 E834	G800-K802 VanDerWaalsContact C-N 3.34Å; G800-K802 PolarHBondContact O-N 3.42Å; K802-C804 PolarHBondContact O-N 2.91Å; K802-I805 PolarHBondContact O-N 2.96Å; K802-K806 WeakPolarHBondContact O-CB 3.16Å; K802-K806 PolarHBondContact O-N 3.1Å; K802-E834 WeakPolarHBondContact CE-OE1 3.29Å; K802-E834 VanDerWaalsContact CE-OE2 3.3Å; K802-E834 WeakPolarHBondContact CE-OE2 3.35Å; K802-E834 VanDerWaalsContact NZ-CD 3.28Å; K802-E834 IonicContact NZ-OE1 3.76Å; K802-E834 PolarHBondContact NZ-OE1 3.08Å; K802-E834 IonicContact NZ-OE2 3.52Å
803	N	89.6	Confident	87.2	Confident	87 Å²	87	33.8 Å²	33.8	47%	0.465	18%	0.179	S	C	.	.	H	α-helix	trans	-66.6	-36.7	178.2	-69.7	-11	0	0	0	111.9	G800 V801 A807	G800-N803 PolarHBondContact O-N 3.2Å; V801-N803 PolarHBondContact O-N 3.32Å; N803-A807 WeakPolarHBondContact O-CB 3.49Å; N803-A807 PolarHBondContact O-N 3.3Å
804	C	92.4	Very high	87.2	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.014	18%	0.182	C	C	.	.	H	α-helix	trans	-63.2	-53.2	174.6	-172.8	0	0	0	0	111.3	G800 V801 K802 K806 A807 L808 F1086 K1090	G800-C804 PolarHBondContact O-N 3.38Å; V801-C804 WeakPolarHBondContact O-CB 3.43Å; V801-C804 PolarHBondContact O-N 2.96Å; K802-C804 PolarHBondContact O-N 2.91Å; C804-K806 VanDerWaalsContact C-N 3.33Å; C804-K806 PolarHBondContact O-N 2.86Å; C804-A807 PolarHBondContact O-N 3.02Å; C804-A807 VanDerWaalsContact O-N 3.16Å; C804-L808 VanDerWaalsContact O-CG 3.29Å; C804-L808 WeakPolarHBondContact O-CG 3.26Å; C804-L808 PolarHBondContact O-N 2.97Å; C804-F1086 HydrophobicContact CB-CD1 4.23Å; C804-F1086 HydrophobicContact CB-CE1 4.18Å; C804-K1090 HydrophobicContact CB-CB 4.47Å
805	I	91	Very high	87.6	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-60.2	-41.4	179.6	-73.3	177.7	0	0	0	111.6	L464 V801 K802 L808 K809 I815 I833 F1086	L464-I805 HydrophobicContact CD2-CD1 4.08Å; V801-I805 HydrophobicContact CG1-CD1 3.78Å; V801-I805 HydrophobicContact CG1-CG1 4.41Å; V801-I805 PolarHBondContact O-N 2.79Å; K802-I805 PolarHBondContact O-N 2.96Å; I805-L808 PolarHBondContact O-N 3.37Å; I805-K809 HydrophobicContact CG2-CD 4.32Å; I805-K809 WeakPolarHBondContact O-CB 3.48Å; I805-K809 WeakPolarHBondContact O-CG 3.38Å; I805-K809 PolarHBondContact O-N 2.82Å; I805-I815 HydrophobicContact CB-CD1 4.43Å; I805-I815 HydrophobicContact CG1-CD1 4.4Å; I805-I815 HydrophobicContact CG2-CD1 4.03Å; I805-I833 HydrophobicContact CD1-CB 4.04Å; I805-I833 HydrophobicContact CD1-CD1 3.72Å; I805-I833 HydrophobicContact CD1-CG1 4Å; I805-F1086 HydrophobicContact CD1-CE1 4.43Å; I805-F1086 HydrophobicContact CG1-CE1 3.97Å; I805-F1086 HydrophobicContact CG1-CZ 4.36Å
806	K	89.4	Confident	88.2	Confident	116 Å²	116	32.2 Å²	32.2	50%	0.504	17%	0.171	S	C	.	.	H	α-helix	trans	-59.7	-49.7	173.9	-176.6	176.7	176.7	-179.4	0	111.7	K802 C804 L808 K809 E810	K802-K806 WeakPolarHBondContact O-CB 3.16Å; K802-K806 PolarHBondContact O-N 3.1Å; C804-K806 VanDerWaalsContact C-N 3.33Å; C804-K806 PolarHBondContact O-N 2.86Å; K806-L808 PolarHBondContact O-N 3.47Å; K806-K809 PolarHBondContact O-N 2.84Å; K806-E810 VanDerWaalsContact CE-OE1 3.22Å; K806-E810 WeakPolarHBondContact CE-OE1 3.47Å; K806-E810 WeakPolarHBondContact O-CG 3.39Å; K806-E810 PolarHBondContact O-N 3.42Å
807	A	88.9	Confident	88.7	Confident	5 Å²	5	30.3 Å²	30.3	4%	0.041	16%	0.163	C	C	.	.	H	α-helix	trans	-61.8	-40.7	178.8	0	0	0	0	0	112.7	N803 C804 E810 A811 K1090 L1094 P1173	N803-A807 WeakPolarHBondContact O-CB 3.49Å; N803-A807 PolarHBondContact O-N 3.3Å; C804-A807 PolarHBondContact O-N 3.02Å; C804-A807 VanDerWaalsContact O-N 3.16Å; A807-E810 PolarHBondContact O-N 2.86Å; A807-A811 WeakPolarHBondContact O-CB 3.38Å; A807-A811 PolarHBondContact O-N 3.16Å; A807-K1090 HydrophobicContact CB-CD 4.17Å; A807-K1090 HydrophobicContact CB-CG 4.18Å; A807-L1094 HydrophobicContact CB-CD1 4.12Å; A807-P1173 HydrophobicContact CB-CB 4.2Å; A807-P1173 HydrophobicContact CB-CG 3.72Å; A807-P1173 WeakPolarHBondContact O-CB 3.39Å
808	L	91.4	Very high	89	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67.4	-39.2	177.2	-66.7	171	0	0	0	112.2	L456 C804 I805 K806 A811 G812 I813 I815 I1089 F1093	L456-L808 HydrophobicContact CD2-CD1 3.82Å; C804-L808 VanDerWaalsContact O-CG 3.29Å; C804-L808 WeakPolarHBondContact O-CG 3.26Å; C804-L808 PolarHBondContact O-N 2.97Å; I805-L808 PolarHBondContact O-N 3.37Å; K806-L808 PolarHBondContact O-N 3.47Å; L808-A811 WeakPolarHBondContact O-CB 3.3Å; L808-A811 PolarHBondContact O-N 3.44Å; L808-G812 PolarHBondContact O-N 2.98Å; L808-I813 HydrophobicContact CD2-CD1 3.73Å; L808-I813 WeakPolarHBondContact O-CB 3.34Å; L808-I813 PolarHBondContact O-N 3.42Å; L808-I813 VanDerWaalsContact O-N 3.09Å; L808-I815 HydrophobicContact CB-CD1 3.92Å; L808-I1089 HydrophobicContact CD1-CG2 4.25Å; L808-F1093 HydrophobicContact CD2-CB 4.4Å; L808-F1093 HydrophobicContact CD2-CD2 3.83Å
809	K	87.9	Confident	89.2	Confident	74 Å²	74	27.7 Å²	27.7	32%	0.322	15%	0.149	S	C	.	.	H	α-helix	trans	-60.8	-43.8	170.3	-77	178.5	171.3	-170.6	0	111.5	I805 K806 G812 I815 E834 H835	I805-K809 HydrophobicContact CG2-CD 4.32Å; I805-K809 WeakPolarHBondContact O-CB 3.48Å; I805-K809 WeakPolarHBondContact O-CG 3.38Å; I805-K809 PolarHBondContact O-N 2.82Å; K806-K809 PolarHBondContact O-N 2.84Å; K809-G812 WeakPolarHBondContact O-CA 3.41Å; K809-G812 PolarHBondContact O-N 3.43Å; K809-I815 HydrophobicContact CG-CD1 4.21Å; K809-E834 PolarHBondContact NZ-O 3.12Å; K809-H835 PolarHBondContact NZ-O 2.98Å
810	E	86.2	Confident	88.9	Confident	96 Å²	96	27.8 Å²	27.8	45%	0.449	16%	0.157	S	C	.	.	H	α-helix	trans	-66.5	-33.5	177.5	-74.5	176.2	-162.2	0	0	113.4	K806 A807 G812 P1173 Y1174	K806-E810 VanDerWaalsContact CE-OE1 3.22Å; K806-E810 WeakPolarHBondContact CE-OE1 3.47Å; K806-E810 WeakPolarHBondContact O-CG 3.39Å; K806-E810 PolarHBondContact O-N 3.42Å; A807-E810 PolarHBondContact O-N 2.86Å; E810-G812 PolarHBondContact O-N 3.2Å; E810-P1173 HydrophobicContact CB-CB 4.11Å; E810-P1173 HydrophobicContact CB-CG 4.49Å; E810-Y1174 WeakPolarHBondContact O-CA 3.35Å
811	A	86.8	Confident	88.5	Confident	2 Å²	2	28.4 Å²	28.4	2%	0.017	15%	0.154	C	C	.	.	H	α-helix	trans	-64.5	-17.1	169.9	0	0	0	0	0	113.2	A807 L808 I813 L1094 P1173 Y1176	A807-A811 WeakPolarHBondContact O-CB 3.38Å; A807-A811 PolarHBondContact O-N 3.16Å; L808-A811 WeakPolarHBondContact O-CB 3.3Å; L808-A811 PolarHBondContact O-N 3.44Å; A811-I813 HydrophobicContact CB-CD1 4.37Å; A811-I813 HydrophobicContact CB-CG1 4.46Å; A811-L1094 HydrophobicContact CB-CD2 3.58Å; A811-P1173 WeakPolarHBondContact CA-O 3.24Å; A811-P1173 HydrophobicContact CB-CB 4.25Å; A811-P1173 WeakPolarHBondContact CB-O 3.41Å; A811-Y1176 HydrophobicContact CB-CD1 4.18Å; A811-Y1176 HydrophobicContact CB-CG 4.28Å
812	G	81.9	Confident	87.8	Confident	38 Å²	38	33.3 Å²	33.3	39%	0.392	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.5	15.4	179.5	0	0	0	0	0	114.5	L808 K809 E810	L808-G812 PolarHBondContact O-N 2.98Å; K809-G812 WeakPolarHBondContact O-CA 3.41Å; K809-G812 PolarHBondContact O-N 3.43Å; E810-G812 PolarHBondContact O-N 3.2Å
813	I	87.9	Confident	87.3	Confident	6 Å²	6	30.4 Å²	30.4	3%	0.031	16%	0.163	C	C	.	.			trans	-79.2	129.1	175.2	-60.6	167.8	0	0	0	108.6	I453 L456 L808 A811 F1093 Y1176	I453-I813 HydrophobicContact CG2-CG2 4.31Å; L456-I813 HydrophobicContact CB-CG2 3.75Å; L808-I813 HydrophobicContact CD2-CD1 3.73Å; L808-I813 WeakPolarHBondContact O-CB 3.34Å; L808-I813 PolarHBondContact O-N 3.42Å; L808-I813 VanDerWaalsContact O-N 3.09Å; A811-I813 HydrophobicContact CB-CD1 4.37Å; A811-I813 HydrophobicContact CB-CG1 4.46Å; I813-F1093 HydrophobicContact CD1-CD2 4.28Å; I813-Y1176 HydrophobicContact CD1-CD1 4.35Å; I813-Y1176 HydrophobicContact CD1-CE1 3.94Å; I813-Y1176 HydrophobicContact CG1-CD1 4.44Å; I813-Y1176 HydrophobicContact CG1-CE1 4.09Å
814	Q	88.1	Confident	86.6	Confident	16 Å²	16	31.3 Å²	31.3	8%	0.075	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	112.6	175.9	-63.2	-170.3	-96.3	0	0	109.2	K454 F455 L456	K454-Q814 PolarHBondContact O-N 2.66Å; F455-Q814 WeakPolarHBondContact CA-O 3.49Å; F455-Q814 HydrophobicContact CD1-CB 3.8Å; F455-Q814 HydrophobicContact CE1-CB 3.87Å; F455-Q814 HydrophobicContact CE1-CG 4.39Å; L456-Q814 PolarHBondContact N-O 3.23Å
815	I	92.1	Very high	85.7	Confident	6 Å²	6	32.1 Å²	32.1	3%	0.031	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	129	-177.8	-51.7	172.8	0	0	0	108.8	L456 I805 L808 K809 H835	L456-I815 HydrophobicContact CB-CG1 4.35Å; L456-I815 HydrophobicContact CD2-CG1 4.31Å; L456-I815 CarbonylContact O-C 3.6Å; L456-I815 WeakPolarHBondContact O-CA 3.28Å; I805-I815 HydrophobicContact CB-CD1 4.43Å; I805-I815 HydrophobicContact CG1-CD1 4.4Å; I805-I815 HydrophobicContact CG2-CD1 4.03Å; L808-I815 HydrophobicContact CB-CD1 3.92Å; K809-I815 HydrophobicContact CG-CD1 4.21Å; I815-H835 PolarHBondContact O-CE1 3.31Å; I815-H835 VanDerWaalsContact O-CE1 3.27Å
816	W	94.4	Very high	85.4	Confident	4 Å²	4	32 Å²	32	2%	0.015	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.5	172.9	-66.9	21.3	0	0	0	108.1	F455 L456 F457 C458 L1003 C1006 V1012 I1025 V1029	F455-W816 HydrophobicContact CE1-CZ2 4.28Å; L456-W816 PolarHBondContact O-N 3.5Å; F457-W816 WeakPolarHBondContact CA-O 3.31Å; F457-W816 HydrophobicContact CD1-CB 3.81Å; F457-W816 HydrophobicContact CD1-CE3 4.45Å; F457-W816 HydrophobicContact CD1-CG 4.47Å; F457-W816 HydrophobicContact CE1-CB 3.92Å; F457-W816 AromaticContact CE1-CD2 3.86Å; F457-W816 HydrophobicContact CE1-CD2 3.86Å; F457-W816 AromaticContact CE1-CE3 3.52Å; F457-W816 HydrophobicContact CE1-CE3 3.52Å; F457-W816 HydrophobicContact CE1-CG 4.1Å; F457-W816 HydrophobicContact CE1-CZ3 4.2Å; F457-W816 HydrophobicContact CZ-CD2 4.48Å; F457-W816 HydrophobicContact CZ-CE3 4.25Å; C458-W816 PolarHBondContact N-O 3.18Å; W816-L1003 HydrophobicContact CH2-CD1 4.5Å; W816-C1006 HydrophobicContact CH2-CB 3.35Å; W816-C1006 HydrophobicContact CZ2-CB 3.72Å; W816-C1006 HydrophobicContact CZ3-CB 4.07Å; W816-V1012 CarbonylContact C-O 3.57Å; W816-V1012 VanDerWaalsContact CA-O 3.31Å; W816-V1012 WeakPolarHBondContact CA-O 3.42Å; W816-V1012 HydrophobicContact CB-CB 4.36Å; W816-V1012 HydrophobicContact CD2-CB 3.7Å; W816-V1012 HydrophobicContact CD2-CG1 4.22Å; W816-V1012 HydrophobicContact CD2-CG2 3.91Å; W816-V1012 HydrophobicContact CE3-CB 4.02Å; W816-V1012 HydrophobicContact CE3-CG1 4Å; W816-V1012 HydrophobicContact CE3-CG2 4.33Å; W816-V1012 HydrophobicContact CG-CB 3.81Å; W816-V1012 HydrophobicContact CG-CG2 4.3Å; W816-V1012 HydrophobicContact CZ2-CG2 4.15Å; W816-I1025 HydrophobicContact CE3-CG2 4.06Å; W816-I1025 HydrophobicContact CZ3-CG2 3.96Å; W816-V1029 HydrophobicContact CH2-CG2 3.52Å; W816-V1029 HydrophobicContact CZ2-CG2 4.34Å; W816-V1029 HydrophobicContact CZ3-CG2 3.69Å
817	I	94.1	Very high	85.1	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.01	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	122.6	-178.1	-64.3	170.7	0	0	0	108.6	C458 K460 L464 C830 I833 H835 V1012 L1013 C1014	C458-I817 WeakPolarHBondContact O-CA 3.43Å; K460-I817 HydrophobicContact CB-CG2 4.33Å; L464-I817 HydrophobicContact CD1-CD1 4.11Å; L464-I817 HydrophobicContact CD1-CG1 4.48Å; I817-C830 VanDerWaalsContact CD1-SG 3.56Å; I817-I833 HydrophobicContact CD1-CD1 3.81Å; I817-H835 HydrophobicContact CD1-CB 4.16Å; I817-V1012 PolarHBondContact N-O 3.08Å; I817-L1013 HydrophobicContact CB-CD1 3.81Å; I817-L1013 HydrophobicContact CG2-CD1 3.66Å; I817-L1013 WeakPolarHBondContact O-CA 3.45Å; I817-C1014 PolarHBondContact O-N 3.1Å
818	L	93.2	Very high	84.7	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	95.3	-173.4	-57.8	-167.4	0	0	0	110.2	F457 C458 C1014 M1017 K1022 I1025 M1057	F457-L818 HydrophobicContact CB-CD1 4.17Å; F457-L818 HydrophobicContact CB-CG 4.47Å; F457-L818 HydrophobicContact CD1-CD1 3.5Å; F457-L818 VanDerWaalsContact CD1-CD1 3.5Å; F457-L818 HydrophobicContact CD1-CD2 4.25Å; F457-L818 HydrophobicContact CD1-CG 3.84Å; F457-L818 HydrophobicContact CE1-CD1 4.22Å; F457-L818 HydrophobicContact CG-CD1 4.12Å; C458-L818 PolarHBondContact O-N 3.38Å; L818-C1014 HydrophobicContact CD2-CB 3.7Å; L818-M1017 HydrophobicContact CB-SD 3.8Å; L818-M1017 HydrophobicContact CD1-CE 4.49Å; L818-M1017 HydrophobicContact CD2-SD 3.9Å; L818-M1017 HydrophobicContact CG-SD 4.3Å; L818-K1022 HydrophobicContact CB-CD 4.42Å; L818-K1022 HydrophobicContact CB-CG 4.31Å; L818-K1022 HydrophobicContact CD1-CB 4.45Å; L818-K1022 VanDerWaalsContact O-CE 3.24Å; L818-K1022 WeakPolarHBondContact O-CE 3.43Å; L818-K1022 PolarHBondContact O-NZ 3.36Å; L818-I1025 HydrophobicContact CD1-CB 4.17Å; L818-I1025 HydrophobicContact CD1-CG2 4.09Å; L818-I1025 HydrophobicContact CD2-CD1 3.96Å; L818-I1025 HydrophobicContact CD2-CG2 4.24Å; L818-M1057 HydrophobicContact CB-SD 4.28Å; L818-M1057 HydrophobicContact CD1-SD 3.87Å
819	T	89.3	Confident	84.4	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	15%	0.154	C	C	.	.			trans	-118.7	146.8	-172.4	-170.8	0	0	0	0	114.1	D459 K460 D821 A826 L1013 C1014 C1015 R1016 M1017	D459-T819 WeakPolarHBondContact OD1-CA 3.15Å; K460-T819 HydrophobicContact CB-CG2 4.42Å; T819-D821 HydrophobicContact CG2-CB 4.21Å; T819-D821 WeakPolarHBondContact OG1-CB 3.33Å; T819-D821 PolarHBondContact OG1-N 2.71Å; T819-D821 VanDerWaalsContact OG1-N 3.12Å; T819-A826 HydrophobicContact CG2-CB 3.72Å; T819-L1013 HydrophobicContact CG2-CD1 4.46Å; T819-C1014 PolarHBondContact N-O 3.46Å; T819-C1015 CarbonylContact O-C 3.58Å; T819-C1015 WeakPolarHBondContact O-CA 3.49Å; T819-R1016 PolarHBondContact O-N 2.73Å; T819-M1017 PolarHBondContact O-N 3.17Å
820	G	78.8	Confident	84.4	Confident	34 Å²	34	24.7 Å²	24.7	35%	0.351	14%	0.139	S	C	.	.	S	Bend	trans	-73.2	-13.9	166.4	0	0	0	0	0	113.3	R1016 M1017	G820-R1016 WeakPolarHBondContact O-CA 3.43Å; G820-M1017 WeakPolarHBondContact CA-O 3.31Å
821	D	76.5	Confident	84.3	Confident	37 Å²	37	22.9 Å²	22.9	20%	0.198	13%	0.13	C	C	.	.	S	Bend	trans	-76.4	169.7	-171.7	-157.9	2.4	0	0	0	113.3	K460 T819 T825 R1016	K460-D821 WeakPolarHBondContact CE-OD2 3.28Å; K460-D821 IonicContact NZ-OD2 2.72Å; K460-D821 PolarHBondContact NZ-OD2 3.29Å; T819-D821 HydrophobicContact CG2-CB 4.21Å; T819-D821 WeakPolarHBondContact OG1-CB 3.33Å; T819-D821 PolarHBondContact OG1-N 2.71Å; T819-D821 VanDerWaalsContact OG1-N 3.12Å; D821-T825 PolarHBondContact OD1-OG1 3.35Å; D821-T825 PolarHBondContact OD2-OG1 3.2Å; D821-R1016 WeakPolarHBondContact O-CG 3.28Å; D821-R1016 PolarHBondContact O-N 3.32Å
822	K	74.4	Confident	84.1	Confident	106 Å²	106	23.8 Å²	23.8	46%	0.461	14%	0.136	S	C	.	.			trans	-61.8	151.7	178.7	-64.4	175.9	-174.1	166.2	0	111.2	E824 T825 A826	K822-E824 VanDerWaalsContact C-N 3.29Å; K822-E824 PolarHBondContact O-N 3.42Å; K822-T825 PolarHBondContact O-OG1 3.47Å; K822-T825 VanDerWaalsContact O-OG1 3.07Å; K822-A826 VanDerWaalsContact O-CB 3.24Å; K822-A826 WeakPolarHBondContact O-CB 3.4Å; K822-A826 PolarHBondContact O-N 3.41Å
823	A	78.2	Confident	84.3	Confident	4 Å²	4	22 Å²	22	3%	0.033	12%	0.118	C	C	.	.	H	α-helix	trans	-68.2	-32.8	-175.6	0	0	0	0	0	112.3	I827 M846 C1015	A823-I827 WeakPolarHBondContact O-CB 3.22Å; A823-I827 WeakPolarHBondContact O-CD1 3.49Å; A823-I827 WeakPolarHBondContact O-CG1 3.5Å; A823-I827 PolarHBondContact O-N 3.12Å; A823-M846 HydrophobicContact CB-CE 3.52Å; A823-M846 HydrophobicContact CB-SD 4.47Å; A823-C1015 HydrophobicContact CB-CB 4.01Å
824	E	75	Confident	84.1	Confident	107 Å²	107	25.9 Å²	25.9	50%	0.5	14%	0.136	S	C	.	.	H	α-helix	trans	-65.9	-51.9	179	-56.7	79.4	-176.4	0	0	110.9	K822 A826 I827 T828 R1016	K822-E824 VanDerWaalsContact C-N 3.29Å; K822-E824 PolarHBondContact O-N 3.42Å; E824-A826 VanDerWaalsContact C-N 3.32Å; E824-A826 PolarHBondContact O-N 3.03Å; E824-I827 PolarHBondContact O-N 3.18Å; E824-T828 PolarHBondContact O-N 3.18Å; E824-T828 VanDerWaalsContact O-N 3.13Å; E824-R1016 IonicContact OE2-NH2 3.15Å
825	T	74.7	Confident	83.9	Confident	18 Å²	18	25.1 Å²	25.1	11%	0.11	13%	0.132	C	C	.	.	H	α-helix	trans	-67.4	-31.1	178	54.5	0	0	0	0	112.7	D821 K822 T828 I829	D821-T825 PolarHBondContact OD1-OG1 3.35Å; D821-T825 PolarHBondContact OD2-OG1 3.2Å; K822-T825 PolarHBondContact O-OG1 3.47Å; K822-T825 VanDerWaalsContact O-OG1 3.07Å; T825-T828 PolarHBondContact O-OG1 3.21Å; T825-I829 WeakPolarHBondContact O-CG1 3.41Å; T825-I829 PolarHBondContact O-N 2.86Å
826	A	83.9	Confident	83.6	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-71.4	-38	175.1	0	0	0	0	0	112.4	T819 K822 E824 C830 L1013	T819-A826 HydrophobicContact CG2-CB 3.72Å; K822-A826 VanDerWaalsContact O-CB 3.24Å; K822-A826 WeakPolarHBondContact O-CB 3.4Å; K822-A826 PolarHBondContact O-N 3.41Å; E824-A826 VanDerWaalsContact C-N 3.32Å; E824-A826 PolarHBondContact O-N 3.03Å; A826-C830 WeakPolarHBondContact O-CB 3.33Å; A826-C830 PolarHBondContact O-N 2.87Å; A826-C830 PolarHBondContact O-SG 2.91Å; A826-L1013 HydrophobicContact CB-CD1 4.03Å; A826-L1013 HydrophobicContact CB-CD2 3.94Å; A826-L1013 HydrophobicContact CB-CG 4.46Å
827	I	84.4	Confident	82.9	Confident	21 Å²	21	27.8 Å²	27.8	11%	0.108	15%	0.149	C	C	.	.	H	α-helix	trans	-66	-44.1	175.5	-72.2	164.9	0	0	0	110.8	A823 E824 C830 Q831 F836 V984 L1013	A823-I827 WeakPolarHBondContact O-CB 3.22Å; A823-I827 WeakPolarHBondContact O-CD1 3.49Å; A823-I827 WeakPolarHBondContact O-CG1 3.5Å; A823-I827 PolarHBondContact O-N 3.12Å; E824-I827 PolarHBondContact O-N 3.18Å; I827-C830 WeakPolarHBondContact O-CB 3.49Å; I827-C830 PolarHBondContact O-N 3.11Å; I827-C830 VanDerWaalsContact O-N 3.14Å; I827-Q831 WeakPolarHBondContact O-CG 3.31Å; I827-Q831 PolarHBondContact O-N 2.73Å; I827-Q831 PolarHBondContact O-OE1 2.88Å; I827-F836 HydrophobicContact CG1-CE2 4.36Å; I827-V984 HydrophobicContact CD1-CG1 4.37Å; I827-V984 HydrophobicContact CD1-CG2 4.35Å; I827-V984 HydrophobicContact CG1-CG2 4.3Å; I827-L1013 HydrophobicContact CG1-CD2 3.91Å
828	T	80.3	Confident	81.8	Confident	19 Å²	19	33.3 Å²	33.3	12%	0.117	19%	0.188	C	C	.	.	H	α-helix	trans	-61.9	-46.3	179.7	56.3	0	0	0	0	111.8	G736 E824 T825 C830 Q831 S832	G736-T828 WeakPolarHBondContact O-CB 3.37Å; E824-T828 PolarHBondContact O-N 3.18Å; E824-T828 VanDerWaalsContact O-N 3.13Å; T825-T828 PolarHBondContact O-OG1 3.21Å; T828-C830 VanDerWaalsContact C-N 3.3Å; T828-C830 PolarHBondContact O-N 3.28Å; T828-Q831 WeakPolarHBondContact O-CB 3.39Å; T828-Q831 PolarHBondContact O-N 3.42Å; T828-S832 PolarHBondContact O-N 3.48Å; T828-S832 PolarHBondContact O-OG 3.21Å; T828-S832 VanDerWaalsContact O-OG 3.13Å
829	I	84.8	Confident	81	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-59.4	-40.5	173.5	-67.8	-59.8	0	0	0	111.7	K460 T465 D795 L797 T825 Q831 S832 I833	K460-I829 HydrophobicContact CD-CB 4.19Å; K460-I829 HydrophobicContact CD-CG1 3.96Å; K460-I829 HydrophobicContact CD-CG2 4.34Å; K460-I829 HydrophobicContact CG-CB 4.15Å; K460-I829 HydrophobicContact CG-CG1 4.31Å; K460-I829 HydrophobicContact CG-CG2 3.77Å; T465-I829 HydrophobicContact CG2-CD1 3.6Å; T465-I829 HydrophobicContact CG2-CG1 4.11Å; D795-I829 HydrophobicContact CB-CD1 3.95Å; L797-I829 HydrophobicContact CD2-CD1 4.1Å; L797-I829 HydrophobicContact CD2-CG2 4.2Å; T825-I829 WeakPolarHBondContact O-CG1 3.41Å; T825-I829 PolarHBondContact O-N 2.86Å; I829-Q831 PolarHBondContact O-N 3.38Å; I829-S832 PolarHBondContact O-N 3.12Å; I829-I833 HydrophobicContact CG2-CD1 4.35Å; I829-I833 HydrophobicContact CG2-CG2 4.49Å; I829-I833 VanDerWaalsContact O-CG1 3.3Å; I829-I833 WeakPolarHBondContact O-CG1 3.48Å; I829-I833 PolarHBondContact O-N 2.87Å; I829-I833 VanDerWaalsContact O-N 3.1Å
830	C	87.3	Confident	80.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.4	-29	175.7	-71.2	0	0	0	0	113.4	I817 A826 I827 T828 H835 F836	I817-C830 VanDerWaalsContact CD1-SG 3.56Å; A826-C830 WeakPolarHBondContact O-CB 3.33Å; A826-C830 PolarHBondContact O-N 2.87Å; A826-C830 PolarHBondContact O-SG 2.91Å; I827-C830 WeakPolarHBondContact O-CB 3.49Å; I827-C830 PolarHBondContact O-N 3.11Å; I827-C830 VanDerWaalsContact O-N 3.14Å; T828-C830 VanDerWaalsContact C-N 3.3Å; T828-C830 PolarHBondContact O-N 3.28Å; C830-H835 HydrophobicContact CB-CB 4.14Å; C830-H835 WeakPolarHBondContact O-CA 3.36Å; C830-H835 WeakPolarHBondContact O-CB 3.35Å; C830-H835 PolarHBondContact O-N 2.95Å; C830-F836 HydrophobicContact CB-CD2 3.34Å; C830-F836 HydrophobicContact CB-CE2 3.62Å; C830-F836 HydrophobicContact CB-CG 3.95Å; C830-F836 HydrophobicContact CB-CZ 4.42Å; C830-F836 PolarHBondContact O-N 2.95Å
831	Q	84.1	Confident	80.5	Confident	57 Å²	57	41.5 Å²	41.5	27%	0.266	23%	0.226	S	C	.	.	H	α-helix	trans	-75.9	-46.6	172.9	-68.8	167.2	-58.4	0	0	110.7	I827 T828 I829 I833 E834 F836	I827-Q831 WeakPolarHBondContact O-CG 3.31Å; I827-Q831 PolarHBondContact O-N 2.73Å; I827-Q831 PolarHBondContact O-OE1 2.88Å; T828-Q831 WeakPolarHBondContact O-CB 3.39Å; T828-Q831 PolarHBondContact O-N 3.42Å; I829-Q831 PolarHBondContact O-N 3.38Å; Q831-I833 VanDerWaalsContact C-N 3.29Å; Q831-I833 PolarHBondContact O-N 2.96Å; Q831-E834 PolarHBondContact O-N 3.31Å; Q831-F836 HydrophobicContact CG-CB 4.39Å
832	S	82.6	Confident	80.9	Confident	21 Å²	21	42.1 Å²	42.1	15%	0.147	23%	0.229	C	C	.	.	H	α-helix	trans	-56.8	-37.9	179.4	-56.5	0	0	0	0	113.7	T828 I829 E834	T828-S832 PolarHBondContact O-N 3.48Å; T828-S832 PolarHBondContact O-OG 3.21Å; T828-S832 VanDerWaalsContact O-OG 3.13Å; I829-S832 PolarHBondContact O-N 3.12Å; S832-E834 VanDerWaalsContact C-N 3.34Å
833	I	86.5	Confident	81.5	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	4.5	178.3	71.5	-162.9	0	0	0	114.1	L464 L797 V801 I805 I817 I829 Q831 H835	L464-I833 HydrophobicContact CD1-CD1 3.97Å; L797-I833 HydrophobicContact CD1-CG2 3.62Å; L797-I833 HydrophobicContact CD2-CG2 3.51Å; L797-I833 HydrophobicContact CG-CG2 4.21Å; V801-I833 HydrophobicContact CG1-CB 4.38Å; V801-I833 HydrophobicContact CG1-CG2 3.77Å; I805-I833 HydrophobicContact CD1-CB 4.04Å; I805-I833 HydrophobicContact CD1-CD1 3.72Å; I805-I833 HydrophobicContact CD1-CG1 4Å; I817-I833 HydrophobicContact CD1-CD1 3.81Å; I829-I833 HydrophobicContact CG2-CD1 4.35Å; I829-I833 HydrophobicContact CG2-CG2 4.49Å; I829-I833 VanDerWaalsContact O-CG1 3.3Å; I829-I833 WeakPolarHBondContact O-CG1 3.48Å; I829-I833 PolarHBondContact O-N 2.87Å; I829-I833 VanDerWaalsContact O-N 3.1Å; Q831-I833 VanDerWaalsContact C-N 3.29Å; Q831-I833 PolarHBondContact O-N 2.96Å; I833-H835 HydrophobicContact CD1-CB 3.74Å; I833-H835 HydrophobicContact CG1-CB 3.56Å; I833-H835 PolarHBondContact O-N 3.45Å
834	E	82.7	Confident	82	Confident	88 Å²	88	43.3 Å²	43.3	41%	0.411	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	31.9	-170.2	-65.9	175.3	-177.6	0	0	113.3	K802 K809 Q831 S832	K802-E834 WeakPolarHBondContact CE-OE1 3.29Å; K802-E834 VanDerWaalsContact CE-OE2 3.3Å; K802-E834 WeakPolarHBondContact CE-OE2 3.35Å; K802-E834 VanDerWaalsContact NZ-CD 3.28Å; K802-E834 IonicContact NZ-OE1 3.76Å; K802-E834 PolarHBondContact NZ-OE1 3.08Å; K802-E834 IonicContact NZ-OE2 3.52Å; K809-E834 PolarHBondContact NZ-O 3.12Å; Q831-E834 PolarHBondContact O-N 3.31Å; S832-E834 VanDerWaalsContact C-N 3.34Å
835	H	85.2	Confident	82.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-69	-48	168.3	-172.4	81.4	0	0	0	109.9	K809 I815 I817 C830 I833 T1011	K809-H835 PolarHBondContact NZ-O 2.98Å; I815-H835 PolarHBondContact O-CE1 3.31Å; I815-H835 VanDerWaalsContact O-CE1 3.27Å; I817-H835 HydrophobicContact CD1-CB 4.16Å; C830-H835 HydrophobicContact CB-CB 4.14Å; C830-H835 WeakPolarHBondContact O-CA 3.36Å; C830-H835 WeakPolarHBondContact O-CB 3.35Å; C830-H835 PolarHBondContact O-N 2.95Å; I833-H835 HydrophobicContact CD1-CB 3.74Å; I833-H835 HydrophobicContact CG1-CB 3.56Å; I833-H835 PolarHBondContact O-N 3.45Å; H835-T1011 VanDerWaalsContact NE2-CB 3.33Å; H835-T1011 WeakPolarHBondContact NE2-CB 3.41Å
836	F	85.2	Confident	83.1	Confident	5 Å²	5	39.6 Å²	39.6	2%	0.022	22%	0.216	C	C	.	.	S	Bend	trans	-97.1	124.2	162.3	-60.4	-35.1	0	0	0	109.8	I827 C830 Q831 M840 L842 V984 T1011 L1013	I827-F836 HydrophobicContact CG1-CE2 4.36Å; C830-F836 HydrophobicContact CB-CD2 3.34Å; C830-F836 HydrophobicContact CB-CE2 3.62Å; C830-F836 HydrophobicContact CB-CG 3.95Å; C830-F836 HydrophobicContact CB-CZ 4.42Å; C830-F836 PolarHBondContact O-N 2.95Å; Q831-F836 HydrophobicContact CG-CB 4.39Å; F836-M840 HydrophobicContact CB-SD 4.1Å; F836-M840 HydrophobicContact CD1-CE 4.1Å; F836-M840 HydrophobicContact CD1-SD 3.75Å; F836-M840 HydrophobicContact CG-SD 4.37Å; F836-L842 HydrophobicContact CD1-CD2 3.79Å; F836-L842 HydrophobicContact CD2-CD1 4.33Å; F836-L842 HydrophobicContact CD2-CD2 3.99Å; F836-L842 HydrophobicContact CE1-CD2 3.87Å; F836-L842 HydrophobicContact CE2-CD2 4.07Å; F836-L842 HydrophobicContact CG-CD2 3.86Å; F836-L842 HydrophobicContact CZ-CD2 4Å; F836-V984 HydrophobicContact CE2-CG2 4.19Å; F836-V984 HydrophobicContact CZ-CG2 4.01Å; F836-T1011 WeakPolarHBondContact CD1-OG1 3.48Å; F836-T1011 VanDerWaalsContact CE1-OG1 3.3Å; F836-T1011 WeakPolarHBondContact CE1-OG1 3.02Å; F836-L1013 HydrophobicContact CE2-CB 4.28Å; F836-L1013 HydrophobicContact CE2-CD2 3.79Å; F836-L1013 HydrophobicContact CZ-CB 3.66Å; F836-L1013 HydrophobicContact CZ-CD2 4.05Å
837	T	79.3	Confident	83	Confident	61 Å²	61	44.3 Å²	44.3	37%	0.374	24%	0.241	S	C	.	.			trans	-82.4	151.7	172.4	52.3	0	0	0	0	110.3	N839 M840 S980	T837-N839 PolarHBondContact O-N 2.89Å; T837-N839 VanDerWaalsContact O-N 3.12Å; T837-M840 WeakPolarHBondContact O-CB 3.38Å; T837-M840 PolarHBondContact O-N 3.03Å; T837-S980 PolarHBondContact OG1-OG 3.17Å; T837-S980 VanDerWaalsContact OG1-OG 3.06Å
838	S	71.7	Confident	82.9	Confident	118 Å²	118	43.5 Å²	43.5	83%	0.825	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-36.7	175.7	48.4	0	0	0	0	113.9	M840	S838-M840 PolarHBondContact O-N 3.01Å
839	N	75.2	Confident	83.1	Confident	147 Å²	147	49.2 Å²	49.2	79%	0.786	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	8.6	-179.8	-59.9	-1.4	0	0	0	114.1	T837	T837-N839 PolarHBondContact O-N 2.89Å; T837-N839 VanDerWaalsContact O-N 3.12Å
840	M	77.1	Confident	83.3	Confident	22 Å²	22	52.2 Å²	52.2	11%	0.108	29%	0.285	C	S	.	.			trans	-88.5	132.6	-172.5	-166.5	154.9	-168.1	0	0	112.3	F836 T837 S838 L842 S980 I981 T1010 T1011	F836-M840 HydrophobicContact CB-SD 4.1Å; F836-M840 HydrophobicContact CD1-CE 4.1Å; F836-M840 HydrophobicContact CD1-SD 3.75Å; F836-M840 HydrophobicContact CG-SD 4.37Å; T837-M840 WeakPolarHBondContact O-CB 3.38Å; T837-M840 PolarHBondContact O-N 3.03Å; S838-M840 PolarHBondContact O-N 3.01Å; M840-L842 HydrophobicContact CG-CD2 4.29Å; M840-S980 WeakPolarHBondContact CA-O 3.21Å; M840-S980 WeakPolarHBondContact CG-O 3.26Å; M840-I981 VanDerWaalsContact CE-O 3.24Å; M840-I981 WeakPolarHBondContact CE-O 3.38Å; M840-T1010 WeakPolarHBondContact CE-OG1 3.45Å; M840-T1011 HydrophobicContact CE-CG2 4.25Å; M840-T1011 WeakPolarHBondContact CE-OG1 3.48Å
841	S	81.7	Confident	83.3	Confident	37 Å²	37	54.8 Å²	54.8	26%	0.259	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	133	169.4	58.2	0	0	0	0	110.4	S980 I981 G982	S841-S980 PolarHBondContact N-O 2.72Å; S841-S980 PolarHBondContact OG-O 3.05Å; S841-I981 CarbonylContact O-C 3.55Å; S841-I981 WeakPolarHBondContact O-CA 3.17Å; S841-G982 PolarHBondContact O-N 2.93Å
842	L	84.4	Confident	83.5	Confident	51 Å²	51	58.7 Å²	58.7	27%	0.267	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	112.1	-177.9	-63.7	-179.9	0	0	0	111.4	F836 M840	F836-L842 HydrophobicContact CD1-CD2 3.79Å; F836-L842 HydrophobicContact CD2-CD1 4.33Å; F836-L842 HydrophobicContact CD2-CD2 3.99Å; F836-L842 HydrophobicContact CE1-CD2 3.87Å; F836-L842 HydrophobicContact CE2-CD2 4.07Å; F836-L842 HydrophobicContact CG-CD2 3.86Å; F836-L842 HydrophobicContact CZ-CD2 4Å; M840-L842 HydrophobicContact CG-CD2 4.29Å
843	I	87.4	Confident	83.8	Confident	16 Å²	16	59.5 Å²	59.5	8%	0.082	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	120.9	170.7	-58.6	174.9	0	0	0	108	I845 Q861 L865 I981 G982 L983 V984 V1009	I843-I845 HydrophobicContact CG2-CG1 4.41Å; I843-Q861 HydrophobicContact CG2-CG 3.86Å; I843-L865 HydrophobicContact CD1-CD1 4.21Å; I843-I981 HydrophobicContact CD1-CG2 3.75Å; I843-I981 HydrophobicContact CG1-CG2 4.06Å; I843-G982 PolarHBondContact N-O 3.02Å; I843-L983 HydrophobicContact CB-CD1 4.11Å; I843-L983 HydrophobicContact CG2-CD1 3.83Å; I843-V984 PolarHBondContact O-N 3.22Å; I843-V1009 HydrophobicContact CD1-CG2 4.27Å
844	K	88.5	Confident	83.9	Confident	119 Å²	119	59.4 Å²	59.4	52%	0.517	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	108.7	-178.3	-64.8	-177.6	-179.9	178.6	0	111.6	M846 V984	K844-M846 HydrophobicContact CB-CG 4.42Å; K844-M846 HydrophobicContact CB-SD 4.31Å; K844-M846 HydrophobicContact CD-SD 4.39Å; K844-V984 WeakPolarHBondContact CA-O 3.2Å; K844-V984 HydrophobicContact CG-CB 4.31Å
845	I	88.6	Confident	84.2	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	87.3	173	-56	-177	0	0	0	108.2	I843 K857 I858 L983 V984 I985 D986 L1005	I843-I845 HydrophobicContact CG2-CG1 4.41Å; I845-K857 HydrophobicContact CG2-CD 4.39Å; I845-I858 HydrophobicContact CD1-CG1 4.1Å; I845-L983 HydrophobicContact CD1-CD1 4Å; I845-L983 HydrophobicContact CG1-CD1 4.14Å; I845-V984 PolarHBondContact N-O 3.34Å; I845-I985 HydrophobicContact CB-CB 4.47Å; I845-I985 HydrophobicContact CB-CD1 4.47Å; I845-I985 HydrophobicContact CB-CG1 4.21Å; I845-I985 HydrophobicContact CG2-CD1 4.28Å; I845-I985 HydrophobicContact CG2-CG1 4.29Å; I845-I985 WeakPolarHBondContact O-CA 3.23Å; I845-D986 PolarHBondContact O-N 3.01Å; I845-L1005 HydrophobicContact CD1-CD2 3.79Å
846	M	84.5	Confident	84.4	Confident	45 Å²	45	63.3 Å²	63.3	22%	0.222	34%	0.337	C	S	.	.			trans	-122.7	154	-175.3	-60.8	177.6	68.6	0	0	112.2	A823 K844 C848 K857	A823-M846 HydrophobicContact CB-CE 3.52Å; A823-M846 HydrophobicContact CB-SD 4.47Å; K844-M846 HydrophobicContact CB-CG 4.42Å; K844-M846 HydrophobicContact CB-SD 4.31Å; K844-M846 HydrophobicContact CD-SD 4.39Å; M846-C848 VanDerWaalsContact C-N 3.28Å; M846-C848 PolarHBondContact O-N 3.39Å; M846-K857 PolarHBondContact O-NZ 3.19Å
847	N	81.1	Confident	84.5	Confident	99 Å²	99	66.2 Å²	66.2	53%	0.529	35%	0.349	S	S	.	.			trans	51.1	36.8	172.3	-64.4	-41.6	0	0	0	115	L849 D986 S989	N847-L849 PolarHBondContact O-N 3.23Å; N847-D986 PolarHBondContact N-OD1 2.87Å; N847-D986 PolarHBondContact N-OD2 3.44Å; N847-S989 PolarHBondContact N-OG 3.17Å
848	C	83.5	Confident	84.9	Confident	4 Å²	4	63.3 Å²	63.3	3%	0.027	33%	0.332	C	S	.	.			trans	-76	122.7	174.3	-52.4	0	0	0	0	109.9	M846 T854 K857 S989	M846-C848 VanDerWaalsContact C-N 3.28Å; M846-C848 PolarHBondContact O-N 3.39Å; C848-T854 WeakPolarHBondContact CB-OG1 3.35Å; C848-K857 PolarHBondContact SG-NZ 3.21Å; C848-S989 WeakPolarHBondContact CB-OG 3.38Å; C848-S989 PolarHBondContact N-OG 2.96Å; C848-S989 PolarHBondContact SG-OG 3.46Å
849	L	83.6	Confident	85.8	Confident	138 Å²	138	61.6 Å²	61.6	72%	0.723	31%	0.308	S	S	*	.			trans	-91.1	-23.9	-175.2	-64.2	176	0	0	0	113.4	N847 Y992	N847-L849 PolarHBondContact O-N 3.23Å; L849-Y992 WeakPolarHBondContact O-CE2 3.29Å; L849-Y992 VanDerWaalsContact O-CZ 3.3Å; L849-Y992 PolarHBondContact O-OH 2.91Å
850	T	88.5	Confident	86.4	Confident	66 Å²	66	57.9 Å²	57.9	41%	0.405	29%	0.286	S	S	.	.	S	Bend	trans	-132.2	154.6	-175.6	66.4	0	0	0	0	112.1	Q852 S853 T854	T850-Q852 VanDerWaalsContact C-N 3.3Å; T850-Q852 PolarHBondContact O-N 2.7Å; T850-S853 PolarHBondContact N-OG 2.87Å; T850-S853 PolarHBondContact O-N 3.49Å; T850-S853 VanDerWaalsContact O-N 3.12Å; T850-S853 PolarHBondContact O-OG 3.02Å; T850-S853 WeakPolarHBondContact OG1-CB 3.32Å; T850-S853 PolarHBondContact OG1-N 2.72Å; T850-S853 PolarHBondContact OG1-OG 3.36Å; T850-T854 PolarHBondContact O-N 3.41Å; T850-T854 PolarHBondContact O-OG1 3.14Å
851	L	88	Confident	86.8	Confident	53 Å²	53	58.7 Å²	58.7	28%	0.277	29%	0.289	S	S	.	.	H	α-helix	trans	-59.9	-37.7	178.3	-175.8	141.4	0	0	0	112.5	T854 A855 Y992 H995 L998	L851-T854 PolarHBondContact O-N 3.22Å; L851-A855 WeakPolarHBondContact O-CB 3.35Å; L851-A855 PolarHBondContact O-N 3.07Å; L851-Y992 HydrophobicContact CB-CD1 4.08Å; L851-H995 HydrophobicContact CD1-CB 3.77Å; L851-L998 HydrophobicContact CD1-CD1 4.46Å; L851-L998 HydrophobicContact CD2-CD1 4.23Å; L851-L998 HydrophobicContact CG-CD1 3.94Å
852	Q	88.6	Confident	86.8	Confident	139 Å²	139	57.3 Å²	57.3	65%	0.65	28%	0.279	S	S	*	.	H	α-helix	trans	-64.3	-40.7	175.2	-61.2	87.8	-17.8	0	0	112	T850 T854 A855 Y856	T850-Q852 VanDerWaalsContact C-N 3.3Å; T850-Q852 PolarHBondContact O-N 2.7Å; Q852-T854 VanDerWaalsContact C-N 3.34Å; Q852-T854 PolarHBondContact O-N 2.77Å; Q852-A855 PolarHBondContact O-N 2.84Å; Q852-Y856 WeakPolarHBondContact O-CB 3.44Å; Q852-Y856 PolarHBondContact O-N 3.17Å
853	S	88.6	Confident	86.8	Confident	38 Å²	38	59.1 Å²	59.1	27%	0.266	29%	0.289	S	S	.	.	H	α-helix	trans	-64.5	-38.7	179.1	71	0	0	0	0	112.3	T850 K857	T850-S853 PolarHBondContact N-OG 2.87Å; T850-S853 PolarHBondContact O-N 3.49Å; T850-S853 VanDerWaalsContact O-N 3.12Å; T850-S853 PolarHBondContact O-OG 3.02Å; T850-S853 WeakPolarHBondContact OG1-CB 3.32Å; T850-S853 PolarHBondContact OG1-N 2.72Å; T850-S853 PolarHBondContact OG1-OG 3.36Å; S853-K857 PolarHBondContact O-N 3.21Å
854	T	87.8	Confident	86.4	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-68.7	-42.5	174	-49	0	0	0	0	111.3	C848 T850 L851 Q852 K857 I858 A993	C848-T854 WeakPolarHBondContact CB-OG1 3.35Å; T850-T854 PolarHBondContact O-N 3.41Å; T850-T854 PolarHBondContact O-OG1 3.14Å; L851-T854 PolarHBondContact O-N 3.22Å; Q852-T854 VanDerWaalsContact C-N 3.34Å; Q852-T854 PolarHBondContact O-N 2.77Å; T854-K857 PolarHBondContact O-N 3.32Å; T854-I858 HydrophobicContact CG2-CD1 3.93Å; T854-I858 WeakPolarHBondContact O-CG1 3.42Å; T854-I858 PolarHBondContact O-N 3.16Å; T854-A993 HydrophobicContact CG2-CB 4.07Å
855	A	89.3	Confident	85.7	Confident	14 Å²	14	55.2 Å²	55.2	12%	0.116	28%	0.276	C	S	.	.	H	α-helix	trans	-59.6	-50	177.5	0	0	0	0	0	112.1	L851 Q852 K857 I858 Y859 L998	L851-A855 WeakPolarHBondContact O-CB 3.35Å; L851-A855 PolarHBondContact O-N 3.07Å; Q852-A855 PolarHBondContact O-N 2.84Å; A855-K857 PolarHBondContact O-N 2.98Å; A855-I858 PolarHBondContact O-N 2.85Å; A855-Y859 HydrophobicContact CB-CD2 4.4Å; A855-Y859 HydrophobicContact CB-CE2 4.25Å; A855-Y859 WeakPolarHBondContact O-CD2 3.43Å; A855-Y859 PolarHBondContact O-N 2.73Å; A855-L998 HydrophobicContact CB-CD1 3.97Å; A855-L998 HydrophobicContact CB-CD2 3.66Å; A855-L998 HydrophobicContact CB-CG 4.45Å
856	Y	89	Confident	85	Confident	155 Å²	155	58.9 Å²	58.9	61%	0.608	29%	0.293	S	S	*	.	H	α-helix	trans	-55.5	-51.1	179.2	178.3	-86.8	0	0	0	111.2	Q852 I858 Y859 E860	Q852-Y856 WeakPolarHBondContact O-CB 3.44Å; Q852-Y856 PolarHBondContact O-N 3.17Å; Y856-I858 VanDerWaalsContact C-N 3.34Å; Y856-I858 PolarHBondContact O-N 2.79Å; Y856-Y859 PolarHBondContact O-N 3.15Å; Y856-E860 HydrophobicContact CE1-CB 4.37Å; Y856-E860 VanDerWaalsContact O-CB 3.29Å; Y856-E860 WeakPolarHBondContact O-CB 3.25Å; Y856-E860 PolarHBondContact O-N 3.41Å
857	K	88.4	Confident	84.5	Confident	66 Å²	66	62.9 Å²	62.9	29%	0.287	31%	0.314	S	S	.	.	H	α-helix	trans	-60.3	-40.2	177.8	-70.7	-179.2	-174.2	174.9	0	112.5	I845 M846 C848 S853 T854 A855 Q861	I845-K857 HydrophobicContact CG2-CD 4.39Å; M846-K857 PolarHBondContact O-NZ 3.19Å; C848-K857 PolarHBondContact SG-NZ 3.21Å; S853-K857 PolarHBondContact O-N 3.21Å; T854-K857 PolarHBondContact O-N 3.32Å; A855-K857 PolarHBondContact O-N 2.98Å; K857-Q861 WeakPolarHBondContact O-CG 3.25Å; K857-Q861 PolarHBondContact O-N 3.24Å
858	I	87.9	Confident	83.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.7	-45.2	178.6	-70.7	168.5	0	0	0	110.8	I845 T854 A855 Y856 L862 A993 F1002 L1005	I845-I858 HydrophobicContact CD1-CG1 4.1Å; T854-I858 HydrophobicContact CG2-CD1 3.93Å; T854-I858 WeakPolarHBondContact O-CG1 3.42Å; T854-I858 PolarHBondContact O-N 3.16Å; A855-I858 PolarHBondContact O-N 2.85Å; Y856-I858 VanDerWaalsContact C-N 3.34Å; Y856-I858 PolarHBondContact O-N 2.79Å; I858-L862 HydrophobicContact CG2-CD1 3.98Å; I858-L862 WeakPolarHBondContact O-CB 3.42Å; I858-L862 WeakPolarHBondContact O-CG 3.45Å; I858-L862 PolarHBondContact O-N 3.23Å; I858-A993 HydrophobicContact CD1-CB 3.99Å; I858-F1002 HydrophobicContact CD1-CB 4.18Å; I858-F1002 HydrophobicContact CD1-CD2 4.16Å; I858-L1005 HydrophobicContact CG1-CD2 4.34Å; I858-L1005 HydrophobicContact CG2-CD2 4.39Å
859	Y	89.4	Confident	83.1	Confident	82 Å²	82	61.9 Å²	61.9	32%	0.322	30%	0.304	S	S	.	.	H	α-helix	trans	-69	-43.9	180	-68.5	-54.1	0	0	0	112.5	A855 Y856 Q861 L862 D863 L998 S1001	A855-Y859 HydrophobicContact CB-CD2 4.4Å; A855-Y859 HydrophobicContact CB-CE2 4.25Å; A855-Y859 WeakPolarHBondContact O-CD2 3.43Å; A855-Y859 PolarHBondContact O-N 2.73Å; Y856-Y859 PolarHBondContact O-N 3.15Å; Y859-Q861 VanDerWaalsContact C-N 3.3Å; Y859-Q861 PolarHBondContact O-N 2.93Å; Y859-L862 HydrophobicContact CD1-CD1 4.31Å; Y859-L862 PolarHBondContact O-N 3.04Å; Y859-L862 VanDerWaalsContact O-N 3.14Å; Y859-D863 WeakPolarHBondContact O-CB 3.47Å; Y859-D863 PolarHBondContact O-N 3.18Å; Y859-L998 HydrophobicContact CE2-CD2 4.08Å; Y859-S1001 WeakPolarHBondContact CE1-OG 3.31Å; Y859-S1001 PolarHBondContact OH-OG 3.15Å
860	E	88.4	Confident	82.4	Confident	69 Å²	69	59.3 Å²	59.3	32%	0.322	29%	0.291	S	S	.	.	H	α-helix	trans	-53.9	-44.2	174.4	178.3	-177	-141.3	0	0	112.3	Y856 T864	Y856-E860 HydrophobicContact CE1-CB 4.37Å; Y856-E860 VanDerWaalsContact O-CB 3.29Å; Y856-E860 WeakPolarHBondContact O-CB 3.25Å; Y856-E860 PolarHBondContact O-N 3.41Å; E860-T864 WeakPolarHBondContact O-CB 3.46Å; E860-T864 PolarHBondContact O-N 3.07Å; E860-T864 PolarHBondContact O-OG1 2.84Å
861	Q	85.6	Confident	81.3	Confident	39 Å²	39	60.4 Å²	60.4	18%	0.182	29%	0.288	C	S	.	.	H	α-helix	trans	-73.2	-36.4	178.8	-63.1	-58.7	-52.5	0	0	112.4	I843 K857 Y859 L865 L1005	I843-Q861 HydrophobicContact CG2-CG 3.86Å; K857-Q861 WeakPolarHBondContact O-CG 3.25Å; K857-Q861 PolarHBondContact O-N 3.24Å; Y859-Q861 VanDerWaalsContact C-N 3.3Å; Y859-Q861 PolarHBondContact O-N 2.93Å; Q861-L865 WeakPolarHBondContact O-CB 3.29Å; Q861-L865 WeakPolarHBondContact O-CD1 3.44Å; Q861-L865 WeakPolarHBondContact O-CG 3.49Å; Q861-L865 PolarHBondContact O-N 3.47Å; Q861-L1005 HydrophobicContact CB-CD1 3.94Å; Q861-L1005 HydrophobicContact CB-CD2 4.49Å
862	L	82.8	Confident	80	Confident	9 Å²	9	59.7 Å²	59.7	5%	0.047	28%	0.284	C	S	.	.	H	α-helix	trans	-62.5	-47.6	173.2	-78.7	171.4	0	0	0	111.8	I858 Y859 L865 Q866 E1004 L1005	I858-L862 HydrophobicContact CG2-CD1 3.98Å; I858-L862 WeakPolarHBondContact O-CB 3.42Å; I858-L862 WeakPolarHBondContact O-CG 3.45Å; I858-L862 PolarHBondContact O-N 3.23Å; Y859-L862 HydrophobicContact CD1-CD1 4.31Å; Y859-L862 PolarHBondContact O-N 3.04Å; Y859-L862 VanDerWaalsContact O-N 3.14Å; L862-L865 PolarHBondContact O-N 3.13Å; L862-Q866 WeakPolarHBondContact O-CG 3.43Å; L862-Q866 PolarHBondContact O-N 3.42Å; L862-E1004 HydrophobicContact CD2-CB 4.28Å; L862-E1004 HydrophobicContact CD2-CG 3.93Å; L862-L1005 HydrophobicContact CD2-CB 3.94Å; L862-L1005 HydrophobicContact CD2-CD1 4.25Å; L862-L1005 HydrophobicContact CG-CB 4.21Å; L862-L1005 HydrophobicContact CG-CD1 4.35Å
863	D	83	Confident	78.7	Confident	89 Å²	89	59.4 Å²	59.4	48%	0.476	28%	0.28	S	S	.	.	H	α-helix	trans	-63.8	-42.6	179.1	-68	-15.9	0	0	0	110.6	Y859 L865 Q866 L867	Y859-D863 WeakPolarHBondContact O-CB 3.47Å; Y859-D863 PolarHBondContact O-N 3.18Å; D863-L865 VanDerWaalsContact C-N 3.34Å; D863-L865 PolarHBondContact O-N 3.44Å; D863-Q866 PolarHBondContact O-N 2.87Å; D863-L867 WeakPolarHBondContact O-CB 3.16Å; D863-L867 WeakPolarHBondContact O-CG 3.24Å; D863-L867 PolarHBondContact O-N 3.47Å
864	T	78.5	Confident	77.3	Confident	46 Å²	46	63.7 Å²	63.7	28%	0.282	30%	0.296	S	S	.	.	H	α-helix	trans	-57.6	-44.7	173.6	-59.2	0	0	0	0	111.9	E860 Y868	E860-T864 WeakPolarHBondContact O-CB 3.46Å; E860-T864 PolarHBondContact O-N 3.07Å; E860-T864 PolarHBondContact O-OG1 2.84Å; T864-Y868 WeakPolarHBondContact O-CB 3.37Å; T864-Y868 PolarHBondContact O-N 3.45Å
865	L	74	Confident	75.5	Confident	7 Å²	7	70.3 Å²	70.3	4%	0.037	33%	0.325	C	S	.	.	H	α-helix	trans	-72.8	-26.4	179	-69.5	169.1	0	0	0	113.2	I843 Q861 L862 D863 K869 I976 I981 L1005 S1008 V1009	I843-L865 HydrophobicContact CD1-CD1 4.21Å; Q861-L865 WeakPolarHBondContact O-CB 3.29Å; Q861-L865 WeakPolarHBondContact O-CD1 3.44Å; Q861-L865 WeakPolarHBondContact O-CG 3.49Å; Q861-L865 PolarHBondContact O-N 3.47Å; L862-L865 PolarHBondContact O-N 3.13Å; D863-L865 VanDerWaalsContact C-N 3.34Å; D863-L865 PolarHBondContact O-N 3.44Å; L865-K869 WeakPolarHBondContact O-CB 3.21Å; L865-K869 PolarHBondContact O-N 3.47Å; L865-I976 HydrophobicContact CB-CD1 4.42Å; L865-I976 HydrophobicContact CD2-CD1 4.17Å; L865-I976 VanDerWaalsContact O-CD1 3.29Å; L865-I976 WeakPolarHBondContact O-CD1 3.26Å; L865-I981 HydrophobicContact CD2-CD1 3.65Å; L865-L1005 HydrophobicContact CD1-CD1 3.75Å; L865-S1008 WeakPolarHBondContact CD1-OG 3.43Å; L865-V1009 HydrophobicContact CD1-CG2 4.35Å
866	Q	73.7	Confident	73.8	Confident	79 Å²	79	75.7 Å²	75.7	37%	0.369	35%	0.352	S	S	.	.	H	α-helix	trans	-71.6	-51.2	171.3	-73.1	-178.9	28	0	0	111	L862 D863 Y868 K869 D870	L862-Q866 WeakPolarHBondContact O-CG 3.43Å; L862-Q866 PolarHBondContact O-N 3.42Å; D863-Q866 PolarHBondContact O-N 2.87Å; Q866-Y868 VanDerWaalsContact C-N 3.29Å; Q866-Y868 PolarHBondContact O-N 3.13Å; Q866-K869 WeakPolarHBondContact O-CB 3.45Å; Q866-K869 PolarHBondContact O-N 3.34Å; Q866-D870 PolarHBondContact O-N 2.99Å
867	L	75.2	Confident	71.9	Confident	129 Å²	129	74.3 Å²	74.3	68%	0.675	36%	0.355	S	S	*	.	H	α-helix	trans	-54	-46	175	-71	170	0	0	0	111.6	D863 K869 D870 Y871	D863-L867 WeakPolarHBondContact O-CB 3.16Å; D863-L867 WeakPolarHBondContact O-CG 3.24Å; D863-L867 PolarHBondContact O-N 3.47Å; L867-K869 VanDerWaalsContact C-N 3.3Å; L867-K869 PolarHBondContact O-N 3.02Å; L867-D870 PolarHBondContact O-N 3.36Å; L867-Y871 PolarHBondContact O-N 3.41Å
868	Y	68.7	Low	69.9	Low	24 Å²	24	78.3 Å²	78.3	9%	0.094	37%	0.374	C	S	.	.	H	α-helix	trans	-62.3	-36.5	178.3	-163.8	-113.9	0	0	0	112.8	T864 Q866 H872 I976 E979	T864-Y868 WeakPolarHBondContact O-CB 3.37Å; T864-Y868 PolarHBondContact O-N 3.45Å; Q866-Y868 VanDerWaalsContact C-N 3.29Å; Q866-Y868 PolarHBondContact O-N 3.13Å; Y868-H872 AromaticContact CE1-CD2 3.66Å; Y868-H872 AromaticContact CE1-NE2 3.5Å; Y868-H872 AromaticContact CE2-NE2 3.92Å; Y868-H872 AromaticContact CZ-CD2 3.75Å; Y868-H872 AromaticContact CZ-NE2 3.26Å; Y868-H872 VanDerWaalsContact CZ-NE2 3.26Å; Y868-H872 PolarHBondContact O-CD2 3.46Å; Y868-H872 PolarHBondContact O-N 2.94Å; Y868-H872 PolarHBondContact OH-NE2 2.88Å; Y868-H872 VanDerWaalsContact OH-NE2 3.15Å; Y868-I976 HydrophobicContact CD1-CB 4.14Å; Y868-I976 HydrophobicContact CD1-CD1 4.16Å; Y868-I976 HydrophobicContact CD1-CG2 3.82Å; Y868-I976 HydrophobicContact CE1-CB 4.43Å; Y868-I976 HydrophobicContact CE1-CG2 4.13Å; Y868-E979 VanDerWaalsContact CE1-OE2 3.3Å; Y868-E979 WeakPolarHBondContact CE1-OE2 3.49Å; Y868-E979 VanDerWaalsContact CZ-OE2 3.23Å; Y868-E979 VanDerWaalsContact OH-CD 3.26Å; Y868-E979 PolarHBondContact OH-OE1 3.3Å; Y868-E979 PolarHBondContact OH-OE2 3.21Å
869	K	65.4	Low	67.7	Low	58 Å²	58	86 Å²	86	25%	0.252	41%	0.41	S	S	.	.	H	α-helix	trans	-70.7	-42.9	176.3	-172.4	-165.3	165.4	-150	0	112	L865 Q866 L867 Y871 H872 K873 Y965 I976	L865-K869 WeakPolarHBondContact O-CB 3.21Å; L865-K869 PolarHBondContact O-N 3.47Å; Q866-K869 WeakPolarHBondContact O-CB 3.45Å; Q866-K869 PolarHBondContact O-N 3.34Å; L867-K869 VanDerWaalsContact C-N 3.3Å; L867-K869 PolarHBondContact O-N 3.02Å; K869-Y871 VanDerWaalsContact C-N 3.31Å; K869-Y871 PolarHBondContact O-N 3.37Å; K869-H872 PolarHBondContact O-N 3.36Å; K869-K873 WeakPolarHBondContact O-CB 3.29Å; K869-K873 PolarHBondContact O-N 3Å; K869-Y965 HydrophobicContact CD-CE1 4.44Å; K869-Y965 HydrophobicContact CD-CE2 4.22Å; K869-Y965 WeakPolarHBondContact CD-OH 3.3Å; K869-Y965 VanDerWaalsContact NZ-CZ 3.27Å; K869-Y965 PolarHBondContact NZ-OH 3.16Å; K869-I976 HydrophobicContact CB-CD1 4.11Å
870	D	68.8	Low	65.2	Low	83 Å²	83	90.3 Å²	90.3	44%	0.444	43%	0.433	S	S	.	.	H	α-helix	trans	-68	-34.2	-177.7	-73.9	-21.3	0	0	0	111.4	Q866 L867 K873 Q874	Q866-D870 PolarHBondContact O-N 2.99Å; L867-D870 PolarHBondContact O-N 3.36Å; D870-K873 PolarHBondContact O-N 2.7Å; D870-Q874 PolarHBondContact O-N 2.71Å; D870-Q874 VanDerWaalsContact O-N 3.15Å
871	Y	65.5	Low	62.9	Low	89 Å²	89	94.4 Å²	94.4	35%	0.349	46%	0.457	S	S	.	.	H	α-helix	trans	-58.1	-52.1	169	-175.5	-101.1	0	0	0	112.8	L867 K869 K873 Q874 K875	L867-Y871 PolarHBondContact O-N 3.41Å; K869-Y871 VanDerWaalsContact C-N 3.31Å; K869-Y871 PolarHBondContact O-N 3.37Å; Y871-K873 VanDerWaalsContact C-N 3.28Å; Y871-K873 PolarHBondContact O-N 3.21Å; Y871-Q874 PolarHBondContact O-N 3.11Å; Y871-Q874 VanDerWaalsContact O-N 3.15Å; Y871-K875 PolarHBondContact O-N 3.46Å
872	H	62.5	Low	60.3	Low	39 Å²	39	98.9 Å²	98.9	18%	0.181	49%	0.492	C	S	.	.	H	α-helix	trans	-63	-33.4	177.4	-85.6	-76.3	0	0	0	112.8	Y868 K869 Q874 K875 D876 A977	Y868-H872 AromaticContact CE1-CD2 3.66Å; Y868-H872 AromaticContact CE1-NE2 3.5Å; Y868-H872 AromaticContact CE2-NE2 3.92Å; Y868-H872 AromaticContact CZ-CD2 3.75Å; Y868-H872 AromaticContact CZ-NE2 3.26Å; Y868-H872 VanDerWaalsContact CZ-NE2 3.26Å; Y868-H872 PolarHBondContact O-CD2 3.46Å; Y868-H872 PolarHBondContact O-N 2.94Å; Y868-H872 PolarHBondContact OH-NE2 2.88Å; Y868-H872 VanDerWaalsContact OH-NE2 3.15Å; K869-H872 PolarHBondContact O-N 3.36Å; H872-Q874 VanDerWaalsContact C-N 3.3Å; H872-Q874 PolarHBondContact O-N 3.02Å; H872-K875 WeakPolarHBondContact O-CB 3.35Å; H872-K875 PolarHBondContact O-N 2.86Å; H872-D876 PolarHBondContact O-N 3Å; H872-A977 HydrophobicContact CB-CB 4.41Å
873	K	61	Low	58	Low	133 Å²	133	102 Å²	102	58%	0.578	52%	0.515	S	S	*	.	H	α-helix	trans	-66.7	-29.9	176.3	-168.6	-172.1	172.4	-155.5	0	112.8	K869 D870 Y871	K869-K873 WeakPolarHBondContact O-CB 3.29Å; K869-K873 PolarHBondContact O-N 3Å; D870-K873 PolarHBondContact O-N 2.7Å; Y871-K873 VanDerWaalsContact C-N 3.28Å; Y871-K873 PolarHBondContact O-N 3.21Å
874	Q	57.6	Low	55.6	Low	127 Å²	127	104 Å²	104	59%	0.593	54%	0.535	S	S	*	.	H	α-helix	trans	-72.1	-37.8	172.4	-69.2	175.2	1.4	0	0	111.5	D870 Y871 H872 D876 N877 H878	D870-Q874 PolarHBondContact O-N 2.71Å; D870-Q874 VanDerWaalsContact O-N 3.15Å; Y871-Q874 PolarHBondContact O-N 3.11Å; Y871-Q874 VanDerWaalsContact O-N 3.15Å; H872-Q874 VanDerWaalsContact C-N 3.3Å; H872-Q874 PolarHBondContact O-N 3.02Å; Q874-D876 PolarHBondContact O-N 2.92Å; Q874-N877 PolarHBondContact O-N 3.04Å; Q874-N877 VanDerWaalsContact O-N 3.12Å; Q874-H878 PolarHBondContact O-N 2.96Å; Q874-H878 VanDerWaalsContact O-N 3.14Å
875	K	51.3	Low	53.4	Low	139 Å²	139	110.5 Å²	110.5	60%	0.604	56%	0.556	S	S	*	*	H	α-helix	trans	-62.1	-40.7	178.6	-169.5	175.8	-178.9	177.1	0	113.2	Y871 H872 N877 H878	Y871-K875 PolarHBondContact O-N 3.46Å; H872-K875 WeakPolarHBondContact O-CB 3.35Å; H872-K875 PolarHBondContact O-N 2.86Å; K875-N877 PolarHBondContact O-N 2.9Å; K875-H878 PolarHBondContact O-N 3.04Å
876	D	54	Low	51.5	Low	127 Å²	127	116.8 Å²	116.8	68%	0.679	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-21.6	175.8	-79.8	-14.3	0	0	0	113.2	H872 Q874	H872-D876 PolarHBondContact O-N 3Å; Q874-D876 PolarHBondContact O-N 2.92Å
877	N	49.2	Very low	49.7	Very low	127 Å²	127	117.7 Å²	117.7	68%	0.679	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-27.2	179.6	-75.9	-8.8	0	0	0	113.6	Q874 K875	Q874-N877 PolarHBondContact O-N 3.04Å; Q874-N877 VanDerWaalsContact O-N 3.12Å; K875-N877 PolarHBondContact O-N 2.9Å
878	H	45.4	Very low	47.8	Very low	150 Å²	150	116.2 Å²	116.2	69%	0.694	60%	0.599	S	S	*	*			trans	-105.8	62.8	-178.5	-76	-73.6	0	0	0	112.8	Q874 K875 H880	Q874-H878 PolarHBondContact O-N 2.96Å; Q874-H878 VanDerWaalsContact O-N 3.14Å; K875-H878 PolarHBondContact O-N 3.04Å; H878-H880 PolarHBondContact O-N 3.02Å
879	H	41.9	Very low	46.3	Very low	162 Å²	162	125.8 Å²	125.8	75%	0.75	64%	0.635	S	S	*	*			trans	-74.7	55.1	164.3	-98.1	-57	0	0	0	112.1
880	H	37.6	Very low	45.4	Very low	172 Å²	172	125.3 Å²	125.3	80%	0.796	64%	0.635	S	S	*	*	S	Bend	trans	-175.6	89.9	160.5	-90.6	-59.8	0	0	0	109.3	H878	H878-H880 PolarHBondContact O-N 3.02Å
881	N	38.6	Very low	43.8	Very low	155 Å²	155	130.4 Å²	130.4	83%	0.829	65%	0.654	S	S	*	*			trans	162.8	106.4	144.6	-85.7	-11.5	0	0	0	109.9	S883	N881-S883 PolarHBondContact O-N 3.38Å
882	S	30.8	Very low	42.3	Very low	133 Å²	133	131.2 Å²	131.2	93%	0.93	67%	0.668	S	S	*	*			trans	-83.6	96.9	174.7	49.5	0	0	0	0	110.5
883	S	35.7	Very low	40.7	Very low	75 Å²	75	134.6 Å²	134.6	52%	0.524	69%	0.686	S	S	.	*			trans	-131.9	143.7	164.8	55.4	0	0	0	0	110.1	N881 Y885	N881-S883 PolarHBondContact O-N 3.38Å; S883-Y885 WeakPolarHBondContact O-CD2 3.4Å; S883-Y885 PolarHBondContact O-N 3.37Å; S883-Y885 VanDerWaalsContact O-N 3.16Å
884	S	31.6	Very low	39.1	Very low	129 Å²	129	135.2 Å²	135.2	90%	0.902	70%	0.696	S	S	*	*			trans	-73.8	101.8	-161.6	-53.8	0	0	0	0	113.3
885	Y	32.4	Very low	37.6	Very low	183 Å²	183	139.6 Å²	139.6	72%	0.718	71%	0.708	S	S	*	*			trans	-110.2	122.2	167.7	-68.4	-78	0	0	0	110.9	S883 I887	S883-Y885 WeakPolarHBondContact O-CD2 3.4Å; S883-Y885 PolarHBondContact O-N 3.37Å; S883-Y885 VanDerWaalsContact O-N 3.16Å; Y885-I887 PolarHBondContact O-N 3.46Å
886	T	35	Very low	36.4	Very low	140 Å²	140	136 Å²	136	86%	0.859	71%	0.711	S	S	*	*			trans	-72.3	121.9	178.7	35.1	0	0	0	0	110.7
887	I	36.2	Very low	35.2	Very low	98 Å²	98	137 Å²	137	50%	0.503	71%	0.705	S	S	.	*			trans	-62.9	128.1	176.9	-59.7	168.2	0	0	0	108.6	Y885 R889	Y885-I887 PolarHBondContact O-N 3.46Å; I887-R889 VanDerWaalsContact C-N 3.31Å; I887-R889 PolarHBondContact O-N 3Å
888	P	35.8	Very low	34.2	Very low	97 Å²	97	136.2 Å²	136.2	63%	0.63	71%	0.71	S	S	*	*			trans	-66.6	96	165	28.3	-32.1	0	0	0	107.8	I890	P888-I890 PolarHBondContact O-N 2.87Å
889	R	37.2	Very low	33.5	Very low	225 Å²	225	134.4 Å²	134.4	85%	0.849	71%	0.714	S	S	*	*			trans	-51.2	128.8	169.3	-82.9	-177.4	170.3	169.6	-2.4	107.5	I887 K891	I887-R889 VanDerWaalsContact C-N 3.31Å; I887-R889 PolarHBondContact O-N 3Å; R889-K891 PolarHBondContact O-N 2.91Å
890	I	45.5	Very low	32.7	Very low	48 Å²	48	130.7 Å²	130.7	25%	0.246	71%	0.707	C	S	.	*			trans	-47	118.9	169.9	-63	171.8	0	0	0	106.5	P888 T892	P888-I890 PolarHBondContact O-N 2.87Å; I890-T892 VanDerWaalsContact C-N 3.35Å; I890-T892 PolarHBondContact O-N 3.37Å
891	K	35.2	Very low	32.2	Very low	191 Å²	191	130.8 Å²	130.8	83%	0.83	71%	0.709	S	S	*	*			trans	-62.4	97.3	-174.7	-82.5	-175.8	175.8	177.7	0	109	R889 I893	R889-K891 PolarHBondContact O-N 2.91Å; K891-I893 VanDerWaalsContact C-N 3.33Å; K891-I893 PolarHBondContact O-N 3.03Å
892	T	34.1	Very low	31.6	Very low	106 Å²	106	127.8 Å²	127.8	65%	0.65	70%	0.7	S	S	*	*			trans	-68.7	93	169.5	31.1	0	0	0	0	108.2	I890 N894	I890-T892 VanDerWaalsContact C-N 3.35Å; I890-T892 PolarHBondContact O-N 3.37Å; T892-N894 PolarHBondContact O-N 3.4Å
893	I	28.5	Very low	31.4	Very low	110 Å²	110	132.2 Å²	132.2	56%	0.564	70%	0.697	S	S	*	*			trans	-71.8	83.2	173.1	-58.2	-177.6	0	0	0	108.5	K891 Y895	K891-I893 VanDerWaalsContact C-N 3.33Å; K891-I893 PolarHBondContact O-N 3.03Å; I893-Y895 VanDerWaalsContact C-N 3.27Å; I893-Y895 HydrophobicContact CG2-CD2 3.15Å; I893-Y895 HydrophobicContact CG2-CE2 3.26Å; I893-Y895 HydrophobicContact CG2-CG 4Å; I893-Y895 PolarHBondContact O-N 3.27Å; I893-Y895 VanDerWaalsContact O-N 3.08Å
894	N	26.7	Very low	30.9	Very low	145 Å²	145	133.5 Å²	133.5	78%	0.775	71%	0.706	S	S	*	*			trans	-77	75.8	166.7	-80	-13.5	0	0	0	109.5	T892 G896	T892-N894 PolarHBondContact O-N 3.4Å; N894-G896 PolarHBondContact O-N 3.37Å; N894-G896 VanDerWaalsContact O-N 3.15Å
895	Y	26.6	Very low	30.6	Very low	219 Å²	219	132 Å²	132	86%	0.859	70%	0.696	S	S	*	*			trans	-74.5	100.5	163.9	-84.1	-57.3	0	0	0	109.5	I893	I893-Y895 VanDerWaalsContact C-N 3.27Å; I893-Y895 HydrophobicContact CG2-CD2 3.15Å; I893-Y895 HydrophobicContact CG2-CE2 3.26Å; I893-Y895 HydrophobicContact CG2-CG 4Å; I893-Y895 PolarHBondContact O-N 3.27Å; I893-Y895 VanDerWaalsContact O-N 3.08Å
896	G	27.1	Very low	30.4	Very low	65 Å²	65	128.6 Å²	128.6	67%	0.67	70%	0.698	S	S	*	*			trans	166.8	39.1	177.8	0	0	0	0	0	117.9	N894	N894-G896 PolarHBondContact O-N 3.37Å; N894-G896 VanDerWaalsContact O-N 3.15Å
897	R	28.5	Very low	29.9	Very low	147 Å²	147	129.5 Å²	129.5	56%	0.555	69%	0.694	S	S	*	*			trans	178.4	107.5	154.9	-104.9	163.3	-175.3	148.2	7.5	113.6
898	S	28.7	Very low	29.5	Very low	111 Å²	111	130.7 Å²	130.7	78%	0.776	70%	0.701	S	S	*	*			trans	-177.8	97.8	150	8.5	0	0	0	0	105.9
899	S	29.9	Very low	29	Very low	111 Å²	111	134.9 Å²	134.9	78%	0.776	71%	0.71	S	S	*	*				74.2	110.6	87.8	67.1	0	0	0	0	113
900	S	25.4	Very low	28.6	Very low	85 Å²	85	129.5 Å²	129.5	59%	0.594	71%	0.707	S	S	*	*			trans	-50	145.1	170.6	44.5	0	0	0	0	114.3
901	M	27.3	Very low	27.6	Very low	173 Å²	173	132.9 Å²	132.9	85%	0.852	73%	0.734	S	S	*	*				-163.7	108.7	127.8	-112.3	166.9	66.6	0	0	113
902	S	26.3	Very low	27.2	Very low	92 Å²	92	128.9 Å²	128.9	64%	0.643	73%	0.73	S	S	*	*			trans	52.7	136.2	133.3	67.3	0	0	0	0	123
903	R	25.7	Very low	27	Very low	227 Å²	227	132.3 Å²	132.3	86%	0.857	74%	0.741	S	S	*	*			trans	95.9	104.6	135.2	-88.1	171.1	-174.2	178.6	1	119.6
904	S	25.5	Very low	27	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	75%	0.745	S	S	*	*				53.3	141.3	117.5	65.6	0	0	0	0	119.4
905	S	25.6	Very low	27	Very low	98 Å²	98	135.9 Å²	135.9	69%	0.685	75%	0.751	S	S	*	*			cis	178.3	167.9	0.3	41.6	0	0	0	0	107.5
906	S	27.3	Very low	27	Very low	110 Å²	110	130.6 Å²	130.6	77%	0.769	75%	0.746	S	S	*	*			trans	71.4	150.2	169.8	88.5	0	0	0	0	115
907	M	25.5	Very low	27	Very low	159 Å²	159	132.2 Å²	132.2	78%	0.783	75%	0.747	S	S	*	*			cis	-162.4	158.4	-12.2	-120.7	-179.8	168.8	0	0	111
908	L	27.2	Very low	26.8	Very low	124 Å²	124	130.9 Å²	130.9	65%	0.649	76%	0.76	S	S	*	*			trans	55.2	113.8	143.3	-66.4	165.5	0	0	0	122.1
909	K	25.6	Very low	26.7	Very low	185 Å²	185	133 Å²	133	80%	0.804	76%	0.76	S	S	*	*				48.4	151.7	107.6	-69.5	-171.8	179.9	178.6	0	122
910	S	28.6	Very low	26.5	Very low	112 Å²	112	135.6 Å²	135.6	78%	0.783	76%	0.764	S	S	*	*			trans	72.3	96.9	152.2	42.1	0	0	0	0	119
911	S	24.7	Very low	26.6	Very low	119 Å²	119	139.2 Å²	139.2	83%	0.832	77%	0.769	S	S	*	*			trans	-66.8	122.4	146.9	51.4	0	0	0	0	112.1
912	S	27.2	Very low	26.4	Very low	106 Å²	106	135.9 Å²	135.9	74%	0.741	76%	0.763	S	S	*	*			trans	-178.7	107.1	138	55.2	0	0	0	0	111.8
913	M	28.5	Very low	26.4	Very low	179 Å²	179	136.7 Å²	136.7	88%	0.882	77%	0.768	S	S	*	*				-174.6	120.6	125.9	-103.8	160.6	65.2	0	0	113
914	S	28.9	Very low	26.5	Very low	92 Å²	92	130.9 Å²	130.9	64%	0.643	76%	0.762	S	S	*	*			trans	29.1	116.6	144.6	57.7	0	0	0	0	122
915	R	27.2	Very low	26.5	Very low	237 Å²	237	130.5 Å²	130.5	89%	0.894	76%	0.76	S	S	*	*				88.2	132.6	129.6	-72	179.7	170.1	168	-2.8	121.1
916	S	26.9	Very low	26.5	Very low	108 Å²	108	137.5 Å²	137.5	76%	0.755	77%	0.773	S	S	*	*			trans	77.9	104.5	152.8	26.2	0	0	0	0	121
917	S	26.7	Very low	26.4	Very low	99 Å²	99	140.1 Å²	140.1	69%	0.692	78%	0.775	S	S	*	*			trans	63.5	93.1	134.3	55.5	0	0	0	0	120.7
918	S	25.1	Very low	26.6	Very low	119 Å²	119	139.9 Å²	139.9	83%	0.832	78%	0.777	S	S	*	*			trans	50.9	79.9	130.5	60.9	0	0	0	0	118.4
919	M	25.5	Very low	26.7	Very low	157 Å²	157	137.3 Å²	137.3	77%	0.773	78%	0.78	S	S	*	*			trans	-144.1	177.1	162.6	-89.2	-127.2	-173.9	0	0	110.6
920	L	26.5	Very low	26.9	Very low	165 Å²	165	136 Å²	136	86%	0.864	78%	0.779	S	S	*	*			trans	85.2	94.7	-171.1	-55.3	166.5	0	0	0	112.9
921	K	27.3	Very low	27	Very low	161 Å²	161	140.5 Å²	140.5	70%	0.7	78%	0.78	S	S	*	*			cis	54.1	99.8	26.1	-76.1	-170.5	176.1	-178.3	0	112.3
922	S	23.8	Very low	27.2	Very low	103 Å²	103	141.6 Å²	141.6	72%	0.72	78%	0.777	S	S	*	*				67.5	91.9	76.8	76.7	0	0	0	0	114.3
923	S	26.4	Very low	27.4	Very low	108 Å²	108	142.5 Å²	142.5	76%	0.755	77%	0.773	S	S	*	*			trans	-155.7	115.5	157.9	-69.5	0	0	0	0	105.2
924	S	25.8	Very low	27.5	Very low	105 Å²	105	139.8 Å²	139.8	73%	0.734	76%	0.762	S	S	*	*				52.7	131.5	83.3	72.1	0	0	0	0	112.3
925	S	26	Very low	27.6	Very low	94 Å²	94	141.5 Å²	141.5	66%	0.657	76%	0.764	S	S	*	*			cis	179.3	134.7	5	36.7	0	0	0	0	107.9
926	Y	27.2	Very low	27.7	Very low	246 Å²	246	136.7 Å²	136.7	97%	0.965	76%	0.756	S	S	*	*			trans	-139.6	128.2	155.6	-88.6	-73	0	0	0	110.4
927	M	24.5	Very low	27.9	Very low	165 Å²	165	136.8 Å²	136.8	81%	0.813	76%	0.757	S	S	*	*			trans	-129	176.5	-169.6	-154.3	-170.5	-171.5	0	0	108.9
928	N	29.2	Very low	27.9	Very low	153 Å²	153	138.6 Å²	138.6	82%	0.818	76%	0.759	S	S	*	*			trans	79.8	136.5	173.7	-47.3	-25.5	0	0	0	114.4
929	G	30.5	Very low	28.1	Very low	70 Å²	70	139.6 Å²	139.6	72%	0.722	76%	0.755	S	S	*	*			cis	-177.3	174.2	-2.8	0	0	0	0	0	108.4
930	M	28.9	Very low	28.3	Very low	159 Å²	159	138.2 Å²	138.2	78%	0.783	75%	0.75	S	S	*	*			cis	-136.2	-173	2.1	-79.9	145.7	69.7	0	0	106.9
931	Y	31.3	Very low	28.3	Very low	206 Å²	206	134.9 Å²	134.9	81%	0.808	74%	0.737	S	S	*	*			cis	-155.9	156.7	37.6	-115.7	-90.7	0	0	0	111.6
932	N	28.1	Very low	28.3	Very low	141 Å²	141	136.6 Å²	136.6	75%	0.754	74%	0.741	S	S	*	*			trans	-50.6	159.6	173.6	-75	-6.8	0	0	0	114.4
933	N	31.9	Very low	28.3	Very low	125 Å²	125	141.3 Å²	141.3	67%	0.668	74%	0.744	S	S	*	*			cis	-161.9	142.9	46.8	-128.1	-6.4	0	0	0	113.4
934	N	29.7	Very low	28.4	Very low	122 Å²	122	146.8 Å²	146.8	65%	0.652	75%	0.75	S	S	*	*			trans	39.6	123.9	137.8	-63.8	3.9	0	0	0	119.5
935	N	30.8	Very low	28.3	Very low	128 Å²	128	147.8 Å²	147.8	68%	0.684	76%	0.755	S	S	*	*			cis	-174.4	148	36.1	-99.3	-14.2	0	0	0	112.6
936	N	29.2	Very low	28.3	Very low	137 Å²	137	146.1 Å²	146.1	73%	0.733	75%	0.753	S	S	*	*			trans	69.5	138.8	144.3	-64.7	-4.7	0	0	0	123.5
937	S	31.9	Very low	28.3	Very low	109 Å²	109	142 Å²	142	76%	0.762	75%	0.748	S	S	*	*			trans	60.1	134.8	165	53.2	0	0	0	0	117.5
938	N	27	Very low	28.4	Very low	137 Å²	137	138.7 Å²	138.7	73%	0.733	74%	0.741	S	S	*	*			cis	165.6	149.9	-19.3	-107.4	20.4	0	0	0	102.3
939	D	29.8	Very low	28.4	Very low	141 Å²	141	141.4 Å²	141.4	75%	0.754	75%	0.746	S	S	*	*			trans	66.3	134.2	164.6	-39.8	-26.4	0	0	0	115.7
940	D	29.8	Very low	28.4	Very low	127 Å²	127	142.3 Å²	142.3	68%	0.679	74%	0.741	S	S	*	*			cis	-153.3	161.6	-3	-132.3	-28.3	0	0	0	111.5
941	T	25.6	Very low	28.3	Very low	95 Å²	95	143.1 Å²	143.1	58%	0.583	75%	0.748	S	S	*	*			trans	-66.6	167.8	170.4	55.3	0	0	0	0	112.1
942	Y	27.4	Very low	28.2	Very low	198 Å²	198	141.2 Å²	141.2	78%	0.776	75%	0.745	S	S	*	*				-178.9	143.7	117.5	-89.8	-61.2	0	0	0	112.6
943	Y	24.1	Very low	28.2	Very low	201 Å²	201	142.8 Å²	142.8	79%	0.788	75%	0.745	S	S	*	*			trans	-73.2	169	174.3	-71.2	-109.2	0	0	0	111.2
944	Y	28	Very low	28.2	Very low	224 Å²	224	144.9 Å²	144.9	88%	0.878	76%	0.755	S	S	*	*				-171.2	137.4	117.5	-103	-68.1	0	0	0	112.5
945	C	23.3	Very low	28.2	Very low	125 Å²	125	146.7 Å²	146.7	85%	0.845	76%	0.757	S	S	*	*			trans	-119.5	144.7	163.6	-177.9	0	0	0	0	108.2
946	G	26.5	Very low	28.3	Very low	60 Å²	60	146.3 Å²	146.3	62%	0.619	76%	0.756	S	S	*	*			trans	89.5	96.3	165	0	0	0	0	0	116.6
947	N	27.4	Very low	28.5	Very low	159 Å²	159	150.9 Å²	150.9	85%	0.85	76%	0.762	S	S	*	*				-173.1	141.3	105.7	-104.2	-39.2	0	0	0	113.8
948	S	26.6	Very low	28.7	Very low	96 Å²	96	151.7 Å²	151.7	67%	0.671	75%	0.752	S	S	*	*	S	Bend	trans	36.8	125.5	144.8	-140.5	0	0	0	0	121.4
949	K	27.9	Very low	29.2	Very low	210 Å²	210	153.1 Å²	153.1	91%	0.913	75%	0.754	S	S	*	*	S	Bend	trans	86.2	9.5	157.6	-57.2	-178.9	178.6	178.2	0	121.7
950	S	30.8	Very low	29.7	Very low	89 Å²	89	151.2 Å²	151.2	62%	0.622	75%	0.751	S	S	*	*			trans	-112.2	-3	178.7	58.7	0	0	0	0	117.5	F952 F953	S950-F952 PolarHBondContact O-N 3.39Å; S950-F953 PolarHBondContact O-N 3.2Å
951	N	27.4	Very low	30.3	Very low	176 Å²	176	151.5 Å²	151.5	94%	0.941	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	26.1	-174.3	-80.3	-12.2	0	0	0	116.6
952	F	28.5	Very low	31	Very low	166 Å²	166	148.8 Å²	148.8	73%	0.728	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	-8.5	172.8	-158.1	-105.9	0	0	0	113.7	S950	S950-F952 PolarHBondContact O-N 3.39Å
953	F	28.8	Very low	31.5	Very low	174 Å²	174	141 Å²	141	76%	0.763	71%	0.705	S	S	*	*	S	Bend	trans	-91.3	-16.1	-168.1	-123.8	-95.3	0	0	0	116.1	S950	S950-F953 PolarHBondContact O-N 3.2Å
954	L	30.8	Very low	32.2	Very low	168 Å²	168	141.2 Å²	141.2	88%	0.88	71%	0.705	S	S	*	*	S	Bend	trans	-81.2	-14.1	-178.7	-104.4	160.1	0	0	0	114.6
955	F	31.5	Very low	32.7	Very low	160 Å²	160	134 Å²	134	70%	0.702	68%	0.676	S	S	*	*	S	Bend	trans	-87.1	-17.3	176.5	-116.9	-96.6	0	0	0	114.1
956	N	31.6	Very low	33.8	Very low	121 Å²	121	130.9 Å²	130.9	65%	0.647	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	1.7	-165.4	-107.6	-19.2	0	0	0	116.5	K958	N956-K958 VanDerWaalsContact C-N 3.3Å; N956-K958 PolarHBondContact O-N 3.35Å
957	R	34.7	Very low	34.4	Very low	232 Å²	232	137.6 Å²	137.6	88%	0.875	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-0.3	172.2	-111.6	-179.7	177.6	-179.5	0.3	114.4	H959	R957-H959 PolarHBondContact O-N 3.33Å
958	K	35.4	Very low	34.9	Very low	127 Å²	127	139.7 Å²	139.7	55%	0.552	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-7.7	-163.4	-80.5	-177.6	172.3	176.1	0	117.7	N956	N956-K958 VanDerWaalsContact C-N 3.3Å; N956-K958 PolarHBondContact O-N 3.35Å
959	H	37.5	Very low	35.8	Very low	166 Å²	166	138 Å²	138	77%	0.769	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-2.2	-162	-115.1	-65.3	0	0	0	118.9	R957	R957-H959 PolarHBondContact O-N 3.33Å
960	C	39.8	Very low	36.8	Very low	102 Å²	102	131.1 Å²	131.1	69%	0.689	61%	0.606	S	S	*	*	S	Bend	trans	-123	-17.5	-169.4	-152.8	0	0	0	0	117.4
961	L	41.9	Very low	37.1	Very low	133 Å²	133	136.1 Å²	136.1	70%	0.696	62%	0.617	S	S	*	*	S	Bend	trans	-80	-44.6	-170.2	-72.5	170.5	0	0	0	114.2	N963 R964 Y965	L961-N963 PolarHBondContact O-N 3.43Å; L961-N963 VanDerWaalsContact O-N 3.13Å; L961-R964 PolarHBondContact O-N 3.1Å; L961-Y965 PolarHBondContact O-N 3.19Å
962	L	41.6	Very low	37.9	Very low	38 Å²	38	136.1 Å²	136.1	20%	0.199	61%	0.608	C	S	.	*	H	α-helix	trans	-56.2	-36.5	-176	-145.5	80.3	0	0	0	112.8	R964 Y965 I966 E1004 H1036	L962-R964 VanDerWaalsContact C-N 3.34Å; L962-R964 PolarHBondContact O-N 3.13Å; L962-Y965 PolarHBondContact O-N 3.26Å; L962-I966 HydrophobicContact CD2-CD1 3.87Å; L962-I966 HydrophobicContact CG-CD1 3.82Å; L962-I966 HydrophobicContact CG-CG1 4.32Å; L962-I966 WeakPolarHBondContact O-CG1 3.22Å; L962-I966 PolarHBondContact O-N 3.36Å; L962-E1004 HydrophobicContact CD1-CB 4.36Å; L962-E1004 HydrophobicContact CD1-CG 3.82Å; L962-E1004 WeakPolarHBondContact CD1-OE1 3.15Å; L962-H1036 HydrophobicContact CD2-CB 4.41Å; L962-H1036 VanDerWaalsContact CD2-CD2 3.5Å; L962-H1036 WeakPolarHBondContact CD2-CD2 3.17Å
963	N	37.5	Very low	38.6	Very low	35 Å²	35	134 Å²	134	19%	0.187	60%	0.601	C	S	.	*	H	α-helix	trans	-68	-24.9	179.5	-80.5	5.2	0	0	0	115	L961 R967 H1036	L961-N963 PolarHBondContact O-N 3.43Å; L961-N963 VanDerWaalsContact O-N 3.13Å; N963-R967 PolarHBondContact O-NE 2.95Å; N963-H1036 PolarHBondContact OD1-O 3.47Å
964	R	38.9	Very low	39.2	Very low	204 Å²	204	128.7 Å²	128.7	77%	0.77	58%	0.584	S	S	*	*	H	α-helix	trans	-88.3	-33.6	171.9	-111	177.2	174.4	167.1	-1.7	111	L961 L962	L961-R964 PolarHBondContact O-N 3.1Å; L962-R964 VanDerWaalsContact C-N 3.34Å; L962-R964 PolarHBondContact O-N 3.13Å
965	Y	38.8	Very low	39.7	Very low	72 Å²	72	121.2 Å²	121.2	28%	0.282	55%	0.547	S	S	.	.	H	α-helix	trans	-70.6	-48.7	-175.7	-138.7	-100.4	0	0	0	113.4	K869 L961 L962 R967 Y968 K969	K869-Y965 HydrophobicContact CD-CE1 4.44Å; K869-Y965 HydrophobicContact CD-CE2 4.22Å; K869-Y965 WeakPolarHBondContact CD-OH 3.3Å; K869-Y965 VanDerWaalsContact NZ-CZ 3.27Å; K869-Y965 PolarHBondContact NZ-OH 3.16Å; L961-Y965 PolarHBondContact O-N 3.19Å; L962-Y965 PolarHBondContact O-N 3.26Å; Y965-R967 PolarHBondContact O-N 2.98Å; Y965-Y968 PolarHBondContact O-N 3.38Å; Y965-K969 HydrophobicContact CE1-CD 4.46Å; Y965-K969 PolarHBondContact O-N 3.1Å
966	I	45.3	Very low	40.1	Very low	60 Å²	60	114 Å²	114	31%	0.308	52%	0.515	S	S	.	.	H	α-helix	trans	-61.8	-31.3	179.7	-66.5	169.3	0	0	0	111.1	L962 H970 H1036	L962-I966 HydrophobicContact CD2-CD1 3.87Å; L962-I966 HydrophobicContact CG-CD1 3.82Å; L962-I966 HydrophobicContact CG-CG1 4.32Å; L962-I966 WeakPolarHBondContact O-CG1 3.22Å; L962-I966 PolarHBondContact O-N 3.36Å; I966-H970 PolarHBondContact O-CD2 2.96Å; I966-H1036 HydrophobicContact CD1-CB 4.42Å
967	R	39.8	Very low	40.6	Very low	201 Å²	201	110.7 Å²	110.7	76%	0.758	51%	0.505	S	S	*	.	H	α-helix	trans	-72.8	-25.5	179.7	-110	-176.3	-79.3	-165.1	-9.2	114.5	N963 Y965	N963-R967 PolarHBondContact O-NE 2.95Å; Y965-R967 PolarHBondContact O-N 2.98Å
968	Y	38.3	Very low	41.2	Very low	203 Å²	203	106.9 Å²	106.9	80%	0.796	50%	0.502	S	S	*	.	H	α-helix	trans	-100.4	-30.4	-177.1	-95.6	-94.5	0	0	0	114.5	Y965	Y965-Y968 PolarHBondContact O-N 3.38Å
969	K	44.4	Very low	42.3	Very low	62 Å²	62	105 Å²	105	27%	0.27	50%	0.495	S	S	.	.	H	α-helix	trans	-84	-8.9	-168.7	-144.6	-177.3	177.3	-166.4	0	115.9	Y965 K971 G975	Y965-K969 HydrophobicContact CE1-CD 4.46Å; Y965-K969 PolarHBondContact O-N 3.1Å; K969-K971 VanDerWaalsContact C-N 3.26Å; K969-K971 PolarHBondContact O-N 3.14Å; K969-G975 WeakPolarHBondContact CE-O 3.27Å; K969-G975 PolarHBondContact NZ-O 3.47Å
970	H	49	Very low	43.9	Very low	64 Å²	64	98.6 Å²	98.6	30%	0.296	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	4.1	-179.5	-78.2	-50.7	0	0	0	115.6	K454 I966 K1177	K454-H970 PolarHBondContact NZ-CE1 3.32Å; K454-H970 PolarHBondContact NZ-NE2 3.14Å; I966-H970 PolarHBondContact O-CD2 2.96Å; H970-K1177 PolarHBondContact O-NZ 3.35Å
971	K	38.4	Very low	46	Very low	194 Å²	194	93.7 Å²	93.7	84%	0.843	44%	0.436	S	S	*	.	S	Bend	trans	-99.2	69.3	170.6	-84.3	-171.7	174.8	178.5	0	113	K969	K969-K971 VanDerWaalsContact C-N 3.26Å; K969-K971 PolarHBondContact O-N 3.14Å
972	K	44.1	Very low	48.1	Very low	176 Å²	176	87.4 Å²	87.4	77%	0.765	40%	0.403	S	S	*	.	S	Bend		170.1	-57.6	125.5	-94.1	177.7	175.9	-177.9	0	111
973	H	43	Very low	50.4	Low	123 Å²	123	85.6 Å²	85.6	57%	0.569	39%	0.394	S	S	*	.			trans	-138.2	137.7	174.3	-59.9	-81.6	0	0	0	109.2
974	P	41.6	Very low	53	Low	62 Å²	62	83.9 Å²	83.9	40%	0.403	39%	0.385	S	S	.	.	S	Bend	trans	-62.7	135.8	159.7	30.2	-32	0	0	0	107.5	T1010	P974-T1010 WeakPolarHBondContact O-CB 3.43Å; P974-T1010 WeakPolarHBondContact O-CG2 3.3Å
975	G	41.4	Very low	55.6	Low	10 Å²	10	74.2 Å²	74.2	10%	0.103	35%	0.348	C	S	.	.	S	Bend	trans	125.9	164.9	-162.1	0	0	0	0	0	111.6	K969	K969-G975 WeakPolarHBondContact CE-O 3.27Å; K969-G975 PolarHBondContact NZ-O 3.47Å
976	I	38.7	Very low	58	Low	8 Å²	8	71 Å²	71	4%	0.041	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-102.7	129.5	170.3	-62.1	167.2	0	0	0	106.3	L865 Y868 K869 N978 E979	L865-I976 HydrophobicContact CB-CD1 4.42Å; L865-I976 HydrophobicContact CD2-CD1 4.17Å; L865-I976 VanDerWaalsContact O-CD1 3.29Å; L865-I976 WeakPolarHBondContact O-CD1 3.26Å; Y868-I976 HydrophobicContact CD1-CB 4.14Å; Y868-I976 HydrophobicContact CD1-CD1 4.16Å; Y868-I976 HydrophobicContact CD1-CG2 3.82Å; Y868-I976 HydrophobicContact CE1-CB 4.43Å; Y868-I976 HydrophobicContact CE1-CG2 4.13Å; K869-I976 HydrophobicContact CB-CD1 4.11Å; I976-N978 PolarHBondContact O-N 2.91Å; I976-E979 PolarHBondContact O-N 2.95Å; I976-E979 VanDerWaalsContact O-N 3.09Å
977	A	41.6	Very low	59.9	Low	53 Å²	53	68.4 Å²	68.4	44%	0.438	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.2	58.1	168.6	0	0	0	0	0	116.3	H872 E979	H872-A977 HydrophobicContact CB-CB 4.41Å; A977-E979 PolarHBondContact O-N 2.8Å; A977-E979 VanDerWaalsContact O-N 3.07Å
978	N	48.4	Very low	62.1	Low	151 Å²	151	65.1 Å²	65.1	81%	0.807	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	-2.9	179.6	-69.8	-10.7	0	0	0	117.2	I976	I976-N978 PolarHBondContact O-N 2.91Å
979	E	58.2	Low	64.6	Low	88 Å²	88	55.4 Å²	55.4	41%	0.411	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-85.2	133.3	177.4	-71.2	177.1	164	0	0	111.9	Y868 I976 A977	Y868-E979 VanDerWaalsContact CE1-OE2 3.3Å; Y868-E979 WeakPolarHBondContact CE1-OE2 3.49Å; Y868-E979 VanDerWaalsContact CZ-OE2 3.23Å; Y868-E979 VanDerWaalsContact OH-CD 3.26Å; Y868-E979 PolarHBondContact OH-OE1 3.3Å; Y868-E979 PolarHBondContact OH-OE2 3.21Å; I976-E979 PolarHBondContact O-N 2.95Å; I976-E979 VanDerWaalsContact O-N 3.09Å; A977-E979 PolarHBondContact O-N 2.8Å; A977-E979 VanDerWaalsContact O-N 3.07Å
980	S	71.6	Confident	66.8	Low	31 Å²	31	52.5 Å²	52.5	22%	0.217	26%	0.264	C	S	.	.			trans	-82	128.9	171.3	50.9	0	0	0	0	110	T837 M840 S841	T837-S980 PolarHBondContact OG1-OG 3.17Å; T837-S980 VanDerWaalsContact OG1-OG 3.06Å; M840-S980 WeakPolarHBondContact CA-O 3.21Å; M840-S980 WeakPolarHBondContact CG-O 3.26Å; S841-S980 PolarHBondContact N-O 2.72Å; S841-S980 PolarHBondContact OG-O 3.05Å
981	I	82.5	Confident	68.7	Low	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126.7	177.6	-48.7	-178	0	0	0	106.5	M840 S841 I843 L865 V1009 T1010	M840-I981 VanDerWaalsContact CE-O 3.24Å; M840-I981 WeakPolarHBondContact CE-O 3.38Å; S841-I981 CarbonylContact O-C 3.55Å; S841-I981 WeakPolarHBondContact O-CA 3.17Å; I843-I981 HydrophobicContact CD1-CG2 3.75Å; I843-I981 HydrophobicContact CG1-CG2 4.06Å; L865-I981 HydrophobicContact CD2-CD1 3.65Å; I981-V1009 HydrophobicContact CG2-CG1 4.39Å; I981-V1009 HydrophobicContact CG2-CG2 4.42Å; I981-V1009 WeakPolarHBondContact O-CG1 3.47Å; I981-T1010 PolarHBondContact O-N 3.4Å; I981-T1010 PolarHBondContact O-OG1 3.25Å; I981-T1010 VanDerWaalsContact O-OG1 3.11Å
982	G	86.7	Confident	71.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	149.5	176.1	0	0	0	0	0	111.5	S841 I843 T1011	S841-G982 PolarHBondContact O-N 2.93Å; I843-G982 PolarHBondContact N-O 3.02Å; G982-T1011 WeakPolarHBondContact CA-O 3.45Å
983	L	90.8	Very high	73.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.3	174.2	175	65.8	0	0	0	109.3	I843 I845 F1002 L1005 V1009 T1011 V1012 L1013	I843-L983 HydrophobicContact CB-CD1 4.11Å; I843-L983 HydrophobicContact CG2-CD1 3.83Å; I845-L983 HydrophobicContact CD1-CD1 4Å; I845-L983 HydrophobicContact CG1-CD1 4.14Å; L983-F1002 HydrophobicContact CD2-CE2 4.44Å; L983-L1005 HydrophobicContact CD1-CD2 4.42Å; L983-L1005 HydrophobicContact CD2-CD2 4.45Å; L983-L1005 HydrophobicContact CD2-CG 4.41Å; L983-V1009 HydrophobicContact CB-CG1 3.83Å; L983-V1009 HydrophobicContact CB-CG2 4.38Å; L983-T1011 PolarHBondContact N-O 3.27Å; L983-V1012 HydrophobicContact CB-CG1 4.5Å; L983-V1012 HydrophobicContact CB-CG2 4.43Å; L983-V1012 HydrophobicContact CD2-CG1 4.25Å; L983-L1013 PolarHBondContact O-N 3.09Å
984	V	92.4	Very high	75.6	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.8	171.5	-173.7	0	0	0	0	108.5	I827 F836 I843 K844 I845 L1013	I827-V984 HydrophobicContact CD1-CG1 4.37Å; I827-V984 HydrophobicContact CD1-CG2 4.35Å; I827-V984 HydrophobicContact CG1-CG2 4.3Å; F836-V984 HydrophobicContact CE2-CG2 4.19Å; F836-V984 HydrophobicContact CZ-CG2 4.01Å; I843-V984 PolarHBondContact O-N 3.22Å; K844-V984 WeakPolarHBondContact CA-O 3.2Å; K844-V984 HydrophobicContact CG-CB 4.31Å; I845-V984 PolarHBondContact N-O 3.34Å; V984-L1013 VanDerWaalsContact CA-O 3.31Å; V984-L1013 WeakPolarHBondContact CA-O 3.41Å; V984-L1013 HydrophobicContact CG1-CD2 4.26Å; V984-L1013 HydrophobicContact CG2-CB 4.45Å; V984-L1013 HydrophobicContact CG2-CD2 4.29Å
985	I	92.5	Very high	77.8	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	141.9	176.1	-171.5	167.7	0	0	0	111.2	I845 L990 A993 F1002 L1013 C1014 C1015	I845-I985 HydrophobicContact CB-CB 4.47Å; I845-I985 HydrophobicContact CB-CD1 4.47Å; I845-I985 HydrophobicContact CB-CG1 4.21Å; I845-I985 HydrophobicContact CG2-CD1 4.28Å; I845-I985 HydrophobicContact CG2-CG1 4.29Å; I845-I985 WeakPolarHBondContact O-CA 3.23Å; I985-L990 HydrophobicContact CD1-CB 4.24Å; I985-L990 HydrophobicContact CD1-CD1 4.25Å; I985-L990 HydrophobicContact CG1-CB 4.34Å; I985-A993 HydrophobicContact CD1-CB 4.13Å; I985-F1002 HydrophobicContact CD1-CD2 4.44Å; I985-F1002 HydrophobicContact CD1-CE2 3.59Å; I985-F1002 HydrophobicContact CD1-CZ 3.94Å; I985-F1002 HydrophobicContact CG2-CZ 4.42Å; I985-L1013 PolarHBondContact N-O 3.09Å; I985-C1014 HydrophobicContact CG2-CB 4.07Å; I985-C1014 WeakPolarHBondContact CG2-SG 3.46Å; I985-C1014 CarbonylContact O-C 3.46Å; I985-C1014 WeakPolarHBondContact O-CA 3.27Å; I985-C1015 PolarHBondContact O-N 3.2Å
986	D	89.6	Confident	79.9	Confident	5 Å²	5	42.7 Å²	42.7	3%	0.027	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	154	175.6	72.3	-14.8	0	0	0	112.9	I845 N847 K988 S989 L990 C1015	I845-D986 PolarHBondContact O-N 3.01Å; N847-D986 PolarHBondContact N-OD1 2.87Å; N847-D986 PolarHBondContact N-OD2 3.44Å; D986-K988 PolarHBondContact O-N 3.43Å; D986-K988 VanDerWaalsContact O-N 3.08Å; D986-S989 PolarHBondContact O-N 3.03Å; D986-S989 VanDerWaalsContact O-N 3.12Å; D986-S989 WeakPolarHBondContact OD1-CB 3.46Å; D986-S989 PolarHBondContact OD1-N 3.42Å; D986-S989 PolarHBondContact OD1-OG 3.11Å; D986-L990 VanDerWaalsContact O-CB 3.29Å; D986-L990 WeakPolarHBondContact O-CB 3.48Å; D986-L990 PolarHBondContact O-N 2.91Å; D986-C1015 CarbonylContact C-O 3.52Å; D986-C1015 WeakPolarHBondContact CA-O 3.49Å
987	G	85.2	Confident	82.1	Confident	4 Å²	4	45.6 Å²	45.6	4%	0.041	24%	0.242	C	C	.	.	H	α-helix	trans	-56.3	-26.5	-178.2	0	0	0	0	0	114.7	Q991 C1015 Q1021	G987-Q991 PolarHBondContact O-N 3.08Å; G987-C1015 PolarHBondContact N-O 3.3Å; G987-Q1021 PolarHBondContact O-NE2 3.05Å
988	K	86.3	Confident	84.3	Confident	132 Å²	132	43.3 Å²	43.3	57%	0.574	22%	0.222	S	C	*	.	H	α-helix	trans	-70.6	-52	173.9	-69.1	-172.2	176.4	-173.7	0	111.9	D986 L990 Q991	D986-K988 PolarHBondContact O-N 3.43Å; D986-K988 VanDerWaalsContact O-N 3.08Å; K988-L990 VanDerWaalsContact C-N 3.28Å; K988-L990 PolarHBondContact O-N 3.44Å; K988-Q991 PolarHBondContact O-N 3.08Å
989	S	90.1	Very high	86.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.1	-35.4	176	-49.2	0	0	0	0	111.3	N847 C848 D986 Q991 Y992 A993	N847-S989 PolarHBondContact N-OG 3.17Å; C848-S989 WeakPolarHBondContact CB-OG 3.38Å; C848-S989 PolarHBondContact N-OG 2.96Å; C848-S989 PolarHBondContact SG-OG 3.46Å; D986-S989 PolarHBondContact O-N 3.03Å; D986-S989 VanDerWaalsContact O-N 3.12Å; D986-S989 WeakPolarHBondContact OD1-CB 3.46Å; D986-S989 PolarHBondContact OD1-N 3.42Å; D986-S989 PolarHBondContact OD1-OG 3.11Å; S989-Q991 VanDerWaalsContact C-N 3.34Å; S989-Q991 PolarHBondContact O-N 3.19Å; S989-Y992 PolarHBondContact O-N 2.9Å; S989-A993 PolarHBondContact O-N 3.14Å
990	L	91.1	Very high	87.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-38.6	178.2	-178	69.8	0	0	0	112.7	I985 D986 K988 Y992 A993 L994 F1002 M1017 Q1021 I1025	I985-L990 HydrophobicContact CD1-CB 4.24Å; I985-L990 HydrophobicContact CD1-CD1 4.25Å; I985-L990 HydrophobicContact CG1-CB 4.34Å; D986-L990 VanDerWaalsContact O-CB 3.29Å; D986-L990 WeakPolarHBondContact O-CB 3.48Å; D986-L990 PolarHBondContact O-N 2.91Å; K988-L990 VanDerWaalsContact C-N 3.28Å; K988-L990 PolarHBondContact O-N 3.44Å; L990-Y992 PolarHBondContact O-N 3.46Å; L990-A993 PolarHBondContact O-N 2.97Å; L990-A993 VanDerWaalsContact O-N 3.09Å; L990-L994 HydrophobicContact CD1-CD1 4.19Å; L990-L994 HydrophobicContact CD1-CD2 4.29Å; L990-L994 HydrophobicContact CD1-CG 3.92Å; L990-L994 HydrophobicContact CD2-CD1 4.25Å; L990-L994 HydrophobicContact CG-CD1 3.85Å; L990-L994 HydrophobicContact CG-CG 4.03Å; L990-L994 WeakPolarHBondContact O-CB 3.23Å; L990-L994 WeakPolarHBondContact O-CG 3.5Å; L990-L994 PolarHBondContact O-N 3.03Å; L990-F1002 HydrophobicContact CD1-CE1 3.72Å; L990-F1002 HydrophobicContact CD1-CZ 3.71Å; L990-M1017 HydrophobicContact CD2-CE 3.64Å; L990-M1017 HydrophobicContact CD2-CG 4.26Å; L990-M1017 HydrophobicContact CD2-SD 4.33Å; L990-Q1021 HydrophobicContact CD2-CB 4.15Å; L990-I1025 HydrophobicContact CD1-CD1 3.79Å; L990-I1025 HydrophobicContact CD1-CG1 4.15Å; L990-I1025 HydrophobicContact CD2-CD1 3.72Å; L990-I1025 HydrophobicContact CD2-CG1 4.13Å; L990-I1025 HydrophobicContact CG-CD1 4.41Å
991	Q	88.6	Confident	88.3	Confident	127 Å²	127	37.8 Å²	37.8	59%	0.593	19%	0.189	S	C	*	.	H	α-helix	trans	-54.3	-40.3	176.1	-176.8	177.2	-6.5	0	0	111.7	G987 K988 S989	G987-Q991 PolarHBondContact O-N 3.08Å; K988-Q991 PolarHBondContact O-N 3.08Å; S989-Q991 VanDerWaalsContact C-N 3.34Å; S989-Q991 PolarHBondContact O-N 3.19Å
992	Y	91.3	Very high	88.6	Confident	75 Å²	75	37.8 Å²	37.8	29%	0.294	19%	0.189	S	C	.	.	H	α-helix	trans	-77.9	-37.4	174.8	-61.3	-59.1	0	0	0	112.9	L849 L851 S989 L990 L994 H995	L849-Y992 WeakPolarHBondContact O-CE2 3.29Å; L849-Y992 VanDerWaalsContact O-CZ 3.3Å; L849-Y992 PolarHBondContact O-OH 2.91Å; L851-Y992 HydrophobicContact CB-CD1 4.08Å; S989-Y992 PolarHBondContact O-N 2.9Å; L990-Y992 PolarHBondContact O-N 3.46Å; Y992-L994 VanDerWaalsContact C-N 3.29Å; Y992-L994 PolarHBondContact O-N 3.15Å; Y992-H995 WeakPolarHBondContact O-CB 3.47Å; Y992-H995 PolarHBondContact O-N 3.43Å; Y992-H995 VanDerWaalsContact O-N 3.11Å
993	A	90	Very high	88.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.2	-30.4	178.6	0	0	0	0	0	113.2	T854 I858 I985 S989 L990 H995 R999 F1002	T854-A993 HydrophobicContact CG2-CB 4.07Å; I858-A993 HydrophobicContact CD1-CB 3.99Å; I985-A993 HydrophobicContact CD1-CB 4.13Å; S989-A993 PolarHBondContact O-N 3.14Å; L990-A993 PolarHBondContact O-N 2.97Å; L990-A993 VanDerWaalsContact O-N 3.09Å; A993-H995 VanDerWaalsContact C-N 3.25Å; A993-H995 PolarHBondContact O-N 3.27Å; A993-R999 WeakPolarHBondContact O-CA 3.23Å; A993-R999 PolarHBondContact O-N 3.47Å; A993-F1002 HydrophobicContact CB-CB 4.36Å; A993-F1002 HydrophobicContact CB-CD1 4.16Å; A993-F1002 HydrophobicContact CB-CD2 3.93Å; A993-F1002 HydrophobicContact CB-CE1 4.49Å; A993-F1002 HydrophobicContact CB-CE2 4.28Å; A993-F1002 HydrophobicContact CB-CG 3.88Å
994	L	88.4	Confident	88.3	Confident	39 Å²	39	41 Å²	41	20%	0.204	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-6.5	174.6	-68.7	176.1	0	0	0	113.8	L990 Y992 L1028	L990-L994 HydrophobicContact CD1-CD1 4.19Å; L990-L994 HydrophobicContact CD1-CD2 4.29Å; L990-L994 HydrophobicContact CD1-CG 3.92Å; L990-L994 HydrophobicContact CD2-CD1 4.25Å; L990-L994 HydrophobicContact CG-CD1 3.85Å; L990-L994 HydrophobicContact CG-CG 4.03Å; L990-L994 WeakPolarHBondContact O-CB 3.23Å; L990-L994 WeakPolarHBondContact O-CG 3.5Å; L990-L994 PolarHBondContact O-N 3.03Å; Y992-L994 VanDerWaalsContact C-N 3.29Å; Y992-L994 PolarHBondContact O-N 3.15Å; L994-L1028 HydrophobicContact CD2-CB 4.46Å; L994-L1028 HydrophobicContact CD2-CD2 3.87Å
995	H	88.1	Confident	88	Confident	90 Å²	90	41 Å²	41	42%	0.417	20%	0.204	S	C	.	.	S	Bend	trans	-59.8	147.5	177.4	-169.5	-97.6	0	0	0	111.6	L851 Y992 A993 S997 L998 R999	L851-H995 HydrophobicContact CD1-CB 3.77Å; Y992-H995 WeakPolarHBondContact O-CB 3.47Å; Y992-H995 PolarHBondContact O-N 3.43Å; Y992-H995 VanDerWaalsContact O-N 3.11Å; A993-H995 VanDerWaalsContact C-N 3.25Å; A993-H995 PolarHBondContact O-N 3.27Å; H995-S997 PolarHBondContact ND1-OG 3.41Å; H995-S997 PolarHBondContact O-N 3.42Å; H995-L998 PolarHBondContact O-N 2.85Å; H995-R999 WeakPolarHBondContact O-CB 3.13Å; H995-R999 PolarHBondContact O-N 3.32Å
996	T	85.3	Confident	87.7	Confident	92 Å²	92	41 Å²	41	56%	0.564	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-28.3	-170	52	0	0	0	0	114.6
997	S	86.2	Confident	87.4	Confident	70 Å²	70	42.7 Å²	42.7	49%	0.49	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-28.1	177.8	53.7	0	0	0	0	114.9	H995	H995-S997 PolarHBondContact ND1-OG 3.41Å; H995-S997 PolarHBondContact O-N 3.42Å
998	L	88.3	Confident	86.9	Confident	4 Å²	4	43.4 Å²	43.4	2%	0.021	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-25.4	-174.5	-69.6	177.4	0	0	0	113.6	L851 A855 Y859 H995 D1000 S1001 F1002	L851-L998 HydrophobicContact CD1-CD1 4.46Å; L851-L998 HydrophobicContact CD2-CD1 4.23Å; L851-L998 HydrophobicContact CG-CD1 3.94Å; A855-L998 HydrophobicContact CB-CD1 3.97Å; A855-L998 HydrophobicContact CB-CD2 3.66Å; A855-L998 HydrophobicContact CB-CG 4.45Å; Y859-L998 HydrophobicContact CE2-CD2 4.08Å; H995-L998 PolarHBondContact O-N 2.85Å; L998-D1000 PolarHBondContact O-N 3.21Å; L998-S1001 PolarHBondContact O-N 3.24Å; L998-F1002 PolarHBondContact O-N 2.86Å
999	R	87.9	Confident	86.6	Confident	74 Å²	74	37.2 Å²	37.2	28%	0.279	19%	0.19	S	C	.	.	H	α-helix	trans	-51.1	-36.2	-171.5	77.7	-179.3	-177.3	-137.7	-25.5	114.5	A993 H995 L1003 L1028	A993-R999 WeakPolarHBondContact O-CA 3.23Å; A993-R999 PolarHBondContact O-N 3.47Å; H995-R999 WeakPolarHBondContact O-CB 3.13Å; H995-R999 PolarHBondContact O-N 3.32Å; R999-L1003 WeakPolarHBondContact O-CB 3.01Å; R999-L1003 PolarHBondContact O-N 3.4Å; R999-L1028 HydrophobicContact CB-CD1 3.8Å; R999-L1028 HydrophobicContact CG-CD1 4.13Å
1000	D	85.8	Confident	86	Confident	60 Å²	60	38.2 Å²	38.2	32%	0.321	20%	0.196	S	C	.	.	H	α-helix	trans	-78.4	-36.4	-173.9	-61.3	-30.4	0	0	0	109.7	L998 E1004	L998-D1000 PolarHBondContact O-N 3.21Å; D1000-E1004 PolarHBondContact O-N 2.76Å; D1000-E1004 VanDerWaalsContact O-N 3.1Å
1001	S	86.4	Confident	85.8	Confident	20 Å²	20	38.6 Å²	38.6	14%	0.14	20%	0.199	C	C	.	.	H	α-helix	trans	-72.1	-37.4	170.1	-60.7	0	0	0	0	112.6	Y859 L998 L1003 E1004 L1005	Y859-S1001 WeakPolarHBondContact CE1-OG 3.31Å; Y859-S1001 PolarHBondContact OH-OG 3.15Å; L998-S1001 PolarHBondContact O-N 3.24Å; S1001-L1003 VanDerWaalsContact C-N 3.34Å; S1001-E1004 PolarHBondContact O-N 2.99Å; S1001-L1005 PolarHBondContact O-N 3.45Å
1002	F	90.6	Very high	85.9	Confident	1 Å²	1	32.5 Å²	32.5	0%	0.004	17%	0.17	C	C	.	.	H	α-helix	trans	-61	-43.5	172.4	175.8	-119.9	0	0	0	111.4	I858 L983 I985 L990 A993 L998 E1004 L1005 C1006 L1028	I858-F1002 HydrophobicContact CD1-CB 4.18Å; I858-F1002 HydrophobicContact CD1-CD2 4.16Å; L983-F1002 HydrophobicContact CD2-CE2 4.44Å; I985-F1002 HydrophobicContact CD1-CD2 4.44Å; I985-F1002 HydrophobicContact CD1-CE2 3.59Å; I985-F1002 HydrophobicContact CD1-CZ 3.94Å; I985-F1002 HydrophobicContact CG2-CZ 4.42Å; L990-F1002 HydrophobicContact CD1-CE1 3.72Å; L990-F1002 HydrophobicContact CD1-CZ 3.71Å; A993-F1002 HydrophobicContact CB-CB 4.36Å; A993-F1002 HydrophobicContact CB-CD1 4.16Å; A993-F1002 HydrophobicContact CB-CD2 3.93Å; A993-F1002 HydrophobicContact CB-CE1 4.49Å; A993-F1002 HydrophobicContact CB-CE2 4.28Å; A993-F1002 HydrophobicContact CB-CG 3.88Å; L998-F1002 PolarHBondContact O-N 2.86Å; F1002-E1004 PolarHBondContact O-N 2.95Å; F1002-L1005 WeakPolarHBondContact O-CB 3.39Å; F1002-L1005 PolarHBondContact O-N 2.81Å; F1002-C1006 VanDerWaalsContact CZ-SG 3.59Å; F1002-C1006 PolarHBondContact O-N 2.83Å; F1002-C1006 PolarHBondContact O-SG 2.85Å; F1002-L1028 HydrophobicContact CD1-CD2 3.68Å; F1002-L1028 HydrophobicContact CE1-CD2 4.01Å
1003	L	87.8	Confident	86	Confident	6 Å²	6	29 Å²	29	3%	0.031	16%	0.156	C	C	.	.	H	α-helix	trans	-62.7	-40.4	174.2	-178.8	61.8	0	0	0	112.1	W816 R999 S1001 L1005 C1006 M1007 V1029 L1033	W816-L1003 HydrophobicContact CH2-CD1 4.5Å; R999-L1003 WeakPolarHBondContact O-CB 3.01Å; R999-L1003 PolarHBondContact O-N 3.4Å; S1001-L1003 VanDerWaalsContact C-N 3.34Å; L1003-L1005 VanDerWaalsContact C-N 3.32Å; L1003-L1005 PolarHBondContact O-N 2.74Å; L1003-C1006 PolarHBondContact O-N 3.17Å; L1003-M1007 HydrophobicContact CD1-CG 4.04Å; L1003-M1007 HydrophobicContact CG-CG 4.3Å; L1003-M1007 WeakPolarHBondContact O-CB 3.34Å; L1003-M1007 WeakPolarHBondContact O-CG 3.42Å; L1003-M1007 PolarHBondContact O-N 2.88Å; L1003-V1029 HydrophobicContact CD1-CG2 3.95Å; L1003-L1033 HydrophobicContact CD2-CD2 4.36Å; L1003-L1033 HydrophobicContact CD2-CG 4.48Å
1004	E	82.8	Confident	86.2	Confident	61 Å²	61	29 Å²	29	29%	0.285	16%	0.157	S	C	.	.	H	α-helix	trans	-59.4	-42.7	173.8	-175.9	169.1	-165.6	0	0	111.8	L862 L962 D1000 S1001 F1002 M1007 S1008	L862-E1004 HydrophobicContact CD2-CB 4.28Å; L862-E1004 HydrophobicContact CD2-CG 3.93Å; L962-E1004 HydrophobicContact CD1-CB 4.36Å; L962-E1004 HydrophobicContact CD1-CG 3.82Å; L962-E1004 WeakPolarHBondContact CD1-OE1 3.15Å; D1000-E1004 PolarHBondContact O-N 2.76Å; D1000-E1004 VanDerWaalsContact O-N 3.1Å; S1001-E1004 PolarHBondContact O-N 2.99Å; F1002-E1004 PolarHBondContact O-N 2.95Å; E1004-M1007 PolarHBondContact O-N 2.99Å; E1004-S1008 WeakPolarHBondContact O-CB 3.49Å; E1004-S1008 PolarHBondContact O-N 3.18Å
1005	L	85.3	Confident	86.2	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-53.5	175.4	-178.9	63.4	0	0	0	110.6	I845 I858 Q861 L862 L865 L983 S1001 F1002 L1003 M1007 S1008 V1009	I845-L1005 HydrophobicContact CD1-CD2 3.79Å; I858-L1005 HydrophobicContact CG1-CD2 4.34Å; I858-L1005 HydrophobicContact CG2-CD2 4.39Å; Q861-L1005 HydrophobicContact CB-CD1 3.94Å; Q861-L1005 HydrophobicContact CB-CD2 4.49Å; L862-L1005 HydrophobicContact CD2-CB 3.94Å; L862-L1005 HydrophobicContact CD2-CD1 4.25Å; L862-L1005 HydrophobicContact CG-CB 4.21Å; L862-L1005 HydrophobicContact CG-CD1 4.35Å; L865-L1005 HydrophobicContact CD1-CD1 3.75Å; L983-L1005 HydrophobicContact CD1-CD2 4.42Å; L983-L1005 HydrophobicContact CD2-CD2 4.45Å; L983-L1005 HydrophobicContact CD2-CG 4.41Å; S1001-L1005 PolarHBondContact O-N 3.45Å; F1002-L1005 WeakPolarHBondContact O-CB 3.39Å; F1002-L1005 PolarHBondContact O-N 2.81Å; L1003-L1005 VanDerWaalsContact C-N 3.32Å; L1003-L1005 PolarHBondContact O-N 2.74Å; L1005-M1007 PolarHBondContact O-N 3.11Å; L1005-S1008 PolarHBondContact O-N 3.35Å; L1005-S1008 PolarHBondContact O-OG 3.08Å; L1005-V1009 WeakPolarHBondContact O-CG2 3.47Å; L1005-V1009 PolarHBondContact O-N 3.16Å
1006	C	87.4	Confident	86	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-57.4	-34.4	177.9	-63.2	0	0	0	0	113.4	W816 F1002 L1003 V1012	W816-C1006 HydrophobicContact CH2-CB 3.35Å; W816-C1006 HydrophobicContact CZ2-CB 3.72Å; W816-C1006 HydrophobicContact CZ3-CB 4.07Å; F1002-C1006 VanDerWaalsContact CZ-SG 3.59Å; F1002-C1006 PolarHBondContact O-N 2.83Å; F1002-C1006 PolarHBondContact O-SG 2.85Å; L1003-C1006 PolarHBondContact O-N 3.17Å; C1006-V1012 HydrophobicContact CB-CG2 4.18Å
1007	M	82.2	Confident	86	Confident	40 Å²	40	24.3 Å²	24.3	20%	0.197	12%	0.123	C	C	.	.	H	α-helix	trans	-79.6	-16.4	178.9	-71	-65.1	-61.8	0	0	114	F455 L1003 E1004 L1005 L1033	F455-M1007 HydrophobicContact CE1-SD 3.97Å; F455-M1007 HydrophobicContact CZ-CE 3.98Å; F455-M1007 HydrophobicContact CZ-SD 3.64Å; L1003-M1007 HydrophobicContact CD1-CG 4.04Å; L1003-M1007 HydrophobicContact CG-CG 4.3Å; L1003-M1007 WeakPolarHBondContact O-CB 3.34Å; L1003-M1007 WeakPolarHBondContact O-CG 3.42Å; L1003-M1007 PolarHBondContact O-N 2.88Å; E1004-M1007 PolarHBondContact O-N 2.99Å; L1005-M1007 PolarHBondContact O-N 3.11Å; M1007-L1033 HydrophobicContact CE-CD1 4.32Å; M1007-L1033 HydrophobicContact CE-CD2 3.97Å; M1007-L1033 HydrophobicContact CG-CD2 4.25Å; M1007-L1033 HydrophobicContact SD-CD1 4.15Å; M1007-L1033 HydrophobicContact SD-CD2 4.1Å
1008	S	75.4	Confident	85.8	Confident	19 Å²	19	24.4 Å²	24.4	13%	0.133	12%	0.12	C	C	.	.	H	α-helix	trans	-84.2	-28.3	177.1	73.5	0	0	0	0	113.2	L865 E1004 L1005	L865-S1008 WeakPolarHBondContact CD1-OG 3.43Å; E1004-S1008 WeakPolarHBondContact O-CB 3.49Å; E1004-S1008 PolarHBondContact O-N 3.18Å; L1005-S1008 PolarHBondContact O-N 3.35Å; L1005-S1008 PolarHBondContact O-OG 3.08Å
1009	V	79.1	Confident	85.4	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.006	13%	0.127	C	C	.	.	S	Bend	trans	-83.1	162.6	-179.7	177	0	0	0	0	110.8	I843 L865 I981 L983 L1005 T1011	I843-V1009 HydrophobicContact CD1-CG2 4.27Å; L865-V1009 HydrophobicContact CD1-CG2 4.35Å; I981-V1009 HydrophobicContact CG2-CG1 4.39Å; I981-V1009 HydrophobicContact CG2-CG2 4.42Å; I981-V1009 WeakPolarHBondContact O-CG1 3.47Å; L983-V1009 HydrophobicContact CB-CG1 3.83Å; L983-V1009 HydrophobicContact CB-CG2 4.38Å; L1005-V1009 WeakPolarHBondContact O-CG2 3.47Å; L1005-V1009 PolarHBondContact O-N 3.16Å; V1009-T1011 WeakPolarHBondContact CG1-O 3.23Å
1010	T	78.8	Confident	85.1	Confident	21 Å²	21	26.1 Å²	26.1	13%	0.129	14%	0.136	C	C	.	.	S	Bend	trans	-92	-38.2	-174.4	86.8	0	0	0	0	113.1	M840 P974 I981	M840-T1010 WeakPolarHBondContact CE-OG1 3.45Å; P974-T1010 WeakPolarHBondContact O-CB 3.43Å; P974-T1010 WeakPolarHBondContact O-CG2 3.3Å; I981-T1010 PolarHBondContact O-N 3.4Å; I981-T1010 PolarHBondContact O-OG1 3.25Å; I981-T1010 VanDerWaalsContact O-OG1 3.11Å
1011	T	86.4	Confident	85.3	Confident	8 Å²	8	24.4 Å²	24.4	5%	0.049	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	154.1	172.7	64.3	0	0	0	0	112.2	H835 F836 M840 G982 L983 V1009	H835-T1011 VanDerWaalsContact NE2-CB 3.33Å; H835-T1011 WeakPolarHBondContact NE2-CB 3.41Å; F836-T1011 WeakPolarHBondContact CD1-OG1 3.48Å; F836-T1011 VanDerWaalsContact CE1-OG1 3.3Å; F836-T1011 WeakPolarHBondContact CE1-OG1 3.02Å; M840-T1011 HydrophobicContact CE-CG2 4.25Å; M840-T1011 WeakPolarHBondContact CE-OG1 3.48Å; G982-T1011 WeakPolarHBondContact CA-O 3.45Å; L983-T1011 PolarHBondContact N-O 3.27Å; V1009-T1011 WeakPolarHBondContact CG1-O 3.23Å
1012	V	91.4	Very high	85.4	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	130.3	-175.8	-176.5	0	0	0	0	109.7	W816 I817 L983 C1006	W816-V1012 CarbonylContact C-O 3.57Å; W816-V1012 VanDerWaalsContact CA-O 3.31Å; W816-V1012 WeakPolarHBondContact CA-O 3.42Å; W816-V1012 HydrophobicContact CB-CB 4.36Å; W816-V1012 HydrophobicContact CD2-CB 3.7Å; W816-V1012 HydrophobicContact CD2-CG1 4.22Å; W816-V1012 HydrophobicContact CD2-CG2 3.91Å; W816-V1012 HydrophobicContact CE3-CB 4.02Å; W816-V1012 HydrophobicContact CE3-CG1 4Å; W816-V1012 HydrophobicContact CE3-CG2 4.33Å; W816-V1012 HydrophobicContact CG-CB 3.81Å; W816-V1012 HydrophobicContact CG-CG2 4.3Å; W816-V1012 HydrophobicContact CZ2-CG2 4.15Å; I817-V1012 PolarHBondContact N-O 3.08Å; L983-V1012 HydrophobicContact CB-CG1 4.5Å; L983-V1012 HydrophobicContact CB-CG2 4.43Å; L983-V1012 HydrophobicContact CD2-CG1 4.25Å; C1006-V1012 HydrophobicContact CB-CG2 4.18Å
1013	L	93.5	Very high	85.3	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.6	172.7	172.8	62.9	0	0	0	109.1	I817 T819 A826 I827 F836 L983 V984 I985 C1015	I817-L1013 HydrophobicContact CB-CD1 3.81Å; I817-L1013 HydrophobicContact CG2-CD1 3.66Å; I817-L1013 WeakPolarHBondContact O-CA 3.45Å; T819-L1013 HydrophobicContact CG2-CD1 4.46Å; A826-L1013 HydrophobicContact CB-CD1 4.03Å; A826-L1013 HydrophobicContact CB-CD2 3.94Å; A826-L1013 HydrophobicContact CB-CG 4.46Å; I827-L1013 HydrophobicContact CG1-CD2 3.91Å; F836-L1013 HydrophobicContact CE2-CB 4.28Å; F836-L1013 HydrophobicContact CE2-CD2 3.79Å; F836-L1013 HydrophobicContact CZ-CB 3.66Å; F836-L1013 HydrophobicContact CZ-CD2 4.05Å; L983-L1013 PolarHBondContact O-N 3.09Å; V984-L1013 VanDerWaalsContact CA-O 3.31Å; V984-L1013 WeakPolarHBondContact CA-O 3.41Å; V984-L1013 HydrophobicContact CG1-CD2 4.26Å; V984-L1013 HydrophobicContact CG2-CB 4.45Å; V984-L1013 HydrophobicContact CG2-CD2 4.29Å; I985-L1013 PolarHBondContact N-O 3.09Å; L1013-C1015 VanDerWaalsContact CG-SG 3.56Å
1014	C	92.4	Very high	85.4	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.007	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.5	174.8	-58	0	0	0	0	109	I817 L818 T819 I985 M1017 I1025	I817-C1014 PolarHBondContact O-N 3.1Å; L818-C1014 HydrophobicContact CD2-CB 3.7Å; T819-C1014 PolarHBondContact N-O 3.46Å; I985-C1014 HydrophobicContact CG2-CB 4.07Å; I985-C1014 WeakPolarHBondContact CG2-SG 3.46Å; I985-C1014 CarbonylContact O-C 3.46Å; I985-C1014 WeakPolarHBondContact O-CA 3.27Å; C1014-M1017 HydrophobicContact CB-CE 4.48Å; C1014-M1017 HydrophobicContact CB-CG 3.98Å; C1014-M1017 HydrophobicContact CB-SD 3.19Å; C1014-M1017 WeakPolarHBondContact CB-SD 3.47Å; C1014-I1025 HydrophobicContact CB-CD1 4.15Å; C1014-I1025 VanDerWaalsContact SG-CD1 3.53Å
1015	C	89.4	Confident	85.9	Confident	1 Å²	1	22.5 Å²	22.5	1%	0.007	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	158.5	-171.2	-50.2	0	0	0	0	111.6	T819 A823 I985 D986 G987 L1013 M1017	T819-C1015 CarbonylContact O-C 3.58Å; T819-C1015 WeakPolarHBondContact O-CA 3.49Å; A823-C1015 HydrophobicContact CB-CB 4.01Å; I985-C1015 PolarHBondContact O-N 3.2Å; D986-C1015 CarbonylContact C-O 3.52Å; D986-C1015 WeakPolarHBondContact CA-O 3.49Å; G987-C1015 PolarHBondContact N-O 3.3Å; L1013-C1015 VanDerWaalsContact CG-SG 3.56Å; C1015-M1017 PolarHBondContact O-N 2.91Å
1016	R	84.4	Confident	86.1	Confident	113 Å²	113	22.5 Å²	22.5	43%	0.426	12%	0.12	S	C	.	.	S	Bend	trans	51	38.7	-178.3	-60	-173.3	-178.8	151.8	7.1	113.6	T819 G820 D821 E824	T819-R1016 PolarHBondContact O-N 2.73Å; G820-R1016 WeakPolarHBondContact O-CA 3.43Å; D821-R1016 WeakPolarHBondContact O-CG 3.28Å; D821-R1016 PolarHBondContact O-N 3.32Å; E824-R1016 IonicContact OE2-NH2 3.15Å
1017	M	83.9	Confident	86.2	Confident	9 Å²	9	27.1 Å²	27.1	4%	0.044	14%	0.14	C	C	.	.			trans	-83.5	141.3	179.6	-65.8	-172	67.4	0	0	112.7	L818 T819 G820 L990 C1014 C1015 Q1021 K1022 I1025	L818-M1017 HydrophobicContact CB-SD 3.8Å; L818-M1017 HydrophobicContact CD1-CE 4.49Å; L818-M1017 HydrophobicContact CD2-SD 3.9Å; L818-M1017 HydrophobicContact CG-SD 4.3Å; T819-M1017 PolarHBondContact O-N 3.17Å; G820-M1017 WeakPolarHBondContact CA-O 3.31Å; L990-M1017 HydrophobicContact CD2-CE 3.64Å; L990-M1017 HydrophobicContact CD2-CG 4.26Å; L990-M1017 HydrophobicContact CD2-SD 4.33Å; C1014-M1017 HydrophobicContact CB-CE 4.48Å; C1014-M1017 HydrophobicContact CB-CG 3.98Å; C1014-M1017 HydrophobicContact CB-SD 3.19Å; C1014-M1017 WeakPolarHBondContact CB-SD 3.47Å; C1015-M1017 PolarHBondContact O-N 2.91Å; M1017-Q1021 HydrophobicContact CE-CB 3.85Å; M1017-Q1021 WeakPolarHBondContact CE-O 3.42Å; M1017-K1022 HydrophobicContact CB-CG 4.06Å; M1017-K1022 VanDerWaalsContact CE-CA 3.43Å; M1017-K1022 HydrophobicContact CE-CB 4.21Å; M1017-K1022 HydrophobicContact CE-CG 3.91Å; M1017-K1022 VanDerWaalsContact CE-N 3.33Å; M1017-K1022 HydrophobicContact SD-CG 4.26Å; M1017-I1025 HydrophobicContact CE-CD1 3.51Å; M1017-I1025 HydrophobicContact CE-CG1 3.9Å; M1017-I1025 HydrophobicContact SD-CD1 4.09Å
1018	T	82.6	Confident	86.6	Confident	71 Å²	71	26 Å²	26	44%	0.436	14%	0.135	S	C	.	.			trans	-80.5	157.2	164.5	64.8	0	0	0	0	111.8	L1020 Q1021 K1022	T1018-L1020 VanDerWaalsContact C-N 3.27Å; T1018-L1020 PolarHBondContact O-N 3.47Å; T1018-Q1021 VanDerWaalsContact N-OE1 3.13Å; T1018-Q1021 WeakPolarHBondContact O-CA 3.3Å; T1018-Q1021 WeakPolarHBondContact O-CB 3.24Å; T1018-Q1021 PolarHBondContact O-N 3.35Å; T1018-Q1021 VanDerWaalsContact OG1-CG 3.3Å; T1018-Q1021 WeakPolarHBondContact OG1-CG 3.47Å; T1018-Q1021 PolarHBondContact OG1-N 3.37Å; T1018-K1022 PolarHBondContact O-N 2.87Å
1019	P	80.1	Confident	87.2	Confident	26 Å²	26	25.1 Å²	25.1	17%	0.169	13%	0.129	C	C	.	.	H	α-helix	trans	-49.6	-43.6	174.7	-34.8	40.8	0	0	0	114.2	Q1021 K1022 A1023 N1053 A1056	P1019-Q1021 VanDerWaalsContact C-N 3.34Å; P1019-Q1021 PolarHBondContact O-N 3.36Å; P1019-K1022 WeakPolarHBondContact O-CB 3.4Å; P1019-K1022 PolarHBondContact O-N 3.38Å; P1019-A1023 PolarHBondContact O-N 2.91Å; P1019-A1023 VanDerWaalsContact O-N 3.09Å; P1019-N1053 WeakPolarHBondContact CB-O 3.49Å; P1019-N1053 HydrophobicContact CG-CB 4.33Å; P1019-N1053 WeakPolarHBondContact CG-OD1 3.43Å; P1019-A1056 HydrophobicContact CB-CB 4.41Å
1020	L	82.4	Confident	87.4	Confident	88 Å²	88	27 Å²	27	46%	0.461	14%	0.138	S	C	.	.	H	α-helix	trans	-66.4	-34.7	177.7	-174.5	63.4	0	0	0	112.2	T1018 S1024	T1018-L1020 VanDerWaalsContact C-N 3.27Å; T1018-L1020 PolarHBondContact O-N 3.47Å; L1020-S1024 VanDerWaalsContact O-CB 3.31Å; L1020-S1024 WeakPolarHBondContact O-CB 3.33Å; L1020-S1024 PolarHBondContact O-N 3.15Å; L1020-S1024 PolarHBondContact O-OG 2.74Å
1021	Q	88.5	Confident	87.5	Confident	24 Å²	24	29.8 Å²	29.8	11%	0.112	15%	0.151	C	C	.	.	H	α-helix	trans	-67.9	-37.6	172.2	-73.6	174.8	-18.2	0	0	111.8	G987 L990 M1017 T1018 P1019 S1024 I1025	G987-Q1021 PolarHBondContact O-NE2 3.05Å; L990-Q1021 HydrophobicContact CD2-CB 4.15Å; M1017-Q1021 HydrophobicContact CE-CB 3.85Å; M1017-Q1021 WeakPolarHBondContact CE-O 3.42Å; T1018-Q1021 VanDerWaalsContact N-OE1 3.13Å; T1018-Q1021 WeakPolarHBondContact O-CA 3.3Å; T1018-Q1021 WeakPolarHBondContact O-CB 3.24Å; T1018-Q1021 PolarHBondContact O-N 3.35Å; T1018-Q1021 VanDerWaalsContact OG1-CG 3.3Å; T1018-Q1021 WeakPolarHBondContact OG1-CG 3.47Å; T1018-Q1021 PolarHBondContact OG1-N 3.37Å; P1019-Q1021 VanDerWaalsContact C-N 3.34Å; P1019-Q1021 PolarHBondContact O-N 3.36Å; Q1021-S1024 WeakPolarHBondContact O-CB 3.18Å; Q1021-S1024 PolarHBondContact O-N 2.93Å; Q1021-S1024 VanDerWaalsContact O-N 3.14Å; Q1021-I1025 PolarHBondContact O-N 3.18Å
1022	K	89.4	Confident	87.1	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.3	-51	176	-62.5	-168.4	-170.1	-174.3	0	110.6	D459 L818 M1017 T1018 P1019 S1024 I1025 V1026 D1054 M1057	D459-K1022 VanDerWaalsContact CG-NZ 3.35Å; D459-K1022 IonicContact OD1-NZ 3.46Å; D459-K1022 PolarHBondContact OD1-NZ 2.95Å; L818-K1022 HydrophobicContact CB-CD 4.42Å; L818-K1022 HydrophobicContact CB-CG 4.31Å; L818-K1022 HydrophobicContact CD1-CB 4.45Å; L818-K1022 VanDerWaalsContact O-CE 3.24Å; L818-K1022 WeakPolarHBondContact O-CE 3.43Å; L818-K1022 PolarHBondContact O-NZ 3.36Å; M1017-K1022 HydrophobicContact CB-CG 4.06Å; M1017-K1022 VanDerWaalsContact CE-CA 3.43Å; M1017-K1022 HydrophobicContact CE-CB 4.21Å; M1017-K1022 HydrophobicContact CE-CG 3.91Å; M1017-K1022 VanDerWaalsContact CE-N 3.33Å; M1017-K1022 HydrophobicContact SD-CG 4.26Å; T1018-K1022 PolarHBondContact O-N 2.87Å; P1019-K1022 WeakPolarHBondContact O-CB 3.4Å; P1019-K1022 PolarHBondContact O-N 3.38Å; K1022-S1024 VanDerWaalsContact C-N 3.27Å; K1022-S1024 PolarHBondContact O-N 3.21Å; K1022-I1025 PolarHBondContact O-N 3.29Å; K1022-V1026 PolarHBondContact O-N 3.49Å; K1022-D1054 WeakPolarHBondContact CD-OD1 3.2Å; K1022-D1054 IonicContact NZ-OD1 2.86Å; K1022-D1054 PolarHBondContact NZ-OD1 3.33Å; K1022-D1054 IonicContact NZ-OD2 2.82Å; K1022-M1057 HydrophobicContact CB-CB 4Å; K1022-M1057 HydrophobicContact CB-CG 4.17Å; K1022-M1057 HydrophobicContact CB-SD 4.12Å; K1022-M1057 HydrophobicContact CD-SD 4.2Å
1023	A	88.4	Confident	86.3	Confident	6 Å²	6	30.3 Å²	30.3	5%	0.05	15%	0.154	C	C	.	.	H	α-helix	trans	-57.7	-38.8	173	0	0	0	0	0	112.5	P1019 V1026 K1027 A1056 Q1060	P1019-A1023 PolarHBondContact O-N 2.91Å; P1019-A1023 VanDerWaalsContact O-N 3.09Å; A1023-V1026 PolarHBondContact O-N 2.92Å; A1023-K1027 WeakPolarHBondContact O-CB 3.48Å; A1023-K1027 PolarHBondContact O-N 3.21Å; A1023-A1056 HydrophobicContact CB-CB 4.13Å; A1023-A1056 WeakPolarHBondContact CB-O 3.34Å; A1023-Q1060 HydrophobicContact CB-CB 4.21Å; A1023-Q1060 HydrophobicContact CB-CG 4.34Å; A1023-Q1060 WeakPolarHBondContact O-CG 3.46Å
1024	S	90.1	Very high	85.2	Confident	41 Å²	41	31.6 Å²	31.6	29%	0.287	17%	0.165	S	C	.	.	H	α-helix	trans	-66.9	-34.9	179.4	-62.5	0	0	0	0	113.5	L1020 Q1021 K1022 L1028	L1020-S1024 VanDerWaalsContact O-CB 3.31Å; L1020-S1024 WeakPolarHBondContact O-CB 3.33Å; L1020-S1024 PolarHBondContact O-N 3.15Å; L1020-S1024 PolarHBondContact O-OG 2.74Å; Q1021-S1024 WeakPolarHBondContact O-CB 3.18Å; Q1021-S1024 PolarHBondContact O-N 2.93Å; Q1021-S1024 VanDerWaalsContact O-N 3.14Å; K1022-S1024 VanDerWaalsContact C-N 3.27Å; K1022-S1024 PolarHBondContact O-N 3.21Å; S1024-L1028 WeakPolarHBondContact O-CB 3.43Å; S1024-L1028 PolarHBondContact O-N 2.71Å
1025	I	92.4	Very high	84	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-66.8	-46.8	172.1	-70	-168	0	0	0	111	F457 W816 L818 L990 C1014 M1017 Q1021 K1022 K1027 L1028 V1029	F457-I1025 HydrophobicContact CD1-CG2 4.39Å; F457-I1025 HydrophobicContact CE1-CG2 3.66Å; F457-I1025 HydrophobicContact CZ-CG2 4.28Å; W816-I1025 HydrophobicContact CE3-CG2 4.06Å; W816-I1025 HydrophobicContact CZ3-CG2 3.96Å; L818-I1025 HydrophobicContact CD1-CB 4.17Å; L818-I1025 HydrophobicContact CD1-CG2 4.09Å; L818-I1025 HydrophobicContact CD2-CD1 3.96Å; L818-I1025 HydrophobicContact CD2-CG2 4.24Å; L990-I1025 HydrophobicContact CD1-CD1 3.79Å; L990-I1025 HydrophobicContact CD1-CG1 4.15Å; L990-I1025 HydrophobicContact CD2-CD1 3.72Å; L990-I1025 HydrophobicContact CD2-CG1 4.13Å; L990-I1025 HydrophobicContact CG-CD1 4.41Å; C1014-I1025 HydrophobicContact CB-CD1 4.15Å; C1014-I1025 VanDerWaalsContact SG-CD1 3.53Å; M1017-I1025 HydrophobicContact CE-CD1 3.51Å; M1017-I1025 HydrophobicContact CE-CG1 3.9Å; M1017-I1025 HydrophobicContact SD-CD1 4.09Å; Q1021-I1025 PolarHBondContact O-N 3.18Å; K1022-I1025 PolarHBondContact O-N 3.29Å; I1025-K1027 VanDerWaalsContact C-N 3.27Å; I1025-K1027 PolarHBondContact O-N 3.47Å; I1025-L1028 WeakPolarHBondContact O-CB 3.25Å; I1025-L1028 PolarHBondContact O-N 3.29Å; I1025-L1028 VanDerWaalsContact O-N 3.11Å; I1025-V1029 PolarHBondContact O-N 2.86Å
1026	V	91	Very high	82.4	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-54.7	-47.5	176.2	173.3	0	0	0	0	110.2	F457 K1022 A1023 V1029 Q1030 I1045 M1057 Q1060 A1061	F457-V1026 HydrophobicContact CB-CG2 4.43Å; F457-V1026 HydrophobicContact CD2-CG2 3.82Å; F457-V1026 HydrophobicContact CE2-CG2 4.18Å; F457-V1026 HydrophobicContact CG-CG2 3.99Å; K1022-V1026 PolarHBondContact O-N 3.49Å; A1023-V1026 PolarHBondContact O-N 2.92Å; V1026-V1029 PolarHBondContact O-N 3.49Å; V1026-Q1030 WeakPolarHBondContact O-CB 3.39Å; V1026-Q1030 PolarHBondContact O-N 3.25Å; V1026-I1045 HydrophobicContact CG1-CG2 4.03Å; V1026-M1057 HydrophobicContact CG2-CG 3.65Å; V1026-Q1060 HydrophobicContact CB-CG 4.2Å; V1026-Q1060 HydrophobicContact CG1-CB 4.28Å; V1026-Q1060 HydrophobicContact CG1-CG 3.98Å; V1026-A1061 HydrophobicContact CG1-CB 4.05Å
1027	K	89.3	Confident	81	Confident	99 Å²	99	35.5 Å²	35.5	43%	0.43	19%	0.189	S	C	.	.	H	α-helix	trans	-64.9	-37.3	177.2	-170.6	174.9	-174.5	171.4	0	113.3	A1023 I1025 I1031 Q1060	A1023-K1027 WeakPolarHBondContact O-CB 3.48Å; A1023-K1027 PolarHBondContact O-N 3.21Å; I1025-K1027 VanDerWaalsContact C-N 3.27Å; I1025-K1027 PolarHBondContact O-N 3.47Å; K1027-I1031 HydrophobicContact CD-CD1 4.42Å; K1027-I1031 HydrophobicContact CG-CD1 3.68Å; K1027-I1031 HydrophobicContact CG-CG1 4.32Å; K1027-I1031 WeakPolarHBondContact O-CB 3.45Å; K1027-I1031 WeakPolarHBondContact O-CG1 3.08Å; K1027-I1031 PolarHBondContact O-N 2.71Å; K1027-Q1060 HydrophobicContact CB-CG 4.05Å
1028	L	89.5	Confident	79.2	Confident	18 Å²	18	44.4 Å²	44.4	9%	0.094	22%	0.222	C	C	.	.	H	α-helix	trans	-60.6	-50.6	175.1	174.4	64.5	0	0	0	110.9	L994 R999 F1002 S1024 I1025 G1032	L994-L1028 HydrophobicContact CD2-CB 4.46Å; L994-L1028 HydrophobicContact CD2-CD2 3.87Å; R999-L1028 HydrophobicContact CB-CD1 3.8Å; R999-L1028 HydrophobicContact CG-CD1 4.13Å; F1002-L1028 HydrophobicContact CD1-CD2 3.68Å; F1002-L1028 HydrophobicContact CE1-CD2 4.01Å; S1024-L1028 WeakPolarHBondContact O-CB 3.43Å; S1024-L1028 PolarHBondContact O-N 2.71Å; I1025-L1028 WeakPolarHBondContact O-CB 3.25Å; I1025-L1028 PolarHBondContact O-N 3.29Å; I1025-L1028 VanDerWaalsContact O-N 3.11Å; L1028-G1032 WeakPolarHBondContact O-CA 3.37Å; L1028-G1032 PolarHBondContact O-N 2.67Å
1029	V	87.7	Confident	77.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-41.2	-179.3	177.5	0	0	0	0	110.5	F455 F457 W816 L1003 I1025 V1026 L1033 I1045	F455-V1029 HydrophobicContact CD1-CG1 4.37Å; F455-V1029 HydrophobicContact CD2-CG1 4.19Å; F455-V1029 HydrophobicContact CE1-CG1 4.44Å; F455-V1029 HydrophobicContact CE2-CG1 4.26Å; F455-V1029 HydrophobicContact CG-CG1 4.25Å; F455-V1029 HydrophobicContact CZ-CG1 4.39Å; F457-V1029 HydrophobicContact CZ-CB 4.07Å; F457-V1029 HydrophobicContact CZ-CG1 4.37Å; F457-V1029 HydrophobicContact CZ-CG2 3.89Å; W816-V1029 HydrophobicContact CH2-CG2 3.52Å; W816-V1029 HydrophobicContact CZ2-CG2 4.34Å; W816-V1029 HydrophobicContact CZ3-CG2 3.69Å; L1003-V1029 HydrophobicContact CD1-CG2 3.95Å; I1025-V1029 PolarHBondContact O-N 2.86Å; V1026-V1029 PolarHBondContact O-N 3.49Å; V1029-L1033 HydrophobicContact CG1-CD1 3.64Å; V1029-L1033 HydrophobicContact CG1-CG 4.33Å; V1029-L1033 WeakPolarHBondContact O-CB 3.32Å; V1029-L1033 WeakPolarHBondContact O-CG 3.35Å; V1029-L1033 PolarHBondContact O-N 3.16Å; V1029-L1033 VanDerWaalsContact O-N 3.16Å; V1029-I1045 HydrophobicContact CB-CD1 4.33Å; V1029-I1045 HydrophobicContact CG1-CD1 4.09Å
1030	Q	83.5	Confident	76.3	Confident	41 Å²	41	52.1 Å²	52.1	19%	0.192	27%	0.265	C	S	.	.	H	α-helix	trans	-62.4	-48.4	178.1	-162.5	-176.6	51.8	0	0	112.7	V1026 A1034 I1045 N1062	V1026-Q1030 WeakPolarHBondContact O-CB 3.39Å; V1026-Q1030 PolarHBondContact O-N 3.25Å; Q1030-A1034 VanDerWaalsContact O-CB 3.23Å; Q1030-A1034 WeakPolarHBondContact O-CB 3.46Å; Q1030-A1034 PolarHBondContact O-N 3.3Å; Q1030-I1045 HydrophobicContact CB-CD1 3.59Å; Q1030-I1045 HydrophobicContact CG-CD1 4.04Å; Q1030-N1062 PolarHBondContact NE2-OD1 3.21Å
1031	I	82.2	Confident	75.2	Confident	79 Å²	79	51 Å²	51	41%	0.405	26%	0.258	S	S	.	.	H	α-helix	trans	-79.1	-43.7	-177.7	-64.8	177.5	0	0	0	111.4	K1027 A1034 K1035	K1027-I1031 HydrophobicContact CD-CD1 4.42Å; K1027-I1031 HydrophobicContact CG-CD1 3.68Å; K1027-I1031 HydrophobicContact CG-CG1 4.32Å; K1027-I1031 WeakPolarHBondContact O-CB 3.45Å; K1027-I1031 WeakPolarHBondContact O-CG1 3.08Å; K1027-I1031 PolarHBondContact O-N 2.71Å; I1031-A1034 PolarHBondContact O-N 3.09Å; I1031-K1035 WeakPolarHBondContact O-CG 3.4Å; I1031-K1035 PolarHBondContact O-N 2.66Å; I1031-K1035 VanDerWaalsContact O-N 3.08Å
1032	G	76.1	Confident	74.3	Confident	2 Å²	2	56 Å²	56	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-49.2	-176.4	0	0	0	0	0	111.9	L1028 A1034 K1035 H1036	L1028-G1032 WeakPolarHBondContact O-CA 3.37Å; L1028-G1032 PolarHBondContact O-N 2.67Å; G1032-A1034 VanDerWaalsContact C-N 3.3Å; G1032-A1034 PolarHBondContact O-N 3.04Å; G1032-K1035 PolarHBondContact O-N 3.19Å; G1032-H1036 PolarHBondContact O-CD2 2.84Å
1033	L	75.3	Confident	73.9	Confident	17 Å²	17	56.7 Å²	56.7	9%	0.089	28%	0.284	C	S	.	.	H	α-helix	trans	-66.7	-32.1	177.5	-62.4	-179.8	0	0	0	112.4	F455 L1003 M1007 V1029 K1035 H1036 S1037 P1043	F455-L1033 HydrophobicContact CD2-CD1 4.39Å; F455-L1033 HydrophobicContact CE2-CD1 3.44Å; F455-L1033 VanDerWaalsContact CE2-CD1 3.44Å; F455-L1033 HydrophobicContact CZ-CD1 3.66Å; L1003-L1033 HydrophobicContact CD2-CD2 4.36Å; L1003-L1033 HydrophobicContact CD2-CG 4.48Å; M1007-L1033 HydrophobicContact CE-CD1 4.32Å; M1007-L1033 HydrophobicContact CE-CD2 3.97Å; M1007-L1033 HydrophobicContact CG-CD2 4.25Å; M1007-L1033 HydrophobicContact SD-CD1 4.15Å; M1007-L1033 HydrophobicContact SD-CD2 4.1Å; V1029-L1033 HydrophobicContact CG1-CD1 3.64Å; V1029-L1033 HydrophobicContact CG1-CG 4.33Å; V1029-L1033 WeakPolarHBondContact O-CB 3.32Å; V1029-L1033 WeakPolarHBondContact O-CG 3.35Å; V1029-L1033 PolarHBondContact O-N 3.16Å; V1029-L1033 VanDerWaalsContact O-N 3.16Å; L1033-K1035 PolarHBondContact O-N 3.26Å; L1033-H1036 PolarHBondContact O-N 3.17Å; L1033-S1037 PolarHBondContact O-N 3.25Å; L1033-S1037 PolarHBondContact O-OG 2.88Å; L1033-P1043 HydrophobicContact CB-CG 3.84Å; L1033-P1043 HydrophobicContact CD1-CG 3.74Å; L1033-P1043 HydrophobicContact CG-CG 4.44Å
1034	A	71.1	Confident	73.8	Confident	27 Å²	27	56.6 Å²	56.6	22%	0.223	28%	0.283	C	S	.	.	H	α-helix	trans	-66.3	-31.2	174.8	0	0	0	0	0	114.1	Q1030 I1031 G1032 S1037 K1042	Q1030-A1034 VanDerWaalsContact O-CB 3.23Å; Q1030-A1034 WeakPolarHBondContact O-CB 3.46Å; Q1030-A1034 PolarHBondContact O-N 3.3Å; I1031-A1034 PolarHBondContact O-N 3.09Å; G1032-A1034 VanDerWaalsContact C-N 3.3Å; G1032-A1034 PolarHBondContact O-N 3.04Å; A1034-S1037 PolarHBondContact O-OG 2.96Å; A1034-K1042 HydrophobicContact CB-CD 4.03Å; A1034-K1042 HydrophobicContact CB-CG 3.76Å
1035	K	65.8	Low	73.9	Confident	109 Å²	109	54.7 Å²	54.7	47%	0.474	27%	0.269	S	S	.	.	H	α-helix	trans	-68.5	-36.7	177.8	-76.4	176.9	177.8	-179.8	0	113	I1031 G1032 L1033	I1031-K1035 WeakPolarHBondContact O-CG 3.4Å; I1031-K1035 PolarHBondContact O-N 2.66Å; I1031-K1035 VanDerWaalsContact O-N 3.08Å; G1032-K1035 PolarHBondContact O-N 3.19Å; L1033-K1035 PolarHBondContact O-N 3.26Å
1036	H	56.5	Low	74	Confident	58 Å²	58	54.6 Å²	54.6	27%	0.269	27%	0.269	S	S	.	.	H	α-helix	trans	-83	-22.9	-176.7	-65.8	-68.7	0	0	0	112.6	L962 N963 I966 G1032 L1033 R1038	L962-H1036 HydrophobicContact CD2-CB 4.41Å; L962-H1036 VanDerWaalsContact CD2-CD2 3.5Å; L962-H1036 WeakPolarHBondContact CD2-CD2 3.17Å; N963-H1036 PolarHBondContact OD1-O 3.47Å; I966-H1036 HydrophobicContact CD1-CB 4.42Å; G1032-H1036 PolarHBondContact O-CD2 2.84Å; L1033-H1036 PolarHBondContact O-N 3.17Å; H1036-R1038 PolarHBondContact O-N 3.5Å
1037	S	54.8	Low	74.2	Confident	29 Å²	29	54.6 Å²	54.6	20%	0.203	27%	0.269	C	S	.	.			trans	-80.6	60.4	-178.8	67.3	0	0	0	0	113	L1033 A1034 L1039 S1040	L1033-S1037 PolarHBondContact O-N 3.25Å; L1033-S1037 PolarHBondContact O-OG 2.88Å; A1034-S1037 PolarHBondContact O-OG 2.96Å; S1037-L1039 PolarHBondContact O-N 2.98Å; S1037-S1040 WeakPolarHBondContact CB-O 3.47Å; S1037-S1040 PolarHBondContact O-N 3.39Å; S1037-S1040 VanDerWaalsContact O-O 3.07Å; S1037-S1040 PolarHBondContact OG-O 3.24Å
1038	R	46.9	Very low	74.5	Confident	196 Å²	196	49.9 Å²	49.9	74%	0.74	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.3	-25.5	-175.7	-79.7	-170.3	178.6	176.2	-0.7	116.4	H1036	H1036-R1038 PolarHBondContact O-N 3.5Å
1039	L	49.1	Very low	74.5	Confident	175 Å²	175	49 Å²	49	92%	0.916	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-147.7	29.7	175	-140.8	80.6	0	0	0	111.1	S1037	S1037-L1039 PolarHBondContact O-N 2.98Å
1040	S	51.5	Low	74.4	Confident	84 Å²	84	49.2 Å²	49.2	59%	0.587	25%	0.245	S	C	*	.	S	Bend	trans	-136.8	151.8	-175.5	-62.9	0	0	0	0	110.2	S1037	S1037-S1040 WeakPolarHBondContact CB-O 3.47Å; S1037-S1040 PolarHBondContact O-N 3.39Å; S1037-S1040 VanDerWaalsContact O-O 3.07Å; S1037-S1040 PolarHBondContact OG-O 3.24Å
1041	M	60.2	Low	73.9	Confident	66 Å²	66	47.4 Å²	47.4	33%	0.325	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-71.9	149	-164.7	-52.8	-163.1	76.1	0	0	112.6	L343 Q1182	L343-M1041 HydrophobicContact CB-CE 3.61Å; L343-M1041 HydrophobicContact CD1-CE 3.51Å; L343-M1041 HydrophobicContact CD1-SD 3.6Å; L343-M1041 VanDerWaalsContact CD1-SD 3.6Å; L343-M1041 HydrophobicContact CG-CE 4.16Å; M1041-Q1182 VanDerWaalsContact CE-CD 3.44Å; M1041-Q1182 HydrophobicContact CE-CG 4.44Å; M1041-Q1182 VanDerWaalsContact CE-NE2 3.28Å; M1041-Q1182 HydrophobicContact SD-CB 4.01Å; M1041-Q1182 HydrophobicContact SD-CG 3.71Å; M1041-Q1182 PolarHBondContact SD-OE1 3.4Å; M1041-Q1182 VanDerWaalsContact SD-OE1 3.33Å
1042	K	70.6	Confident	73.3	Confident	127 Å²	127	44.2 Å²	44.2	55%	0.552	22%	0.224	S	C	*	.	P	Polyproline II helix	trans	-58.2	132.5	168.6	-58.3	-172.5	-178.9	172.1	0	108.2	A1034	A1034-K1042 HydrophobicContact CB-CD 4.03Å; A1034-K1042 HydrophobicContact CB-CG 3.76Å
1043	P	79.2	Confident	73.3	Confident	16 Å²	16	45 Å²	45	10%	0.104	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-68.6	136.3	177.7	28.9	-33.3	0	0	0	109.9	K454 F455 L1033	K454-P1043 HydrophobicContact CB-CB 4.31Å; K454-P1043 HydrophobicContact CD-CB 4.06Å; F455-P1043 HydrophobicContact CD2-CB 4.15Å; F455-P1043 HydrophobicContact CD2-CG 4.49Å; F455-P1043 HydrophobicContact CE2-CB 4.12Å; F455-P1043 HydrophobicContact CE2-CG 4.32Å; L1033-P1043 HydrophobicContact CB-CG 3.84Å; L1033-P1043 HydrophobicContact CD1-CG 3.74Å; L1033-P1043 HydrophobicContact CG-CG 4.44Å
1044	V	88	Confident	73.6	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.024	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	130.5	174.1	-177.8	0	0	0	0	109.1	T339 E449 Q452 I453 K454 F455 N1062 I1063	T339-V1044 HydrophobicContact CG2-CG2 3.85Å; E449-V1044 HydrophobicContact CB-CG1 4.35Å; E449-V1044 WeakPolarHBondContact OE2-CG1 3.4Å; E449-V1044 VanDerWaalsContact OE2-CG2 3.31Å; E449-V1044 WeakPolarHBondContact OE2-CG2 3.37Å; Q452-V1044 HydrophobicContact CB-CB 4.27Å; Q452-V1044 HydrophobicContact CB-CG2 3.68Å; Q452-V1044 WeakPolarHBondContact O-CB 3.14Å; I453-V1044 HydrophobicContact CG1-CG1 4.28Å; K454-V1044 PolarHBondContact N-O 3.37Å; F455-V1044 PolarHBondContact N-O 3.36Å; V1044-N1062 HydrophobicContact CG1-CB 4.09Å; V1044-I1063 HydrophobicContact CG1-CD1 4.16Å; V1044-I1063 HydrophobicContact CG1-CG1 4.35Å
1045	I	92.2	Very high	74.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.6	-176.7	-68.7	164.7	0	0	0	108.8	F455 F457 V1026 V1029 Q1030 A1061 N1062 I1063	F455-I1045 HydrophobicContact CB-CG1 4.14Å; F457-I1045 HydrophobicContact CD2-CG2 3.5Å; F457-I1045 VanDerWaalsContact CD2-CG2 3.5Å; F457-I1045 HydrophobicContact CE2-CG1 4.45Å; F457-I1045 HydrophobicContact CE2-CG2 3.4Å; V1026-I1045 HydrophobicContact CG1-CG2 4.03Å; V1029-I1045 HydrophobicContact CB-CD1 4.33Å; V1029-I1045 HydrophobicContact CG1-CD1 4.09Å; Q1030-I1045 HydrophobicContact CB-CD1 3.59Å; Q1030-I1045 HydrophobicContact CG-CD1 4.04Å; I1045-A1061 HydrophobicContact CG2-CB 4.16Å; I1045-N1062 WeakPolarHBondContact O-CA 3.41Å; I1045-N1062 WeakPolarHBondContact O-CB 3.49Å; I1045-N1062 PolarHBondContact O-N 3.46Å; I1045-I1063 PolarHBondContact O-N 3.08Å; I1045-I1063 VanDerWaalsContact O-N 3.07Å
1046	A	94.5	Very high	74.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	147.6	168.5	0	0	0	0	0	110.8	I453 F455 L456 F457 I1063 F1093	I453-A1046 HydrophobicContact CD1-CB 3.94Å; I453-A1046 HydrophobicContact CG1-CB 4.25Å; I453-A1046 HydrophobicContact CG2-CB 3.78Å; F455-A1046 PolarHBondContact O-N 3.1Å; L456-A1046 WeakPolarHBondContact CA-O 3.16Å; L456-A1046 HydrophobicContact CD1-CB 3.77Å; F457-A1046 PolarHBondContact N-O 3.22Å; A1046-I1063 CarbonylContact C-O 3.58Å; A1046-I1063 VanDerWaalsContact CA-O 3.28Å; A1046-I1063 WeakPolarHBondContact CA-O 3.44Å; A1046-I1063 HydrophobicContact CB-CB 4.29Å; A1046-F1093 HydrophobicContact CB-CE2 4.45Å; A1046-F1093 HydrophobicContact CB-CZ 4.04Å
1047	A	94.9	Very high	76.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	140.3	171.2	0	0	0	0	0	110.9	F457 M1057 A1061 I1063 V1065	F457-A1047 HydrophobicContact CB-CB 4.34Å; F457-A1047 CarbonylContact O-C 3.56Å; F457-A1047 VanDerWaalsContact O-CA 3.26Å; F457-A1047 WeakPolarHBondContact O-CA 3.44Å; A1047-M1057 HydrophobicContact CB-CE 4.31Å; A1047-M1057 HydrophobicContact CB-CG 3.88Å; A1047-M1057 HydrophobicContact CB-SD 4.44Å; A1047-A1061 HydrophobicContact CB-CB 3.53Å; A1047-I1063 PolarHBondContact N-O 3.16Å; A1047-V1065 PolarHBondContact O-N 3.12Å
1048	V	94.8	Very high	78	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	131.9	-177.3	-172.6	0	0	0	0	109.7	L456 F457 D459 T463 M1057 V1065 V1067 F1086 I1089	L456-V1048 HydrophobicContact CD1-CG2 3.58Å; L456-V1048 HydrophobicContact CG-CG2 4.49Å; F457-V1048 PolarHBondContact O-N 3.09Å; D459-V1048 PolarHBondContact N-O 2.98Å; T463-V1048 HydrophobicContact CG2-CB 4.37Å; T463-V1048 HydrophobicContact CG2-CG1 3.67Å; V1048-M1057 VanDerWaalsContact O-CE 3.3Å; V1048-M1057 WeakPolarHBondContact O-CE 3.28Å; V1048-V1065 VanDerWaalsContact CA-O 3.32Å; V1048-V1065 WeakPolarHBondContact CA-O 3.22Å; V1048-V1065 HydrophobicContact CG1-CG1 4.5Å; V1048-V1065 HydrophobicContact CG2-CB 4.1Å; V1048-V1067 HydrophobicContact CG1-CG2 3.61Å; V1048-F1086 HydrophobicContact CG1-CD2 4.28Å; V1048-F1086 HydrophobicContact CG1-CE2 4.24Å; V1048-I1089 HydrophobicContact CB-CD1 4.48Å; V1048-I1089 HydrophobicContact CG1-CD1 3.75Å; V1048-I1089 HydrophobicContact CG2-CD1 3.86Å
1049	G	90.1	Very high	79.8	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	168	173.4	0	0	0	0	0	111.8	T463 V1065 G1066 V1067	T463-G1049 VanDerWaalsContact OG1-CA 3.28Å; T463-G1049 WeakPolarHBondContact OG1-CA 3.17Å; G1049-V1065 PolarHBondContact N-O 2.88Å; G1049-G1066 CarbonylContact O-C 3.58Å; G1049-G1066 VanDerWaalsContact O-CA 3.3Å; G1049-G1066 WeakPolarHBondContact O-CA 3.24Å; G1049-V1067 PolarHBondContact O-N 3.27Å
1050	D	85.3	Confident	81.7	Confident	3 Å²	3	20.4 Å²	20.4	2%	0.016	11%	0.113	C	C	.	.	S	Bend	trans	-121.8	-34.2	179	63.9	-53.3	0	0	0	113.2	G462 T463 V1067 A1075	G462-D1050 VanDerWaalsContact CA-OD2 3.31Å; G462-D1050 WeakPolarHBondContact CA-OD2 3.26Å; T463-D1050 PolarHBondContact N-OD1 2.68Å; T463-D1050 PolarHBondContact OG1-N 3.04Å; T463-D1050 PolarHBondContact OG1-OD1 3.22Å; D1050-V1067 WeakPolarHBondContact CA-O 3.39Å; D1050-V1067 HydrophobicContact CB-CB 4.15Å; D1050-V1067 WeakPolarHBondContact CB-O 3.43Å; D1050-A1075 WeakPolarHBondContact O-CB 3.42Å
1051	G	73.6	Confident	83.6	Confident	3 Å²	3	16.5 Å²	16.5	3%	0.031	9%	0.086	C	C	.	.	S	Bend	trans	-87.5	164.6	179.7	0	0	0	0	0	115.2	N1053 D1054	G1051-N1053 PolarHBondContact O-N 3.08Å; G1051-D1054 PolarHBondContact O-N 3.45Å
1052	G	68.3	Low	85	Confident	12 Å²	12	14.6 Å²	14.6	12%	0.124	8%	0.077	C	C	.	.	H	α-helix	trans	-60.9	-26	177.7	0	0	0	0	0	114.4	N184 D1054 V1055	N184-G1052 VanDerWaalsContact O-CA 3.3Å; N184-G1052 WeakPolarHBondContact O-CA 3.31Å; G1052-D1054 PolarHBondContact O-N 3.19Å; G1052-D1054 VanDerWaalsContact O-N 3.14Å; G1052-V1055 WeakPolarHBondContact O-CB 3.29Å; G1052-V1055 WeakPolarHBondContact O-CG2 3.49Å; G1052-V1055 PolarHBondContact O-N 3.25Å
1053	N	75.9	Confident	86	Confident	20 Å²	20	8.5 Å²	8.5	11%	0.107	5%	0.051	C	C	.	.	H	α-helix	trans	-45.9	-38.9	168.3	-100.8	-13.4	0	0	0	113.6	L185 D186 P1019 G1051	L185-N1053 PolarHBondContact O-OD1 2.97Å; D186-N1053 VanDerWaalsContact C-CG 3.49Å; D186-N1053 WeakPolarHBondContact CA-OD1 3.36Å; D186-N1053 PolarHBondContact O-ND2 3.19Å; P1019-N1053 WeakPolarHBondContact CB-O 3.49Å; P1019-N1053 HydrophobicContact CG-CB 4.33Å; P1019-N1053 WeakPolarHBondContact CG-OD1 3.43Å; G1051-N1053 PolarHBondContact O-N 3.08Å
1054	D	83	Confident	86.6	Confident	3 Å²	3	7.8 Å²	7.8	2%	0.016	5%	0.046	C	C	.	.	H	α-helix	trans	-93.4	-10	-169	-63.9	-52.3	0	0	0	112.8	D459 K1022 G1051 G1052 A1056 M1057 I1058	D459-D1054 WeakPolarHBondContact CB-OD2 3.23Å; K1022-D1054 WeakPolarHBondContact CD-OD1 3.2Å; K1022-D1054 IonicContact NZ-OD1 2.86Å; K1022-D1054 PolarHBondContact NZ-OD1 3.33Å; K1022-D1054 IonicContact NZ-OD2 2.82Å; G1051-D1054 PolarHBondContact O-N 3.45Å; G1052-D1054 PolarHBondContact O-N 3.19Å; G1052-D1054 VanDerWaalsContact O-N 3.14Å; D1054-A1056 PolarHBondContact O-N 3.34Å; D1054-M1057 HydrophobicContact CB-CE 3.99Å; D1054-M1057 CarbonylContact O-C 3.5Å; D1054-M1057 WeakPolarHBondContact O-CA 3.27Å; D1054-M1057 WeakPolarHBondContact O-CB 3.36Å; D1054-M1057 PolarHBondContact O-N 3.15Å; D1054-M1057 WeakPolarHBondContact OD1-CE 3.31Å; D1054-I1058 HydrophobicContact CB-CD1 4Å; D1054-I1058 HydrophobicContact CB-CG1 4.41Å; D1054-I1058 WeakPolarHBondContact O-CB 3.45Å; D1054-I1058 VanDerWaalsContact O-CG1 3.25Å; D1054-I1058 WeakPolarHBondContact O-CG1 3.35Å; D1054-I1058 PolarHBondContact O-N 3.45Å
1055	V	80.6	Confident	86.9	Confident	10 Å²	10	7.6 Å²	7.6	6%	0.061	5%	0.045	C	C	.	.	H	α-helix	trans	-52.8	-42.5	175.4	172.2	0	0	0	0	111.2	G1052 M1057 I1058 L1059 E1074 A1078	G1052-V1055 WeakPolarHBondContact O-CB 3.29Å; G1052-V1055 WeakPolarHBondContact O-CG2 3.49Å; G1052-V1055 PolarHBondContact O-N 3.25Å; V1055-M1057 VanDerWaalsContact C-N 3.32Å; V1055-M1057 PolarHBondContact O-N 3.38Å; V1055-I1058 PolarHBondContact O-N 3.27Å; V1055-L1059 HydrophobicContact CG1-CD1 3.68Å; V1055-L1059 HydrophobicContact CG1-CG 4.23Å; V1055-L1059 WeakPolarHBondContact O-CB 3.25Å; V1055-L1059 VanDerWaalsContact O-CG 3.24Å; V1055-L1059 WeakPolarHBondContact O-CG 3.4Å; V1055-L1059 PolarHBondContact O-N 3.3Å; V1055-E1074 HydrophobicContact CG2-CB 4.46Å; V1055-A1078 HydrophobicContact CB-CB 4.39Å; V1055-A1078 HydrophobicContact CG1-CB 3.75Å; V1055-A1078 HydrophobicContact CG2-CB 4.04Å
1056	A	82.6	Confident	86.9	Confident	11 Å²	11	7.6 Å²	7.6	9%	0.091	5%	0.045	C	C	.	.	H	α-helix	trans	-64.1	-35.3	176.8	0	0	0	0	0	112.9	P1019 A1023 D1054 Q1060	P1019-A1056 HydrophobicContact CB-CB 4.41Å; A1023-A1056 HydrophobicContact CB-CB 4.13Å; A1023-A1056 WeakPolarHBondContact CB-O 3.34Å; D1054-A1056 PolarHBondContact O-N 3.34Å; A1056-Q1060 VanDerWaalsContact O-CB 3.26Å; A1056-Q1060 WeakPolarHBondContact O-CB 3.33Å; A1056-Q1060 PolarHBondContact O-N 3.21Å
1057	M	88.2	Confident	86.7	Confident	0 Å²	0	7.6 Å²	7.6	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-74.1	-47.2	177.5	-172.9	-177.4	57.8	0	0	111.4	F457 L818 K1022 V1026 A1047 V1048 D1054 V1055 Q1060 A1061	F457-M1057 HydrophobicContact CB-SD 4.05Å; L818-M1057 HydrophobicContact CB-SD 4.28Å; L818-M1057 HydrophobicContact CD1-SD 3.87Å; K1022-M1057 HydrophobicContact CB-CB 4Å; K1022-M1057 HydrophobicContact CB-CG 4.17Å; K1022-M1057 HydrophobicContact CB-SD 4.12Å; K1022-M1057 HydrophobicContact CD-SD 4.2Å; V1026-M1057 HydrophobicContact CG2-CG 3.65Å; A1047-M1057 HydrophobicContact CB-CE 4.31Å; A1047-M1057 HydrophobicContact CB-CG 3.88Å; A1047-M1057 HydrophobicContact CB-SD 4.44Å; V1048-M1057 VanDerWaalsContact O-CE 3.3Å; V1048-M1057 WeakPolarHBondContact O-CE 3.28Å; D1054-M1057 HydrophobicContact CB-CE 3.99Å; D1054-M1057 CarbonylContact O-C 3.5Å; D1054-M1057 WeakPolarHBondContact O-CA 3.27Å; D1054-M1057 WeakPolarHBondContact O-CB 3.36Å; D1054-M1057 PolarHBondContact O-N 3.15Å; D1054-M1057 WeakPolarHBondContact OD1-CE 3.31Å; V1055-M1057 VanDerWaalsContact C-N 3.32Å; V1055-M1057 PolarHBondContact O-N 3.38Å; M1057-Q1060 PolarHBondContact O-N 3.12Å; M1057-A1061 PolarHBondContact O-N 3.08Å; M1057-A1061 VanDerWaalsContact O-N 3.09Å
1058	I	88.8	Confident	86.2	Confident	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-60.9	-45	179.3	-72.3	171	0	0	0	111.4	K336 D1054 V1055 A1075 A1079	K336-I1058 PolarHBondContact NZ-O 3.33Å; D1054-I1058 HydrophobicContact CB-CD1 4Å; D1054-I1058 HydrophobicContact CB-CG1 4.41Å; D1054-I1058 WeakPolarHBondContact O-CB 3.45Å; D1054-I1058 VanDerWaalsContact O-CG1 3.25Å; D1054-I1058 WeakPolarHBondContact O-CG1 3.35Å; D1054-I1058 PolarHBondContact O-N 3.45Å; V1055-I1058 PolarHBondContact O-N 3.27Å; I1058-A1075 HydrophobicContact CD1-CB 3.77Å; I1058-A1079 HydrophobicContact CG2-CB 3.92Å
1059	L	85.7	Confident	85	Confident	33 Å²	33	10.2 Å²	10.2	17%	0.173	6%	0.061	C	C	.	.	H	α-helix	trans	-71.5	-29.7	177.8	-67.8	174.3	0	0	0	112.8	N332 K336 V1055 A1078	N332-L1059 HydrophobicContact CB-CB 3.75Å; N332-L1059 HydrophobicContact CB-CD1 4.06Å; K336-L1059 WeakPolarHBondContact CE-O 2.98Å; V1055-L1059 HydrophobicContact CG1-CD1 3.68Å; V1055-L1059 HydrophobicContact CG1-CG 4.23Å; V1055-L1059 WeakPolarHBondContact O-CB 3.25Å; V1055-L1059 VanDerWaalsContact O-CG 3.24Å; V1055-L1059 WeakPolarHBondContact O-CG 3.4Å; V1055-L1059 PolarHBondContact O-N 3.3Å; L1059-A1078 HydrophobicContact CD2-CB 4.35Å; L1059-A1078 WeakPolarHBondContact CD2-O 3.23Å; L1059-A1078 HydrophobicContact CG-CB 4.46Å
1060	Q	87.9	Confident	83.7	Confident	36 Å²	36	18.4 Å²	18.4	17%	0.168	10%	0.097	C	C	.	.	H	α-helix	trans	-80.8	-21	179.7	-176.5	55.9	93.4	0	0	113.2	A1023 V1026 K1027 A1056 M1057	A1023-Q1060 HydrophobicContact CB-CB 4.21Å; A1023-Q1060 HydrophobicContact CB-CG 4.34Å; A1023-Q1060 WeakPolarHBondContact O-CG 3.46Å; V1026-Q1060 HydrophobicContact CB-CG 4.2Å; V1026-Q1060 HydrophobicContact CG1-CB 4.28Å; V1026-Q1060 HydrophobicContact CG1-CG 3.98Å; K1027-Q1060 HydrophobicContact CB-CG 4.05Å; A1056-Q1060 VanDerWaalsContact O-CB 3.26Å; A1056-Q1060 WeakPolarHBondContact O-CB 3.33Å; A1056-Q1060 PolarHBondContact O-N 3.21Å; M1057-Q1060 PolarHBondContact O-N 3.12Å
1061	A	90.4	Very high	82.2	Confident	3 Å²	3	18.6 Å²	18.6	3%	0.025	10%	0.097	C	C	.	.	S	Bend	trans	-76.6	157.2	175.4	0	0	0	0	0	112.8	K336 V1026 I1045 A1047 M1057 I1063	K336-A1061 VanDerWaalsContact CE-O 3.31Å; K336-A1061 WeakPolarHBondContact CE-O 3.17Å; K336-A1061 PolarHBondContact NZ-O 3.17Å; V1026-A1061 HydrophobicContact CG1-CB 4.05Å; I1045-A1061 HydrophobicContact CG2-CB 4.16Å; A1047-A1061 HydrophobicContact CB-CB 3.53Å; M1057-A1061 PolarHBondContact O-N 3.08Å; M1057-A1061 VanDerWaalsContact O-N 3.09Å; A1061-I1063 VanDerWaalsContact C-N 3.28Å; A1061-I1063 WeakPolarHBondContact CB-O 3.41Å; A1061-I1063 PolarHBondContact O-N 3.05Å
1062	N	90	Very high	81.6	Confident	25 Å²	25	19.3 Å²	19.3	13%	0.134	11%	0.105	C	C	.	.	S	Bend	trans	-63.8	-36	173.6	-75.4	86.8	0	0	0	111.7	K336 Q1030 V1044 I1045	K336-N1062 WeakPolarHBondContact CD-O 3.45Å; Q1030-N1062 PolarHBondContact NE2-OD1 3.21Å; V1044-N1062 HydrophobicContact CG1-CB 4.09Å; I1045-N1062 WeakPolarHBondContact O-CA 3.41Å; I1045-N1062 WeakPolarHBondContact O-CB 3.49Å; I1045-N1062 PolarHBondContact O-N 3.46Å
1063	I	92.7	Very high	81.7	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	125.8	172.6	-50.2	176.8	0	0	0	108.3	E449 L450 I453 V1044 I1045 A1046 A1047 A1061 V1065 Y1081	E449-I1063 VanDerWaalsContact C-CD1 3.45Å; E449-I1063 HydrophobicContact CB-CD1 3.64Å; E449-I1063 HydrophobicContact CB-CG1 3.98Å; L450-I1063 HydrophobicContact CD2-CD1 3.91Å; L450-I1063 HydrophobicContact CD2-CG2 4.08Å; L450-I1063 HydrophobicContact CG-CD1 4.34Å; I453-I1063 HydrophobicContact CD1-CD1 3.9Å; I453-I1063 HydrophobicContact CG1-CD1 3.78Å; V1044-I1063 HydrophobicContact CG1-CD1 4.16Å; V1044-I1063 HydrophobicContact CG1-CG1 4.35Å; I1045-I1063 PolarHBondContact O-N 3.08Å; I1045-I1063 VanDerWaalsContact O-N 3.07Å; A1046-I1063 CarbonylContact C-O 3.58Å; A1046-I1063 VanDerWaalsContact CA-O 3.28Å; A1046-I1063 WeakPolarHBondContact CA-O 3.44Å; A1046-I1063 HydrophobicContact CB-CB 4.29Å; A1047-I1063 PolarHBondContact N-O 3.16Å; A1061-I1063 VanDerWaalsContact C-N 3.28Å; A1061-I1063 WeakPolarHBondContact CB-O 3.41Å; A1061-I1063 PolarHBondContact O-N 3.05Å; I1063-V1065 HydrophobicContact CG2-CG2 4.25Å; I1063-Y1081 HydrophobicContact CG2-CD2 3.88Å; I1063-Y1081 HydrophobicContact CG2-CE2 4.07Å
1064	G	92.1	Very high	81.5	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	130	170.4	0	0	0	0	0	110.8	D1080 Y1081	G1064-D1080 PolarHBondContact N-OD2 3.04Å; G1064-D1080 WeakPolarHBondContact O-CB 3.48Å; G1064-D1080 PolarHBondContact O-N 3.17Å; G1064-Y1081 PolarHBondContact O-N 3.4Å; G1064-Y1081 VanDerWaalsContact O-N 3.12Å
1065	V	94.1	Very high	81.3	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	121.6	175.6	-179.8	0	0	0	0	108.9	A1047 V1048 G1049 I1063 Y1081 V1083 I1089 F1093	A1047-V1065 PolarHBondContact O-N 3.12Å; V1048-V1065 VanDerWaalsContact CA-O 3.32Å; V1048-V1065 WeakPolarHBondContact CA-O 3.22Å; V1048-V1065 HydrophobicContact CG1-CG1 4.5Å; V1048-V1065 HydrophobicContact CG2-CB 4.1Å; G1049-V1065 PolarHBondContact N-O 2.88Å; I1063-V1065 HydrophobicContact CG2-CG2 4.25Å; V1065-Y1081 CarbonylContact C-O 3.5Å; V1065-Y1081 VanDerWaalsContact CA-O 3.3Å; V1065-Y1081 WeakPolarHBondContact CA-O 3.39Å; V1065-V1083 HydrophobicContact CG1-CG1 4.29Å; V1065-V1083 HydrophobicContact CG1-CG2 3.57Å; V1065-I1089 HydrophobicContact CG1-CG1 4.46Å; V1065-F1093 HydrophobicContact CG2-CE1 4.19Å; V1065-F1093 HydrophobicContact CG2-CZ 4.24Å
1066	G	91.1	Very high	81.3	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	121.7	178	0	0	0	0	0	110.3	G1049 Y1081 S1082 V1083	G1049-G1066 CarbonylContact O-C 3.58Å; G1049-G1066 VanDerWaalsContact O-CA 3.3Å; G1049-G1066 WeakPolarHBondContact O-CA 3.24Å; G1066-Y1081 PolarHBondContact N-O 3.04Å; G1066-S1082 CarbonylContact O-C 3.55Å; G1066-S1082 VanDerWaalsContact O-CA 3.29Å; G1066-S1082 WeakPolarHBondContact O-CA 3.32Å; G1066-V1083 PolarHBondContact O-N 2.71Å
1067	V	90.5	Very high	80.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	138	170.2	-175.1	0	0	0	0	108.5	T463 V1048 G1049 D1050 G1069 V1076 V1083	T463-V1067 HydrophobicContact CG2-CG2 4.33Å; V1048-V1067 HydrophobicContact CG1-CG2 3.61Å; G1049-V1067 PolarHBondContact O-N 3.27Å; D1050-V1067 WeakPolarHBondContact CA-O 3.39Å; D1050-V1067 HydrophobicContact CB-CB 4.15Å; D1050-V1067 WeakPolarHBondContact CB-O 3.43Å; V1067-G1069 PolarHBondContact O-N 3.02Å; V1067-V1076 WeakPolarHBondContact O-CG2 3.4Å; V1067-V1083 VanDerWaalsContact CA-O 3.3Å; V1067-V1083 WeakPolarHBondContact CA-O 3.4Å; V1067-V1083 HydrophobicContact CG2-CG2 4.04Å
1068	Y	84	Confident	80.3	Confident	37 Å²	37	33.7 Å²	33.7	15%	0.145	16%	0.16	C	C	.	.			trans	-69.8	99	171.6	-73.5	-95.8	0	0	0	109.4	I437 V1076 S1082 V1083 T1084	I437-Y1068 HydrophobicContact CD1-CD1 4.06Å; I437-Y1068 HydrophobicContact CD1-CG 4.48Å; I437-Y1068 HydrophobicContact CG2-CD1 3.87Å; I437-Y1068 HydrophobicContact CG2-CD2 4Å; I437-Y1068 HydrophobicContact CG2-CE1 3.62Å; I437-Y1068 HydrophobicContact CG2-CE2 3.76Å; I437-Y1068 HydrophobicContact CG2-CG 4.05Å; Y1068-V1076 HydrophobicContact CD1-CG1 4.22Å; Y1068-V1076 HydrophobicContact CD1-CG2 4.07Å; Y1068-V1076 HydrophobicContact CD2-CG2 4.18Å; Y1068-V1076 HydrophobicContact CE1-CG1 3.7Å; Y1068-V1076 HydrophobicContact CE1-CG2 4.36Å; Y1068-V1076 HydrophobicContact CE2-CG1 4.35Å; Y1068-V1076 HydrophobicContact CE2-CG2 4.47Å; Y1068-V1076 HydrophobicContact CG-CG2 3.98Å; Y1068-S1082 VanDerWaalsContact CE2-CB 3.48Å; Y1068-S1082 WeakPolarHBondContact CE2-OG 3.16Å; Y1068-S1082 PolarHBondContact OH-OG 3.3Å; Y1068-V1083 WeakPolarHBondContact CD2-O 3.48Å; Y1068-V1083 PolarHBondContact N-O 3.11Å; Y1068-T1084 HydrophobicContact CD2-CG2 4.21Å; Y1068-T1084 HydrophobicContact CE2-CG2 4.49Å
1069	G	70.2	Confident	80.2	Confident	18 Å²	18	34 Å²	34	19%	0.186	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-85.3	155.8	171.6	0	0	0	0	0	111.9	V1067 E1071	V1067-G1069 PolarHBondContact O-N 3.02Å; G1069-E1071 PolarHBondContact O-N 3Å
1070	K	62.9	Low	80.4	Confident	173 Å²	173	33 Å²	33	75%	0.752	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-15.4	159.9	-64.3	-179.5	-179.5	177	0	111.8
1071	E	54.5	Low	80.6	Confident	6 Å²	6	31.3 Å²	31.3	3%	0.028	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-23.2	-172.7	-64.3	-152.2	-175	0	0	115.1	M183 N184 G187 N189 N467 G1069	M183-E1071 WeakPolarHBondContact CE-O 3.46Å; M183-E1071 VanDerWaalsContact CG-CA 3.48Å; M183-E1071 HydrophobicContact CG-CB 3.38Å; M183-E1071 HydrophobicContact CG-CG 3.59Å; M183-E1071 WeakPolarHBondContact CG-O 3.49Å; M183-E1071 VanDerWaalsContact SD-CA 3.57Å; M183-E1071 HydrophobicContact SD-CB 4.06Å; M183-E1071 HydrophobicContact SD-CG 4.01Å; N184-E1071 PolarHBondContact OD1-O 3.19Å; G187-E1071 WeakPolarHBondContact CA-OE2 3.44Å; N189-E1071 VanDerWaalsContact CG-OE1 3.31Å; N189-E1071 PolarHBondContact ND2-OE1 3.47Å; N189-E1071 PolarHBondContact OD1-OE1 2.99Å; N467-E1071 PolarHBondContact ND2-OE1 3.34Å; G1069-E1071 PolarHBondContact O-N 3Å
1072	G	60.2	Low	80.6	Confident	19 Å²	19	31.2 Å²	31.2	20%	0.196	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	152.3	-176.4	-173.6	0	0	0	0	0	111.4	N184	N184-G1072 WeakPolarHBondContact OD1-CA 3.23Å
1073	R	70.2	Confident	80.7	Confident	151 Å²	151	30 Å²	30	57%	0.57	14%	0.142	S	C	*	.	S	Bend	trans	-124.1	10.5	178.7	-63.2	-175.5	179.7	-176.9	-1.8	113.1	V1076 R1077	R1073-V1076 HydrophobicContact CB-CB 4.46Å; R1073-V1076 WeakPolarHBondContact O-CB 3.38Å; R1073-V1076 PolarHBondContact O-N 3.05Å; R1073-R1077 WeakPolarHBondContact O-CB 3.5Å; R1073-R1077 WeakPolarHBondContact O-CG 3.28Å; R1073-R1077 PolarHBondContact O-N 2.94Å
1074	E	71.8	Confident	80.6	Confident	62 Å²	62	30.2 Å²	30.2	29%	0.29	14%	0.143	S	C	.	.	H	α-helix	trans	-68.8	-39.2	-175	-67	-59.7	105.4	0	0	112.7	V1055 R1077 A1078	V1055-E1074 HydrophobicContact CG2-CB 4.46Å; E1074-R1077 PolarHBondContact O-N 3.13Å; E1074-R1077 IonicContact OE1-CZ 3.16Å; E1074-R1077 IonicContact OE1-NH1 3.94Å; E1074-R1077 PolarHBondContact OE1-NH1 2.99Å; E1074-R1077 IonicContact OE2-NH1 2.92Å; E1074-A1078 WeakPolarHBondContact O-CB 3.35Å; E1074-A1078 PolarHBondContact O-N 3.39Å
1075	A	78.2	Confident	80.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.6	-47.2	171	0	0	0	0	0	111.6	D1050 I1058 R1077 A1078 A1079	D1050-A1075 WeakPolarHBondContact O-CB 3.42Å; I1058-A1075 HydrophobicContact CD1-CB 3.77Å; A1075-R1077 VanDerWaalsContact C-N 3.25Å; A1075-R1077 PolarHBondContact O-N 3.44Å; A1075-A1078 PolarHBondContact O-N 2.94Å; A1075-A1078 VanDerWaalsContact O-N 3.13Å; A1075-A1079 VanDerWaalsContact O-CB 3.24Å; A1075-A1079 WeakPolarHBondContact O-CB 3.47Å; A1075-A1079 PolarHBondContact O-N 3.44Å
1076	V	82.2	Confident	80.4	Confident	9 Å²	9	31.4 Å²	31.4	6%	0.055	15%	0.148	C	C	.	.	H	α-helix	trans	-54.4	-38.6	175.7	160.9	0	0	0	0	112.6	N442 V1067 Y1068 R1073	N442-V1076 PolarHBondContact ND2-O 3.12Å; V1067-V1076 WeakPolarHBondContact O-CG2 3.4Å; Y1068-V1076 HydrophobicContact CD1-CG1 4.22Å; Y1068-V1076 HydrophobicContact CD1-CG2 4.07Å; Y1068-V1076 HydrophobicContact CD2-CG2 4.18Å; Y1068-V1076 HydrophobicContact CE1-CG1 3.7Å; Y1068-V1076 HydrophobicContact CE1-CG2 4.36Å; Y1068-V1076 HydrophobicContact CE2-CG1 4.35Å; Y1068-V1076 HydrophobicContact CE2-CG2 4.47Å; Y1068-V1076 HydrophobicContact CG-CG2 3.98Å; R1073-V1076 HydrophobicContact CB-CB 4.46Å; R1073-V1076 WeakPolarHBondContact O-CB 3.38Å; R1073-V1076 PolarHBondContact O-N 3.05Å
1077	R	74.1	Confident	80.4	Confident	110 Å²	110	36.5 Å²	36.5	42%	0.415	17%	0.168	S	C	.	.	H	α-helix	trans	-79.3	-27.4	179.3	-69.5	171.1	74.5	-148.7	0.7	113.5	L121 R1073 E1074 A1075	L121-R1077 VanDerWaalsContact CD1-NH2 3.31Å; R1073-R1077 WeakPolarHBondContact O-CB 3.5Å; R1073-R1077 WeakPolarHBondContact O-CG 3.28Å; R1073-R1077 PolarHBondContact O-N 2.94Å; E1074-R1077 PolarHBondContact O-N 3.13Å; E1074-R1077 IonicContact OE1-CZ 3.16Å; E1074-R1077 IonicContact OE1-NH1 3.94Å; E1074-R1077 PolarHBondContact OE1-NH1 2.99Å; E1074-R1077 IonicContact OE2-NH1 2.92Å; A1075-R1077 VanDerWaalsContact C-N 3.25Å; A1075-R1077 PolarHBondContact O-N 3.44Å
1078	A	75.7	Confident	80.6	Confident	26 Å²	26	37.1 Å²	37.1	22%	0.215	17%	0.17	C	C	.	.	H	α-helix	trans	-89.5	-15.7	177.5	0	0	0	0	0	113.9	V1055 L1059 E1074 A1075	V1055-A1078 HydrophobicContact CB-CB 4.39Å; V1055-A1078 HydrophobicContact CG1-CB 3.75Å; V1055-A1078 HydrophobicContact CG2-CB 4.04Å; L1059-A1078 HydrophobicContact CD2-CB 4.35Å; L1059-A1078 WeakPolarHBondContact CD2-O 3.23Å; L1059-A1078 HydrophobicContact CG-CB 4.46Å; E1074-A1078 WeakPolarHBondContact O-CB 3.35Å; E1074-A1078 PolarHBondContact O-N 3.39Å; A1075-A1078 PolarHBondContact O-N 2.94Å; A1075-A1078 VanDerWaalsContact O-N 3.13Å
1079	A	86.4	Confident	81	Confident	5 Å²	5	35.4 Å²	35.4	4%	0.041	16%	0.164	C	C	.	.	S	Bend	trans	-77.7	155.9	-179.2	0	0	0	0	0	113.3	N442 I1058 A1075 Y1081	N442-A1079 WeakPolarHBondContact CB-O 3.49Å; N442-A1079 PolarHBondContact ND2-O 3.41Å; I1058-A1079 HydrophobicContact CG2-CB 3.92Å; A1075-A1079 VanDerWaalsContact O-CB 3.24Å; A1075-A1079 WeakPolarHBondContact O-CB 3.47Å; A1075-A1079 PolarHBondContact O-N 3.44Å; A1079-Y1081 WeakPolarHBondContact CB-O 3.31Å
1080	D	88.9	Confident	82.2	Confident	12 Å²	12	37.2 Å²	37.2	6%	0.064	17%	0.166	C	C	.	.	S	Bend	trans	-75.9	-31.8	173	-60.6	-72.1	0	0	0	111.5	K336 N442 N443 L446 G1064	K336-D1080 WeakPolarHBondContact CE-OD2 3.38Å; K336-D1080 IonicContact NZ-OD2 3.69Å; K336-D1080 PolarHBondContact NZ-OD2 2.95Å; N442-D1080 PolarHBondContact N-O 3.31Å; N443-D1080 HydrophobicContact CB-CB 3.88Å; N443-D1080 PolarHBondContact N-O 2.9Å; N443-D1080 PolarHBondContact ND2-OD1 3.4Å; L446-D1080 HydrophobicContact CD1-CB 3.99Å; L446-D1080 VanDerWaalsContact CD1-CG 3.49Å; L446-D1080 WeakPolarHBondContact CD1-OD1 3.41Å; G1064-D1080 PolarHBondContact N-OD2 3.04Å; G1064-D1080 WeakPolarHBondContact O-CB 3.48Å; G1064-D1080 PolarHBondContact O-N 3.17Å
1081	Y	92.4	Very high	83.7	Confident	1 Å²	1	30.2 Å²	30.2	0%	0.004	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.4	173.5	-62.8	-84.5	0	0	0	110	I424 A441 L446 A447 L450 I1063 G1064 V1065 G1066 A1079 L1092	I424-Y1081 HydrophobicContact CD1-CE1 4.08Å; I424-Y1081 HydrophobicContact CG2-CD1 4.19Å; I424-Y1081 HydrophobicContact CG2-CE1 4.29Å; A441-Y1081 HydrophobicContact CB-CD1 3.65Å; A441-Y1081 HydrophobicContact CB-CE1 3.54Å; L446-Y1081 VanDerWaalsContact C-OH 3.28Å; L446-Y1081 HydrophobicContact CB-CE2 4.34Å; A447-Y1081 WeakPolarHBondContact CA-OH 3.49Å; A447-Y1081 PolarHBondContact N-OH 3.36Å; A447-Y1081 VanDerWaalsContact N-OH 3.17Å; L450-Y1081 HydrophobicContact CD1-CE1 4.04Å; L450-Y1081 HydrophobicContact CD1-CE2 3.93Å; L450-Y1081 HydrophobicContact CD2-CD2 4.08Å; L450-Y1081 HydrophobicContact CD2-CE2 3.86Å; L450-Y1081 HydrophobicContact CG-CE2 3.96Å; I1063-Y1081 HydrophobicContact CG2-CD2 3.88Å; I1063-Y1081 HydrophobicContact CG2-CE2 4.07Å; G1064-Y1081 PolarHBondContact O-N 3.4Å; G1064-Y1081 VanDerWaalsContact O-N 3.12Å; V1065-Y1081 CarbonylContact C-O 3.5Å; V1065-Y1081 VanDerWaalsContact CA-O 3.3Å; V1065-Y1081 WeakPolarHBondContact CA-O 3.39Å; G1066-Y1081 PolarHBondContact N-O 3.04Å; A1079-Y1081 WeakPolarHBondContact CB-O 3.31Å; Y1081-L1092 HydrophobicContact CD1-CD1 4.28Å; Y1081-L1092 HydrophobicContact CG-CD2 4.3Å
1082	S	91.1	Very high	85.6	Confident	1 Å²	1	30 Å²	30	1%	0.007	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	136.4	167.2	69.7	0	0	0	0	110.4	S439 H440 G1066 Y1068	S439-S1082 CarbonylContact C-O 3.6Å; S439-S1082 VanDerWaalsContact CA-O 3.25Å; S439-S1082 WeakPolarHBondContact CA-O 3.36Å; S439-S1082 VanDerWaalsContact CB-O 3.25Å; S439-S1082 WeakPolarHBondContact CB-O 3.32Å; H440-S1082 WeakPolarHBondContact CB-OG 3.21Å; H440-S1082 PolarHBondContact N-O 3.02Å; H440-S1082 PolarHBondContact N-OG 2.96Å; H440-S1082 VanDerWaalsContact N-OG 3.16Å; H440-S1082 PolarHBondContact O-N 3.03Å; H440-S1082 PolarHBondContact O-OG 2.98Å; G1066-S1082 CarbonylContact O-C 3.55Å; G1066-S1082 VanDerWaalsContact O-CA 3.29Å; G1066-S1082 WeakPolarHBondContact O-CA 3.32Å; Y1068-S1082 VanDerWaalsContact CE2-CB 3.48Å; Y1068-S1082 WeakPolarHBondContact CE2-OG 3.16Å; Y1068-S1082 PolarHBondContact OH-OG 3.3Å
1083	V	92.2	Very high	87.3	Confident	1 Å²	1	29 Å²	29	1%	0.006	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134.5	177.7	-69.6	0	0	0	0	110.4	S439 V1065 G1066 V1067 Y1068 E1085 H1088 I1089 L1092	S439-V1083 WeakPolarHBondContact OG-CA 3.35Å; V1065-V1083 HydrophobicContact CG1-CG1 4.29Å; V1065-V1083 HydrophobicContact CG1-CG2 3.57Å; G1066-V1083 PolarHBondContact O-N 2.71Å; V1067-V1083 VanDerWaalsContact CA-O 3.3Å; V1067-V1083 WeakPolarHBondContact CA-O 3.4Å; V1067-V1083 HydrophobicContact CG2-CG2 4.04Å; Y1068-V1083 WeakPolarHBondContact CD2-O 3.48Å; Y1068-V1083 PolarHBondContact N-O 3.11Å; V1083-E1085 VanDerWaalsContact C-N 3.32Å; V1083-E1085 PolarHBondContact O-N 3.43Å; V1083-H1088 HydrophobicContact CB-CB 4.46Å; V1083-I1089 HydrophobicContact CG2-CG1 4.12Å; V1083-L1092 HydrophobicContact CG1-CD2 3.96Å
1084	T	89.7	Confident	88.4	Confident	4 Å²	4	22 Å²	22	3%	0.025	10%	0.098	C	C	.	.	S	Bend	trans	-63.7	-36.1	-176.6	44	0	0	0	0	113.6	M430 N432 I437 S439 Y1068 H1088	M430-T1084 PolarHBondContact O-OG1 3.48Å; N432-T1084 HydrophobicContact CB-CG2 4.02Å; I437-T1084 HydrophobicContact CB-CG2 3.89Å; I437-T1084 HydrophobicContact CG2-CG2 3.71Å; I437-T1084 VanDerWaalsContact O-CG2 3.29Å; I437-T1084 WeakPolarHBondContact O-CG2 3.25Å; S439-T1084 PolarHBondContact OG-N 3.44Å; Y1068-T1084 HydrophobicContact CD2-CG2 4.21Å; Y1068-T1084 HydrophobicContact CE2-CG2 4.49Å; T1084-H1088 PolarHBondContact OG1-CE1 3.49Å; T1084-H1088 PolarHBondContact OG1-ND1 3.05Å
1085	E	89.8	Confident	89.4	Confident	25 Å²	25	19 Å²	19	12%	0.117	9%	0.085	C	C	.	.	S	Bend	trans	-146.8	152.4	-177.9	-62.2	173.1	128.7	0	0	109.6	P799 V1083 R1087 H1088	P799-E1085 WeakPolarHBondContact CG-OE1 3.46Å; V1083-E1085 VanDerWaalsContact C-N 3.32Å; V1083-E1085 PolarHBondContact O-N 3.43Å; E1085-R1087 HydrophobicContact CB-CG 4.06Å; E1085-R1087 PolarHBondContact O-N 3.43Å; E1085-R1087 VanDerWaalsContact O-N 3.14Å; E1085-R1087 IonicContact OE1-NH2 3.37Å; E1085-R1087 IonicContact OE2-CZ 3.15Å; E1085-R1087 IonicContact OE2-NE 3.73Å; E1085-R1087 PolarHBondContact OE2-NE 2.93Å; E1085-R1087 IonicContact OE2-NH2 3.79Å; E1085-R1087 PolarHBondContact OE2-NH2 3.27Å; E1085-H1088 PolarHBondContact O-N 3.11Å; E1085-H1088 IonicContact OE2-CE1 3.67Å; E1085-H1088 PolarHBondContact OE2-CE1 3.23Å; E1085-H1088 IonicContact OE2-NE2 2.97Å
1086	F	92.1	Very high	90.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-29.7	-178.6	-170.1	-85.5	0	0	0	113.3	C458 T463 L464 V801 C804 I805 V1048 H1088 I1089	C458-F1086 HydrophobicContact CB-CE2 4.5Å; T463-F1086 HydrophobicContact CG2-CD2 3.91Å; T463-F1086 HydrophobicContact CG2-CE2 4.16Å; T463-F1086 WeakPolarHBondContact O-CB 3.41Å; T463-F1086 WeakPolarHBondContact O-CD2 3.3Å; L464-F1086 HydrophobicContact CD2-CD1 4.19Å; L464-F1086 HydrophobicContact CD2-CD2 3.81Å; L464-F1086 HydrophobicContact CD2-CE1 3.93Å; L464-F1086 HydrophobicContact CD2-CE2 3.51Å; L464-F1086 HydrophobicContact CD2-CG 4.15Å; L464-F1086 HydrophobicContact CD2-CZ 3.59Å; V801-F1086 HydrophobicContact CB-CD1 4.35Å; V801-F1086 HydrophobicContact CG1-CD1 4.29Å; V801-F1086 HydrophobicContact CG1-CE1 4.46Å; V801-F1086 HydrophobicContact CG2-CB 3.97Å; V801-F1086 HydrophobicContact CG2-CD1 3.84Å; V801-F1086 HydrophobicContact CG2-CG 4.11Å; C804-F1086 HydrophobicContact CB-CD1 4.23Å; C804-F1086 HydrophobicContact CB-CE1 4.18Å; I805-F1086 HydrophobicContact CD1-CE1 4.43Å; I805-F1086 HydrophobicContact CG1-CE1 3.97Å; I805-F1086 HydrophobicContact CG1-CZ 4.36Å; V1048-F1086 HydrophobicContact CG1-CD2 4.28Å; V1048-F1086 HydrophobicContact CG1-CE2 4.24Å; F1086-H1088 PolarHBondContact O-N 3Å; F1086-I1089 HydrophobicContact CD2-CD1 3.6Å; F1086-I1089 HydrophobicContact CE2-CD1 3.7Å; F1086-I1089 HydrophobicContact CG-CD1 4.04Å; F1086-I1089 HydrophobicContact CZ-CD1 4.22Å; F1086-I1089 VanDerWaalsContact O-CB 3.32Å; F1086-I1089 WeakPolarHBondContact O-CB 3.33Å; F1086-I1089 WeakPolarHBondContact O-CG1 3.27Å; F1086-I1089 PolarHBondContact O-N 2.94Å
1087	R	91.7	Very high	90.7	Very high	107 Å²	107	19.4 Å²	19.4	40%	0.404	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-30.3	177	59.7	171	178	176.4	-6.6	113.4	P799 E1085 I1089 K1090	P799-R1087 WeakPolarHBondContact O-CB 3.24Å; E1085-R1087 HydrophobicContact CB-CG 4.06Å; E1085-R1087 PolarHBondContact O-N 3.43Å; E1085-R1087 VanDerWaalsContact O-N 3.14Å; E1085-R1087 IonicContact OE1-NH2 3.37Å; E1085-R1087 IonicContact OE2-CZ 3.15Å; E1085-R1087 IonicContact OE2-NE 3.73Å; E1085-R1087 PolarHBondContact OE2-NE 2.93Å; E1085-R1087 IonicContact OE2-NH2 3.79Å; E1085-R1087 PolarHBondContact OE2-NH2 3.27Å; R1087-I1089 PolarHBondContact O-N 3.13Å; R1087-K1090 WeakPolarHBondContact O-CB 3.08Å; R1087-K1090 PolarHBondContact O-N 3Å; R1087-K1090 VanDerWaalsContact O-N 3.11Å
1088	H	93.5	Very high	91.6	Very high	13 Å²	13	14.4 Å²	14.4	6%	0.06	7%	0.067	C	C	.	.	H	α-helix	trans	-68.4	-18.3	-178.9	-58.6	136.9	0	0	0	112.6	H429 M430 V1083 T1084 E1085 F1086 K1090 R1091 L1092	H429-H1088 PolarHBondContact O-CD2 3.43Å; M430-H1088 HydrophobicContact CB-CB 4.35Å; M430-H1088 HydrophobicContact CG-CB 4.16Å; M430-H1088 HydrophobicContact SD-CB 4.3Å; V1083-H1088 HydrophobicContact CB-CB 4.46Å; T1084-H1088 PolarHBondContact OG1-CE1 3.49Å; T1084-H1088 PolarHBondContact OG1-ND1 3.05Å; E1085-H1088 PolarHBondContact O-N 3.11Å; E1085-H1088 IonicContact OE2-CE1 3.67Å; E1085-H1088 PolarHBondContact OE2-CE1 3.23Å; E1085-H1088 IonicContact OE2-NE2 2.97Å; F1086-H1088 PolarHBondContact O-N 3Å; H1088-K1090 PolarHBondContact O-N 3.33Å; H1088-R1091 WeakPolarHBondContact O-CB 3.2Å; H1088-R1091 PolarHBondContact O-N 3.34Å; H1088-L1092 PolarHBondContact O-N 3.49Å
1089	I	94.3	Very high	92.4	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-59.1	-33.8	171.5	-59.1	173	0	0	0	111.6	L808 V1048 V1065 V1083 F1086 R1087 R1091 L1092 F1093	L808-I1089 HydrophobicContact CD1-CG2 4.25Å; V1048-I1089 HydrophobicContact CB-CD1 4.48Å; V1048-I1089 HydrophobicContact CG1-CD1 3.75Å; V1048-I1089 HydrophobicContact CG2-CD1 3.86Å; V1065-I1089 HydrophobicContact CG1-CG1 4.46Å; V1083-I1089 HydrophobicContact CG2-CG1 4.12Å; F1086-I1089 HydrophobicContact CD2-CD1 3.6Å; F1086-I1089 HydrophobicContact CE2-CD1 3.7Å; F1086-I1089 HydrophobicContact CG-CD1 4.04Å; F1086-I1089 HydrophobicContact CZ-CD1 4.22Å; F1086-I1089 VanDerWaalsContact O-CB 3.32Å; F1086-I1089 WeakPolarHBondContact O-CB 3.33Å; F1086-I1089 WeakPolarHBondContact O-CG1 3.27Å; F1086-I1089 PolarHBondContact O-N 2.94Å; R1087-I1089 PolarHBondContact O-N 3.13Å; I1089-R1091 VanDerWaalsContact C-N 3.27Å; I1089-R1091 PolarHBondContact O-N 3.3Å; I1089-L1092 PolarHBondContact O-N 3.03Å; I1089-F1093 HydrophobicContact CG2-CD1 4.26Å; I1089-F1093 HydrophobicContact CG2-CD2 3.67Å; I1089-F1093 HydrophobicContact CG2-CE1 4.07Å; I1089-F1093 HydrophobicContact CG2-CE2 3.44Å; I1089-F1093 VanDerWaalsContact CG2-CE2 3.44Å; I1089-F1093 HydrophobicContact CG2-CG 4.07Å; I1089-F1093 HydrophobicContact CG2-CZ 3.66Å; I1089-F1093 PolarHBondContact O-N 3.43Å
1090	K	94.4	Very high	92.7	Very high	56 Å²	56	14.1 Å²	14.1	24%	0.243	6%	0.059	C	C	.	.	H	α-helix	trans	-56	-45	173.1	-175.5	-170.9	172.5	-171.8	0	110.5	C804 A807 R1087 H1088 L1094 L1170	C804-K1090 HydrophobicContact CB-CB 4.47Å; A807-K1090 HydrophobicContact CB-CD 4.17Å; A807-K1090 HydrophobicContact CB-CG 4.18Å; R1087-K1090 WeakPolarHBondContact O-CB 3.08Å; R1087-K1090 PolarHBondContact O-N 3Å; R1087-K1090 VanDerWaalsContact O-N 3.11Å; H1088-K1090 PolarHBondContact O-N 3.33Å; K1090-L1094 HydrophobicContact CG-CD1 3.81Å; K1090-L1094 WeakPolarHBondContact O-CB 3.38Å; K1090-L1094 VanDerWaalsContact O-CG 3.27Å; K1090-L1094 WeakPolarHBondContact O-CG 3.49Å; K1090-L1094 PolarHBondContact O-N 3.14Å; K1090-L1094 VanDerWaalsContact O-N 3.13Å; K1090-L1170 WeakPolarHBondContact CE-O 3.47Å; K1090-L1170 HydrophobicContact CG-CD2 4.45Å; K1090-L1170 PolarHBondContact NZ-O 2.95Å
1091	R	94.5	Very high	92.9	Very high	26 Å²	26	13.6 Å²	13.6	10%	0.098	6%	0.056	C	C	.	.	H	α-helix	trans	-74.6	-48	-179	-168.9	172.6	179.3	87.9	7.2	111.1	D427 M430 H1088 I1089 F1093 L1095 H1096 E1166	D427-R1091 IonicContact OD1-CZ 2.76Å; D427-R1091 IonicContact OD1-NE 2.67Å; D427-R1091 PolarHBondContact OD1-NE 3.12Å; D427-R1091 IonicContact OD1-NH2 3.31Å; D427-R1091 PolarHBondContact OD1-NH2 2.93Å; D427-R1091 IonicContact OD2-CZ 3.51Å; D427-R1091 IonicContact OD2-NE 3.83Å; D427-R1091 PolarHBondContact OD2-NE 3.34Å; D427-R1091 IonicContact OD2-NH2 3.58Å; M430-R1091 HydrophobicContact CG-CG 4.46Å; M430-R1091 HydrophobicContact SD-CB 4.26Å; M430-R1091 HydrophobicContact SD-CG 4.33Å; H1088-R1091 WeakPolarHBondContact O-CB 3.2Å; H1088-R1091 PolarHBondContact O-N 3.34Å; I1089-R1091 VanDerWaalsContact C-N 3.27Å; I1089-R1091 PolarHBondContact O-N 3.3Å; R1091-F1093 PolarHBondContact O-N 2.98Å; R1091-L1095 HydrophobicContact CG-CB 4.36Å; R1091-L1095 HydrophobicContact CG-CD2 4Å; R1091-L1095 VanDerWaalsContact O-CB 3.24Å; R1091-L1095 WeakPolarHBondContact O-CB 3.21Å; R1091-L1095 PolarHBondContact O-N 3.36Å; R1091-H1096 PolarHBondContact O-N 3.13Å; R1091-E1166 IonicContact CZ-OE1 2.6Å; R1091-E1166 IonicContact CZ-OE2 3.3Å; R1091-E1166 VanDerWaalsContact NH1-CD 3.29Å; R1091-E1166 IonicContact NH1-OE1 2.71Å; R1091-E1166 PolarHBondContact NH1-OE1 3.17Å; R1091-E1166 IonicContact NH1-OE2 2.6Å; R1091-E1166 VanDerWaalsContact NH2-CD 3.26Å; R1091-E1166 IonicContact NH2-OE1 2.79Å; R1091-E1166 PolarHBondContact NH2-OE1 2.92Å; R1091-E1166 VanDerWaalsContact NH2-OE1 3.16Å; R1091-E1166 IonicContact NH2-OE2 3.62Å; R1091-E1166 PolarHBondContact NH2-OE2 3.45Å
1092	L	95.2	Very high	92.8	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.005	6%	0.061	C	C	.	.	I	π-helix	trans	-54.8	-46.9	178.9	-175.4	64.2	0	0	0	112.5	I424 M430 L450 Y1081 V1083 H1088 I1089 H1096 G1097	I424-L1092 HydrophobicContact CD1-CD1 4.47Å; I424-L1092 HydrophobicContact CG2-CD1 3.78Å; M430-L1092 HydrophobicContact SD-CB 4.41Å; L450-L1092 HydrophobicContact CD1-CD1 3.79Å; L450-L1092 HydrophobicContact CD1-CG 4.16Å; L450-L1092 HydrophobicContact CD2-CD2 4.36Å; L450-L1092 HydrophobicContact CD2-CG 4.19Å; Y1081-L1092 HydrophobicContact CD1-CD1 4.28Å; Y1081-L1092 HydrophobicContact CG-CD2 4.3Å; V1083-L1092 HydrophobicContact CG1-CD2 3.96Å; H1088-L1092 PolarHBondContact O-N 3.49Å; I1089-L1092 PolarHBondContact O-N 3.03Å; L1092-H1096 WeakPolarHBondContact O-CB 3.37Å; L1092-G1097 PolarHBondContact O-N 3.42Å
1093	F	94.7	Very high	92.9	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	6%	0.064	C	C	.	.	I	π-helix	trans	-81.6	-51.8	-177.8	-64.7	-2.3	0	0	0	112.3	L450 I453 L456 L808 I813 A1046 V1065 I1089 R1091 G1097 H1098 Y1176	L450-F1093 HydrophobicContact CD2-CD1 3.87Å; L450-F1093 HydrophobicContact CD2-CE1 3.81Å; I453-F1093 HydrophobicContact CD1-CD1 3.54Å; I453-F1093 HydrophobicContact CD1-CD2 3.68Å; I453-F1093 HydrophobicContact CD1-CE1 3.44Å; I453-F1093 VanDerWaalsContact CD1-CE1 3.44Å; I453-F1093 HydrophobicContact CD1-CE2 3.58Å; I453-F1093 HydrophobicContact CD1-CG 3.68Å; I453-F1093 HydrophobicContact CD1-CZ 3.47Å; I453-F1093 VanDerWaalsContact CD1-CZ 3.47Å; L456-F1093 HydrophobicContact CD1-CE2 3.85Å; L456-F1093 HydrophobicContact CD1-CZ 4.16Å; L456-F1093 HydrophobicContact CD2-CE2 4.26Å; L808-F1093 HydrophobicContact CD2-CB 4.4Å; L808-F1093 HydrophobicContact CD2-CD2 3.83Å; I813-F1093 HydrophobicContact CD1-CD2 4.28Å; A1046-F1093 HydrophobicContact CB-CE2 4.45Å; A1046-F1093 HydrophobicContact CB-CZ 4.04Å; V1065-F1093 HydrophobicContact CG2-CE1 4.19Å; V1065-F1093 HydrophobicContact CG2-CZ 4.24Å; I1089-F1093 HydrophobicContact CG2-CD1 4.26Å; I1089-F1093 HydrophobicContact CG2-CD2 3.67Å; I1089-F1093 HydrophobicContact CG2-CE1 4.07Å; I1089-F1093 HydrophobicContact CG2-CE2 3.44Å; I1089-F1093 VanDerWaalsContact CG2-CE2 3.44Å; I1089-F1093 HydrophobicContact CG2-CG 4.07Å; I1089-F1093 HydrophobicContact CG2-CZ 3.66Å; I1089-F1093 PolarHBondContact O-N 3.43Å; R1091-F1093 PolarHBondContact O-N 2.98Å; F1093-G1097 WeakPolarHBondContact O-CA 3.46Å; F1093-G1097 PolarHBondContact O-N 2.94Å; F1093-H1098 PolarHBondContact O-N 3.31Å; F1093-Y1176 VanDerWaalsContact O-CE2 3.26Å; F1093-Y1176 WeakPolarHBondContact O-CE2 3.11Å
1094	L	93	Very high	92.9	Very high	3 Å²	3	15.4 Å²	15.4	2%	0.016	6%	0.063	C	C	.	.	I	π-helix	trans	-78	-29.4	-169.5	-54.7	179.3	0	0	0	113.8	A807 A811 K1090 H1098 P1173 Y1176	A807-L1094 HydrophobicContact CB-CD1 4.12Å; A811-L1094 HydrophobicContact CB-CD2 3.58Å; K1090-L1094 HydrophobicContact CG-CD1 3.81Å; K1090-L1094 WeakPolarHBondContact O-CB 3.38Å; K1090-L1094 VanDerWaalsContact O-CG 3.27Å; K1090-L1094 WeakPolarHBondContact O-CG 3.49Å; K1090-L1094 PolarHBondContact O-N 3.14Å; K1090-L1094 VanDerWaalsContact O-N 3.13Å; L1094-H1098 VanDerWaalsContact O-CB 3.22Å; L1094-H1098 WeakPolarHBondContact O-CB 3.26Å; L1094-P1173 HydrophobicContact CD1-CB 3.8Å; L1094-P1173 HydrophobicContact CD1-CG 4.15Å; L1094-Y1176 HydrophobicContact CD2-CD2 4.01Å; L1094-Y1176 HydrophobicContact CD2-CG 4Å
1095	L	94.1	Very high	93	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	6%	0.062	C	C	.	.	I	π-helix	trans	-96.7	-70.6	178.2	-175.6	68.6	0	0	0	110.5	R1091 G1097 H1098 W1099 E1166 L1169 L1170	R1091-L1095 HydrophobicContact CG-CB 4.36Å; R1091-L1095 HydrophobicContact CG-CD2 4Å; R1091-L1095 VanDerWaalsContact O-CB 3.24Å; R1091-L1095 WeakPolarHBondContact O-CB 3.21Å; R1091-L1095 PolarHBondContact O-N 3.36Å; L1095-G1097 PolarHBondContact O-N 3.3Å; L1095-H1098 PolarHBondContact O-N 2.92Å; L1095-W1099 HydrophobicContact CD1-CD2 4.04Å; L1095-W1099 HydrophobicContact CD1-CE3 4.17Å; L1095-W1099 HydrophobicContact CD1-CH2 3.73Å; L1095-W1099 HydrophobicContact CD1-CZ2 3.57Å; L1095-W1099 HydrophobicContact CD1-CZ3 4.02Å; L1095-W1099 HydrophobicContact CD2-CZ3 4.36Å; L1095-W1099 HydrophobicContact CG-CD2 4.41Å; L1095-W1099 HydrophobicContact CG-CE3 4.18Å; L1095-W1099 HydrophobicContact CG-CH2 4.3Å; L1095-W1099 HydrophobicContact CG-CZ3 4.12Å; L1095-W1099 PolarHBondContact O-N 3.25Å; L1095-E1166 HydrophobicContact CD1-CB 3.85Å; L1095-E1166 HydrophobicContact CD1-CG 3.78Å; L1095-E1166 HydrophobicContact CD2-CG 3.76Å; L1095-E1166 HydrophobicContact CG-CG 4.41Å; L1095-L1169 HydrophobicContact CD1-CB 4.42Å; L1095-L1169 HydrophobicContact CD1-CD1 3.86Å; L1095-L1170 HydrophobicContact CB-CD2 4.44Å
1096	H	94.6	Very high	93.1	Very high	16 Å²	16	14.1 Å²	14.1	7%	0.074	6%	0.057	C	C	.	.	I	π-helix	trans	-64.5	-43.8	-173.3	-73.2	-63.4	0	0	0	112.5	I424 D427 R1091 L1092 H1098 W1099 S1100	I424-H1096 HydrophobicContact CD1-CB 4.13Å; I424-H1096 HydrophobicContact CG1-CB 3.84Å; D427-H1096 IonicContact OD2-CD2 2.64Å; D427-H1096 IonicContact OD2-CE1 3.48Å; D427-H1096 IonicContact OD2-NE2 2.67Å; D427-H1096 PolarHBondContact OD2-NE2 2.83Å; R1091-H1096 PolarHBondContact O-N 3.13Å; L1092-H1096 WeakPolarHBondContact O-CB 3.37Å; H1096-H1098 PolarHBondContact O-N 3.38Å; H1096-W1099 PolarHBondContact O-N 3.04Å; H1096-S1100 WeakPolarHBondContact O-CB 3.25Å; H1096-S1100 PolarHBondContact O-N 3.46Å; H1096-S1100 PolarHBondContact O-OG 3.31Å
1097	G	92.5	Very high	93.1	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	6%	0.057	C	C	.	.	I	π-helix	trans	-61	-42.1	174.2	0	0	0	0	0	113.1	L450 G451 L1092 F1093 L1095 Y1101	L450-G1097 VanDerWaalsContact CB-CA 3.48Å; G451-G1097 WeakPolarHBondContact CA-O 3.34Å; G451-G1097 PolarHBondContact N-O 2.92Å; L1092-G1097 PolarHBondContact O-N 3.42Å; F1093-G1097 WeakPolarHBondContact O-CA 3.46Å; F1093-G1097 PolarHBondContact O-N 2.94Å; L1095-G1097 PolarHBondContact O-N 3.3Å; G1097-Y1101 WeakPolarHBondContact O-CB 3.21Å; G1097-Y1101 PolarHBondContact O-N 2.91Å; G1097-Y1101 VanDerWaalsContact O-N 3.09Å
1098	H	92.6	Very high	93.1	Very high	5 Å²	5	9 Å²	9	2%	0.023	4%	0.038	C	C	.	.	H	α-helix	trans	-67.4	-45	178.5	-167.7	-34.9	0	0	0	112.4	F1093 L1094 L1095 H1096 Y1102 H1163 L1169 I1179	F1093-H1098 PolarHBondContact O-N 3.31Å; L1094-H1098 VanDerWaalsContact O-CB 3.22Å; L1094-H1098 WeakPolarHBondContact O-CB 3.26Å; L1095-H1098 PolarHBondContact O-N 2.92Å; H1096-H1098 PolarHBondContact O-N 3.38Å; H1098-Y1102 VanDerWaalsContact O-CB 3.27Å; H1098-Y1102 WeakPolarHBondContact O-CB 3.46Å; H1098-Y1102 PolarHBondContact O-N 3.45Å; H1098-H1163 AromaticContact CE1-NE2 3.09Å; H1098-H1163 PolarHBondContact CE1-NE2 3.49Å; H1098-H1163 AromaticContact CG-NE2 3.49Å; H1098-H1163 AromaticContact ND1-NE2 2.66Å; H1098-H1163 PolarHBondContact ND1-NE2 2.87Å; H1098-L1169 VanDerWaalsContact CD2-CD2 3.45Å; H1098-L1169 WeakPolarHBondContact CD2-CD2 3.45Å; H1098-I1179 HydrophobicContact CB-CD1 3.95Å; H1098-I1179 WeakPolarHBondContact CE1-CG2 3.45Å
1099	W	92.9	Very high	93	Very high	24 Å²	24	8.4 Å²	8.4	9%	0.091	4%	0.035	C	C	.	.	H	α-helix	trans	-65.4	-47.2	176.8	-75.9	-8.2	0	0	0	111.7	L1095 H1096 Y1102 R1103 R1162 H1163 I1164 E1166 L1169	L1095-W1099 HydrophobicContact CD1-CD2 4.04Å; L1095-W1099 HydrophobicContact CD1-CE3 4.17Å; L1095-W1099 HydrophobicContact CD1-CH2 3.73Å; L1095-W1099 HydrophobicContact CD1-CZ2 3.57Å; L1095-W1099 HydrophobicContact CD1-CZ3 4.02Å; L1095-W1099 HydrophobicContact CD2-CZ3 4.36Å; L1095-W1099 HydrophobicContact CG-CD2 4.41Å; L1095-W1099 HydrophobicContact CG-CE3 4.18Å; L1095-W1099 HydrophobicContact CG-CH2 4.3Å; L1095-W1099 HydrophobicContact CG-CZ3 4.12Å; L1095-W1099 PolarHBondContact O-N 3.25Å; H1096-W1099 PolarHBondContact O-N 3.04Å; W1099-Y1102 PolarHBondContact O-N 3.19Å; W1099-R1103 VanDerWaalsContact O-CB 3.28Å; W1099-R1103 WeakPolarHBondContact O-CB 3.44Å; W1099-R1103 WeakPolarHBondContact O-CD 3.35Å; W1099-R1103 WeakPolarHBondContact O-CG 3.47Å; W1099-R1103 PolarHBondContact O-N 3.04Å; W1099-R1162 HydrophobicContact CH2-CG 4.31Å; W1099-R1162 HydrophobicContact CZ2-CB 4.4Å; W1099-R1162 HydrophobicContact CZ2-CG 4.15Å; W1099-H1163 AromaticContact CD1-CE1 3.22Å; W1099-H1163 AromaticContact CD1-ND1 3.81Å; W1099-H1163 AromaticContact CD1-NE2 3.17Å; W1099-H1163 AromaticContact NE1-CE1 3.71Å; W1099-H1163 AromaticContact NE1-NE2 3.89Å; W1099-I1164 PolarHBondContact NE1-O 2.83Å; W1099-E1166 HydrophobicContact CH2-CB 4.19Å; W1099-E1166 HydrophobicContact CZ2-CB 4.25Å; W1099-L1169 VanDerWaalsContact NE1-CD1 3.33Å
1100	S	92.7	Very high	92.9	Very high	1 Å²	1	8.9 Å²	8.9	1%	0.007	4%	0.037	C	C	.	.	H	α-helix	trans	-61	-49.3	-177.8	-60.9	0	0	0	0	112.4	A447 H1096 Y1102 I1104	A447-S1100 WeakPolarHBondContact O-CB 3.39Å; H1096-S1100 WeakPolarHBondContact O-CB 3.25Å; H1096-S1100 PolarHBondContact O-N 3.46Å; H1096-S1100 PolarHBondContact O-OG 3.31Å; S1100-Y1102 PolarHBondContact O-N 3.35Å; S1100-I1104 WeakPolarHBondContact O-CG1 3.34Å; S1100-I1104 PolarHBondContact O-N 2.92Å; S1100-I1104 VanDerWaalsContact O-N 3.1Å
1101	Y	92.6	Very high	92.8	Very high	1 Å²	1	6.2 Å²	6.2	0%	0.004	3%	0.025	C	C	.	.	H	α-helix	trans	-60.5	-45.2	176	172.9	-90.6	0	0	0	111.9	Q452 G1097 T1105 I1179 Q1182 A1183 N1184	Q452-Y1101 HydrophobicContact CG-CD2 3.67Å; Q452-Y1101 HydrophobicContact CG-CE2 3.86Å; Q452-Y1101 HydrophobicContact CG-CG 4.46Å; Q452-Y1101 VanDerWaalsContact NE2-CZ 3.27Å; G1097-Y1101 WeakPolarHBondContact O-CB 3.21Å; G1097-Y1101 PolarHBondContact O-N 2.91Å; G1097-Y1101 VanDerWaalsContact O-N 3.09Å; Y1101-T1105 HydrophobicContact CD1-CG2 4.48Å; Y1101-T1105 HydrophobicContact CD2-CG2 3.9Å; Y1101-T1105 HydrophobicContact CE1-CG2 4.05Å; Y1101-T1105 HydrophobicContact CE2-CG2 3.42Å; Y1101-T1105 VanDerWaalsContact CE2-CG2 3.42Å; Y1101-T1105 HydrophobicContact CG-CG2 4.38Å; Y1101-T1105 VanDerWaalsContact CZ-CG2 3.46Å; Y1101-T1105 WeakPolarHBondContact O-CB 3.44Å; Y1101-T1105 WeakPolarHBondContact O-CG2 3.39Å; Y1101-T1105 PolarHBondContact O-N 3.05Å; Y1101-T1105 VanDerWaalsContact O-N 3.08Å; Y1101-T1105 PolarHBondContact O-OG1 3.35Å; Y1101-I1179 HydrophobicContact CD1-CB 3.78Å; Y1101-I1179 HydrophobicContact CD1-CD1 3.95Å; Y1101-I1179 HydrophobicContact CD1-CG1 4.41Å; Y1101-I1179 HydrophobicContact CD1-CG2 4.2Å; Y1101-I1179 HydrophobicContact CE1-CB 3.89Å; Y1101-I1179 HydrophobicContact CE1-CG2 4.35Å; Y1101-I1179 HydrophobicContact CG-CD1 4.42Å; Y1101-Q1182 HydrophobicContact CE2-CB 4.47Å; Y1101-Q1182 HydrophobicContact CE2-CG 4.26Å; Y1101-Q1182 WeakPolarHBondContact OH-CA 3.47Å; Y1101-A1183 PolarHBondContact OH-N 3.2Å; Y1101-N1184 HydrophobicContact CE1-CB 4.39Å; Y1101-N1184 PolarHBondContact OH-N 3.47Å
1102	Y	91.4	Very high	92.7	Very high	25 Å²	25	5.1 Å²	5.1	10%	0.098	2%	0.021	C	C	.	.	H	α-helix	trans	-63.9	-49.3	-179.1	-173.2	-88.9	0	0	0	111.6	H1098 W1099 S1100 I1104 T1105 I1106 Y1157 H1163	H1098-Y1102 VanDerWaalsContact O-CB 3.27Å; H1098-Y1102 WeakPolarHBondContact O-CB 3.46Å; H1098-Y1102 PolarHBondContact O-N 3.45Å; W1099-Y1102 PolarHBondContact O-N 3.19Å; S1100-Y1102 PolarHBondContact O-N 3.35Å; Y1102-I1104 PolarHBondContact O-N 2.94Å; Y1102-T1105 PolarHBondContact O-N 3.4Å; Y1102-T1105 PolarHBondContact O-OG1 3.01Å; Y1102-I1106 HydrophobicContact CD1-CG1 4.14Å; Y1102-I1106 HydrophobicContact CD2-CG1 4.47Å; Y1102-I1106 HydrophobicContact CE1-CG1 3.81Å; Y1102-I1106 HydrophobicContact CE2-CD1 4.42Å; Y1102-I1106 HydrophobicContact CE2-CG1 4.16Å; Y1102-I1106 HydrophobicContact CG-CG1 4.46Å; Y1102-I1106 WeakPolarHBondContact O-CG1 3.43Å; Y1102-I1106 PolarHBondContact O-N 2.88Å; Y1102-Y1157 WeakPolarHBondContact CE1-OH 3.19Å; Y1102-H1163 HydrophobicContact CD1-CB 3.86Å; Y1102-H1163 AromaticContact CD1-CE1 3.96Å; Y1102-H1163 AromaticContact CD1-CG 3.55Å; Y1102-H1163 AromaticContact CD1-ND1 3.76Å; Y1102-H1163 AromaticContact CD2-CD2 3.76Å; Y1102-H1163 HydrophobicContact CE1-CB 3.43Å; Y1102-H1163 VanDerWaalsContact CE1-CB 3.43Å; Y1102-H1163 AromaticContact CE1-CD2 3.98Å; Y1102-H1163 AromaticContact CE1-CG 3.56Å; Y1102-H1163 AromaticContact CE2-CD2 3.73Å; Y1102-H1163 AromaticContact CG-CD2 3.91Å; Y1102-H1163 AromaticContact CG-CG 3.86Å; Y1102-H1163 AromaticContact CG-ND1 3.9Å; Y1102-H1163 AromaticContact CZ-CD2 3.84Å; Y1102-H1163 AromaticContact CZ-CG 3.88Å
1103	R	92.9	Very high	92.6	Very high	17 Å²	17	5.1 Å²	5.1	6%	0.064	2%	0.021	C	C	.	.	H	α-helix	trans	-55.2	-52.6	178.6	-78.7	168.4	-177.7	-179.8	0.1	112.8	W1099 T1107 G1158 M1159 E1161	W1099-R1103 VanDerWaalsContact O-CB 3.28Å; W1099-R1103 WeakPolarHBondContact O-CB 3.44Å; W1099-R1103 WeakPolarHBondContact O-CD 3.35Å; W1099-R1103 WeakPolarHBondContact O-CG 3.47Å; W1099-R1103 PolarHBondContact O-N 3.04Å; R1103-T1107 WeakPolarHBondContact O-CB 3.25Å; R1103-T1107 PolarHBondContact O-N 3.29Å; R1103-T1107 PolarHBondContact O-OG1 2.96Å; R1103-G1158 WeakPolarHBondContact CB-O 3.28Å; R1103-G1158 WeakPolarHBondContact CD-O 3.47Å; R1103-M1159 PolarHBondContact NH1-O 3.36Å; R1103-E1161 VanDerWaalsContact CZ-O 3.27Å; R1103-E1161 PolarHBondContact NE-O 3.49Å; R1103-E1161 PolarHBondContact NH2-O 3.36Å
1104	I	91.9	Very high	92.5	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-66.4	-42.8	-177.4	-70.4	164.9	0	0	0	110.7	I413 Q417 L420 D448 S1100 Y1102 T1107 M1108	I413-I1104 HydrophobicContact CG1-CG2 4.41Å; I413-I1104 HydrophobicContact CG2-CG2 3.88Å; Q417-I1104 HydrophobicContact CG-CD1 3.73Å; L420-I1104 HydrophobicContact CD1-CD1 3.75Å; L420-I1104 HydrophobicContact CD1-CG1 4.1Å; D448-I1104 HydrophobicContact CB-CD1 3.9Å; S1100-I1104 WeakPolarHBondContact O-CG1 3.34Å; S1100-I1104 PolarHBondContact O-N 2.92Å; S1100-I1104 VanDerWaalsContact O-N 3.1Å; Y1102-I1104 PolarHBondContact O-N 2.94Å; I1104-T1107 WeakPolarHBondContact O-CB 3.21Å; I1104-T1107 PolarHBondContact O-N 3.25Å; I1104-M1108 HydrophobicContact CG2-SD 4.36Å; I1104-M1108 WeakPolarHBondContact O-CG 3.39Å; I1104-M1108 PolarHBondContact O-N 3.05Å
1105	T	91.8	Very high	92.4	Very high	0 Å²	0	5 Å²	5	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-72.2	-36.3	-175.7	57.1	0	0	0	0	113.5	Y1101 Y1102 L1109 N1184 L1185	Y1101-T1105 HydrophobicContact CD1-CG2 4.48Å; Y1101-T1105 HydrophobicContact CD2-CG2 3.9Å; Y1101-T1105 HydrophobicContact CE1-CG2 4.05Å; Y1101-T1105 HydrophobicContact CE2-CG2 3.42Å; Y1101-T1105 VanDerWaalsContact CE2-CG2 3.42Å; Y1101-T1105 HydrophobicContact CG-CG2 4.38Å; Y1101-T1105 VanDerWaalsContact CZ-CG2 3.46Å; Y1101-T1105 WeakPolarHBondContact O-CB 3.44Å; Y1101-T1105 WeakPolarHBondContact O-CG2 3.39Å; Y1101-T1105 PolarHBondContact O-N 3.05Å; Y1101-T1105 VanDerWaalsContact O-N 3.08Å; Y1101-T1105 PolarHBondContact O-OG1 3.35Å; Y1102-T1105 PolarHBondContact O-N 3.4Å; Y1102-T1105 PolarHBondContact O-OG1 3.01Å; T1105-L1109 WeakPolarHBondContact O-CG 3.28Å; T1105-L1109 PolarHBondContact O-N 3.3Å; T1105-N1184 WeakPolarHBondContact OG1-CB 3.47Å; T1105-N1184 PolarHBondContact OG1-ND2 3.34Å; T1105-L1185 HydrophobicContact CG2-CD1 3.83Å; T1105-L1185 HydrophobicContact CG2-CD2 4.43Å; T1105-L1185 HydrophobicContact CG2-CG 3.92Å
1106	I	91.9	Very high	92.4	Very high	1 Å²	1	5.5 Å²	5.5	1%	0.005	2%	0.024	C	C	.	.	H	α-helix	trans	-70.5	-37.3	171.8	-60.1	-60.9	0	0	0	110.9	Y1102 M1108 L1109 F1110 Y1157	Y1102-I1106 HydrophobicContact CD1-CG1 4.14Å; Y1102-I1106 HydrophobicContact CD2-CG1 4.47Å; Y1102-I1106 HydrophobicContact CE1-CG1 3.81Å; Y1102-I1106 HydrophobicContact CE2-CD1 4.42Å; Y1102-I1106 HydrophobicContact CE2-CG1 4.16Å; Y1102-I1106 HydrophobicContact CG-CG1 4.46Å; Y1102-I1106 WeakPolarHBondContact O-CG1 3.43Å; Y1102-I1106 PolarHBondContact O-N 2.88Å; I1106-M1108 VanDerWaalsContact C-N 3.35Å; I1106-M1108 PolarHBondContact O-N 3.15Å; I1106-L1109 HydrophobicContact CD1-CD1 4.09Å; I1106-L1109 PolarHBondContact O-N 3.33Å; I1106-L1109 VanDerWaalsContact O-N 3.13Å; I1106-F1110 HydrophobicContact CG2-CD2 3.96Å; I1106-F1110 HydrophobicContact CG2-CE2 3.54Å; I1106-F1110 HydrophobicContact CG2-CZ 4.15Å; I1106-F1110 WeakPolarHBondContact O-CD2 3.35Å; I1106-F1110 PolarHBondContact O-N 3.24Å; I1106-Y1157 HydrophobicContact CB-CE1 3.71Å; I1106-Y1157 HydrophobicContact CG2-CD1 4.15Å; I1106-Y1157 HydrophobicContact CG2-CE1 3.36Å
1107	T	92.3	Very high	92.4	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-55.6	-49.1	171.8	-60.1	0	0	0	0	111.1	T412 Q416 R1103 I1104 L1109 F1110 F1111 G1158	T412-T1107 HydrophobicContact CG2-CG2 4.3Å; Q416-T1107 PolarHBondContact NE2-OG1 3.42Å; R1103-T1107 WeakPolarHBondContact O-CB 3.25Å; R1103-T1107 PolarHBondContact O-N 3.29Å; R1103-T1107 PolarHBondContact O-OG1 2.96Å; I1104-T1107 WeakPolarHBondContact O-CB 3.21Å; I1104-T1107 PolarHBondContact O-N 3.25Å; T1107-L1109 VanDerWaalsContact C-N 3.28Å; T1107-L1109 PolarHBondContact O-N 3.02Å; T1107-F1110 PolarHBondContact O-N 3.13Å; T1107-F1110 VanDerWaalsContact O-N 3.15Å; T1107-F1111 HydrophobicContact CG2-CD2 3.83Å; T1107-F1111 HydrophobicContact CG2-CE2 3.71Å; T1107-F1111 WeakPolarHBondContact O-CD2 3.35Å; T1107-F1111 PolarHBondContact O-N 3.24Å; T1107-G1158 WeakPolarHBondContact OG1-CA 3.3Å
1108	M	91.2	Very high	92.4	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-54.8	-42.2	175.9	-72.5	175.1	73.3	0	0	112.7	R340 S344 I409 I413 I1104 I1106 F1111 Y1112 L1185	R340-M1108 HydrophobicContact CG-SD 4.02Å; S344-M1108 VanDerWaalsContact OG-CE 3.25Å; S344-M1108 WeakPolarHBondContact OG-CE 3.37Å; I409-M1108 HydrophobicContact CD1-CG 4.45Å; I413-M1108 HydrophobicContact CD1-CG 3.5Å; I413-M1108 VanDerWaalsContact CD1-CG 3.5Å; I413-M1108 HydrophobicContact CD1-SD 4.01Å; I413-M1108 HydrophobicContact CG1-CG 4.35Å; I1104-M1108 HydrophobicContact CG2-SD 4.36Å; I1104-M1108 WeakPolarHBondContact O-CG 3.39Å; I1104-M1108 PolarHBondContact O-N 3.05Å; I1106-M1108 VanDerWaalsContact C-N 3.35Å; I1106-M1108 PolarHBondContact O-N 3.15Å; M1108-F1111 WeakPolarHBondContact O-CB 3.35Å; M1108-F1111 PolarHBondContact O-N 2.73Å; M1108-Y1112 HydrophobicContact CB-CE2 4.2Å; M1108-Y1112 HydrophobicContact CE-CE2 4.44Å; M1108-Y1112 WeakPolarHBondContact CE-OH 3.38Å; M1108-Y1112 WeakPolarHBondContact O-CD2 3.28Å; M1108-Y1112 PolarHBondContact O-N 2.98Å; M1108-L1185 HydrophobicContact CE-CD1 4.47Å; M1108-L1185 HydrophobicContact SD-CD1 4.3Å
1109	L	92.2	Very high	92.4	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-67.5	-37.3	178.9	-67.8	164.8	0	0	0	112.5	T1105 I1106 T1107 F1111 Y1112 H1113 Y1189 I1190 W1193	T1105-L1109 WeakPolarHBondContact O-CG 3.28Å; T1105-L1109 PolarHBondContact O-N 3.3Å; I1106-L1109 HydrophobicContact CD1-CD1 4.09Å; I1106-L1109 PolarHBondContact O-N 3.33Å; I1106-L1109 VanDerWaalsContact O-N 3.13Å; T1107-L1109 VanDerWaalsContact C-N 3.28Å; T1107-L1109 PolarHBondContact O-N 3.02Å; L1109-F1111 VanDerWaalsContact C-N 3.34Å; L1109-Y1112 PolarHBondContact O-N 3.3Å; L1109-H1113 VanDerWaalsContact O-CB 3.3Å; L1109-H1113 WeakPolarHBondContact O-CB 3.37Å; L1109-H1113 PolarHBondContact O-N 3.49Å; L1109-Y1189 HydrophobicContact CD1-CD1 3.84Å; L1109-Y1189 HydrophobicContact CD1-CE1 3.52Å; L1109-I1190 HydrophobicContact CD2-CG1 3.91Å; L1109-W1193 HydrophobicContact CB-CD2 3.93Å; L1109-W1193 HydrophobicContact CB-CE3 4.3Å; L1109-W1193 HydrophobicContact CB-CG 4.16Å; L1109-W1193 HydrophobicContact CB-CZ2 4.46Å; L1109-W1193 HydrophobicContact CD2-CB 4.35Å; L1109-W1193 HydrophobicContact CD2-CG 4.06Å
1110	F	92.2	Very high	92.5	Very high	10 Å²	10	4.3 Å²	4.3	4%	0.044	2%	0.021	C	C	.	.	H	α-helix	trans	-61.9	-40.6	170.6	-73.2	-54.9	0	0	0	112.2	I1106 T1107 H1113 K1114 Y1157 W1193 W1259	I1106-F1110 HydrophobicContact CG2-CD2 3.96Å; I1106-F1110 HydrophobicContact CG2-CE2 3.54Å; I1106-F1110 HydrophobicContact CG2-CZ 4.15Å; I1106-F1110 WeakPolarHBondContact O-CD2 3.35Å; I1106-F1110 PolarHBondContact O-N 3.24Å; T1107-F1110 PolarHBondContact O-N 3.13Å; T1107-F1110 VanDerWaalsContact O-N 3.15Å; F1110-H1113 PolarHBondContact O-N 2.91Å; F1110-K1114 WeakPolarHBondContact O-CB 3.45Å; F1110-K1114 WeakPolarHBondContact O-CG 3.39Å; F1110-K1114 PolarHBondContact O-N 3.3Å; F1110-Y1157 HydrophobicContact CD2-CD1 4.4Å; F1110-Y1157 AromaticContact CE2-CD1 3.83Å; F1110-Y1157 HydrophobicContact CE2-CD1 3.83Å; F1110-Y1157 AromaticContact CE2-CD2 3.94Å; F1110-Y1157 HydrophobicContact CE2-CD2 3.94Å; F1110-Y1157 HydrophobicContact CE2-CE1 4.06Å; F1110-Y1157 HydrophobicContact CE2-CE2 4.13Å; F1110-Y1157 AromaticContact CE2-CG 3.79Å; F1110-Y1157 HydrophobicContact CE2-CG 3.79Å; F1110-Y1157 HydrophobicContact CZ-CD2 4.46Å; F1110-Y1157 HydrophobicContact CZ-CE2 4.46Å; F1110-W1193 HydrophobicContact CD1-CH2 4.14Å; F1110-W1193 AromaticContact CD1-CZ3 3.73Å; F1110-W1193 HydrophobicContact CD1-CZ3 3.73Å; F1110-W1193 AromaticContact CE1-CH2 3.84Å; F1110-W1193 HydrophobicContact CE1-CH2 3.84Å; F1110-W1193 AromaticContact CE1-CZ3 3.8Å; F1110-W1193 HydrophobicContact CE1-CZ3 3.8Å; F1110-W1193 HydrophobicContact CZ-CH2 4.36Å; F1110-W1259 HydrophobicContact CE1-CB 4.38Å; F1110-W1259 HydrophobicContact CZ-CB 3.77Å; F1110-W1259 HydrophobicContact CZ-CG 4.4Å
1111	F	91.7	Very high	92.5	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-62.9	-41.9	175	-87.4	-84.2	0	0	0	112.6	P406 I409 T412 T1107 M1108 L1109 K1114 A1115	P406-F1111 HydrophobicContact CB-CD1 3.91Å; P406-F1111 HydrophobicContact CG-CB 4.1Å; P406-F1111 HydrophobicContact CG-CD1 3.99Å; I409-F1111 HydrophobicContact CB-CB 4.37Å; I409-F1111 HydrophobicContact CB-CD1 4.02Å; I409-F1111 HydrophobicContact CB-CG 4.1Å; I409-F1111 HydrophobicContact CD1-CB 3.71Å; I409-F1111 HydrophobicContact CD1-CG 4.25Å; I409-F1111 HydrophobicContact CG1-CB 3.89Å; I409-F1111 HydrophobicContact CG1-CD1 4.3Å; I409-F1111 HydrophobicContact CG1-CD2 4.11Å; I409-F1111 HydrophobicContact CG1-CG 3.85Å; T412-F1111 HydrophobicContact CG2-CE2 3.8Å; T412-F1111 HydrophobicContact CG2-CZ 3.98Å; T412-F1111 VanDerWaalsContact OG1-CZ 3.29Å; T412-F1111 WeakPolarHBondContact OG1-CZ 3.35Å; T1107-F1111 HydrophobicContact CG2-CD2 3.83Å; T1107-F1111 HydrophobicContact CG2-CE2 3.71Å; T1107-F1111 WeakPolarHBondContact O-CD2 3.35Å; T1107-F1111 PolarHBondContact O-N 3.24Å; M1108-F1111 WeakPolarHBondContact O-CB 3.35Å; M1108-F1111 PolarHBondContact O-N 2.73Å; L1109-F1111 VanDerWaalsContact C-N 3.34Å; F1111-K1114 VanDerWaalsContact CD1-CE 3.44Å; F1111-K1114 VanDerWaalsContact CE1-NZ 3.29Å; F1111-K1114 WeakPolarHBondContact O-CG 3.35Å; F1111-A1115 VanDerWaalsContact O-CB 3.28Å; F1111-A1115 WeakPolarHBondContact O-CB 3.36Å; F1111-A1115 PolarHBondContact O-N 3.46Å
1112	Y	91.8	Very high	92.4	Very high	3 Å²	3	4.3 Å²	4.3	1%	0.012	2%	0.021	C	C	.	.	H	α-helix	trans	-67.5	-45.9	175.5	-60	-40.1	0	0	0	112.1	I347 L348 F351 I409 M1108 L1109 A1115 V1116	I347-Y1112 HydrophobicContact CD1-CE2 4.41Å; I347-Y1112 HydrophobicContact CG2-CE1 4.09Å; I347-Y1112 HydrophobicContact CG2-CE2 3.82Å; I347-Y1112 WeakPolarHBondContact CG2-OH 3.05Å; L348-Y1112 HydrophobicContact CD2-CE1 4.29Å; F351-Y1112 HydrophobicContact CD2-CD1 4.19Å; F351-Y1112 HydrophobicContact CD2-CE1 4.24Å; F351-Y1112 AromaticContact CE2-CD1 3.57Å; F351-Y1112 HydrophobicContact CE2-CD1 3.57Å; F351-Y1112 HydrophobicContact CE2-CD2 4.31Å; F351-Y1112 AromaticContact CE2-CE1 3.91Å; F351-Y1112 HydrophobicContact CE2-CE1 3.91Å; F351-Y1112 AromaticContact CE2-CG 3.81Å; F351-Y1112 HydrophobicContact CE2-CG 3.81Å; F351-Y1112 HydrophobicContact CZ-CD1 4.05Å; F351-Y1112 HydrophobicContact CZ-CG 4.03Å; I409-Y1112 HydrophobicContact CD1-CD1 4.43Å; I409-Y1112 HydrophobicContact CD1-CE1 3.82Å; M1108-Y1112 HydrophobicContact CB-CE2 4.2Å; M1108-Y1112 HydrophobicContact CE-CE2 4.44Å; M1108-Y1112 WeakPolarHBondContact CE-OH 3.38Å; M1108-Y1112 WeakPolarHBondContact O-CD2 3.28Å; M1108-Y1112 PolarHBondContact O-N 2.98Å; L1109-Y1112 PolarHBondContact O-N 3.3Å; Y1112-A1115 PolarHBondContact O-N 2.96Å; Y1112-V1116 WeakPolarHBondContact O-CB 3.27Å; Y1112-V1116 VanDerWaalsContact O-CG2 3.25Å; Y1112-V1116 WeakPolarHBondContact O-CG2 3.27Å; Y1112-V1116 PolarHBondContact O-N 2.81Å
1113	H	93.5	Very high	92.4	Very high	1 Å²	1	5.4 Å²	5.4	1%	0.005	3%	0.028	C	C	.	.	H	α-helix	trans	-58.4	-49.9	178.3	166.5	88.8	0	0	0	112.3	L1109 F1110 A1115 V1116 A1117 W1193 D1196 G1197 H1200	L1109-H1113 VanDerWaalsContact O-CB 3.3Å; L1109-H1113 WeakPolarHBondContact O-CB 3.37Å; L1109-H1113 PolarHBondContact O-N 3.49Å; F1110-H1113 PolarHBondContact O-N 2.91Å; H1113-A1115 PolarHBondContact O-N 3.03Å; H1113-V1116 PolarHBondContact O-N 3.45Å; H1113-A1117 WeakPolarHBondContact O-CB 3.5Å; H1113-A1117 PolarHBondContact O-N 2.92Å; H1113-W1193 HydrophobicContact CB-CE3 3.9Å; H1113-D1196 PolarHBondContact CE1-O 3.41Å; H1113-D1196 IonicContact CE1-OD2 2.71Å; H1113-D1196 PolarHBondContact CE1-OD2 3.47Å; H1113-D1196 IonicContact ND1-OD2 2.82Å; H1113-D1196 PolarHBondContact ND1-OD2 3.18Å; H1113-G1197 WeakPolarHBondContact ND1-CA 3.47Å; H1113-G1197 PolarHBondContact ND1-N 3.37Å; H1113-H1200 AromaticContact CE1-CD2 3.59Å; H1113-H1200 AromaticContact CE1-CG 3.75Å; H1113-H1200 AromaticContact CE1-NE2 3.94Å; H1113-H1200 AromaticContact NE2-CG 3.9Å; H1113-H1200 AromaticContact NE2-ND1 3.91Å
1114	K	92.6	Very high	92.4	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-66.1	-37.1	-178.7	78.9	-176.6	-168.3	176.5	0	112.5	F1110 F1111 A1117 F1118 Y1145 N1146 T1150 V1252	F1110-K1114 WeakPolarHBondContact O-CB 3.45Å; F1110-K1114 WeakPolarHBondContact O-CG 3.39Å; F1110-K1114 PolarHBondContact O-N 3.3Å; F1111-K1114 VanDerWaalsContact CD1-CE 3.44Å; F1111-K1114 VanDerWaalsContact CE1-NZ 3.29Å; F1111-K1114 WeakPolarHBondContact O-CG 3.35Å; K1114-A1117 PolarHBondContact O-N 3.16Å; K1114-F1118 VanDerWaalsContact O-CB 3.28Å; K1114-F1118 WeakPolarHBondContact O-CB 3.45Å; K1114-F1118 PolarHBondContact O-N 3.07Å; K1114-Y1145 HydrophobicContact CB-CE1 4.21Å; K1114-Y1145 HydrophobicContact CG-CE1 4.28Å; K1114-Y1145 PolarHBondContact O-OH 3.45Å; K1114-N1146 WeakPolarHBondContact CE-OD1 3.22Å; K1114-T1150 WeakPolarHBondContact CD-OG1 3.24Å; K1114-T1150 WeakPolarHBondContact CE-OG1 3.48Å; K1114-T1150 PolarHBondContact NZ-OG1 3.3Å; K1114-V1252 HydrophobicContact CB-CG1 3.75Å
1115	A	91.9	Very high	92.3	Very high	1 Å²	1	5.2 Å²	5.2	1%	0.008	3%	0.029	C	C	.	.	H	α-helix	trans	-66.9	-44.3	177.1	0	0	0	0	0	111.5	L404 P406 F1111 Y1112 H1113 F1118 V1119	L404-A1115 WeakPolarHBondContact O-CB 3.25Å; P406-A1115 HydrophobicContact CG-CB 4.24Å; F1111-A1115 VanDerWaalsContact O-CB 3.28Å; F1111-A1115 WeakPolarHBondContact O-CB 3.36Å; F1111-A1115 PolarHBondContact O-N 3.46Å; Y1112-A1115 PolarHBondContact O-N 2.96Å; H1113-A1115 PolarHBondContact O-N 3.03Å; A1115-F1118 PolarHBondContact O-N 2.87Å; A1115-V1119 WeakPolarHBondContact O-CG2 3.42Å; A1115-V1119 PolarHBondContact O-N 2.87Å
1116	V	94.3	Very high	92.2	Very high	10 Å²	10	5.4 Å²	5.4	6%	0.061	3%	0.03	C	C	.	.	H	α-helix	trans	-63.1	-43.2	174.3	172.5	0	0	0	0	111.4	F351 L404 Y1112 H1113 V1119 C1120 V1194 I1198	F351-V1116 HydrophobicContact CE1-CG2 3.88Å; L404-V1116 HydrophobicContact CD1-CG2 3.83Å; Y1112-V1116 WeakPolarHBondContact O-CB 3.27Å; Y1112-V1116 VanDerWaalsContact O-CG2 3.25Å; Y1112-V1116 WeakPolarHBondContact O-CG2 3.27Å; Y1112-V1116 PolarHBondContact O-N 2.81Å; H1113-V1116 PolarHBondContact O-N 3.45Å; V1116-V1119 PolarHBondContact O-N 3.18Å; V1116-C1120 WeakPolarHBondContact O-CB 3.36Å; V1116-C1120 PolarHBondContact O-N 3.4Å; V1116-V1194 HydrophobicContact CG1-CG1 4.18Å; V1116-V1194 WeakPolarHBondContact CG1-O 3.49Å; V1116-V1194 HydrophobicContact CG2-CG1 4.35Å; V1116-V1194 HydrophobicContact CG2-CG2 4.35Å; V1116-I1198 HydrophobicContact CG1-CG1 3.74Å
1117	A	94.5	Very high	92.1	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-63.8	-42.2	178.4	0	0	0	0	0	112.3	H1113 K1114 N1121 G1197 H1200 G1201 L1248	H1113-A1117 WeakPolarHBondContact O-CB 3.5Å; H1113-A1117 PolarHBondContact O-N 2.92Å; K1114-A1117 PolarHBondContact O-N 3.16Å; A1117-N1121 WeakPolarHBondContact O-CB 3.44Å; A1117-N1121 PolarHBondContact O-N 3.49Å; A1117-G1197 WeakPolarHBondContact CA-O 3.13Å; A1117-G1197 VanDerWaalsContact CB-O 3.25Å; A1117-G1197 WeakPolarHBondContact CB-O 3.24Å; A1117-H1200 HydrophobicContact CB-CB 3.85Å; A1117-G1201 VanDerWaalsContact O-CA 3.24Å; A1117-G1201 WeakPolarHBondContact O-CA 3.47Å; A1117-L1248 HydrophobicContact CB-CD1 3.79Å
1118	F	92.7	Very high	91.8	Very high	1 Å²	1	14.9 Å²	14.9	0%	0.004	7%	0.071	C	C	.	.	H	α-helix	trans	-63.5	-46.9	175.6	-174.3	-89.8	0	0	0	112.7	Y403 K1114 A1115 N1121 Q1122 F1137 F1142 Y1145 F1245 L1248	Y403-F1118 HydrophobicContact CG-CE1 4.22Å; K1114-F1118 VanDerWaalsContact O-CB 3.28Å; K1114-F1118 WeakPolarHBondContact O-CB 3.45Å; K1114-F1118 PolarHBondContact O-N 3.07Å; A1115-F1118 PolarHBondContact O-N 2.87Å; F1118-N1121 WeakPolarHBondContact O-CB 3.31Å; F1118-N1121 PolarHBondContact O-N 3.03Å; F1118-Q1122 HydrophobicContact CE1-CG 4.38Å; F1118-Q1122 PolarHBondContact O-N 3.44Å; F1118-F1137 HydrophobicContact CE2-CE2 4.02Å; F1118-F1137 AromaticContact CE2-CZ 3.64Å; F1118-F1137 HydrophobicContact CE2-CZ 3.64Å; F1118-F1137 AromaticContact CZ-CE2 3.89Å; F1118-F1137 HydrophobicContact CZ-CE2 3.89Å; F1118-F1137 AromaticContact CZ-CZ 3.74Å; F1118-F1137 HydrophobicContact CZ-CZ 3.74Å; F1118-F1142 AromaticContact CE1-CD1 3.39Å; F1118-F1142 HydrophobicContact CE1-CD1 3.39Å; F1118-F1142 AromaticContact CE1-CE1 3.65Å; F1118-F1142 HydrophobicContact CE1-CE1 3.65Å; F1118-F1142 HydrophobicContact CE1-CG 4.12Å; F1118-F1142 HydrophobicContact CZ-CB 4.16Å; F1118-F1142 AromaticContact CZ-CD1 3.43Å; F1118-F1142 HydrophobicContact CZ-CD1 3.43Å; F1118-F1142 VanDerWaalsContact CZ-CD1 3.43Å; F1118-F1142 HydrophobicContact CZ-CD2 4.29Å; F1118-F1142 AromaticContact CZ-CE1 3.78Å; F1118-F1142 HydrophobicContact CZ-CE1 3.78Å; F1118-F1142 AromaticContact CZ-CG 3.7Å; F1118-F1142 HydrophobicContact CZ-CG 3.7Å; F1118-F1142 HydrophobicContact CZ-CZ 4.33Å; F1118-Y1145 HydrophobicContact CB-CD1 4.24Å; F1118-Y1145 HydrophobicContact CB-CE1 3.76Å; F1118-Y1145 AromaticContact CD2-CD1 3.64Å; F1118-Y1145 HydrophobicContact CD2-CD1 3.64Å; F1118-Y1145 AromaticContact CD2-CD2 3.86Å; F1118-Y1145 HydrophobicContact CD2-CD2 3.86Å; F1118-Y1145 AromaticContact CD2-CE1 3.87Å; F1118-Y1145 HydrophobicContact CD2-CE1 3.87Å; F1118-Y1145 HydrophobicContact CD2-CE2 4.07Å; F1118-Y1145 AromaticContact CD2-CG 3.65Å; F1118-Y1145 HydrophobicContact CD2-CG 3.65Å; F1118-Y1145 HydrophobicContact CE2-CD1 4.27Å; F1118-Y1145 HydrophobicContact CE2-CD2 4.25Å; F1118-Y1145 AromaticContact CE2-CG 3.94Å; F1118-Y1145 HydrophobicContact CE2-CG 3.94Å; F1118-Y1145 HydrophobicContact CG-CD1 4.03Å; F1118-Y1145 HydrophobicContact CG-CE1 4.05Å; F1118-Y1145 HydrophobicContact CG-CG 4.47Å; F1118-F1245 HydrophobicContact CE2-CD2 4.29Å; F1118-F1245 HydrophobicContact CE2-CE2 4.16Å; F1118-L1248 HydrophobicContact CB-CD2 4.17Å; F1118-L1248 HydrophobicContact CD2-CD2 3.92Å; F1118-L1248 HydrophobicContact CG-CD2 4.48Å
1119	V	92.1	Very high	91.4	Very high	5 Å²	5	16.4 Å²	16.4	3%	0.03	8%	0.079	C	C	.	.	H	α-helix	trans	-66.4	-43.6	176.5	170	0	0	0	0	111.3	I401 L404 A1115 V1116 N1121 Q1122 L1123	I401-V1119 HydrophobicContact CG1-CG1 4.4Å; I401-V1119 HydrophobicContact CG2-CG1 3.94Å; L404-V1119 HydrophobicContact CB-CG2 3.98Å; L404-V1119 HydrophobicContact CD1-CB 4.31Å; L404-V1119 HydrophobicContact CD1-CG2 4.3Å; L404-V1119 VanDerWaalsContact N-CG2 3.35Å; A1115-V1119 WeakPolarHBondContact O-CG2 3.42Å; A1115-V1119 PolarHBondContact O-N 2.87Å; V1116-V1119 PolarHBondContact O-N 3.18Å; V1119-N1121 VanDerWaalsContact C-N 3.27Å; V1119-N1121 PolarHBondContact O-N 3.09Å; V1119-Q1122 CarbonylContact O-C 3.5Å; V1119-Q1122 WeakPolarHBondContact O-CA 3.44Å; V1119-Q1122 WeakPolarHBondContact O-CB 3.34Å; V1119-Q1122 PolarHBondContact O-N 3.32Å; V1119-L1123 HydrophobicContact CG1-CD1 4.38Å; V1119-L1123 HydrophobicContact CG1-CG 4.22Å; V1119-L1123 WeakPolarHBondContact O-CG 3.48Å; V1119-L1123 PolarHBondContact O-N 2.99Å
1120	C	93.9	Very high	91	Very high	15 Å²	15	17.1 Å²	17.1	10%	0.101	9%	0.086	C	C	.	.	H	α-helix	trans	-59.5	-38.4	178.2	180	0	0	0	0	112.3	V1116 L1123 C1124 I1198	V1116-C1120 WeakPolarHBondContact O-CB 3.36Å; V1116-C1120 PolarHBondContact O-N 3.4Å; C1120-L1123 PolarHBondContact O-N 3.38Å; C1120-C1124 PolarHBondContact O-N 3.48Å; C1120-C1124 PolarHBondContact O-SG 3.34Å; C1120-I1198 PolarHBondContact SG-O 2.85Å; C1120-I1198 VanDerWaalsContact SG-O 3.38Å
1121	N	93.2	Very high	90.8	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.6	-47.1	172	-174.1	-87.7	0	0	0	111.6	A1117 F1118 V1119 L1123 C1124 V1125 T1204 S1244 L1248	A1117-N1121 WeakPolarHBondContact O-CB 3.44Å; A1117-N1121 PolarHBondContact O-N 3.49Å; F1118-N1121 WeakPolarHBondContact O-CB 3.31Å; F1118-N1121 PolarHBondContact O-N 3.03Å; V1119-N1121 VanDerWaalsContact C-N 3.27Å; V1119-N1121 PolarHBondContact O-N 3.09Å; N1121-L1123 PolarHBondContact O-N 3.33Å; N1121-C1124 WeakPolarHBondContact O-CB 3.26Å; N1121-C1124 PolarHBondContact O-N 3.11Å; N1121-V1125 WeakPolarHBondContact O-CG2 3.27Å; N1121-V1125 PolarHBondContact O-N 2.69Å; N1121-V1125 VanDerWaalsContact O-N 3.14Å; N1121-T1204 PolarHBondContact ND2-OG1 3.37Å; N1121-S1244 PolarHBondContact ND2-OG 2.95Å; N1121-L1248 HydrophobicContact CB-CD2 4.2Å
1122	Q	90	Very high	90.3	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.009	11%	0.105	C	C	.	.	H	α-helix	trans	-65.1	-33.9	174.7	-63.6	-57.7	-65.1	0	0	113.3	I400 F1118 V1119 C1124 V1125 I1126 F1137 F1142	I400-Q1122 HydrophobicContact CG2-CB 3.93Å; I400-Q1122 HydrophobicContact CG2-CG 4.26Å; F1118-Q1122 HydrophobicContact CE1-CG 4.38Å; F1118-Q1122 PolarHBondContact O-N 3.44Å; V1119-Q1122 CarbonylContact O-C 3.5Å; V1119-Q1122 WeakPolarHBondContact O-CA 3.44Å; V1119-Q1122 WeakPolarHBondContact O-CB 3.34Å; V1119-Q1122 PolarHBondContact O-N 3.32Å; Q1122-C1124 VanDerWaalsContact C-N 3.32Å; Q1122-C1124 PolarHBondContact O-N 2.99Å; Q1122-V1125 WeakPolarHBondContact O-CB 3.4Å; Q1122-V1125 PolarHBondContact O-N 3.16Å; Q1122-I1126 WeakPolarHBondContact O-CG1 3.47Å; Q1122-I1126 PolarHBondContact O-N 2.95Å; Q1122-F1137 VanDerWaalsContact NE2-CZ 3.27Å; Q1122-F1142 HydrophobicContact CG-CE1 4.24Å; Q1122-F1142 HydrophobicContact CG-CZ 4.31Å
1123	L	91.9	Very high	89.8	Confident	48 Å²	48	21.8 Å²	21.8	25%	0.251	11%	0.113	S	C	.	.	H	α-helix	trans	-64.7	-36.5	174	-64.5	-172.7	0	0	0	112.1	I358 I362 I401 V1119 C1120 N1121 I1126 Y1127	I358-L1123 HydrophobicContact CG2-CD1 4.14Å; I358-L1123 HydrophobicContact CG2-CD2 4.44Å; I362-L1123 HydrophobicContact CD1-CD2 3.33Å; I401-L1123 HydrophobicContact CD1-CD2 3.96Å; I401-L1123 HydrophobicContact CG1-CD2 4.1Å; V1119-L1123 HydrophobicContact CG1-CD1 4.38Å; V1119-L1123 HydrophobicContact CG1-CG 4.22Å; V1119-L1123 WeakPolarHBondContact O-CG 3.48Å; V1119-L1123 PolarHBondContact O-N 2.99Å; C1120-L1123 PolarHBondContact O-N 3.38Å; N1121-L1123 PolarHBondContact O-N 3.33Å; L1123-I1126 HydrophobicContact CD2-CD1 4.35Å; L1123-I1126 PolarHBondContact O-N 2.91Å; L1123-Y1127 PolarHBondContact O-N 3.2Å
1124	C	92.1	Very high	89.2	Confident	12 Å²	12	26.7 Å²	26.7	8%	0.081	14%	0.138	C	C	.	.	H	α-helix	trans	-67.6	-36.3	174.3	-59.6	0	0	0	0	111.9	C1120 N1121 Q1122 Y1127 N1128 Y1205 F1206	C1120-C1124 PolarHBondContact O-N 3.48Å; C1120-C1124 PolarHBondContact O-SG 3.34Å; N1121-C1124 WeakPolarHBondContact O-CB 3.26Å; N1121-C1124 PolarHBondContact O-N 3.11Å; Q1122-C1124 VanDerWaalsContact C-N 3.32Å; Q1122-C1124 PolarHBondContact O-N 2.99Å; C1124-Y1127 PolarHBondContact O-N 2.88Å; C1124-N1128 PolarHBondContact O-N 2.92Å; C1124-N1128 PolarHBondContact O-ND2 3.42Å; C1124-Y1205 HydrophobicContact CB-CD1 3.42Å; C1124-Y1205 VanDerWaalsContact CB-CD1 3.42Å; C1124-Y1205 HydrophobicContact CB-CD2 4.09Å; C1124-Y1205 HydrophobicContact CB-CE1 4Å; C1124-Y1205 HydrophobicContact CB-CG 3.49Å; C1124-Y1205 VanDerWaalsContact CB-CG 3.49Å; C1124-F1206 HydrophobicContact CB-CE2 4.09Å
1125	V	89.9	Confident	88.7	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	15%	0.147	C	C	.	.	H	α-helix	trans	-60.5	-53	171	175.6	0	0	0	0	110.6	N1121 Q1122 Y1127 N1128 N1129 S1136 Y1205 F1237	N1121-V1125 WeakPolarHBondContact O-CG2 3.27Å; N1121-V1125 PolarHBondContact O-N 2.69Å; N1121-V1125 VanDerWaalsContact O-N 3.14Å; Q1122-V1125 WeakPolarHBondContact O-CB 3.4Å; Q1122-V1125 PolarHBondContact O-N 3.16Å; V1125-Y1127 VanDerWaalsContact C-N 3.25Å; V1125-Y1127 PolarHBondContact O-N 3.46Å; V1125-N1128 PolarHBondContact O-N 2.92Å; V1125-N1129 VanDerWaalsContact O-CB 3.3Å; V1125-N1129 WeakPolarHBondContact O-CB 3.45Å; V1125-N1129 PolarHBondContact O-N 3.07Å; V1125-N1129 PolarHBondContact O-OD1 3.35Å; V1125-S1136 WeakPolarHBondContact CG2-OG 3.45Å; V1125-Y1205 HydrophobicContact CB-CE2 4.3Å; V1125-Y1205 HydrophobicContact CG2-CD2 3.75Å; V1125-Y1205 HydrophobicContact CG2-CE2 3.56Å; V1125-F1237 HydrophobicContact CG1-CE2 3.99Å; V1125-F1237 HydrophobicContact CG1-CZ 3.67Å
1126	I	90	Very high	88.1	Confident	4 Å²	4	28.3 Å²	28.3	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-58.6	-36.3	-179.7	-69.9	164.5	0	0	0	111.6	I362 F397 I400 Q1122 L1123 N1129 Y1131	I362-I1126 HydrophobicContact CG2-CG2 4.09Å; F397-I1126 HydrophobicContact CD1-CD1 4.05Å; F397-I1126 HydrophobicContact CE1-CD1 4.1Å; F397-I1126 HydrophobicContact CE1-CG1 4.35Å; F397-I1126 HydrophobicContact CE1-CG2 3.74Å; F397-I1126 HydrophobicContact CZ-CG2 4.41Å; I400-I1126 HydrophobicContact CD1-CD1 4.21Å; I400-I1126 HydrophobicContact CG2-CD1 4.14Å; Q1122-I1126 WeakPolarHBondContact O-CG1 3.47Å; Q1122-I1126 PolarHBondContact O-N 2.95Å; L1123-I1126 HydrophobicContact CD2-CD1 4.35Å; L1123-I1126 PolarHBondContact O-N 2.91Å; I1126-N1129 WeakPolarHBondContact CA-OD1 3.47Å; I1126-N1129 PolarHBondContact O-OD1 3.3Å; I1126-Y1131 HydrophobicContact CG2-CD1 3.89Å; I1126-Y1131 WeakPolarHBondContact O-CA 3.3Å; I1126-Y1131 PolarHBondContact O-N 2.78Å
1127	Y	89.8	Confident	87.6	Confident	146 Å²	146	28 Å²	28	57%	0.573	15%	0.146	S	C	*	.	H	α-helix	trans	-66.7	-47.3	177.4	176.9	-100	0	0	0	112.2	L1123 C1124 V1125	L1123-Y1127 PolarHBondContact O-N 3.2Å; C1124-Y1127 PolarHBondContact O-N 2.88Å; V1125-Y1127 VanDerWaalsContact C-N 3.25Å; V1125-Y1127 PolarHBondContact O-N 3.46Å
1128	N	85.8	Confident	86.7	Confident	53 Å²	53	29.1 Å²	29.1	28%	0.283	16%	0.157	S	C	.	.	H	α-helix	trans	-83.2	-20.6	-175.3	-68.4	-46.1	0	0	0	114.2	C1124 V1125 G1130 Y1205	C1124-N1128 PolarHBondContact O-N 2.92Å; C1124-N1128 PolarHBondContact O-ND2 3.42Å; V1125-N1128 PolarHBondContact O-N 2.92Å; N1128-G1130 PolarHBondContact O-N 2.88Å; N1128-Y1205 WeakPolarHBondContact CB-OH 3.37Å; N1128-Y1205 WeakPolarHBondContact ND2-CE1 3.45Å; N1128-Y1205 PolarHBondContact ND2-OH 3.03Å; N1128-Y1205 VanDerWaalsContact ND2-OH 3.12Å
1129	N	84.1	Confident	86	Confident	32 Å²	32	31.3 Å²	31.3	17%	0.171	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	10.5	176.5	79	3.9	0	0	0	113.7	V1125 I1126 Y1131 S1132 I1134 F1237	V1125-N1129 VanDerWaalsContact O-CB 3.3Å; V1125-N1129 WeakPolarHBondContact O-CB 3.45Å; V1125-N1129 PolarHBondContact O-N 3.07Å; V1125-N1129 PolarHBondContact O-OD1 3.35Å; I1126-N1129 WeakPolarHBondContact CA-OD1 3.47Å; I1126-N1129 PolarHBondContact O-OD1 3.3Å; N1129-Y1131 PolarHBondContact OD1-N 3.12Å; N1129-S1132 WeakPolarHBondContact CB-OG 3.16Å; N1129-S1132 PolarHBondContact ND2-O 3.22Å; N1129-S1132 PolarHBondContact ND2-OG 3.41Å; N1129-S1132 VanDerWaalsContact ND2-OG 3.15Å; N1129-S1132 PolarHBondContact O-OG 2.98Å; N1129-S1132 PolarHBondContact OD1-N 3.24Å; N1129-S1132 PolarHBondContact OD1-O 3.14Å; N1129-S1132 PolarHBondContact OD1-OG 2.85Å; N1129-I1134 PolarHBondContact ND2-O 3.15Å; N1129-F1237 HydrophobicContact CB-CE2 4.19Å; N1129-F1237 HydrophobicContact CB-CZ 4.39Å
1130	G	83.8	Confident	85.4	Confident	15 Å²	15	34.7 Å²	34.7	16%	0.155	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	31.9	-178.8	0	0	0	0	0	114.4	W369 N1128 S1132	W369-G1130 VanDerWaalsContact CE3-O 3.24Å; W369-G1130 WeakPolarHBondContact CZ3-O 3.4Å; N1128-G1130 PolarHBondContact O-N 2.88Å; G1130-S1132 PolarHBondContact O-N 2.9Å
1131	Y	86.7	Confident	84.9	Confident	30 Å²	30	34 Å²	34	12%	0.118	18%	0.183	C	C	.	.	S	Bend	trans	57	29.5	-171.9	-57	-91.5	0	0	0	113.7	I362 L365 W369 I1126 N1129	I362-Y1131 HydrophobicContact CG2-CD1 4.27Å; L365-Y1131 HydrophobicContact CB-CD1 4.47Å; L365-Y1131 HydrophobicContact CB-CE1 3.72Å; L365-Y1131 HydrophobicContact CD1-CE1 4.39Å; W369-Y1131 HydrophobicContact CB-CD2 3.68Å; W369-Y1131 HydrophobicContact CB-CE2 3.88Å; W369-Y1131 AromaticContact CD1-CD2 3.91Å; W369-Y1131 AromaticContact CD1-CE2 3.77Å; W369-Y1131 HydrophobicContact CD2-CD2 4.08Å; W369-Y1131 AromaticContact CG-CD2 3.61Å; W369-Y1131 HydrophobicContact CG-CD2 3.61Å; W369-Y1131 AromaticContact CG-CE2 3.86Å; W369-Y1131 HydrophobicContact CG-CE2 3.86Å; I1126-Y1131 HydrophobicContact CG2-CD1 3.89Å; I1126-Y1131 WeakPolarHBondContact O-CA 3.3Å; I1126-Y1131 PolarHBondContact O-N 2.78Å; N1129-Y1131 PolarHBondContact OD1-N 3.12Å
1132	S	82.3	Confident	84.3	Confident	44 Å²	44	34.4 Å²	34.4	31%	0.308	19%	0.185	S	C	.	.			trans	-73.5	138.4	171.8	52.8	0	0	0	0	110.1	N1129 G1130 I1134	N1129-S1132 WeakPolarHBondContact CB-OG 3.16Å; N1129-S1132 PolarHBondContact ND2-O 3.22Å; N1129-S1132 PolarHBondContact ND2-OG 3.41Å; N1129-S1132 VanDerWaalsContact ND2-OG 3.15Å; N1129-S1132 PolarHBondContact O-OG 2.98Å; N1129-S1132 PolarHBondContact OD1-N 3.24Å; N1129-S1132 PolarHBondContact OD1-O 3.14Å; N1129-S1132 PolarHBondContact OD1-OG 2.85Å; G1130-S1132 PolarHBondContact O-N 2.9Å; S1132-I1134 PolarHBondContact O-N 3.18Å
1133	E	81.3	Confident	83.8	Confident	38 Å²	38	36 Å²	36	18%	0.178	19%	0.193	C	C	.	.	S	Bend	trans	-75.3	24.7	-171.4	-57.4	170.8	147.4	0	0	112.8	T393 R396 F397	T393-E1133 WeakPolarHBondContact CA-OE1 3.32Å; T393-E1133 WeakPolarHBondContact CB-OE1 3.47Å; T393-E1133 WeakPolarHBondContact CG2-OE1 3.43Å; T393-E1133 PolarHBondContact OG1-OE1 2.8Å; R396-E1133 VanDerWaalsContact CD-CD 3.42Å; R396-E1133 WeakPolarHBondContact CD-OE2 3.25Å; R396-E1133 IonicContact CZ-OE2 2.66Å; R396-E1133 IonicContact NE-OE2 3.58Å; R396-E1133 IonicContact NH1-OE2 3.93Å; R396-E1133 PolarHBondContact NH1-OE2 3.2Å; F397-E1133 HydrophobicContact CE1-CG 4.46Å; F397-E1133 HydrophobicContact CE2-CG 4.37Å; F397-E1133 HydrophobicContact CZ-CG 4.11Å
1134	I	81.2	Confident	83.3	Confident	104 Å²	104	35 Å²	35	53%	0.533	19%	0.189	S	C	.	.			trans	-109.4	121.4	-168.9	-53.7	175.8	0	0	0	110	N1129 S1132 F1237	N1129-I1134 PolarHBondContact ND2-O 3.15Å; S1132-I1134 PolarHBondContact O-N 3.18Å; I1134-F1237 HydrophobicContact CG2-CE1 4.49Å
1135	P	81.2	Confident	83.1	Confident	31 Å²	31	34.4 Å²	34.4	20%	0.201	19%	0.186	C	C	.	.			trans	-71.5	153.8	175	31.5	-35.5	0	0	0	111.7	F1137 F1142	P1135-F1137 VanDerWaalsContact C-N 3.29Å; P1135-F1137 PolarHBondContact O-N 3.02Å; P1135-F1142 HydrophobicContact CB-CE2 3.83Å; P1135-F1142 HydrophobicContact CB-CZ 3.6Å; P1135-F1142 HydrophobicContact CG-CE2 4.46Å
1136	S	79.2	Confident	82.7	Confident	4 Å²	4	35 Å²	35	3%	0.028	19%	0.189	C	C	.	.	S	Bend	trans	-76.2	-12.2	-176.9	57.3	0	0	0	0	115.2	V1125	V1125-S1136 WeakPolarHBondContact CG2-OG 3.45Å
1137	F	83.2	Confident	82.1	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.018	21%	0.212	C	C	.	.	S	Bend	trans	-150.3	156.7	-180	52.9	-105.7	0	0	0	110.3	F1118 Q1122 P1135 L1141 F1142 G1241 F1245	F1118-F1137 HydrophobicContact CE2-CE2 4.02Å; F1118-F1137 AromaticContact CE2-CZ 3.64Å; F1118-F1137 HydrophobicContact CE2-CZ 3.64Å; F1118-F1137 AromaticContact CZ-CE2 3.89Å; F1118-F1137 HydrophobicContact CZ-CE2 3.89Å; F1118-F1137 AromaticContact CZ-CZ 3.74Å; F1118-F1137 HydrophobicContact CZ-CZ 3.74Å; Q1122-F1137 VanDerWaalsContact NE2-CZ 3.27Å; P1135-F1137 VanDerWaalsContact C-N 3.29Å; P1135-F1137 PolarHBondContact O-N 3.02Å; F1137-L1141 HydrophobicContact CB-CD1 3.84Å; F1137-L1141 HydrophobicContact CD2-CB 3.8Å; F1137-L1141 HydrophobicContact CD2-CD1 3.99Å; F1137-L1141 HydrophobicContact CE2-CB 4.17Å; F1137-L1141 HydrophobicContact CG-CD1 4.22Å; F1137-F1142 AromaticContact CD2-CD2 3.94Å; F1137-F1142 HydrophobicContact CD2-CD2 3.94Å; F1137-F1142 AromaticContact CD2-CE2 3.68Å; F1137-F1142 HydrophobicContact CD2-CE2 3.68Å; F1137-F1142 AromaticContact CE2-CD2 3.53Å; F1137-F1142 HydrophobicContact CE2-CD2 3.53Å; F1137-F1142 AromaticContact CE2-CE2 3.36Å; F1137-F1142 HydrophobicContact CE2-CE2 3.36Å; F1137-F1142 HydrophobicContact CE2-CG 4.3Å; F1137-F1142 HydrophobicContact CE2-CZ 4.02Å; F1137-F1142 HydrophobicContact CZ-CE2 4.2Å; F1137-F1142 HydrophobicContact CZ-CZ 4.45Å; F1137-F1142 WeakPolarHBondContact O-CE2 3.29Å; F1137-G1241 WeakPolarHBondContact CD1-O 3.47Å; F1137-F1245 HydrophobicContact CD1-CB 3.89Å; F1137-F1245 HydrophobicContact CD1-CD2 4.4Å; F1137-F1245 HydrophobicContact CD2-CD2 4.23Å; F1137-F1245 HydrophobicContact CE1-CB 3.89Å; F1137-F1245 AromaticContact CE1-CD2 3.94Å; F1137-F1245 HydrophobicContact CE1-CD2 3.94Å; F1137-F1245 HydrophobicContact CE1-CG 4.38Å; F1137-F1245 AromaticContact CE2-CD2 3.75Å; F1137-F1245 HydrophobicContact CE2-CD2 3.75Å; F1137-F1245 HydrophobicContact CE2-CE2 4.2Å; F1137-F1245 HydrophobicContact CG-CB 4.42Å; F1137-F1245 HydrophobicContact CZ-CB 4.43Å; F1137-F1245 AromaticContact CZ-CD2 3.6Å; F1137-F1245 HydrophobicContact CZ-CD2 3.6Å; F1137-F1245 HydrophobicContact CZ-CE2 4.37Å; F1137-F1245 HydrophobicContact CZ-CG 4.45Å
1138	G	77.3	Confident	81.8	Confident	22 Å²	22	34.4 Å²	34.4	23%	0.227	20%	0.197	C	C	.	.			trans	-59.4	146.1	-171.6	0	0	0	0	0	115.8	I1140 L1141 E1294	G1138-I1140 PolarHBondContact O-N 3.48Å; G1138-L1141 WeakPolarHBondContact O-CB 3.31Å; G1138-L1141 PolarHBondContact O-N 2.64Å; G1138-E1294 WeakPolarHBondContact CA-OE1 3.49Å; G1138-E1294 PolarHBondContact N-OE1 2.86Å
1139	T	77.9	Confident	81.9	Confident	47 Å²	47	31.9 Å²	31.9	29%	0.288	18%	0.183	S	C	.	.	H	α-helix	trans	-54.4	-26.1	-174.5	-39.1	0	0	0	0	114.4	V91 L1141 F1142	V91-T1139 HydrophobicContact CG1-CG2 4.49Å; T1139-L1141 VanDerWaalsContact C-N 3.28Å; T1139-L1141 PolarHBondContact O-N 3.39Å; T1139-F1142 WeakPolarHBondContact O-CB 3.46Å; T1139-F1142 PolarHBondContact O-N 3.18Å
1140	I	79.3	Confident	82.1	Confident	76 Å²	76	30.4 Å²	30.4	39%	0.39	18%	0.175	S	C	.	.	H	α-helix	trans	-65.4	-32.8	179.4	-151.1	157.9	0	0	0	112.1	G1138 F1142 I1143 C1144 F1284	G1138-I1140 PolarHBondContact O-N 3.48Å; I1140-F1142 VanDerWaalsContact C-N 3.32Å; I1140-F1142 PolarHBondContact O-N 3.14Å; I1140-I1143 HydrophobicContact CG1-CD1 4.39Å; I1140-I1143 WeakPolarHBondContact O-CB 3.37Å; I1140-I1143 PolarHBondContact O-N 3.15Å; I1140-I1143 VanDerWaalsContact O-N 3.1Å; I1140-C1144 PolarHBondContact O-N 3.42Å; I1140-C1144 VanDerWaalsContact O-N 3.11Å; I1140-C1144 PolarHBondContact O-SG 3.49Å; I1140-C1144 VanDerWaalsContact O-SG 3.38Å; I1140-F1284 HydrophobicContact CD1-CE2 3.98Å; I1140-F1284 HydrophobicContact CG2-CE1 4.03Å; I1140-F1284 HydrophobicContact CG2-CE2 3.87Å; I1140-F1284 HydrophobicContact CG2-CZ 3.57Å
1141	L	82.2	Confident	82.2	Confident	2 Å²	2	32 Å²	32	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-70.5	-29.2	-178.2	-63.6	163.8	0	0	0	112	F1137 G1138 T1139 I1143 C1144 Y1145 N1242 F1245 L1281 Y1298	F1137-L1141 HydrophobicContact CB-CD1 3.84Å; F1137-L1141 HydrophobicContact CD2-CB 3.8Å; F1137-L1141 HydrophobicContact CD2-CD1 3.99Å; F1137-L1141 HydrophobicContact CE2-CB 4.17Å; F1137-L1141 HydrophobicContact CG-CD1 4.22Å; G1138-L1141 WeakPolarHBondContact O-CB 3.31Å; G1138-L1141 PolarHBondContact O-N 2.64Å; T1139-L1141 VanDerWaalsContact C-N 3.28Å; T1139-L1141 PolarHBondContact O-N 3.39Å; L1141-I1143 PolarHBondContact O-N 3.41Å; L1141-C1144 PolarHBondContact O-N 2.69Å; L1141-Y1145 WeakPolarHBondContact O-CB 3.37Å; L1141-Y1145 PolarHBondContact O-N 3.5Å; L1141-N1242 WeakPolarHBondContact CD1-OD1 3.48Å; L1141-F1245 HydrophobicContact CB-CD2 4.41Å; L1141-F1245 HydrophobicContact CB-CE1 4.45Å; L1141-F1245 HydrophobicContact CB-CE2 3.92Å; L1141-F1245 HydrophobicContact CB-CZ 3.94Å; L1141-F1245 HydrophobicContact CD2-CE1 4.04Å; L1141-F1245 HydrophobicContact CD2-CZ 4.22Å; L1141-L1281 HydrophobicContact CD2-CD2 3.6Å; L1141-Y1298 WeakPolarHBondContact CD1-OH 3.25Å; L1141-Y1298 VanDerWaalsContact CD2-OH 3.29Å; L1141-Y1298 WeakPolarHBondContact CD2-OH 3.4Å
1142	F	80.6	Confident	82.3	Confident	7 Å²	7	33.4 Å²	33.4	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-58.7	-34.5	171.1	-72.7	-113.1	0	0	0	111.9	Y403 F1118 Q1122 P1135 F1137 T1139 I1140	Y403-F1142 HydrophobicContact CD1-CB 4.32Å; Y403-F1142 HydrophobicContact CD1-CD1 4.45Å; Y403-F1142 AromaticContact CD2-CD1 3.57Å; Y403-F1142 HydrophobicContact CD2-CD1 3.57Å; Y403-F1142 HydrophobicContact CD2-CE1 4.21Å; Y403-F1142 HydrophobicContact CE1-CB 3.71Å; Y403-F1142 HydrophobicContact CE1-CD1 4.35Å; Y403-F1142 HydrophobicContact CE2-CB 4.1Å; Y403-F1142 AromaticContact CE2-CD1 3.45Å; Y403-F1142 HydrophobicContact CE2-CD1 3.45Å; Y403-F1142 VanDerWaalsContact CE2-CD1 3.45Å; Y403-F1142 HydrophobicContact CE2-CE1 4.26Å; Y403-F1142 HydrophobicContact CE2-CG 4.16Å; Y403-F1142 HydrophobicContact CG-CD1 4.08Å; Y403-F1142 AromaticContact CZ-CD1 3.86Å; F1118-F1142 AromaticContact CE1-CD1 3.39Å; F1118-F1142 HydrophobicContact CE1-CD1 3.39Å; F1118-F1142 AromaticContact CE1-CE1 3.65Å; F1118-F1142 HydrophobicContact CE1-CE1 3.65Å; F1118-F1142 HydrophobicContact CE1-CG 4.12Å; F1118-F1142 HydrophobicContact CZ-CB 4.16Å; F1118-F1142 AromaticContact CZ-CD1 3.43Å; F1118-F1142 HydrophobicContact CZ-CD1 3.43Å; F1118-F1142 VanDerWaalsContact CZ-CD1 3.43Å; F1118-F1142 HydrophobicContact CZ-CD2 4.29Å; F1118-F1142 AromaticContact CZ-CE1 3.78Å; F1118-F1142 HydrophobicContact CZ-CE1 3.78Å; F1118-F1142 AromaticContact CZ-CG 3.7Å; F1118-F1142 HydrophobicContact CZ-CG 3.7Å; F1118-F1142 HydrophobicContact CZ-CZ 4.33Å; Q1122-F1142 HydrophobicContact CG-CE1 4.24Å; Q1122-F1142 HydrophobicContact CG-CZ 4.31Å; P1135-F1142 HydrophobicContact CB-CE2 3.83Å; P1135-F1142 HydrophobicContact CB-CZ 3.6Å; P1135-F1142 HydrophobicContact CG-CE2 4.46Å; F1137-F1142 AromaticContact CD2-CD2 3.94Å; F1137-F1142 HydrophobicContact CD2-CD2 3.94Å; F1137-F1142 AromaticContact CD2-CE2 3.68Å; F1137-F1142 HydrophobicContact CD2-CE2 3.68Å; F1137-F1142 AromaticContact CE2-CD2 3.53Å; F1137-F1142 HydrophobicContact CE2-CD2 3.53Å; F1137-F1142 AromaticContact CE2-CE2 3.36Å; F1137-F1142 HydrophobicContact CE2-CE2 3.36Å; F1137-F1142 HydrophobicContact CE2-CG 4.3Å; F1137-F1142 HydrophobicContact CE2-CZ 4.02Å; F1137-F1142 HydrophobicContact CZ-CE2 4.2Å; F1137-F1142 HydrophobicContact CZ-CZ 4.45Å; F1137-F1142 WeakPolarHBondContact O-CE2 3.29Å; T1139-F1142 WeakPolarHBondContact O-CB 3.46Å; T1139-F1142 PolarHBondContact O-N 3.18Å; I1140-F1142 VanDerWaalsContact C-N 3.32Å; I1140-F1142 PolarHBondContact O-N 3.14Å
1143	I	79.8	Confident	82.6	Confident	36 Å²	36	31.5 Å²	31.5	19%	0.185	17%	0.174	C	C	.	.	H	α-helix	trans	-75.6	-53.5	175.4	-40.1	170.4	0	0	0	109.8	V91 I1140 L1141 Y1145 N1146 L1147	V91-I1143 HydrophobicContact CB-CD1 3.9Å; V91-I1143 HydrophobicContact CG1-CD1 3.35Å; V91-I1143 HydrophobicContact CG1-CG1 3.51Å; V91-I1143 HydrophobicContact CG2-CD1 3.47Å; V91-I1143 VanDerWaalsContact CG2-CD1 3.47Å; I1140-I1143 HydrophobicContact CG1-CD1 4.39Å; I1140-I1143 WeakPolarHBondContact O-CB 3.37Å; I1140-I1143 PolarHBondContact O-N 3.15Å; I1140-I1143 VanDerWaalsContact O-N 3.1Å; L1141-I1143 PolarHBondContact O-N 3.41Å; I1143-Y1145 PolarHBondContact O-N 2.95Å; I1143-N1146 PolarHBondContact O-N 3.2Å; I1143-L1147 HydrophobicContact CG2-CB 4.37Å; I1143-L1147 HydrophobicContact CG2-CD2 4.21Å; I1143-L1147 WeakPolarHBondContact O-CB 3.49Å; I1143-L1147 PolarHBondContact O-N 3.46Å
1144	C	82.5	Confident	82.9	Confident	26 Å²	26	30 Å²	30	18%	0.176	17%	0.168	C	C	.	.	H	α-helix	trans	-54.5	-40.4	-176.6	-65.5	0	0	0	0	111.1	I1140 L1141 N1146 L1147 T1148 M1149	I1140-C1144 PolarHBondContact O-N 3.42Å; I1140-C1144 VanDerWaalsContact O-N 3.11Å; I1140-C1144 PolarHBondContact O-SG 3.49Å; I1140-C1144 VanDerWaalsContact O-SG 3.38Å; L1141-C1144 PolarHBondContact O-N 2.69Å; C1144-N1146 VanDerWaalsContact C-N 3.32Å; C1144-N1146 PolarHBondContact O-N 2.72Å; C1144-L1147 PolarHBondContact O-N 2.9Å; C1144-T1148 PolarHBondContact O-N 3.17Å; C1144-T1148 PolarHBondContact O-OG1 3.16Å; C1144-M1149 HydrophobicContact CB-CE 4.03Å; C1144-M1149 HydrophobicContact CB-CG 4.05Å; C1144-M1149 WeakPolarHBondContact O-CB 3.3Å; C1144-M1149 VanDerWaalsContact O-CG 3.22Å; C1144-M1149 WeakPolarHBondContact O-CG 3.4Å; C1144-M1149 PolarHBondContact O-N 3.35Å
1145	Y	86.7	Confident	83.3	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.146	C	C	.	.	I	π-helix	trans	-48.4	-51.1	175.3	-172.1	-100.4	0	0	0	112.8	K1114 F1118 L1141 I1143 T1150 F1245 L1248 W1249	K1114-Y1145 HydrophobicContact CB-CE1 4.21Å; K1114-Y1145 HydrophobicContact CG-CE1 4.28Å; K1114-Y1145 PolarHBondContact O-OH 3.45Å; F1118-Y1145 HydrophobicContact CB-CD1 4.24Å; F1118-Y1145 HydrophobicContact CB-CE1 3.76Å; F1118-Y1145 AromaticContact CD2-CD1 3.64Å; F1118-Y1145 HydrophobicContact CD2-CD1 3.64Å; F1118-Y1145 AromaticContact CD2-CD2 3.86Å; F1118-Y1145 HydrophobicContact CD2-CD2 3.86Å; F1118-Y1145 AromaticContact CD2-CE1 3.87Å; F1118-Y1145 HydrophobicContact CD2-CE1 3.87Å; F1118-Y1145 HydrophobicContact CD2-CE2 4.07Å; F1118-Y1145 AromaticContact CD2-CG 3.65Å; F1118-Y1145 HydrophobicContact CD2-CG 3.65Å; F1118-Y1145 HydrophobicContact CE2-CD1 4.27Å; F1118-Y1145 HydrophobicContact CE2-CD2 4.25Å; F1118-Y1145 AromaticContact CE2-CG 3.94Å; F1118-Y1145 HydrophobicContact CE2-CG 3.94Å; F1118-Y1145 HydrophobicContact CG-CD1 4.03Å; F1118-Y1145 HydrophobicContact CG-CE1 4.05Å; F1118-Y1145 HydrophobicContact CG-CG 4.47Å; L1141-Y1145 WeakPolarHBondContact O-CB 3.37Å; L1141-Y1145 PolarHBondContact O-N 3.5Å; I1143-Y1145 PolarHBondContact O-N 2.95Å; Y1145-T1150 HydrophobicContact CD2-CG2 4.22Å; Y1145-T1150 HydrophobicContact CE1-CG2 4.3Å; Y1145-T1150 HydrophobicContact CE2-CG2 3.88Å; Y1145-T1150 WeakPolarHBondContact O-CB 3.47Å; Y1145-T1150 WeakPolarHBondContact O-CG2 3.45Å; Y1145-T1150 PolarHBondContact O-N 3.22Å; Y1145-T1150 VanDerWaalsContact O-N 3.16Å; Y1145-T1150 PolarHBondContact O-OG1 3.1Å; Y1145-F1245 AromaticContact CD2-CE2 3.97Å; Y1145-F1245 HydrophobicContact CD2-CE2 3.97Å; Y1145-F1245 HydrophobicContact CD2-CZ 4.35Å; Y1145-F1245 HydrophobicContact CG-CE2 4.4Å; Y1145-L1248 HydrophobicContact CE2-CD2 4.09Å; Y1145-L1248 HydrophobicContact CE2-CG 4.14Å; Y1145-W1249 HydrophobicContact CE2-CB 4.5Å
1146	N	81.2	Confident	83.7	Confident	15 Å²	15	24.3 Å²	24.3	8%	0.08	14%	0.137	C	C	.	.	I	π-helix	trans	-89.4	-25.7	-173.9	-82.9	-48.7	0	0	0	114.7	S408 K1114 I1143 C1144	S408-N1146 PolarHBondContact OG-O 2.95Å; S408-N1146 VanDerWaalsContact OG-O 3.11Å; K1114-N1146 WeakPolarHBondContact CE-OD1 3.22Å; I1143-N1146 PolarHBondContact O-N 3.2Å; C1144-N1146 VanDerWaalsContact C-N 3.32Å; C1144-N1146 PolarHBondContact O-N 2.72Å
1147	L	79.1	Confident	84.2	Confident	95 Å²	95	24.1 Å²	24.1	50%	0.497	14%	0.135	S	C	.	.	I	π-helix	trans	-96.3	-38.7	-173.3	-174.9	63.5	0	0	0	113.6	I1143 C1144 F1151	I1143-L1147 HydrophobicContact CG2-CB 4.37Å; I1143-L1147 HydrophobicContact CG2-CD2 4.21Å; I1143-L1147 WeakPolarHBondContact O-CB 3.49Å; I1143-L1147 PolarHBondContact O-N 3.46Å; C1144-L1147 PolarHBondContact O-N 2.9Å; L1147-F1151 WeakPolarHBondContact O-CB 3.36Å; L1147-F1151 WeakPolarHBondContact O-CG 3.22Å
1148	T	82.4	Confident	84.4	Confident	41 Å²	41	24 Å²	24	25%	0.252	13%	0.134	S	C	.	.	I	π-helix	trans	-123.7	-47.5	-171.7	71.8	0	0	0	0	112.5	C1144 N1277	C1144-T1148 PolarHBondContact O-N 3.17Å; C1144-T1148 PolarHBondContact O-OG1 3.16Å; T1148-N1277 WeakPolarHBondContact CB-OD1 3.28Å; T1148-N1277 PolarHBondContact O-ND2 3.26Å; T1148-N1277 PolarHBondContact OG1-OD1 3.14Å
1149	M	87.3	Confident	85	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.13	C	C	.	.	I	π-helix	trans	-67.5	-46	-171	-61	-70.6	166	0	0	113.3	C1144 W1249 T1274 N1277 L1281	C1144-M1149 HydrophobicContact CB-CE 4.03Å; C1144-M1149 HydrophobicContact CB-CG 4.05Å; C1144-M1149 WeakPolarHBondContact O-CB 3.3Å; C1144-M1149 VanDerWaalsContact O-CG 3.22Å; C1144-M1149 WeakPolarHBondContact O-CG 3.4Å; C1144-M1149 PolarHBondContact O-N 3.35Å; M1149-W1249 HydrophobicContact CB-CD2 4.2Å; M1149-W1249 HydrophobicContact CB-CG 4.18Å; M1149-W1249 HydrophobicContact CB-CZ2 4.41Å; M1149-W1249 PolarHBondContact O-NE1 2.93Å; M1149-W1249 HydrophobicContact SD-CD2 4.01Å; M1149-W1249 HydrophobicContact SD-CE3 4.02Å; M1149-W1249 HydrophobicContact SD-CH2 3.61Å; M1149-W1249 HydrophobicContact SD-CZ2 3.59Å; M1149-W1249 VanDerWaalsContact SD-CZ2 3.59Å; M1149-W1249 HydrophobicContact SD-CZ3 3.83Å; M1149-T1274 WeakPolarHBondContact O-CG2 3.28Å; M1149-N1277 HydrophobicContact CE-CB 3.76Å; M1149-N1277 HydrophobicContact SD-CB 3.39Å; M1149-N1277 WeakPolarHBondContact SD-CB 3.5Å; M1149-L1281 HydrophobicContact CE-CD1 4.32Å; M1149-L1281 HydrophobicContact CE-CD2 3.7Å; M1149-L1281 HydrophobicContact CE-CG 3.82Å
1150	T	88.6	Confident	85.6	Confident	2 Å²	2	24.2 Å²	24.2	1%	0.012	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-8.3	-178.5	65.2	0	0	0	0	114	K1114 Y1145 S1154 V1252	K1114-T1150 WeakPolarHBondContact CD-OG1 3.24Å; K1114-T1150 WeakPolarHBondContact CE-OG1 3.48Å; K1114-T1150 PolarHBondContact NZ-OG1 3.3Å; Y1145-T1150 HydrophobicContact CD2-CG2 4.22Å; Y1145-T1150 HydrophobicContact CE1-CG2 4.3Å; Y1145-T1150 HydrophobicContact CE2-CG2 3.88Å; Y1145-T1150 WeakPolarHBondContact O-CB 3.47Å; Y1145-T1150 WeakPolarHBondContact O-CG2 3.45Å; Y1145-T1150 PolarHBondContact O-N 3.22Å; Y1145-T1150 VanDerWaalsContact O-N 3.16Å; Y1145-T1150 PolarHBondContact O-OG1 3.1Å; T1150-S1154 PolarHBondContact O-N 3.3Å; T1150-S1154 PolarHBondContact O-OG 2.97Å; T1150-V1252 HydrophobicContact CG2-CG1 4.31Å
1151	F	86.2	Confident	86.1	Confident	48 Å²	48	20.6 Å²	20.6	21%	0.211	11%	0.108	C	C	.	.	H	α-helix	trans	-66.6	-54.3	-172.7	172.7	-100.5	0	0	0	112.3	T412 L1147 V1153 S1154 L1155	T412-F1151 HydrophobicContact CG2-CE2 4.45Å; T412-F1151 WeakPolarHBondContact OG1-CE2 3.26Å; L1147-F1151 WeakPolarHBondContact O-CB 3.36Å; L1147-F1151 WeakPolarHBondContact O-CG 3.22Å; F1151-V1153 VanDerWaalsContact C-N 3.33Å; F1151-V1153 PolarHBondContact O-N 3.39Å; F1151-S1154 PolarHBondContact O-N 3.13Å; F1151-S1154 VanDerWaalsContact O-N 3.14Å; F1151-L1155 HydrophobicContact CE1-CD2 3.65Å; F1151-L1155 HydrophobicContact CZ-CD2 3.75Å; F1151-L1155 WeakPolarHBondContact O-CB 3.47Å; F1151-L1155 PolarHBondContact O-N 2.96Å
1152	L	88.1	Confident	86.3	Confident	60 Å²	60	25.8 Å²	25.8	31%	0.314	13%	0.127	S	C	.	.	H	α-helix	trans	-59.8	-39.1	-172.7	-70.4	173.1	0	0	0	113.2	G1156 T1274	L1152-G1156 PolarHBondContact O-N 3.46Å; L1152-T1274 HydrophobicContact CB-CG2 3.94Å
1153	V	89.5	Confident	86.5	Confident	4 Å²	4	26.3 Å²	26.3	2%	0.024	13%	0.13	C	C	.	.	H	α-helix	trans	-70.3	-42.7	176.9	162.7	0	0	0	0	111.9	F1151 L1155 G1156 Y1157 S1256 H1271 T1274	F1151-V1153 VanDerWaalsContact C-N 3.33Å; F1151-V1153 PolarHBondContact O-N 3.39Å; V1153-L1155 VanDerWaalsContact C-N 3.31Å; V1153-L1155 PolarHBondContact O-N 2.87Å; V1153-G1156 PolarHBondContact O-N 2.94Å; V1153-Y1157 PolarHBondContact O-N 2.9Å; V1153-Y1157 VanDerWaalsContact O-N 3.08Å; V1153-S1256 WeakPolarHBondContact CG1-OG 3.43Å; V1153-H1271 VanDerWaalsContact CG1-CE1 3.46Å; V1153-H1271 WeakPolarHBondContact CG1-CE1 3.42Å; V1153-H1271 HydrophobicContact CG2-CB 4.49Å; V1153-H1271 VanDerWaalsContact CG2-CE1 3.45Å; V1153-H1271 WeakPolarHBondContact CG2-CE1 3.38Å; V1153-H1271 VanDerWaalsContact CG2-ND1 3.25Å; V1153-H1271 WeakPolarHBondContact CG2-ND1 3.3Å; V1153-T1274 HydrophobicContact CB-CG2 4.13Å; V1153-T1274 HydrophobicContact CG2-CG2 3.51Å
1154	S	88.1	Confident	86.7	Confident	7 Å²	7	26.4 Å²	26.4	5%	0.049	13%	0.13	C	C	.	.	H	α-helix	trans	-61.4	-41.8	175.3	-52.5	0	0	0	0	111.4	T1150 F1151	T1150-S1154 PolarHBondContact O-N 3.3Å; T1150-S1154 PolarHBondContact O-OG 2.97Å; F1151-S1154 PolarHBondContact O-N 3.13Å; F1151-S1154 VanDerWaalsContact O-N 3.14Å
1155	L	88.4	Confident	86.9	Confident	15 Å²	15	30.1 Å²	30.1	8%	0.079	15%	0.145	C	C	.	.	H	α-helix	trans	-68	-51.6	178.2	171.8	60.6	0	0	0	111.5	T412 F415 Q416 F1151 V1153 Y1157 G1158 M1159	T412-L1155 HydrophobicContact CG2-CB 4.24Å; T412-L1155 HydrophobicContact CG2-CD1 4.03Å; F415-L1155 HydrophobicContact CD1-CD1 3.71Å; F415-L1155 HydrophobicContact CD1-CD2 4.29Å; F415-L1155 HydrophobicContact CE1-CD1 4.05Å; F415-L1155 HydrophobicContact CE1-CD2 4.07Å; Q416-L1155 HydrophobicContact CG-CD1 3.88Å; Q416-L1155 PolarHBondContact NE2-O 3.04Å; F1151-L1155 HydrophobicContact CE1-CD2 3.65Å; F1151-L1155 HydrophobicContact CZ-CD2 3.75Å; F1151-L1155 WeakPolarHBondContact O-CB 3.47Å; F1151-L1155 PolarHBondContact O-N 2.96Å; V1153-L1155 VanDerWaalsContact C-N 3.31Å; V1153-L1155 PolarHBondContact O-N 2.87Å; L1155-Y1157 VanDerWaalsContact C-N 3.3Å; L1155-Y1157 PolarHBondContact O-N 3.36Å; L1155-G1158 PolarHBondContact O-N 3.23Å; L1155-G1158 VanDerWaalsContact O-N 3.13Å; L1155-M1159 HydrophobicContact CD1-CG 3.95Å; L1155-M1159 HydrophobicContact CD1-SD 3.57Å; L1155-M1159 VanDerWaalsContact CD1-SD 3.57Å; L1155-M1159 HydrophobicContact CD2-SD 4.12Å; L1155-M1159 HydrophobicContact CG-CG 4.39Å; L1155-M1159 HydrophobicContact CG-SD 3.56Å; L1155-M1159 VanDerWaalsContact CG-SD 3.56Å; L1155-M1159 WeakPolarHBondContact O-CG 3.45Å; L1155-M1159 PolarHBondContact O-N 3.16Å
1156	G	89.6	Confident	87	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.5	-37.7	-177.6	0	0	0	0	0	113	L1152 V1153 M1159 F1160 L1267	L1152-G1156 PolarHBondContact O-N 3.46Å; V1153-G1156 PolarHBondContact O-N 2.94Å; G1156-M1159 PolarHBondContact O-N 3.41Å; G1156-F1160 PolarHBondContact O-N 3.38Å; G1156-L1267 VanDerWaalsContact C-CD1 3.48Å
1157	Y	91.2	Very high	87.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-57.3	-55.4	171.8	-175.1	-84.1	0	0	0	111.2	Y1102 I1106 F1110 V1153 L1155 M1159 F1160 E1161	Y1102-Y1157 WeakPolarHBondContact CE1-OH 3.19Å; I1106-Y1157 HydrophobicContact CB-CE1 3.71Å; I1106-Y1157 HydrophobicContact CG2-CD1 4.15Å; I1106-Y1157 HydrophobicContact CG2-CE1 3.36Å; F1110-Y1157 HydrophobicContact CD2-CD1 4.4Å; F1110-Y1157 AromaticContact CE2-CD1 3.83Å; F1110-Y1157 HydrophobicContact CE2-CD1 3.83Å; F1110-Y1157 AromaticContact CE2-CD2 3.94Å; F1110-Y1157 HydrophobicContact CE2-CD2 3.94Å; F1110-Y1157 HydrophobicContact CE2-CE1 4.06Å; F1110-Y1157 HydrophobicContact CE2-CE2 4.13Å; F1110-Y1157 AromaticContact CE2-CG 3.79Å; F1110-Y1157 HydrophobicContact CE2-CG 3.79Å; F1110-Y1157 HydrophobicContact CZ-CD2 4.46Å; F1110-Y1157 HydrophobicContact CZ-CE2 4.46Å; V1153-Y1157 PolarHBondContact O-N 2.9Å; V1153-Y1157 VanDerWaalsContact O-N 3.08Å; L1155-Y1157 VanDerWaalsContact C-N 3.3Å; L1155-Y1157 PolarHBondContact O-N 3.36Å; Y1157-M1159 PolarHBondContact O-N 2.83Å; Y1157-F1160 PolarHBondContact O-N 2.75Å; Y1157-E1161 HydrophobicContact CD1-CB 4.32Å; Y1157-E1161 HydrophobicContact CD2-CB 4.32Å; Y1157-E1161 HydrophobicContact CE1-CB 4.15Å; Y1157-E1161 HydrophobicContact CE1-CG 4.04Å; Y1157-E1161 HydrophobicContact CE2-CB 4.18Å; Y1157-E1161 HydrophobicContact CE2-CG 3.87Å; Y1157-E1161 HydrophobicContact CG-CB 4.39Å; Y1157-E1161 WeakPolarHBondContact O-CB 3.37Å; Y1157-E1161 PolarHBondContact O-N 3.3Å; Y1157-E1161 PolarHBondContact OH-OE1 2.96Å
1158	G	87.4	Confident	87.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-72.3	-11	-178.9	0	0	0	0	0	115.1	Q416 R1103 T1107 L1155	Q416-G1158 VanDerWaalsContact NE2-CA 3.32Å; R1103-G1158 WeakPolarHBondContact CB-O 3.28Å; R1103-G1158 WeakPolarHBondContact CD-O 3.47Å; T1107-G1158 WeakPolarHBondContact OG1-CA 3.3Å; L1155-G1158 PolarHBondContact O-N 3.23Å; L1155-G1158 VanDerWaalsContact O-N 3.13Å
1159	M	89.1	Confident	87.9	Confident	28 Å²	28	35.4 Å²	35.4	14%	0.138	16%	0.163	C	C	.	.	H	α-helix	trans	-84.4	-49.7	169.3	-74.2	170.6	64.3	0	0	112.2	F415 Q416 L419 R1103 L1155 G1156 Y1157	F415-M1159 HydrophobicContact CE1-SD 4.28Å; Q416-M1159 HydrophobicContact CG-CG 4.46Å; L419-M1159 HydrophobicContact CD1-CE 3.4Å; L419-M1159 HydrophobicContact CD1-CG 3.77Å; L419-M1159 HydrophobicContact CD1-SD 3.62Å; R1103-M1159 PolarHBondContact NH1-O 3.36Å; L1155-M1159 HydrophobicContact CD1-CG 3.95Å; L1155-M1159 HydrophobicContact CD1-SD 3.57Å; L1155-M1159 VanDerWaalsContact CD1-SD 3.57Å; L1155-M1159 HydrophobicContact CD2-SD 4.12Å; L1155-M1159 HydrophobicContact CG-CG 4.39Å; L1155-M1159 HydrophobicContact CG-SD 3.56Å; L1155-M1159 VanDerWaalsContact CG-SD 3.56Å; L1155-M1159 WeakPolarHBondContact O-CG 3.45Å; L1155-M1159 PolarHBondContact O-N 3.16Å; G1156-M1159 PolarHBondContact O-N 3.41Å; Y1157-M1159 PolarHBondContact O-N 2.83Å
1160	F	90.5	Very high	88	Confident	47 Å²	47	36.7 Å²	36.7	21%	0.206	17%	0.17	C	C	.	.	H	α-helix	trans	-117	-7.3	-160.5	-58	-66.6	0	0	0	115.9	F423 G1156 Y1157 R1162 N1264 M1266	F423-F1160 HydrophobicContact CZ-CE1 4.18Å; G1156-F1160 PolarHBondContact O-N 3.38Å; Y1157-F1160 PolarHBondContact O-N 2.75Å; F1160-R1162 PolarHBondContact O-N 3.39Å; F1160-N1264 PolarHBondContact O-ND2 3.36Å; F1160-N1264 VanDerWaalsContact O-ND2 3.12Å; F1160-M1266 HydrophobicContact CD1-CB 4.05Å; F1160-M1266 HydrophobicContact CD1-CG 4.23Å; F1160-M1266 HydrophobicContact CD2-CB 3.59Å; F1160-M1266 HydrophobicContact CE1-CB 4.06Å; F1160-M1266 HydrophobicContact CE1-CG 3.95Å; F1160-M1266 HydrophobicContact CE2-CB 3.6Å; F1160-M1266 HydrophobicContact CE2-CG 4.25Å; F1160-M1266 HydrophobicContact CG-CB 3.82Å; F1160-M1266 HydrophobicContact CZ-CB 3.83Å; F1160-M1266 HydrophobicContact CZ-CG 3.95Å
1161	E	89.7	Confident	88	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.202	C	C	.	.			trans	-62.4	131.6	-179.9	173.1	71.7	165.7	0	0	111.8	R1103 Y1157 H1163 K1261	R1103-E1161 VanDerWaalsContact CZ-O 3.27Å; R1103-E1161 PolarHBondContact NE-O 3.49Å; R1103-E1161 PolarHBondContact NH2-O 3.36Å; Y1157-E1161 HydrophobicContact CD1-CB 4.32Å; Y1157-E1161 HydrophobicContact CD2-CB 4.32Å; Y1157-E1161 HydrophobicContact CE1-CB 4.15Å; Y1157-E1161 HydrophobicContact CE1-CG 4.04Å; Y1157-E1161 HydrophobicContact CE2-CB 4.18Å; Y1157-E1161 HydrophobicContact CE2-CG 3.87Å; Y1157-E1161 HydrophobicContact CG-CB 4.39Å; Y1157-E1161 WeakPolarHBondContact O-CB 3.37Å; Y1157-E1161 PolarHBondContact O-N 3.3Å; Y1157-E1161 PolarHBondContact OH-OE1 2.96Å; E1161-H1163 HydrophobicContact CG-CB 4.3Å; E1161-K1261 WeakPolarHBondContact OE1-CB 3.29Å; E1161-K1261 PolarHBondContact OE1-N 3.3Å; E1161-K1261 PolarHBondContact OE2-N 3.23Å; E1161-K1261 VanDerWaalsContact OE2-N 3.16Å
1162	R	87.1	Confident	87.9	Confident	111 Å²	111	43.3 Å²	43.3	42%	0.419	20%	0.204	S	C	.	.			trans	-119.6	79.9	170.3	-63	-178.2	-61	-171.6	-1.3	109.7	W1099 F1160 I1164 D1262 N1264	W1099-R1162 HydrophobicContact CH2-CG 4.31Å; W1099-R1162 HydrophobicContact CZ2-CB 4.4Å; W1099-R1162 HydrophobicContact CZ2-CG 4.15Å; F1160-R1162 PolarHBondContact O-N 3.39Å; R1162-I1164 PolarHBondContact O-N 2.95Å; R1162-D1262 HydrophobicContact CB-CB 4.35Å; R1162-D1262 WeakPolarHBondContact CB-OD2 3.38Å; R1162-D1262 IonicContact CZ-OD2 2.81Å; R1162-D1262 IonicContact NE-OD2 3.61Å; R1162-D1262 PolarHBondContact NE-OD2 3.11Å; R1162-D1262 IonicContact NH2-OD1 3.82Å; R1162-D1262 IonicContact NH2-OD2 3.97Å; R1162-D1262 PolarHBondContact NH2-OD2 3.37Å; R1162-N1264 PolarHBondContact NH2-OD1 3.05Å
1163	H	84.3	Confident	87.9	Confident	17 Å²	17	40.8 Å²	40.8	8%	0.079	19%	0.191	C	C	.	.	S	Bend	trans	-63.7	-21.3	-174.8	78.3	-61.1	0	0	0	115.3	H1098 W1099 Y1102 E1161 K1261	H1098-H1163 AromaticContact CE1-NE2 3.09Å; H1098-H1163 PolarHBondContact CE1-NE2 3.49Å; H1098-H1163 AromaticContact CG-NE2 3.49Å; H1098-H1163 AromaticContact ND1-NE2 2.66Å; H1098-H1163 PolarHBondContact ND1-NE2 2.87Å; W1099-H1163 AromaticContact CD1-CE1 3.22Å; W1099-H1163 AromaticContact CD1-ND1 3.81Å; W1099-H1163 AromaticContact CD1-NE2 3.17Å; W1099-H1163 AromaticContact NE1-CE1 3.71Å; W1099-H1163 AromaticContact NE1-NE2 3.89Å; Y1102-H1163 HydrophobicContact CD1-CB 3.86Å; Y1102-H1163 AromaticContact CD1-CE1 3.96Å; Y1102-H1163 AromaticContact CD1-CG 3.55Å; Y1102-H1163 AromaticContact CD1-ND1 3.76Å; Y1102-H1163 AromaticContact CD2-CD2 3.76Å; Y1102-H1163 HydrophobicContact CE1-CB 3.43Å; Y1102-H1163 VanDerWaalsContact CE1-CB 3.43Å; Y1102-H1163 AromaticContact CE1-CD2 3.98Å; Y1102-H1163 AromaticContact CE1-CG 3.56Å; Y1102-H1163 AromaticContact CE2-CD2 3.73Å; Y1102-H1163 AromaticContact CG-CD2 3.91Å; Y1102-H1163 AromaticContact CG-CG 3.86Å; Y1102-H1163 AromaticContact CG-ND1 3.9Å; Y1102-H1163 AromaticContact CZ-CD2 3.84Å; Y1102-H1163 AromaticContact CZ-CG 3.88Å; E1161-H1163 HydrophobicContact CG-CB 4.3Å; H1163-K1261 HydrophobicContact CB-CD 4.16Å; H1163-K1261 VanDerWaalsContact O-CD 3.24Å; H1163-K1261 WeakPolarHBondContact O-CD 3.34Å
1164	I	84.7	Confident	87.6	Confident	38 Å²	38	42.6 Å²	42.6	20%	0.195	20%	0.198	C	C	.	.	S	Bend	trans	-142.1	137.7	171.1	-59.8	171.7	0	0	0	107.4	W1099 R1162 I1168 L1169 L1175	W1099-I1164 PolarHBondContact NE1-O 2.83Å; R1162-I1164 PolarHBondContact O-N 2.95Å; I1164-I1168 HydrophobicContact CG2-CB 3.92Å; I1164-I1168 HydrophobicContact CG2-CG2 3.88Å; I1164-L1169 HydrophobicContact CB-CD1 4.3Å; I1164-L1169 HydrophobicContact CB-CD2 4.31Å; I1164-L1169 HydrophobicContact CB-CG 4.13Å; I1164-L1169 HydrophobicContact CD1-CD2 4.24Å; I1164-L1169 HydrophobicContact CG2-CD1 4.45Å; I1164-L1169 HydrophobicContact CG2-CD2 4.13Å; I1164-L1169 HydrophobicContact CG2-CG 3.8Å; I1164-L1175 HydrophobicContact CD1-CD1 4.44Å
1165	E	85.8	Confident	87.5	Confident	105 Å²	105	42.6 Å²	42.6	49%	0.491	20%	0.198	S	C	.	.			trans	-62.7	145.2	177	-162.6	-162.6	154.4	0	0	112.5	K1167 I1168 L1169	E1165-K1167 PolarHBondContact O-N 3.15Å; E1165-K1167 WeakPolarHBondContact OE1-CD 3.5Å; E1165-I1168 HydrophobicContact CB-CD1 4.05Å; E1165-I1168 HydrophobicContact CB-CG1 4.21Å; E1165-I1168 PolarHBondContact O-N 3.3Å; E1165-I1168 VanDerWaalsContact O-N 3.17Å; E1165-L1169 PolarHBondContact O-N 3.27Å
1166	E	89.7	Confident	87.5	Confident	54 Å²	54	42.1 Å²	42.1	25%	0.252	20%	0.195	S	C	.	.	H	α-helix	trans	-51.4	-50.7	179.8	174.6	176.3	137.4	0	0	113.8	R1091 L1095 W1099 I1168 L1169 L1170	R1091-E1166 IonicContact CZ-OE1 2.6Å; R1091-E1166 IonicContact CZ-OE2 3.3Å; R1091-E1166 VanDerWaalsContact NH1-CD 3.29Å; R1091-E1166 IonicContact NH1-OE1 2.71Å; R1091-E1166 PolarHBondContact NH1-OE1 3.17Å; R1091-E1166 IonicContact NH1-OE2 2.6Å; R1091-E1166 VanDerWaalsContact NH2-CD 3.26Å; R1091-E1166 IonicContact NH2-OE1 2.79Å; R1091-E1166 PolarHBondContact NH2-OE1 2.92Å; R1091-E1166 VanDerWaalsContact NH2-OE1 3.16Å; R1091-E1166 IonicContact NH2-OE2 3.62Å; R1091-E1166 PolarHBondContact NH2-OE2 3.45Å; L1095-E1166 HydrophobicContact CD1-CB 3.85Å; L1095-E1166 HydrophobicContact CD1-CG 3.78Å; L1095-E1166 HydrophobicContact CD2-CG 3.76Å; L1095-E1166 HydrophobicContact CG-CG 4.41Å; W1099-E1166 HydrophobicContact CH2-CB 4.19Å; W1099-E1166 HydrophobicContact CZ2-CB 4.25Å; E1166-I1168 PolarHBondContact O-N 3.11Å; E1166-L1169 PolarHBondContact O-N 2.96Å; E1166-L1169 VanDerWaalsContact O-N 3.16Å; E1166-L1170 HydrophobicContact CG-CD1 3.92Å; E1166-L1170 PolarHBondContact O-N 3.05Å
1167	K	87.4	Confident	87.1	Confident	141 Å²	141	47 Å²	47	61%	0.613	22%	0.216	S	C	*	.	H	α-helix	trans	-58.1	-38.8	-178.4	-64.7	179.9	-175.8	170.6	0	111.5	E1165 N1171	E1165-K1167 PolarHBondContact O-N 3.15Å; E1165-K1167 WeakPolarHBondContact OE1-CD 3.5Å; K1167-N1171 VanDerWaalsContact O-CB 3.23Å; K1167-N1171 WeakPolarHBondContact O-CB 3.16Å; K1167-N1171 PolarHBondContact O-N 3.17Å; K1167-N1171 PolarHBondContact O-ND2 2.79Å
1168	I	86.1	Confident	86.5	Confident	64 Å²	64	49 Å²	49	33%	0.328	23%	0.233	S	C	.	.	H	α-helix	trans	-69	-42.2	-179.6	-58.4	176.7	0	0	0	110.6	I1164 E1165 E1166 K1172 L1175	I1164-I1168 HydrophobicContact CG2-CB 3.92Å; I1164-I1168 HydrophobicContact CG2-CG2 3.88Å; E1165-I1168 HydrophobicContact CB-CD1 4.05Å; E1165-I1168 HydrophobicContact CB-CG1 4.21Å; E1165-I1168 PolarHBondContact O-N 3.3Å; E1165-I1168 VanDerWaalsContact O-N 3.17Å; E1166-I1168 PolarHBondContact O-N 3.11Å; I1168-K1172 HydrophobicContact CG2-CD 4.11Å; I1168-K1172 WeakPolarHBondContact O-CB 3.47Å; I1168-K1172 PolarHBondContact O-N 3.28Å; I1168-L1175 HydrophobicContact CG2-CD1 4.11Å
1169	L	87.4	Confident	86.4	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-43.3	177.4	-74.6	169.3	0	0	0	112.3	L1095 H1098 W1099 I1164 E1165 E1166 K1172 L1175	L1095-L1169 HydrophobicContact CD1-CB 4.42Å; L1095-L1169 HydrophobicContact CD1-CD1 3.86Å; H1098-L1169 VanDerWaalsContact CD2-CD2 3.45Å; H1098-L1169 WeakPolarHBondContact CD2-CD2 3.45Å; W1099-L1169 VanDerWaalsContact NE1-CD1 3.33Å; I1164-L1169 HydrophobicContact CB-CD1 4.3Å; I1164-L1169 HydrophobicContact CB-CD2 4.31Å; I1164-L1169 HydrophobicContact CB-CG 4.13Å; I1164-L1169 HydrophobicContact CD1-CD2 4.24Å; I1164-L1169 HydrophobicContact CG2-CD1 4.45Å; I1164-L1169 HydrophobicContact CG2-CD2 4.13Å; I1164-L1169 HydrophobicContact CG2-CG 3.8Å; E1165-L1169 PolarHBondContact O-N 3.27Å; E1166-L1169 PolarHBondContact O-N 2.96Å; E1166-L1169 VanDerWaalsContact O-N 3.16Å; L1169-K1172 CarbonylContact O-C 3.57Å; L1169-L1175 HydrophobicContact CD2-CB 4.3Å; L1169-L1175 HydrophobicContact CD2-CD1 4.28Å
1170	L	89.1	Confident	85.7	Confident	27 Å²	27	49 Å²	49	14%	0.141	24%	0.235	C	C	.	.	H	α-helix	trans	-74.1	-26	-179.3	-66.3	175.4	0	0	0	113.7	K1090 L1095 E1166	K1090-L1170 WeakPolarHBondContact CE-O 3.47Å; K1090-L1170 HydrophobicContact CG-CD2 4.45Å; K1090-L1170 PolarHBondContact NZ-O 2.95Å; L1095-L1170 HydrophobicContact CB-CD2 4.44Å; E1166-L1170 HydrophobicContact CG-CD1 3.92Å; E1166-L1170 PolarHBondContact O-N 3.05Å
1171	N	87.8	Confident	85	Confident	128 Å²	128	52.4 Å²	52.4	68%	0.684	25%	0.247	S	C	*	.	H	α-helix	trans	-91.2	-18.5	176.7	-69.7	-8.4	0	0	0	113.6	K1167 P1173	K1167-N1171 VanDerWaalsContact O-CB 3.23Å; K1167-N1171 WeakPolarHBondContact O-CB 3.16Å; K1167-N1171 PolarHBondContact O-N 3.17Å; K1167-N1171 PolarHBondContact O-ND2 2.79Å; N1171-P1173 VanDerWaalsContact C-CD 3.49Å
1172	K	85.6	Confident	84.5	Confident	61 Å²	61	52.6 Å²	52.6	27%	0.265	25%	0.248	S	C	.	.			trans	-124.5	68.1	177.4	-62	176.3	-177.5	172.9	0	111.2	I1168 L1169 Y1174 L1175	I1168-K1172 HydrophobicContact CG2-CD 4.11Å; I1168-K1172 WeakPolarHBondContact O-CB 3.47Å; I1168-K1172 PolarHBondContact O-N 3.28Å; L1169-K1172 CarbonylContact O-C 3.57Å; K1172-Y1174 HydrophobicContact CB-CD1 4.27Å; K1172-Y1174 HydrophobicContact CB-CE1 3.84Å; K1172-Y1174 HydrophobicContact CD-CE1 4.49Å; K1172-Y1174 HydrophobicContact CG-CE1 4.13Å; K1172-Y1174 PolarHBondContact O-N 3.11Å; K1172-L1175 HydrophobicContact CB-CD1 3.82Å; K1172-L1175 HydrophobicContact CB-CG 4.1Å; K1172-L1175 WeakPolarHBondContact O-CB 3.45Å; K1172-L1175 WeakPolarHBondContact O-CG 3.47Å; K1172-L1175 PolarHBondContact O-N 3.04Å
1173	P	86.9	Confident	84	Confident	6 Å²	6	48.2 Å²	48.2	4%	0.039	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-54.4	-29.6	-174	-26.8	35.4	0	0	0	114.5	A807 E810 A811 L1094 N1171 L1175 Y1176	A807-P1173 HydrophobicContact CB-CB 4.2Å; A807-P1173 HydrophobicContact CB-CG 3.72Å; A807-P1173 WeakPolarHBondContact O-CB 3.39Å; E810-P1173 HydrophobicContact CB-CB 4.11Å; E810-P1173 HydrophobicContact CB-CG 4.49Å; A811-P1173 WeakPolarHBondContact CA-O 3.24Å; A811-P1173 HydrophobicContact CB-CB 4.25Å; A811-P1173 WeakPolarHBondContact CB-O 3.41Å; L1094-P1173 HydrophobicContact CD1-CB 3.8Å; L1094-P1173 HydrophobicContact CD1-CG 4.15Å; N1171-P1173 VanDerWaalsContact C-CD 3.49Å; P1173-L1175 PolarHBondContact O-N 2.71Å; P1173-Y1176 VanDerWaalsContact O-CB 3.3Å; P1173-Y1176 WeakPolarHBondContact O-CB 3.3Å; P1173-Y1176 PolarHBondContact O-N 2.85Å; P1173-Y1176 VanDerWaalsContact O-N 3.11Å
1174	Y	84.6	Confident	84	Confident	42 Å²	42	48.4 Å²	48.4	17%	0.165	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-56.4	-18.3	177.6	70.2	-114	0	0	0	115	E810 K1172 Y1176 K1177 K1340	E810-Y1174 WeakPolarHBondContact O-CA 3.35Å; K1172-Y1174 HydrophobicContact CB-CD1 4.27Å; K1172-Y1174 HydrophobicContact CB-CE1 3.84Å; K1172-Y1174 HydrophobicContact CD-CE1 4.49Å; K1172-Y1174 HydrophobicContact CG-CE1 4.13Å; K1172-Y1174 PolarHBondContact O-N 3.11Å; Y1174-Y1176 PolarHBondContact O-N 2.97Å; Y1174-K1177 WeakPolarHBondContact O-CB 3.49Å; Y1174-K1177 PolarHBondContact O-N 3.38Å; Y1174-K1340 VanDerWaalsContact CB-NZ 3.32Å; Y1174-K1340 HydrophobicContact CD1-CD 4.42Å; Y1174-K1340 HydrophobicContact CD2-CD 3.88Å; Y1174-K1340 HydrophobicContact CE1-CD 4.12Å; Y1174-K1340 HydrophobicContact CE2-CD 3.55Å; Y1174-K1340 HydrophobicContact CG-CD 4.31Å
1175	L	85.4	Confident	84	Confident	8 Å²	8	46.9 Å²	46.9	4%	0.042	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-64.1	-31.9	178	-70.2	172.1	0	0	0	111.4	I1164 I1168 L1169 K1172 P1173 K1177 A1178	I1164-L1175 HydrophobicContact CD1-CD1 4.44Å; I1168-L1175 HydrophobicContact CG2-CD1 4.11Å; L1169-L1175 HydrophobicContact CD2-CB 4.3Å; L1169-L1175 HydrophobicContact CD2-CD1 4.28Å; K1172-L1175 HydrophobicContact CB-CD1 3.82Å; K1172-L1175 HydrophobicContact CB-CG 4.1Å; K1172-L1175 WeakPolarHBondContact O-CB 3.45Å; K1172-L1175 WeakPolarHBondContact O-CG 3.47Å; K1172-L1175 PolarHBondContact O-N 3.04Å; P1173-L1175 PolarHBondContact O-N 2.71Å; L1175-K1177 PolarHBondContact O-N 2.82Å; L1175-K1177 VanDerWaalsContact O-N 3.14Å; L1175-A1178 WeakPolarHBondContact O-CB 3.34Å; L1175-A1178 PolarHBondContact O-N 3.47Å
1176	Y	87.6	Confident	84	Confident	5 Å²	5	47 Å²	47	2%	0.02	23%	0.228	C	C	.	.	H	α-helix	trans	-53.4	-34.5	172.8	-171.6	-91.7	0	0	0	112.8	L450 G451 Q452 I453 A811 I813 F1093 L1094 P1173 Y1174 A1178 I1179 S1180	L450-Y1176 WeakPolarHBondContact O-CE2 3.48Å; L450-Y1176 PolarHBondContact O-OH 2.99Å; G451-Y1176 VanDerWaalsContact C-OH 3.27Å; Q452-Y1176 PolarHBondContact N-OH 3.28Å; I453-Y1176 WeakPolarHBondContact CB-OH 3.41Å; I453-Y1176 PolarHBondContact N-OH 2.85Å; A811-Y1176 HydrophobicContact CB-CD1 4.18Å; A811-Y1176 HydrophobicContact CB-CG 4.28Å; I813-Y1176 HydrophobicContact CD1-CD1 4.35Å; I813-Y1176 HydrophobicContact CD1-CE1 3.94Å; I813-Y1176 HydrophobicContact CG1-CD1 4.44Å; I813-Y1176 HydrophobicContact CG1-CE1 4.09Å; F1093-Y1176 VanDerWaalsContact O-CE2 3.26Å; F1093-Y1176 WeakPolarHBondContact O-CE2 3.11Å; L1094-Y1176 HydrophobicContact CD2-CD2 4.01Å; L1094-Y1176 HydrophobicContact CD2-CG 4Å; P1173-Y1176 VanDerWaalsContact O-CB 3.3Å; P1173-Y1176 WeakPolarHBondContact O-CB 3.3Å; P1173-Y1176 PolarHBondContact O-N 2.85Å; P1173-Y1176 VanDerWaalsContact O-N 3.11Å; Y1174-Y1176 PolarHBondContact O-N 2.97Å; Y1176-A1178 PolarHBondContact O-N 3.45Å; Y1176-I1179 WeakPolarHBondContact O-CG1 3.34Å; Y1176-I1179 PolarHBondContact O-N 2.88Å; Y1176-S1180 PolarHBondContact O-N 2.96Å
1177	K	82.2	Confident	83.8	Confident	101 Å²	101	48.2 Å²	48.2	44%	0.439	25%	0.248	S	C	.	.	H	α-helix	trans	-63.5	-23.9	175.8	-167.7	166.7	-179.3	168.1	0	113.3	H970 Y1174 L1175 S1180	H970-K1177 PolarHBondContact O-NZ 3.35Å; Y1174-K1177 WeakPolarHBondContact O-CB 3.49Å; Y1174-K1177 PolarHBondContact O-N 3.38Å; L1175-K1177 PolarHBondContact O-N 2.82Å; L1175-K1177 VanDerWaalsContact O-N 3.14Å; K1177-S1180 PolarHBondContact O-OG 3.45Å
1178	A	79.2	Confident	83.8	Confident	44 Å²	44	49.4 Å²	49.4	36%	0.364	25%	0.249	S	C	.	.	H	α-helix	trans	-69.9	-36.1	-179.1	0	0	0	0	0	112.8	L1175 Y1176 A1183 W1333	L1175-A1178 WeakPolarHBondContact O-CB 3.34Å; L1175-A1178 PolarHBondContact O-N 3.47Å; Y1176-A1178 PolarHBondContact O-N 3.45Å; A1178-A1183 VanDerWaalsContact O-CB 3.29Å; A1178-A1183 WeakPolarHBondContact O-CB 3.44Å; A1178-W1333 HydrophobicContact CB-CH2 4.04Å; A1178-W1333 HydrophobicContact CB-CZ3 4.48Å
1179	I	83.6	Confident	84	Confident	7 Å²	7	48.3 Å²	48.3	4%	0.036	24%	0.241	C	C	.	.	H	α-helix	trans	-84.9	-20.3	177.9	56.7	162.6	0	0	0	113.7	G451 Q452 H1098 Y1101 Y1176 A1183	G451-I1179 WeakPolarHBondContact O-CD1 3.32Å; Q452-I1179 PolarHBondContact NE2-O 3.38Å; H1098-I1179 HydrophobicContact CB-CD1 3.95Å; H1098-I1179 WeakPolarHBondContact CE1-CG2 3.45Å; Y1101-I1179 HydrophobicContact CD1-CB 3.78Å; Y1101-I1179 HydrophobicContact CD1-CD1 3.95Å; Y1101-I1179 HydrophobicContact CD1-CG1 4.41Å; Y1101-I1179 HydrophobicContact CD1-CG2 4.2Å; Y1101-I1179 HydrophobicContact CE1-CB 3.89Å; Y1101-I1179 HydrophobicContact CE1-CG2 4.35Å; Y1101-I1179 HydrophobicContact CG-CD1 4.42Å; Y1176-I1179 WeakPolarHBondContact O-CG1 3.34Å; Y1176-I1179 PolarHBondContact O-N 2.88Å; I1179-A1183 PolarHBondContact O-N 2.96Å
1180	S	76.1	Confident	84.2	Confident	21 Å²	21	48.9 Å²	48.9	15%	0.147	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	156.2	-179.3	75	0	0	0	0	113.9	Y1176 K1177 Q1182	Y1176-S1180 PolarHBondContact O-N 2.96Å; K1177-S1180 PolarHBondContact O-OG 3.45Å; S1180-Q1182 VanDerWaalsContact C-N 3.3Å
1181	Y	74.9	Confident	84.4	Confident	117 Å²	117	53.5 Å²	53.5	46%	0.459	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	41.6	-171.8	-56.1	-89.1	0	0	0	112.8	K454 A1183	K454-Y1181 HydrophobicContact CD-CE1 4.43Å; K454-Y1181 VanDerWaalsContact CE-OH 3.27Å; K454-Y1181 WeakPolarHBondContact CE-OH 3.34Å; K454-Y1181 PolarHBondContact NZ-OH 2.94Å; Y1181-A1183 VanDerWaalsContact C-N 3.31Å; Y1181-A1183 PolarHBondContact O-N 3.4Å
1182	Q	79	Confident	84.6	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.019	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.1	53.7	-179.9	-59.7	-166.4	4.5	0	0	112.9	T339 Q452 M1041 Y1101 S1180 N1184 L1185	T339-Q1182 VanDerWaalsContact C-NE2 3.34Å; T339-Q1182 PolarHBondContact O-NE2 3.18Å; T339-Q1182 PolarHBondContact OG1-NE2 2.95Å; Q452-Q1182 HydrophobicContact CG-CG 4.3Å; M1041-Q1182 VanDerWaalsContact CE-CD 3.44Å; M1041-Q1182 HydrophobicContact CE-CG 4.44Å; M1041-Q1182 VanDerWaalsContact CE-NE2 3.28Å; M1041-Q1182 HydrophobicContact SD-CB 4.01Å; M1041-Q1182 HydrophobicContact SD-CG 3.71Å; M1041-Q1182 PolarHBondContact SD-OE1 3.4Å; M1041-Q1182 VanDerWaalsContact SD-OE1 3.33Å; Y1101-Q1182 HydrophobicContact CE2-CB 4.47Å; Y1101-Q1182 HydrophobicContact CE2-CG 4.26Å; Y1101-Q1182 WeakPolarHBondContact OH-CA 3.47Å; S1180-Q1182 VanDerWaalsContact C-N 3.3Å; Q1182-N1184 PolarHBondContact O-N 3Å; Q1182-N1184 VanDerWaalsContact O-N 3.13Å; Q1182-L1185 HydrophobicContact CB-CB 4.44Å; Q1182-L1185 PolarHBondContact O-N 2.97Å
1183	A	77.1	Confident	84.9	Confident	19 Å²	19	47.1 Å²	47.1	16%	0.157	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-54.3	-40	-169	0	0	0	0	0	113.5	Y1101 A1178 I1179 Y1181 L1185	Y1101-A1183 PolarHBondContact OH-N 3.2Å; A1178-A1183 VanDerWaalsContact O-CB 3.29Å; A1178-A1183 WeakPolarHBondContact O-CB 3.44Å; I1179-A1183 PolarHBondContact O-N 2.96Å; Y1181-A1183 VanDerWaalsContact C-N 3.31Å; Y1181-A1183 PolarHBondContact O-N 3.4Å; A1183-L1185 VanDerWaalsContact C-N 3.34Å; A1183-L1185 PolarHBondContact O-N 3.26Å
1184	N	84.1	Confident	85.3	Confident	22 Å²	22	48.3 Å²	48.3	12%	0.118	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-72.8	-15.2	178.7	-61.6	-2.6	0	0	0	114.5	Y1101 T1105 Q1182 Y1189	Y1101-N1184 HydrophobicContact CE1-CB 4.39Å; Y1101-N1184 PolarHBondContact OH-N 3.47Å; T1105-N1184 WeakPolarHBondContact OG1-CB 3.47Å; T1105-N1184 PolarHBondContact OG1-ND2 3.34Å; Q1182-N1184 PolarHBondContact O-N 3Å; Q1182-N1184 VanDerWaalsContact O-N 3.13Å; N1184-Y1189 VanDerWaalsContact O-CD1 3.26Å; N1184-Y1189 WeakPolarHBondContact O-CD1 3.22Å
1185	L	85	Confident	85.8	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.026	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-112.4	19.7	-178.6	-62.1	179.7	0	0	0	113.1	R340 L343 T1105 M1108 Q1182 A1183 I1190	R340-L1185 HydrophobicContact CG-CD1 4.05Å; L343-L1185 HydrophobicContact CD2-CB 3.65Å; L343-L1185 HydrophobicContact CD2-CD1 3.71Å; L343-L1185 HydrophobicContact CD2-CG 4.28Å; T1105-L1185 HydrophobicContact CG2-CD1 3.83Å; T1105-L1185 HydrophobicContact CG2-CD2 4.43Å; T1105-L1185 HydrophobicContact CG2-CG 3.92Å; M1108-L1185 HydrophobicContact CE-CD1 4.47Å; M1108-L1185 HydrophobicContact SD-CD1 4.3Å; Q1182-L1185 HydrophobicContact CB-CB 4.44Å; Q1182-L1185 PolarHBondContact O-N 2.97Å; A1183-L1185 VanDerWaalsContact C-N 3.34Å; A1183-L1185 PolarHBondContact O-N 3.26Å; L1185-I1190 WeakPolarHBondContact O-CD1 3.45Å
1186	K	85.1	Confident	86.2	Confident	107 Å²	107	50.9 Å²	50.9	47%	0.465	25%	0.254	S	S	.	.			trans	-66.5	137.1	171	-71.7	171.9	-179.6	160.9	0	110.1	W1188 Y1189 I1190	K1186-W1188 VanDerWaalsContact C-N 3.27Å; K1186-W1188 PolarHBondContact O-N 3.42Å; K1186-W1188 VanDerWaalsContact O-N 3.15Å; K1186-Y1189 WeakPolarHBondContact O-CA 3.4Å; K1186-Y1189 WeakPolarHBondContact O-CB 3.44Å; K1186-Y1189 PolarHBondContact O-N 3.13Å; K1186-I1190 PolarHBondContact O-N 2.96Å; K1186-I1190 VanDerWaalsContact O-N 3.07Å
1187	A	85.8	Confident	86.6	Confident	81 Å²	81	50.7 Å²	50.7	67%	0.669	25%	0.253	S	S	*	.	H	α-helix	trans	-51.4	-41.5	-177.5	0	0	0	0	0	113.9	Y1189 I1190 F1191	A1187-Y1189 VanDerWaalsContact C-N 3.31Å; A1187-Y1189 PolarHBondContact O-N 3.28Å; A1187-I1190 PolarHBondContact O-N 3.34Å; A1187-F1191 WeakPolarHBondContact O-CB 3.46Å; A1187-F1191 PolarHBondContact O-N 3.16Å
1188	W	88.3	Confident	87.2	Confident	165 Å²	165	49.7 Å²	49.7	63%	0.625	25%	0.252	S	S	*	.	H	α-helix	trans	-56.7	-41.1	173.6	134.5	-98.9	0	0	0	113	K1186 F1191 L1192	K1186-W1188 VanDerWaalsContact C-N 3.27Å; K1186-W1188 PolarHBondContact O-N 3.42Å; K1186-W1188 VanDerWaalsContact O-N 3.15Å; W1188-F1191 PolarHBondContact O-N 2.96Å; W1188-L1192 HydrophobicContact CE3-CD2 4.48Å; W1188-L1192 HydrophobicContact CE3-CG 4.29Å; W1188-L1192 HydrophobicContact CH2-CD1 3.65Å; W1188-L1192 HydrophobicContact CH2-CD2 3.86Å; W1188-L1192 HydrophobicContact CH2-CG 3.96Å; W1188-L1192 HydrophobicContact CZ2-CD1 3.64Å; W1188-L1192 HydrophobicContact CZ2-CG 4.31Å; W1188-L1192 HydrophobicContact CZ3-CD1 4.14Å; W1188-L1192 HydrophobicContact CZ3-CD2 3.74Å; W1188-L1192 HydrophobicContact CZ3-CG 3.94Å; W1188-L1192 PolarHBondContact O-N 3.39Å
1189	Y	89.2	Confident	88	Confident	41 Å²	41	52.3 Å²	52.3	16%	0.161	25%	0.252	C	S	.	.	H	α-helix	trans	-74.4	-42	-178.4	-167.1	-110.6	0	0	0	110.4	L1109 N1184 K1186 A1187 F1191 L1192 W1193 W1259	L1109-Y1189 HydrophobicContact CD1-CD1 3.84Å; L1109-Y1189 HydrophobicContact CD1-CE1 3.52Å; N1184-Y1189 VanDerWaalsContact O-CD1 3.26Å; N1184-Y1189 WeakPolarHBondContact O-CD1 3.22Å; K1186-Y1189 WeakPolarHBondContact O-CA 3.4Å; K1186-Y1189 WeakPolarHBondContact O-CB 3.44Å; K1186-Y1189 PolarHBondContact O-N 3.13Å; A1187-Y1189 VanDerWaalsContact C-N 3.31Å; A1187-Y1189 PolarHBondContact O-N 3.28Å; Y1189-F1191 VanDerWaalsContact C-N 3.26Å; Y1189-F1191 PolarHBondContact O-N 3.26Å; Y1189-L1192 HydrophobicContact CD2-CD1 4.4Å; Y1189-L1192 WeakPolarHBondContact O-CB 3.36Å; Y1189-L1192 PolarHBondContact O-N 3.26Å; Y1189-L1192 VanDerWaalsContact O-N 3.15Å; Y1189-W1193 AromaticContact CD1-NE1 3.87Å; Y1189-W1193 AromaticContact CE1-CD1 3.93Å; Y1189-W1193 AromaticContact CE1-NE1 3.3Å; Y1189-W1193 VanDerWaalsContact CE1-NE1 3.3Å; Y1189-W1193 AromaticContact CZ-NE1 3.48Å; Y1189-W1193 PolarHBondContact O-N 3.43Å; Y1189-W1259 VanDerWaalsContact OH-CH2 3.27Å; Y1189-W1259 WeakPolarHBondContact OH-CH2 3.1Å
1190	I	91.3	Very high	88.6	Confident	16 Å²	16	52 Å²	52	8%	0.082	25%	0.251	C	S	.	.	H	α-helix	trans	-57.2	-42.5	172.7	-62.7	164.9	0	0	0	110.5	I347 L1109 L1185 K1186 A1187 L1192 W1193 V1194	I347-I1190 HydrophobicContact CD1-CD1 3.45Å; I347-I1190 VanDerWaalsContact CD1-CD1 3.45Å; I347-I1190 HydrophobicContact CG1-CD1 3.93Å; L1109-I1190 HydrophobicContact CD2-CG1 3.91Å; L1185-I1190 WeakPolarHBondContact O-CD1 3.45Å; K1186-I1190 PolarHBondContact O-N 2.96Å; K1186-I1190 VanDerWaalsContact O-N 3.07Å; A1187-I1190 PolarHBondContact O-N 3.34Å; I1190-L1192 VanDerWaalsContact C-N 3.32Å; I1190-L1192 PolarHBondContact O-N 2.88Å; I1190-W1193 PolarHBondContact O-N 2.94Å; I1190-V1194 HydrophobicContact CG2-CG2 4.36Å; I1190-V1194 WeakPolarHBondContact O-CG2 3.27Å; I1190-V1194 PolarHBondContact O-N 3.33Å
1191	F	92.6	Very high	89.5	Confident	123 Å²	123	51 Å²	51	54%	0.539	24%	0.244	S	C	.	.	H	α-helix	trans	-59.1	-37.6	177.4	-179.4	-109.2	0	0	0	113.2	A1187 W1188 Y1189 V1194 I1195	A1187-F1191 WeakPolarHBondContact O-CB 3.46Å; A1187-F1191 PolarHBondContact O-N 3.16Å; W1188-F1191 PolarHBondContact O-N 2.96Å; Y1189-F1191 VanDerWaalsContact C-N 3.26Å; Y1189-F1191 PolarHBondContact O-N 3.26Å; F1191-V1194 PolarHBondContact O-N 3.2Å; F1191-I1195 HydrophobicContact CD1-CD1 3.89Å; F1191-I1195 HydrophobicContact CE1-CD1 3.41Å; F1191-I1195 VanDerWaalsContact CE1-CD1 3.41Å; F1191-I1195 HydrophobicContact CE1-CG1 4.37Å; F1191-I1195 HydrophobicContact CE2-CD1 4.35Å; F1191-I1195 HydrophobicContact CZ-CD1 3.67Å; F1191-I1195 HydrophobicContact CZ-CG1 4.29Å; F1191-I1195 WeakPolarHBondContact O-CG1 3.36Å; F1191-I1195 PolarHBondContact O-N 3.39Å
1192	L	92.4	Very high	90.5	Very high	47 Å²	47	50.1 Å²	50.1	25%	0.246	24%	0.242	C	C	.	.	H	α-helix	trans	-61.1	-43.6	171.4	-68.3	179.8	0	0	0	112.3	W1188 Y1189 I1190 V1194 I1195 D1196 W1325	W1188-L1192 HydrophobicContact CE3-CD2 4.48Å; W1188-L1192 HydrophobicContact CE3-CG 4.29Å; W1188-L1192 HydrophobicContact CH2-CD1 3.65Å; W1188-L1192 HydrophobicContact CH2-CD2 3.86Å; W1188-L1192 HydrophobicContact CH2-CG 3.96Å; W1188-L1192 HydrophobicContact CZ2-CD1 3.64Å; W1188-L1192 HydrophobicContact CZ2-CG 4.31Å; W1188-L1192 HydrophobicContact CZ3-CD1 4.14Å; W1188-L1192 HydrophobicContact CZ3-CD2 3.74Å; W1188-L1192 HydrophobicContact CZ3-CG 3.94Å; W1188-L1192 PolarHBondContact O-N 3.39Å; Y1189-L1192 HydrophobicContact CD2-CD1 4.4Å; Y1189-L1192 WeakPolarHBondContact O-CB 3.36Å; Y1189-L1192 PolarHBondContact O-N 3.26Å; Y1189-L1192 VanDerWaalsContact O-N 3.15Å; I1190-L1192 VanDerWaalsContact C-N 3.32Å; I1190-L1192 PolarHBondContact O-N 2.88Å; L1192-V1194 VanDerWaalsContact C-N 3.3Å; L1192-V1194 PolarHBondContact O-N 3.06Å; L1192-I1195 PolarHBondContact O-N 3.01Å; L1192-D1196 WeakPolarHBondContact O-CB 2.94Å; L1192-D1196 PolarHBondContact O-N 3.12Å; L1192-W1325 HydrophobicContact CD1-CH2 4.41Å; L1192-W1325 HydrophobicContact CD1-CZ2 4.27Å
1193	W	93.4	Very high	91.3	Very high	8 Å²	8	50.7 Å²	50.7	3%	0.03	25%	0.245	C	C	.	.	H	α-helix	trans	-69	-28	178	-74.5	85.7	0	0	0	112.9	L1109 F1110 H1113 Y1189 I1190 G1197 W1259	L1109-W1193 HydrophobicContact CB-CD2 3.93Å; L1109-W1193 HydrophobicContact CB-CE3 4.3Å; L1109-W1193 HydrophobicContact CB-CG 4.16Å; L1109-W1193 HydrophobicContact CB-CZ2 4.46Å; L1109-W1193 HydrophobicContact CD2-CB 4.35Å; L1109-W1193 HydrophobicContact CD2-CG 4.06Å; F1110-W1193 HydrophobicContact CD1-CH2 4.14Å; F1110-W1193 AromaticContact CD1-CZ3 3.73Å; F1110-W1193 HydrophobicContact CD1-CZ3 3.73Å; F1110-W1193 AromaticContact CE1-CH2 3.84Å; F1110-W1193 HydrophobicContact CE1-CH2 3.84Å; F1110-W1193 AromaticContact CE1-CZ3 3.8Å; F1110-W1193 HydrophobicContact CE1-CZ3 3.8Å; F1110-W1193 HydrophobicContact CZ-CH2 4.36Å; H1113-W1193 HydrophobicContact CB-CE3 3.9Å; Y1189-W1193 AromaticContact CD1-NE1 3.87Å; Y1189-W1193 AromaticContact CE1-CD1 3.93Å; Y1189-W1193 AromaticContact CE1-NE1 3.3Å; Y1189-W1193 VanDerWaalsContact CE1-NE1 3.3Å; Y1189-W1193 AromaticContact CZ-NE1 3.48Å; Y1189-W1193 PolarHBondContact O-N 3.43Å; I1190-W1193 PolarHBondContact O-N 2.94Å; W1193-G1197 PolarHBondContact O-N 3.25Å; W1193-W1259 HydrophobicContact CH2-CD2 4.05Å; W1193-W1259 AromaticContact CH2-CE2 4Å; W1193-W1259 HydrophobicContact CH2-CG 4.35Å; W1193-W1259 HydrophobicContact CH2-CZ2 4.38Å; W1193-W1259 HydrophobicContact CZ2-CD2 4.19Å; W1193-W1259 AromaticContact CZ2-CE2 3.95Å; W1193-W1259 HydrophobicContact CZ2-CE3 4.34Å; W1193-W1259 HydrophobicContact CZ2-CH2 4.06Å; W1193-W1259 AromaticContact CZ2-CZ2 3.87Å; W1193-W1259 HydrophobicContact CZ2-CZ2 3.87Å; W1193-W1259 HydrophobicContact CZ2-CZ3 4.28Å
1194	V	93.8	Very high	92.1	Very high	32 Å²	32	49.8 Å²	49.8	19%	0.194	24%	0.238	C	C	.	.	H	α-helix	trans	-68.5	-46	170.5	173.3	0	0	0	0	110.7	F351 V1116 I1190 F1191 L1192 D1196 G1197 I1198	F351-V1194 HydrophobicContact CE1-CG2 4.31Å; F351-V1194 HydrophobicContact CZ-CG2 4.04Å; V1116-V1194 HydrophobicContact CG1-CG1 4.18Å; V1116-V1194 WeakPolarHBondContact CG1-O 3.49Å; V1116-V1194 HydrophobicContact CG2-CG1 4.35Å; V1116-V1194 HydrophobicContact CG2-CG2 4.35Å; I1190-V1194 HydrophobicContact CG2-CG2 4.36Å; I1190-V1194 WeakPolarHBondContact O-CG2 3.27Å; I1190-V1194 PolarHBondContact O-N 3.33Å; F1191-V1194 PolarHBondContact O-N 3.2Å; L1192-V1194 VanDerWaalsContact C-N 3.3Å; L1192-V1194 PolarHBondContact O-N 3.06Å; V1194-D1196 VanDerWaalsContact C-N 3.35Å; V1194-D1196 PolarHBondContact O-N 3.5Å; V1194-G1197 PolarHBondContact O-N 2.92Å; V1194-I1198 HydrophobicContact CG1-CD1 4.12Å; V1194-I1198 WeakPolarHBondContact O-CG1 3.35Å; V1194-I1198 PolarHBondContact O-N 3.37Å
1195	I	95.3	Very high	92.6	Very high	82 Å²	82	49.3 Å²	49.3	42%	0.421	24%	0.235	S	C	.	.	H	α-helix	trans	-59.9	-45.3	174.5	-71	170.1	0	0	0	111.1	F1191 L1192 G1197 I1198 W1199	F1191-I1195 HydrophobicContact CD1-CD1 3.89Å; F1191-I1195 HydrophobicContact CE1-CD1 3.41Å; F1191-I1195 VanDerWaalsContact CE1-CD1 3.41Å; F1191-I1195 HydrophobicContact CE1-CG1 4.37Å; F1191-I1195 HydrophobicContact CE2-CD1 4.35Å; F1191-I1195 HydrophobicContact CZ-CD1 3.67Å; F1191-I1195 HydrophobicContact CZ-CG1 4.29Å; F1191-I1195 WeakPolarHBondContact O-CG1 3.36Å; F1191-I1195 PolarHBondContact O-N 3.39Å; L1192-I1195 PolarHBondContact O-N 3.01Å; I1195-G1197 VanDerWaalsContact C-N 3.27Å; I1195-G1197 PolarHBondContact O-N 3.18Å; I1195-I1198 PolarHBondContact O-N 3.45Å; I1195-I1198 VanDerWaalsContact O-N 3.16Å; I1195-W1199 PolarHBondContact O-N 2.87Å
1196	D	94.2	Very high	93	Very high	22 Å²	22	50.6 Å²	50.6	12%	0.118	24%	0.24	C	C	.	.	H	α-helix	trans	-61.1	-36.5	176.6	-166.8	50.1	0	0	0	111.5	H1113 L1192 V1194 H1200 R1255	H1113-D1196 PolarHBondContact CE1-O 3.41Å; H1113-D1196 IonicContact CE1-OD2 2.71Å; H1113-D1196 PolarHBondContact CE1-OD2 3.47Å; H1113-D1196 IonicContact ND1-OD2 2.82Å; H1113-D1196 PolarHBondContact ND1-OD2 3.18Å; L1192-D1196 WeakPolarHBondContact O-CB 2.94Å; L1192-D1196 PolarHBondContact O-N 3.12Å; V1194-D1196 VanDerWaalsContact C-N 3.35Å; V1194-D1196 PolarHBondContact O-N 3.5Å; D1196-H1200 PolarHBondContact O-CD2 2.81Å; D1196-H1200 PolarHBondContact O-N 2.67Å; D1196-R1255 IonicContact OD1-NE 2.66Å; D1196-R1255 IonicContact OD2-CZ 2.71Å; D1196-R1255 IonicContact OD2-NE 3.65Å; D1196-R1255 PolarHBondContact OD2-NE 2.75Å; D1196-R1255 IonicContact OD2-NH2 3.67Å; D1196-R1255 PolarHBondContact OD2-NH2 3.36Å
1197	G	95.1	Very high	93.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-47	171.1	0	0	0	0	0	112.7	H1113 A1117 W1193 V1194 I1195 W1199 H1200 G1201	H1113-G1197 WeakPolarHBondContact ND1-CA 3.47Å; H1113-G1197 PolarHBondContact ND1-N 3.37Å; A1117-G1197 WeakPolarHBondContact CA-O 3.13Å; A1117-G1197 VanDerWaalsContact CB-O 3.25Å; A1117-G1197 WeakPolarHBondContact CB-O 3.24Å; W1193-G1197 PolarHBondContact O-N 3.25Å; V1194-G1197 PolarHBondContact O-N 2.92Å; I1195-G1197 VanDerWaalsContact C-N 3.27Å; I1195-G1197 PolarHBondContact O-N 3.18Å; G1197-W1199 VanDerWaalsContact C-N 3.32Å; G1197-W1199 PolarHBondContact O-N 3.25Å; G1197-H1200 PolarHBondContact O-N 3.41Å; G1197-G1201 PolarHBondContact O-N 2.74Å
1198	I	96	Very high	93.6	Very high	81 Å²	81	42.8 Å²	42.8	42%	0.415	19%	0.192	S	C	.	.	H	α-helix	trans	-59.1	-44	176.4	-67.6	165.7	0	0	0	110.5	V1116 C1120 V1194 I1195 G1201 F1202	V1116-I1198 HydrophobicContact CG1-CG1 3.74Å; C1120-I1198 PolarHBondContact SG-O 2.85Å; C1120-I1198 VanDerWaalsContact SG-O 3.38Å; V1194-I1198 HydrophobicContact CG1-CD1 4.12Å; V1194-I1198 WeakPolarHBondContact O-CG1 3.35Å; V1194-I1198 PolarHBondContact O-N 3.37Å; I1195-I1198 PolarHBondContact O-N 3.45Å; I1195-I1198 VanDerWaalsContact O-N 3.16Å; I1198-G1201 PolarHBondContact O-N 3.4Å; I1198-F1202 VanDerWaalsContact O-CB 3.3Å; I1198-F1202 WeakPolarHBondContact O-CB 3.28Å; I1198-F1202 PolarHBondContact O-N 3.16Å
1199	W	96.4	Very high	93.7	Very high	99 Å²	99	36.3 Å²	36.3	38%	0.375	17%	0.167	S	C	.	.	H	α-helix	trans	-57.5	-50.2	175.5	177.3	-102.6	0	0	0	112	I1195 G1197 G1201 F1202 I1203 I1317 A1318 P1321	I1195-W1199 PolarHBondContact O-N 2.87Å; G1197-W1199 VanDerWaalsContact C-N 3.32Å; G1197-W1199 PolarHBondContact O-N 3.25Å; W1199-G1201 PolarHBondContact O-N 2.77Å; W1199-F1202 PolarHBondContact O-N 3.46Å; W1199-I1203 HydrophobicContact CD2-CG1 3.85Å; W1199-I1203 HydrophobicContact CE3-CG1 4.23Å; W1199-I1203 HydrophobicContact CG-CG1 4.39Å; W1199-I1203 HydrophobicContact CH2-CD1 3.79Å; W1199-I1203 HydrophobicContact CH2-CG1 4.12Å; W1199-I1203 HydrophobicContact CZ2-CD1 3.76Å; W1199-I1203 HydrophobicContact CZ2-CG1 3.7Å; W1199-I1203 HydrophobicContact CZ3-CD1 4.18Å; W1199-I1203 HydrophobicContact CZ3-CG1 4.35Å; W1199-I1203 WeakPolarHBondContact O-CB 3.07Å; W1199-I1203 WeakPolarHBondContact O-CG1 3.09Å; W1199-I1203 PolarHBondContact O-N 3.44Å; W1199-I1317 HydrophobicContact CZ2-CG2 4.14Å; W1199-I1317 PolarHBondContact NE1-O 2.69Å; W1199-A1318 VanDerWaalsContact CD1-O 3.3Å; W1199-A1318 PolarHBondContact NE1-O 3.44Å; W1199-P1321 HydrophobicContact CZ2-CG 4.28Å
1200	H	95.5	Very high	93.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-57.1	-49.3	176.8	-87.9	-115.1	0	0	0	111.8	H1113 A1117 D1196 G1197 F1202 T1204 A1318	H1113-H1200 AromaticContact CE1-CD2 3.59Å; H1113-H1200 AromaticContact CE1-CG 3.75Å; H1113-H1200 AromaticContact CE1-NE2 3.94Å; H1113-H1200 AromaticContact NE2-CG 3.9Å; H1113-H1200 AromaticContact NE2-ND1 3.91Å; A1117-H1200 HydrophobicContact CB-CB 3.85Å; D1196-H1200 PolarHBondContact O-CD2 2.81Å; D1196-H1200 PolarHBondContact O-N 2.67Å; G1197-H1200 PolarHBondContact O-N 3.41Å; H1200-F1202 PolarHBondContact O-N 3.16Å; H1200-T1204 WeakPolarHBondContact O-CB 3.45Å; H1200-T1204 WeakPolarHBondContact O-CG2 3.3Å; H1200-T1204 PolarHBondContact O-N 3Å; H1200-T1204 PolarHBondContact O-OG1 2.93Å; H1200-A1318 PolarHBondContact NE2-O 2.92Å
1201	G	94.5	Very high	93.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.8	-37.6	-179.4	0	0	0	0	0	114.2	A1117 G1197 I1198 W1199 T1204 Y1205	A1117-G1201 VanDerWaalsContact O-CA 3.24Å; A1117-G1201 WeakPolarHBondContact O-CA 3.47Å; G1197-G1201 PolarHBondContact O-N 2.74Å; I1198-G1201 PolarHBondContact O-N 3.4Å; W1199-G1201 PolarHBondContact O-N 2.77Å; G1201-T1204 PolarHBondContact O-OG1 3.48Å; G1201-Y1205 WeakPolarHBondContact O-CB 3.38Å; G1201-Y1205 PolarHBondContact O-N 2.99Å
1202	F	95.4	Very high	93.6	Very high	98 Å²	98	35 Å²	35	43%	0.43	17%	0.166	S	C	.	.	H	α-helix	trans	-67.5	-52.8	176.9	-172.1	-88	0	0	0	111.5	I1198 W1199 H1200 T1204 Y1205 F1206	I1198-F1202 VanDerWaalsContact O-CB 3.3Å; I1198-F1202 WeakPolarHBondContact O-CB 3.28Å; I1198-F1202 PolarHBondContact O-N 3.16Å; W1199-F1202 PolarHBondContact O-N 3.46Å; H1200-F1202 PolarHBondContact O-N 3.16Å; F1202-T1204 PolarHBondContact O-N 3.49Å; F1202-Y1205 PolarHBondContact O-N 3.17Å; F1202-F1206 AromaticContact CD1-CD2 3.85Å; F1202-F1206 HydrophobicContact CD1-CD2 3.85Å; F1202-F1206 AromaticContact CD2-CD2 3.71Å; F1202-F1206 HydrophobicContact CD2-CD2 3.71Å; F1202-F1206 AromaticContact CD2-CE2 3.57Å; F1202-F1206 HydrophobicContact CD2-CE2 3.57Å; F1202-F1206 AromaticContact CE1-CD2 3.7Å; F1202-F1206 HydrophobicContact CE1-CD2 3.7Å; F1202-F1206 HydrophobicContact CE1-CE2 4.25Å; F1202-F1206 HydrophobicContact CE1-CG 4.34Å; F1202-F1206 AromaticContact CE2-CD2 3.58Å; F1202-F1206 HydrophobicContact CE2-CD2 3.58Å; F1202-F1206 AromaticContact CE2-CE2 3.26Å; F1202-F1206 HydrophobicContact CE2-CE2 3.26Å; F1202-F1206 HydrophobicContact CE2-CZ 4.18Å; F1202-F1206 AromaticContact CG-CD2 3.84Å; F1202-F1206 HydrophobicContact CG-CD2 3.84Å; F1202-F1206 HydrophobicContact CG-CE2 4.19Å; F1202-F1206 AromaticContact CZ-CD2 3.56Å; F1202-F1206 HydrophobicContact CZ-CD2 3.56Å; F1202-F1206 AromaticContact CZ-CE2 3.64Å; F1202-F1206 HydrophobicContact CZ-CE2 3.64Å; F1202-F1206 HydrophobicContact CZ-CG 4.34Å; F1202-F1206 HydrophobicContact CZ-CZ 4.44Å; F1202-F1206 WeakPolarHBondContact O-CD2 3.33Å; F1202-F1206 PolarHBondContact O-N 2.81Å
1203	I	96	Very high	93.2	Very high	16 Å²	16	33.3 Å²	33.3	8%	0.082	16%	0.16	C	C	.	.	H	α-helix	trans	-64	-42.9	-177.9	-68.8	-60.5	0	0	0	111.8	W1199 Y1205 I1207 T1314 I1317 A1318	W1199-I1203 HydrophobicContact CD2-CG1 3.85Å; W1199-I1203 HydrophobicContact CE3-CG1 4.23Å; W1199-I1203 HydrophobicContact CG-CG1 4.39Å; W1199-I1203 HydrophobicContact CH2-CD1 3.79Å; W1199-I1203 HydrophobicContact CH2-CG1 4.12Å; W1199-I1203 HydrophobicContact CZ2-CD1 3.76Å; W1199-I1203 HydrophobicContact CZ2-CG1 3.7Å; W1199-I1203 HydrophobicContact CZ3-CD1 4.18Å; W1199-I1203 HydrophobicContact CZ3-CG1 4.35Å; W1199-I1203 WeakPolarHBondContact O-CB 3.07Å; W1199-I1203 WeakPolarHBondContact O-CG1 3.09Å; W1199-I1203 PolarHBondContact O-N 3.44Å; I1203-Y1205 PolarHBondContact O-N 3.42Å; I1203-I1207 HydrophobicContact CG2-CD1 3.65Å; I1203-I1207 HydrophobicContact CG2-CG1 4.3Å; I1203-I1207 PolarHBondContact O-N 3.48Å; I1203-T1314 HydrophobicContact CG2-CG2 4.34Å; I1203-I1317 HydrophobicContact CD1-CG2 3.97Å; I1203-I1317 HydrophobicContact CG1-CG2 4.34Å; I1203-I1317 HydrophobicContact CG2-CB 4.26Å; I1203-I1317 HydrophobicContact CG2-CG2 3.94Å; I1203-A1318 HydrophobicContact CG2-CB 4.05Å
1204	T	94.8	Very high	92.6	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-71.2	-13	-179	66.1	0	0	0	0	113.1	N1121 H1200 G1201 F1202 P1208 S1244 L1248 T1314	N1121-T1204 PolarHBondContact ND2-OG1 3.37Å; H1200-T1204 WeakPolarHBondContact O-CB 3.45Å; H1200-T1204 WeakPolarHBondContact O-CG2 3.3Å; H1200-T1204 PolarHBondContact O-N 3Å; H1200-T1204 PolarHBondContact O-OG1 2.93Å; G1201-T1204 PolarHBondContact O-OG1 3.48Å; F1202-T1204 PolarHBondContact O-N 3.49Å; T1204-P1208 WeakPolarHBondContact O-CD 3.2Å; T1204-P1208 WeakPolarHBondContact O-CG 3.18Å; T1204-S1244 WeakPolarHBondContact O-CB 3.36Å; T1204-S1244 PolarHBondContact O-OG 3.34Å; T1204-L1248 HydrophobicContact CG2-CB 4.18Å; T1204-L1248 HydrophobicContact CG2-CD1 4.27Å; T1204-T1314 HydrophobicContact CG2-CG2 4.26Å
1205	Y	93.9	Very high	91.9	Very high	13 Å²	13	31.6 Å²	31.6	5%	0.051	15%	0.151	C	C	.	.	H	α-helix	trans	-93.8	-54	170.8	176.4	-86.8	0	0	0	112.2	C1124 V1125 N1128 G1201 F1202 I1203 I1207 P1208 Y1209 S1244	C1124-Y1205 HydrophobicContact CB-CD1 3.42Å; C1124-Y1205 VanDerWaalsContact CB-CD1 3.42Å; C1124-Y1205 HydrophobicContact CB-CD2 4.09Å; C1124-Y1205 HydrophobicContact CB-CE1 4Å; C1124-Y1205 HydrophobicContact CB-CG 3.49Å; C1124-Y1205 VanDerWaalsContact CB-CG 3.49Å; V1125-Y1205 HydrophobicContact CB-CE2 4.3Å; V1125-Y1205 HydrophobicContact CG2-CD2 3.75Å; V1125-Y1205 HydrophobicContact CG2-CE2 3.56Å; N1128-Y1205 WeakPolarHBondContact CB-OH 3.37Å; N1128-Y1205 WeakPolarHBondContact ND2-CE1 3.45Å; N1128-Y1205 PolarHBondContact ND2-OH 3.03Å; N1128-Y1205 VanDerWaalsContact ND2-OH 3.12Å; G1201-Y1205 WeakPolarHBondContact O-CB 3.38Å; G1201-Y1205 PolarHBondContact O-N 2.99Å; F1202-Y1205 PolarHBondContact O-N 3.17Å; I1203-Y1205 PolarHBondContact O-N 3.42Å; Y1205-I1207 PolarHBondContact O-N 3.02Å; Y1205-P1208 VanDerWaalsContact O-CD 3.31Å; Y1205-P1208 WeakPolarHBondContact O-CD 3.49Å; Y1205-P1208 WeakPolarHBondContact O-CG 3.36Å; Y1205-Y1209 HydrophobicContact CE1-CD1 4.45Å; Y1205-Y1209 HydrophobicContact CE1-CG 4.12Å; Y1205-Y1209 WeakPolarHBondContact O-CB 3.13Å; Y1205-Y1209 PolarHBondContact O-N 2.83Å; Y1205-S1244 WeakPolarHBondContact CA-OG 3.43Å
1206	F	93.2	Very high	90.9	Very high	32 Å²	32	34.7 Å²	34.7	14%	0.14	17%	0.169	C	C	.	.	H	α-helix	trans	-71	-33.7	-169.3	-82.2	-74.4	0	0	0	113.4	C1124 F1202 Y1209 Y1210	C1124-F1206 HydrophobicContact CB-CE2 4.09Å; F1202-F1206 AromaticContact CD1-CD2 3.85Å; F1202-F1206 HydrophobicContact CD1-CD2 3.85Å; F1202-F1206 AromaticContact CD2-CD2 3.71Å; F1202-F1206 HydrophobicContact CD2-CD2 3.71Å; F1202-F1206 AromaticContact CD2-CE2 3.57Å; F1202-F1206 HydrophobicContact CD2-CE2 3.57Å; F1202-F1206 AromaticContact CE1-CD2 3.7Å; F1202-F1206 HydrophobicContact CE1-CD2 3.7Å; F1202-F1206 HydrophobicContact CE1-CE2 4.25Å; F1202-F1206 HydrophobicContact CE1-CG 4.34Å; F1202-F1206 AromaticContact CE2-CD2 3.58Å; F1202-F1206 HydrophobicContact CE2-CD2 3.58Å; F1202-F1206 AromaticContact CE2-CE2 3.26Å; F1202-F1206 HydrophobicContact CE2-CE2 3.26Å; F1202-F1206 HydrophobicContact CE2-CZ 4.18Å; F1202-F1206 AromaticContact CG-CD2 3.84Å; F1202-F1206 HydrophobicContact CG-CD2 3.84Å; F1202-F1206 HydrophobicContact CG-CE2 4.19Å; F1202-F1206 AromaticContact CZ-CD2 3.56Å; F1202-F1206 HydrophobicContact CZ-CD2 3.56Å; F1202-F1206 AromaticContact CZ-CE2 3.64Å; F1202-F1206 HydrophobicContact CZ-CE2 3.64Å; F1202-F1206 HydrophobicContact CZ-CG 4.34Å; F1202-F1206 HydrophobicContact CZ-CZ 4.44Å; F1202-F1206 WeakPolarHBondContact O-CD2 3.33Å; F1202-F1206 PolarHBondContact O-N 2.81Å; F1206-Y1209 HydrophobicContact CD1-CD1 4.3Å; F1206-Y1209 PolarHBondContact O-N 3.44Å; F1206-Y1210 HydrophobicContact CB-CD2 4.35Å; F1206-Y1210 HydrophobicContact CB-CE2 4.35Å; F1206-Y1210 HydrophobicContact CD1-CD2 4.4Å; F1206-Y1210 AromaticContact CD1-CE2 3.74Å; F1206-Y1210 HydrophobicContact CD1-CE2 3.74Å; F1206-Y1210 HydrophobicContact CG-CE2 4.47Å; F1206-Y1210 WeakPolarHBondContact O-CD2 3.4Å; F1206-Y1210 PolarHBondContact O-N 3.03Å
1207	I	93.2	Very high	90.1	Very high	24 Å²	24	39.9 Å²	39.9	12%	0.123	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-52.3	176.9	-61.5	-177.5	0	0	0	112	I1203 Y1205 Y1209 Y1210 C1211 L1313 T1314 I1317	I1203-I1207 HydrophobicContact CG2-CD1 3.65Å; I1203-I1207 HydrophobicContact CG2-CG1 4.3Å; I1203-I1207 PolarHBondContact O-N 3.48Å; Y1205-I1207 PolarHBondContact O-N 3.02Å; I1207-Y1209 VanDerWaalsContact C-N 3.28Å; I1207-Y1209 PolarHBondContact O-N 3.15Å; I1207-Y1210 PolarHBondContact O-N 3.15Å; I1207-C1211 VanDerWaalsContact O-CB 3.28Å; I1207-C1211 WeakPolarHBondContact O-CB 3.33Å; I1207-C1211 PolarHBondContact O-N 3.04Å; I1207-C1211 PolarHBondContact O-SG 3.35Å; I1207-C1211 VanDerWaalsContact O-SG 3.39Å; I1207-L1313 HydrophobicContact CG2-CD2 4.48Å; I1207-T1314 HydrophobicContact CB-CG2 4.33Å; I1207-T1314 HydrophobicContact CD1-CG2 4.48Å; I1207-T1314 WeakPolarHBondContact CG2-OG1 3.39Å; I1207-I1317 HydrophobicContact CD1-CB 4.19Å; I1207-I1317 HydrophobicContact CD1-CD1 3.81Å; I1207-I1317 HydrophobicContact CD1-CG2 4.26Å
1208	P	91.3	Very high	89.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-34	173.4	17.1	-26.1	0	0	0	113	T1204 Y1205 L1212 Y1247	T1204-P1208 WeakPolarHBondContact O-CD 3.2Å; T1204-P1208 WeakPolarHBondContact O-CG 3.18Å; Y1205-P1208 VanDerWaalsContact O-CD 3.31Å; Y1205-P1208 WeakPolarHBondContact O-CD 3.49Å; Y1205-P1208 WeakPolarHBondContact O-CG 3.36Å; P1208-L1212 HydrophobicContact CB-CD1 3.76Å; P1208-L1212 HydrophobicContact CB-CG 4.3Å; P1208-L1212 WeakPolarHBondContact O-CA 3.49Å; P1208-L1212 WeakPolarHBondContact O-CB 3.49Å; P1208-L1212 WeakPolarHBondContact O-CG 3.45Å; P1208-L1212 PolarHBondContact O-N 2.78Å; P1208-Y1247 HydrophobicContact CB-CD2 4.14Å; P1208-Y1247 HydrophobicContact CB-CE2 3.9Å; P1208-Y1247 HydrophobicContact CG-CD2 3.89Å; P1208-Y1247 HydrophobicContact CG-CE2 4.18Å
1209	Y	90.7	Very high	88.6	Confident	28 Å²	28	48.3 Å²	48.3	11%	0.11	24%	0.243	C	C	.	.	H	α-helix	trans	-60.9	-50.3	175.7	179.1	-113.1	0	0	0	112.3	Y1205 F1206 I1207 A1213 G1214 G1215 N1216	Y1205-Y1209 HydrophobicContact CE1-CD1 4.45Å; Y1205-Y1209 HydrophobicContact CE1-CG 4.12Å; Y1205-Y1209 WeakPolarHBondContact O-CB 3.13Å; Y1205-Y1209 PolarHBondContact O-N 2.83Å; F1206-Y1209 HydrophobicContact CD1-CD1 4.3Å; F1206-Y1209 PolarHBondContact O-N 3.44Å; I1207-Y1209 VanDerWaalsContact C-N 3.28Å; I1207-Y1209 PolarHBondContact O-N 3.15Å; Y1209-A1213 HydrophobicContact CD2-CB 4.27Å; Y1209-A1213 CarbonylContact O-C 3.55Å; Y1209-A1213 WeakPolarHBondContact O-CA 3.28Å; Y1209-A1213 VanDerWaalsContact O-CB 3.26Å; Y1209-A1213 WeakPolarHBondContact O-CB 3.41Å; Y1209-A1213 PolarHBondContact O-N 2.93Å; Y1209-G1214 PolarHBondContact O-N 3.17Å; Y1209-G1215 VanDerWaalsContact CE1-CA 3.44Å; Y1209-G1215 PolarHBondContact O-N 2.72Å; Y1209-G1215 VanDerWaalsContact O-N 3.09Å; Y1209-N1216 PolarHBondContact OH-ND2 2.87Å; Y1209-N1216 PolarHBondContact OH-OD1 3.15Å
1210	Y	90.8	Very high	87.8	Confident	94 Å²	94	48 Å²	48	37%	0.369	25%	0.246	S	C	.	.	H	α-helix	trans	-71.3	-38.9	178.2	-75.3	-65.1	0	0	0	113.5	F1206 I1207 G1214 L1217 Y1218	F1206-Y1210 HydrophobicContact CB-CD2 4.35Å; F1206-Y1210 HydrophobicContact CB-CE2 4.35Å; F1206-Y1210 HydrophobicContact CD1-CD2 4.4Å; F1206-Y1210 AromaticContact CD1-CE2 3.74Å; F1206-Y1210 HydrophobicContact CD1-CE2 3.74Å; F1206-Y1210 HydrophobicContact CG-CE2 4.47Å; F1206-Y1210 WeakPolarHBondContact O-CD2 3.4Å; F1206-Y1210 PolarHBondContact O-N 3.03Å; I1207-Y1210 PolarHBondContact O-N 3.15Å; Y1210-G1214 CarbonylContact O-C 3.42Å; Y1210-G1214 WeakPolarHBondContact O-CA 3.45Å; Y1210-G1214 PolarHBondContact O-N 2.82Å; Y1210-L1217 HydrophobicContact CE1-CD1 4.17Å; Y1210-Y1218 HydrophobicContact CD1-CE2 4.48Å
1211	C	90.1	Very high	87.1	Confident	58 Å²	58	48.7 Å²	48.7	39%	0.392	25%	0.252	S	S	.	.	H	α-helix	trans	-90.5	-21	-172.1	-60.5	0	0	0	0	114.9	I1207 T1310	I1207-C1211 VanDerWaalsContact O-CB 3.28Å; I1207-C1211 WeakPolarHBondContact O-CB 3.33Å; I1207-C1211 PolarHBondContact O-N 3.04Å; I1207-C1211 PolarHBondContact O-SG 3.35Å; I1207-C1211 VanDerWaalsContact O-SG 3.39Å; C1211-T1310 HydrophobicContact CB-CG2 3.26Å
1212	L	88.8	Confident	86.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-106.7	-39.5	178.6	-51.3	176.8	0	0	0	111.9	P1208 A1221 Y1235 A1243 A1306 T1310	P1208-L1212 HydrophobicContact CB-CD1 3.76Å; P1208-L1212 HydrophobicContact CB-CG 4.3Å; P1208-L1212 WeakPolarHBondContact O-CA 3.49Å; P1208-L1212 WeakPolarHBondContact O-CB 3.49Å; P1208-L1212 WeakPolarHBondContact O-CG 3.45Å; P1208-L1212 PolarHBondContact O-N 2.78Å; L1212-A1221 WeakPolarHBondContact O-CB 3.43Å; L1212-A1221 PolarHBondContact O-N 3.19Å; L1212-Y1235 HydrophobicContact CB-CD1 3.89Å; L1212-Y1235 HydrophobicContact CB-CD2 4.31Å; L1212-Y1235 HydrophobicContact CB-CE1 3.94Å; L1212-Y1235 HydrophobicContact CB-CE2 4.38Å; L1212-Y1235 HydrophobicContact CB-CG 4.06Å; L1212-Y1235 HydrophobicContact CD1-CD1 4.3Å; L1212-Y1235 HydrophobicContact CD1-CE1 3.77Å; L1212-Y1235 HydrophobicContact CD2-CE1 4.2Å; L1212-Y1235 HydrophobicContact CD2-CE2 4.37Å; L1212-Y1235 HydrophobicContact CG-CE1 4.18Å; L1212-A1243 HydrophobicContact CD1-CB 3.75Å; L1212-A1306 HydrophobicContact CD2-CB 3.77Å; L1212-T1310 HydrophobicContact CD2-CG2 4.09Å
1213	A	85.4	Confident	85.6	Confident	13 Å²	13	48.3 Å²	48.3	11%	0.107	25%	0.253	C	S	.	.	S	Bend	trans	-100.3	4.3	179.6	0	0	0	0	0	113.6	Y1209 G1215 I1240	Y1209-A1213 HydrophobicContact CD2-CB 4.27Å; Y1209-A1213 CarbonylContact O-C 3.55Å; Y1209-A1213 WeakPolarHBondContact O-CA 3.28Å; Y1209-A1213 VanDerWaalsContact O-CB 3.26Å; Y1209-A1213 WeakPolarHBondContact O-CB 3.41Å; Y1209-A1213 PolarHBondContact O-N 2.93Å; A1213-G1215 PolarHBondContact O-N 2.98Å; A1213-I1240 HydrophobicContact CB-CD1 3.39Å; A1213-I1240 HydrophobicContact CB-CG1 4.03Å
1214	G	80.8	Confident	84.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	67.7	-8.5	-174.3	0	0	0	0	0	115.4	Y1209 Y1210 N1216 L1217 Y1218	Y1209-G1214 PolarHBondContact O-N 3.17Å; Y1210-G1214 CarbonylContact O-C 3.42Å; Y1210-G1214 WeakPolarHBondContact O-CA 3.45Å; Y1210-G1214 PolarHBondContact O-N 2.82Å; G1214-N1216 VanDerWaalsContact C-N 3.26Å; G1214-N1216 PolarHBondContact O-N 2.92Å; G1214-L1217 PolarHBondContact O-N 3.46Å; G1214-Y1218 WeakPolarHBondContact CA-O 3.5Å; G1214-Y1218 WeakPolarHBondContact O-CD2 3.35Å; G1214-Y1218 PolarHBondContact O-N 3.44Å
1215	G	78.6	Confident	83.3	Confident	4 Å²	4	56.2 Å²	56.2	4%	0.041	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	53.4	36.2	179.9	0	0	0	0	0	115.1	Y1209 A1213 L1217	Y1209-G1215 VanDerWaalsContact CE1-CA 3.44Å; Y1209-G1215 PolarHBondContact O-N 2.72Å; Y1209-G1215 VanDerWaalsContact O-N 3.09Å; A1213-G1215 PolarHBondContact O-N 2.98Å; G1215-L1217 PolarHBondContact O-N 2.79Å
1216	N	73.8	Confident	81.8	Confident	147 Å²	147	59.8 Å²	59.8	79%	0.786	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	61.9	10.5	-174.3	-52.7	-15.5	0	0	0	115.5	Y1209 G1214	Y1209-N1216 PolarHBondContact OH-ND2 2.87Å; Y1209-N1216 PolarHBondContact OH-OD1 3.15Å; G1214-N1216 VanDerWaalsContact C-N 3.26Å; G1214-N1216 PolarHBondContact O-N 2.92Å
1217	L	78.8	Confident	80.3	Confident	130 Å²	130	64.6 Å²	64.6	68%	0.681	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	-30.4	-175	-87.5	147.6	0	0	0	113.5	Y1210 G1214 G1215	Y1210-L1217 HydrophobicContact CE1-CD1 4.17Å; G1214-L1217 PolarHBondContact O-N 3.46Å; G1215-L1217 PolarHBondContact O-N 2.79Å
1218	Y	81.5	Confident	78.7	Confident	166 Å²	166	69.1 Å²	69.1	65%	0.651	35%	0.352	S	S	*	.	S	Bend	trans	-116.7	169.7	178.9	-51.7	-72.6	0	0	0	110.4	Y1210 G1214	Y1210-Y1218 HydrophobicContact CD1-CE2 4.48Å; G1214-Y1218 WeakPolarHBondContact CA-O 3.5Å; G1214-Y1218 WeakPolarHBondContact O-CD2 3.35Å; G1214-Y1218 PolarHBondContact O-N 3.44Å
1219	A	77.4	Confident	76.8	Confident	92 Å²	92	77.2 Å²	77.2	76%	0.76	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-66.8	144	172.2	0	0	0	0	0	111.1
1220	E	79.5	Confident	75.2	Confident	93 Å²	93	82.6 Å²	82.6	44%	0.435	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-60.9	143	170.9	-68	174.9	177.7	0	0	110.5	N1234	E1220-N1234 WeakPolarHBondContact OE2-CB 3.15Å; E1220-N1234 PolarHBondContact OE2-ND2 3.22Å
1221	A	81	Confident	73.9	Confident	15 Å²	15	81 Å²	81	12%	0.124	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-69.8	149.5	173.5	0	0	0	0	0	110.4	L1212 Y1235 A1306	L1212-A1221 WeakPolarHBondContact O-CB 3.43Å; L1212-A1221 PolarHBondContact O-N 3.19Å; A1221-Y1235 HydrophobicContact CB-CD2 3.87Å; A1221-Y1235 HydrophobicContact CB-CE2 3.67Å; A1221-Y1235 WeakPolarHBondContact O-CD2 3.47Å; A1221-A1306 HydrophobicContact CB-CB 3.69Å
1222	I	80	Confident	73	Confident	85 Å²	85	83.2 Å²	83.2	44%	0.436	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	144	-176.4	-72.4	170.7	0	0	0	109.9	N1232 G1233	I1222-N1232 HydrophobicContact CG2-CB 3.43Å; I1222-N1232 VanDerWaalsContact CG2-CB 3.43Å; I1222-G1233 WeakPolarHBondContact CA-O 3.24Å
1223	F	78.2	Confident	72.2	Confident	5 Å²	5	83.4 Å²	83.4	2%	0.022	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	155.6	171.4	71.7	-87.5	0	0	0	112.8	Q1225 G1233 N1234 Y1235 M1239 Q1300	F1223-Q1225 HydrophobicContact CD2-CG 4.21Å; F1223-Q1225 HydrophobicContact CE2-CG 3.63Å; F1223-Q1225 HydrophobicContact CZ-CG 4.18Å; F1223-G1233 WeakPolarHBondContact CD1-O 3.25Å; F1223-G1233 PolarHBondContact N-O 3.24Å; F1223-G1233 PolarHBondContact O-N 3.27Å; F1223-N1234 WeakPolarHBondContact CE1-O 3.36Å; F1223-Y1235 HydrophobicContact CD1-CD2 4.41Å; F1223-Y1235 HydrophobicContact CD1-CE2 4.3Å; F1223-M1239 HydrophobicContact CD1-CE 4.03Å; F1223-M1239 HydrophobicContact CE1-CE 3.49Å; F1223-M1239 VanDerWaalsContact CE1-CE 3.49Å; F1223-M1239 HydrophobicContact CE1-SD 3.63Å; F1223-M1239 HydrophobicContact CE2-CE 4.33Å; F1223-M1239 HydrophobicContact CZ-CE 3.66Å; F1223-M1239 HydrophobicContact CZ-SD 3.68Å; F1223-Q1300 HydrophobicContact CE2-CB 3.91Å; F1223-Q1300 HydrophobicContact CE2-CG 4.09Å; F1223-Q1300 HydrophobicContact CZ-CB 4.31Å
1224	Y	71.1	Confident	72	Confident	123 Å²	123	86.8 Å²	86.8	48%	0.482	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	121.7	-179.5	-174.2	-96.6	0	0	0	111.3	I1226	Y1224-I1226 HydrophobicContact CE1-CG1 4.49Å
1225	Q	70.4	Confident	72.2	Confident	58 Å²	58	87.2 Å²	87.2	27%	0.271	45%	0.448	S	S	.	.			trans	-94.3	137.1	174.4	-69	-174.9	-10.8	0	0	111.1	F1223	F1223-Q1225 HydrophobicContact CD2-CG 4.21Å; F1223-Q1225 HydrophobicContact CE2-CG 3.63Å; F1223-Q1225 HydrophobicContact CZ-CG 4.18Å
1226	I	63.4	Low	72.4	Confident	89 Å²	89	89.6 Å²	89.6	46%	0.456	46%	0.459	S	S	.	.	S	Bend	trans	-81.5	-35.5	-179.9	-69.8	176.6	0	0	0	112.2	Y1224 H1228 R1303	Y1224-I1226 HydrophobicContact CE1-CG1 4.49Å; I1226-H1228 PolarHBondContact O-N 2.88Å; I1226-R1303 VanDerWaalsContact CD1-CZ 3.42Å; I1226-R1303 VanDerWaalsContact CD1-NH2 3.3Å
1227	N	62.3	Low	73	Confident	132 Å²	132	86.6 Å²	86.6	71%	0.706	44%	0.439	S	S	*	.	S	Bend	trans	-77.8	-7.9	-168.9	-64.4	2.4	0	0	0	114
1228	H	59.6	Low	73.3	Confident	120 Å²	120	81.3 Å²	81.3	56%	0.556	41%	0.412	S	S	*	.	S	Bend	trans	-134.7	105.8	175.4	-74	-59.7	0	0	0	108.3	I1226 N1230 T1231	I1226-H1228 PolarHBondContact O-N 2.88Å; H1228-N1230 PolarHBondContact O-N 3.45Å; H1228-N1230 VanDerWaalsContact O-N 3.11Å; H1228-T1231 HydrophobicContact CB-CG2 4.02Å; H1228-T1231 WeakPolarHBondContact CB-OG1 3.38Å; H1228-T1231 PolarHBondContact O-N 3.34Å; H1228-T1231 PolarHBondContact O-OG1 2.86Å
1229	H	51.4	Low	73.6	Confident	170 Å²	170	73.4 Å²	73.4	79%	0.787	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	120.3	178.5	-70.3	-76.5	0	0	0	110.4
1230	N	56.4	Low	74.1	Confident	140 Å²	140	69.9 Å²	69.9	75%	0.749	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	14.9	178.1	-59.1	-13.3	0	0	0	117.9	H1228	H1228-N1230 PolarHBondContact O-N 3.45Å; H1228-N1230 VanDerWaalsContact O-N 3.11Å
1231	T	64.2	Low	74.6	Confident	60 Å²	60	65.6 Å²	65.6	37%	0.368	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-94.8	127	170.6	65.1	0	0	0	0	113	H1228	H1228-T1231 HydrophobicContact CB-CG2 4.02Å; H1228-T1231 WeakPolarHBondContact CB-OG1 3.38Å; H1228-T1231 PolarHBondContact O-N 3.34Å; H1228-T1231 PolarHBondContact O-OG1 2.86Å
1232	N	70	Confident	75	Confident	106 Å²	106	64.9 Å²	64.9	57%	0.567	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	127.1	170	-80.5	-15.6	0	0	0	110.4	I1222	I1222-N1232 HydrophobicContact CG2-CB 3.43Å; I1222-N1232 VanDerWaalsContact CG2-CB 3.43Å
1233	G	73.1	Confident	75.5	Confident	3 Å²	3	60.9 Å²	60.9	3%	0.031	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	141.2	175.5	0	0	0	0	0	112.5	I1222 F1223	I1222-G1233 WeakPolarHBondContact CA-O 3.24Å; F1223-G1233 WeakPolarHBondContact CD1-O 3.25Å; F1223-G1233 PolarHBondContact N-O 3.24Å; F1223-G1233 PolarHBondContact O-N 3.27Å
1234	N	80.8	Confident	76.2	Confident	85 Å²	85	60.7 Å²	60.7	46%	0.455	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	157.1	175.7	-67.9	24.4	0	0	0	111.4	E1220 F1223 D1236	E1220-N1234 WeakPolarHBondContact OE2-CB 3.15Å; E1220-N1234 PolarHBondContact OE2-ND2 3.22Å; F1223-N1234 WeakPolarHBondContact CE1-O 3.36Å; N1234-D1236 PolarHBondContact O-N 3.3Å
1235	Y	84.9	Confident	77.2	Confident	9 Å²	9	54.8 Å²	54.8	4%	0.035	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-76	118.3	176.5	-83.2	-101.1	0	0	0	112.1	L1212 A1221 F1223 M1239 I1240 L1301 S1304	L1212-Y1235 HydrophobicContact CB-CD1 3.89Å; L1212-Y1235 HydrophobicContact CB-CD2 4.31Å; L1212-Y1235 HydrophobicContact CB-CE1 3.94Å; L1212-Y1235 HydrophobicContact CB-CE2 4.38Å; L1212-Y1235 HydrophobicContact CB-CG 4.06Å; L1212-Y1235 HydrophobicContact CD1-CD1 4.3Å; L1212-Y1235 HydrophobicContact CD1-CE1 3.77Å; L1212-Y1235 HydrophobicContact CD2-CE1 4.2Å; L1212-Y1235 HydrophobicContact CD2-CE2 4.37Å; L1212-Y1235 HydrophobicContact CG-CE1 4.18Å; A1221-Y1235 HydrophobicContact CB-CD2 3.87Å; A1221-Y1235 HydrophobicContact CB-CE2 3.67Å; A1221-Y1235 WeakPolarHBondContact O-CD2 3.47Å; F1223-Y1235 HydrophobicContact CD1-CD2 4.41Å; F1223-Y1235 HydrophobicContact CD1-CE2 4.3Å; Y1235-M1239 HydrophobicContact CD1-CB 3.92Å; Y1235-M1239 HydrophobicContact CD1-CE 4.3Å; Y1235-M1239 HydrophobicContact CE1-CE 4.27Å; Y1235-I1240 HydrophobicContact CD1-CG1 4.44Å; Y1235-L1301 HydrophobicContact CD1-CD2 4.36Å; Y1235-L1301 HydrophobicContact CE1-CD2 3.57Å; Y1235-S1304 WeakPolarHBondContact OH-CB 3.43Å; Y1235-S1304 PolarHBondContact OH-OG 2.8Å
1236	D	83.4	Confident	78.2	Confident	54 Å²	54	52.5 Å²	52.5	29%	0.289	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-87.3	169.9	168.5	69	52.2	0	0	0	113.2	N1234 T1238 M1239 I1240 R1297	N1234-D1236 PolarHBondContact O-N 3.3Å; D1236-T1238 PolarHBondContact O-N 3.26Å; D1236-T1238 WeakPolarHBondContact OD1-CA 3.42Å; D1236-T1238 WeakPolarHBondContact OD1-CB 3.35Å; D1236-T1238 PolarHBondContact OD1-N 3.18Å; D1236-T1238 PolarHBondContact OD1-OG1 2.9Å; D1236-M1239 PolarHBondContact O-N 2.75Å; D1236-M1239 VanDerWaalsContact O-N 3.08Å; D1236-M1239 PolarHBondContact OD1-N 3.02Å; D1236-I1240 WeakPolarHBondContact O-CD1 3.32Å; D1236-I1240 WeakPolarHBondContact O-CG1 3.46Å; D1236-I1240 PolarHBondContact O-N 3.4Å; D1236-R1297 IonicContact OD1-NH2 3.76Å; D1236-R1297 IonicContact OD2-CZ 3.16Å; D1236-R1297 IonicContact OD2-NH1 2.74Å; D1236-R1297 PolarHBondContact OD2-NH1 2.96Å; D1236-R1297 IonicContact OD2-NH2 2.92Å; D1236-R1297 PolarHBondContact OD2-NH2 2.91Å
1237	F	85.1	Confident	79.7	Confident	83 Å²	83	48.3 Å²	48.3	36%	0.364	25%	0.248	S	C	.	.	H	α-helix	trans	-51.5	-38.3	179.1	-179.8	-106.7	0	0	0	113.7	V1125 N1129 I1134 G1241	V1125-F1237 HydrophobicContact CG1-CE2 3.99Å; V1125-F1237 HydrophobicContact CG1-CZ 3.67Å; N1129-F1237 HydrophobicContact CB-CE2 4.19Å; N1129-F1237 HydrophobicContact CB-CZ 4.39Å; I1134-F1237 HydrophobicContact CG2-CE1 4.49Å; F1237-G1241 PolarHBondContact O-N 3.46Å
1238	T	85.3	Confident	81.2	Confident	19 Å²	19	42 Å²	42	12%	0.117	22%	0.215	C	C	.	.	H	α-helix	trans	-76.5	-33	-179.6	68	0	0	0	0	112.3	D1236 N1242 N1293	D1236-T1238 PolarHBondContact O-N 3.26Å; D1236-T1238 WeakPolarHBondContact OD1-CA 3.42Å; D1236-T1238 WeakPolarHBondContact OD1-CB 3.35Å; D1236-T1238 PolarHBondContact OD1-N 3.18Å; D1236-T1238 PolarHBondContact OD1-OG1 2.9Å; T1238-N1242 VanDerWaalsContact O-CB 3.3Å; T1238-N1242 WeakPolarHBondContact O-CB 3.11Å; T1238-N1242 PolarHBondContact O-N 3.28Å; T1238-N1242 PolarHBondContact O-ND2 3.06Å; T1238-N1293 HydrophobicContact CG2-CB 4.17Å
1239	M	87.9	Confident	82.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-67.6	-42.1	172.1	-68.8	-171.6	65.6	0	0	111.6	F1223 Y1235 D1236 N1242 A1243 Q1300 L1301	F1223-M1239 HydrophobicContact CD1-CE 4.03Å; F1223-M1239 HydrophobicContact CE1-CE 3.49Å; F1223-M1239 VanDerWaalsContact CE1-CE 3.49Å; F1223-M1239 HydrophobicContact CE1-SD 3.63Å; F1223-M1239 HydrophobicContact CE2-CE 4.33Å; F1223-M1239 HydrophobicContact CZ-CE 3.66Å; F1223-M1239 HydrophobicContact CZ-SD 3.68Å; Y1235-M1239 HydrophobicContact CD1-CB 3.92Å; Y1235-M1239 HydrophobicContact CD1-CE 4.3Å; Y1235-M1239 HydrophobicContact CE1-CE 4.27Å; D1236-M1239 PolarHBondContact O-N 2.75Å; D1236-M1239 VanDerWaalsContact O-N 3.08Å; D1236-M1239 PolarHBondContact OD1-N 3.02Å; M1239-N1242 PolarHBondContact O-N 3.44Å; M1239-A1243 WeakPolarHBondContact O-CB 3.35Å; M1239-A1243 PolarHBondContact O-N 3.37Å; M1239-Q1300 HydrophobicContact CE-CB 3.82Å; M1239-L1301 HydrophobicContact CB-CD2 4.31Å; M1239-L1301 HydrophobicContact CE-CD2 3.93Å; M1239-L1301 HydrophobicContact CE-CG 4.24Å
1240	I	89.1	Confident	84.8	Confident	19 Å²	19	30 Å²	30	10%	0.097	16%	0.16	C	C	.	.	H	α-helix	trans	-64	-44.3	176	-60.2	153.1	0	0	0	110.3	A1213 Y1235 D1236 A1243 S1244	A1213-I1240 HydrophobicContact CB-CD1 3.39Å; A1213-I1240 HydrophobicContact CB-CG1 4.03Å; Y1235-I1240 HydrophobicContact CD1-CG1 4.44Å; D1236-I1240 WeakPolarHBondContact O-CD1 3.32Å; D1236-I1240 WeakPolarHBondContact O-CG1 3.46Å; D1236-I1240 PolarHBondContact O-N 3.4Å; I1240-A1243 PolarHBondContact O-N 3.01Å; I1240-S1244 VanDerWaalsContact O-CB 3.31Å; I1240-S1244 WeakPolarHBondContact O-CB 3.4Å; I1240-S1244 PolarHBondContact O-N 2.94Å
1241	G	89.3	Confident	86.6	Confident	3 Å²	3	23.4 Å²	23.4	3%	0.031	12%	0.124	C	C	.	.	H	α-helix	trans	-58.8	-49.6	174.7	0	0	0	0	0	112.9	F1137 F1237 A1243 S1244 F1245	F1137-G1241 WeakPolarHBondContact CD1-O 3.47Å; F1237-G1241 PolarHBondContact O-N 3.46Å; G1241-A1243 PolarHBondContact O-N 3.28Å; G1241-S1244 PolarHBondContact O-N 3.45Å; G1241-F1245 WeakPolarHBondContact O-CB 3.39Å; G1241-F1245 PolarHBondContact O-N 3.17Å
1242	N	89.3	Confident	88	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-64.1	-38.1	177.5	-84.2	-55.8	0	0	0	113.1	L1141 T1238 M1239 F1245 V1246 E1294 Y1298 L1301	L1141-N1242 WeakPolarHBondContact CD1-OD1 3.48Å; T1238-N1242 VanDerWaalsContact O-CB 3.3Å; T1238-N1242 WeakPolarHBondContact O-CB 3.11Å; T1238-N1242 PolarHBondContact O-N 3.28Å; T1238-N1242 PolarHBondContact O-ND2 3.06Å; M1239-N1242 PolarHBondContact O-N 3.44Å; N1242-F1245 PolarHBondContact O-N 2.88Å; N1242-V1246 WeakPolarHBondContact O-CG2 3.25Å; N1242-V1246 PolarHBondContact O-N 3Å; N1242-V1246 VanDerWaalsContact O-N 3.13Å; N1242-E1294 PolarHBondContact ND2-OE2 2.63Å; N1242-Y1298 HydrophobicContact CB-CE1 3.9Å; N1242-Y1298 VanDerWaalsContact OD1-CZ 3.27Å; N1242-Y1298 PolarHBondContact OD1-OH 3Å; N1242-L1301 HydrophobicContact CB-CD1 3.8Å
1243	A	91.3	Very high	89.1	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-63.4	-47.4	173	0	0	0	0	0	111.4	L1212 M1239 I1240 G1241 F1245 V1246 Y1247 L1301 F1307	L1212-A1243 HydrophobicContact CD1-CB 3.75Å; M1239-A1243 WeakPolarHBondContact O-CB 3.35Å; M1239-A1243 PolarHBondContact O-N 3.37Å; I1240-A1243 PolarHBondContact O-N 3.01Å; G1241-A1243 PolarHBondContact O-N 3.28Å; A1243-F1245 VanDerWaalsContact C-N 3.32Å; A1243-F1245 PolarHBondContact O-N 3.21Å; A1243-V1246 PolarHBondContact O-N 2.86Å; A1243-Y1247 WeakPolarHBondContact O-CD1 3.46Å; A1243-Y1247 VanDerWaalsContact O-CG 3.23Å; A1243-Y1247 PolarHBondContact O-N 2.93Å; A1243-L1301 HydrophobicContact CB-CD1 4.34Å; A1243-L1301 HydrophobicContact CB-CD2 4.04Å; A1243-F1307 HydrophobicContact CB-CD2 4.07Å; A1243-F1307 HydrophobicContact CB-CE2 4.15Å
1244	S	92.9	Very high	90	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.007	10%	0.1	C	C	.	.	H	α-helix	trans	-60	-39.9	177.2	-171.1	0	0	0	0	112.6	N1121 T1204 Y1205 I1240 G1241 Y1247 L1248	N1121-S1244 PolarHBondContact ND2-OG 2.95Å; T1204-S1244 WeakPolarHBondContact O-CB 3.36Å; T1204-S1244 PolarHBondContact O-OG 3.34Å; Y1205-S1244 WeakPolarHBondContact CA-OG 3.43Å; I1240-S1244 VanDerWaalsContact O-CB 3.31Å; I1240-S1244 WeakPolarHBondContact O-CB 3.4Å; I1240-S1244 PolarHBondContact O-N 2.94Å; G1241-S1244 PolarHBondContact O-N 3.45Å; S1244-Y1247 PolarHBondContact O-N 2.94Å; S1244-L1248 VanDerWaalsContact O-CB 3.32Å; S1244-L1248 WeakPolarHBondContact O-CB 3.41Å; S1244-L1248 PolarHBondContact O-N 3.43Å
1245	F	91.8	Very high	90.5	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-60.3	-48.9	174	177.2	-95.2	0	0	0	112.5	F1118 F1137 L1141 Y1145 G1241 N1242 A1243 Y1247 L1248 W1249	F1118-F1245 HydrophobicContact CE2-CD2 4.29Å; F1118-F1245 HydrophobicContact CE2-CE2 4.16Å; F1137-F1245 HydrophobicContact CD1-CB 3.89Å; F1137-F1245 HydrophobicContact CD1-CD2 4.4Å; F1137-F1245 HydrophobicContact CD2-CD2 4.23Å; F1137-F1245 HydrophobicContact CE1-CB 3.89Å; F1137-F1245 AromaticContact CE1-CD2 3.94Å; F1137-F1245 HydrophobicContact CE1-CD2 3.94Å; F1137-F1245 HydrophobicContact CE1-CG 4.38Å; F1137-F1245 AromaticContact CE2-CD2 3.75Å; F1137-F1245 HydrophobicContact CE2-CD2 3.75Å; F1137-F1245 HydrophobicContact CE2-CE2 4.2Å; F1137-F1245 HydrophobicContact CG-CB 4.42Å; F1137-F1245 HydrophobicContact CZ-CB 4.43Å; F1137-F1245 AromaticContact CZ-CD2 3.6Å; F1137-F1245 HydrophobicContact CZ-CD2 3.6Å; F1137-F1245 HydrophobicContact CZ-CE2 4.37Å; F1137-F1245 HydrophobicContact CZ-CG 4.45Å; L1141-F1245 HydrophobicContact CB-CD2 4.41Å; L1141-F1245 HydrophobicContact CB-CE1 4.45Å; L1141-F1245 HydrophobicContact CB-CE2 3.92Å; L1141-F1245 HydrophobicContact CB-CZ 3.94Å; L1141-F1245 HydrophobicContact CD2-CE1 4.04Å; L1141-F1245 HydrophobicContact CD2-CZ 4.22Å; Y1145-F1245 AromaticContact CD2-CE2 3.97Å; Y1145-F1245 HydrophobicContact CD2-CE2 3.97Å; Y1145-F1245 HydrophobicContact CD2-CZ 4.35Å; Y1145-F1245 HydrophobicContact CG-CE2 4.4Å; G1241-F1245 WeakPolarHBondContact O-CB 3.39Å; G1241-F1245 PolarHBondContact O-N 3.17Å; N1242-F1245 PolarHBondContact O-N 2.88Å; A1243-F1245 VanDerWaalsContact C-N 3.32Å; A1243-F1245 PolarHBondContact O-N 3.21Å; F1245-Y1247 VanDerWaalsContact C-N 3.35Å; F1245-Y1247 PolarHBondContact O-N 3.29Å; F1245-L1248 PolarHBondContact O-N 3.46Å; F1245-W1249 WeakPolarHBondContact O-CB 3.23Å; F1245-W1249 PolarHBondContact O-N 3.5Å
1246	V	91.4	Very high	90.7	Very high	10 Å²	10	15.3 Å²	15.3	6%	0.061	8%	0.079	C	C	.	.	H	α-helix	trans	-63.6	-41.6	178.9	172.7	0	0	0	0	110.9	N1242 A1243 W1249 I1250 Y1298 F1307	N1242-V1246 WeakPolarHBondContact O-CG2 3.25Å; N1242-V1246 PolarHBondContact O-N 3Å; N1242-V1246 VanDerWaalsContact O-N 3.13Å; A1243-V1246 PolarHBondContact O-N 2.86Å; V1246-W1249 PolarHBondContact O-N 3.25Å; V1246-I1250 HydrophobicContact CG1-CD1 3.74Å; V1246-I1250 WeakPolarHBondContact O-CG1 3.43Å; V1246-I1250 PolarHBondContact O-N 3.32Å; V1246-Y1298 HydrophobicContact CG2-CE1 4.19Å; V1246-F1307 HydrophobicContact CG1-CZ 4.22Å
1247	Y	94.3	Very high	90.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65.9	-41.5	177.3	-62.3	-9.3	0	0	0	112	P1208 A1243 S1244 F1245 S1251 F1307 T1310 F1311 T1314	P1208-Y1247 HydrophobicContact CB-CD2 4.14Å; P1208-Y1247 HydrophobicContact CB-CE2 3.9Å; P1208-Y1247 HydrophobicContact CG-CD2 3.89Å; P1208-Y1247 HydrophobicContact CG-CE2 4.18Å; A1243-Y1247 WeakPolarHBondContact O-CD1 3.46Å; A1243-Y1247 VanDerWaalsContact O-CG 3.23Å; A1243-Y1247 PolarHBondContact O-N 2.93Å; S1244-Y1247 PolarHBondContact O-N 2.94Å; F1245-Y1247 VanDerWaalsContact C-N 3.35Å; F1245-Y1247 PolarHBondContact O-N 3.29Å; Y1247-S1251 WeakPolarHBondContact O-CB 3.39Å; Y1247-S1251 PolarHBondContact O-N 3.43Å; Y1247-S1251 PolarHBondContact O-OG 2.84Å; Y1247-F1307 HydrophobicContact CD1-CE2 4.34Å; Y1247-F1307 AromaticContact CE1-CD2 3.84Å; Y1247-F1307 HydrophobicContact CE1-CD2 3.84Å; Y1247-F1307 AromaticContact CE1-CE2 3.39Å; Y1247-F1307 HydrophobicContact CE1-CE2 3.39Å; Y1247-F1307 AromaticContact CE1-CZ 3.9Å; Y1247-F1307 HydrophobicContact CE1-CZ 3.9Å; Y1247-F1307 AromaticContact CZ-CD2 3.76Å; Y1247-F1307 AromaticContact CZ-CE2 3.79Å; Y1247-F1307 WeakPolarHBondContact OH-CA 3.49Å; Y1247-F1307 WeakPolarHBondContact OH-CD2 3.39Å; Y1247-F1307 PolarHBondContact OH-O 3.48Å; Y1247-T1310 PolarHBondContact OH-OG1 3.34Å; Y1247-F1311 HydrophobicContact CD1-CB 4.32Å; Y1247-F1311 AromaticContact CD1-CD2 3.71Å; Y1247-F1311 HydrophobicContact CD1-CD2 3.71Å; Y1247-F1311 HydrophobicContact CD1-CG 4.5Å; Y1247-F1311 HydrophobicContact CE1-CB 3.64Å; Y1247-F1311 AromaticContact CE1-CD2 3.83Å; Y1247-F1311 HydrophobicContact CE1-CD2 3.83Å; Y1247-F1311 HydrophobicContact CE1-CG 4.19Å; Y1247-T1314 HydrophobicContact CD2-CG2 3.99Å; Y1247-T1314 HydrophobicContact CG-CG2 4.32Å
1248	L	94.2	Very high	91.2	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-61.5	-49.3	174.5	175	64.8	0	0	0	111.6	A1117 F1118 N1121 Y1145 T1204 S1244 F1245 S1251 V1252	A1117-L1248 HydrophobicContact CB-CD1 3.79Å; F1118-L1248 HydrophobicContact CB-CD2 4.17Å; F1118-L1248 HydrophobicContact CD2-CD2 3.92Å; F1118-L1248 HydrophobicContact CG-CD2 4.48Å; N1121-L1248 HydrophobicContact CB-CD2 4.2Å; Y1145-L1248 HydrophobicContact CE2-CD2 4.09Å; Y1145-L1248 HydrophobicContact CE2-CG 4.14Å; T1204-L1248 HydrophobicContact CG2-CB 4.18Å; T1204-L1248 HydrophobicContact CG2-CD1 4.27Å; S1244-L1248 VanDerWaalsContact O-CB 3.32Å; S1244-L1248 WeakPolarHBondContact O-CB 3.41Å; S1244-L1248 PolarHBondContact O-N 3.43Å; F1245-L1248 PolarHBondContact O-N 3.46Å; L1248-S1251 PolarHBondContact O-N 3.23Å; L1248-V1252 HydrophobicContact CD1-CG2 4.1Å; L1248-V1252 WeakPolarHBondContact O-CB 3.16Å; L1248-V1252 WeakPolarHBondContact O-CG2 3.26Å; L1248-V1252 PolarHBondContact O-N 2.86Å
1249	W	93	Very high	91.3	Very high	5 Å²	5	11.6 Å²	11.6	2%	0.019	6%	0.063	C	C	.	.	H	α-helix	trans	-56.6	-53.9	179.3	166.9	34.1	0	0	0	111.4	Y1145 M1149 F1245 V1246 S1251 V1252 T1253 T1274 N1277 L1278 L1281	Y1145-W1249 HydrophobicContact CE2-CB 4.5Å; M1149-W1249 HydrophobicContact CB-CD2 4.2Å; M1149-W1249 HydrophobicContact CB-CG 4.18Å; M1149-W1249 HydrophobicContact CB-CZ2 4.41Å; M1149-W1249 PolarHBondContact O-NE1 2.93Å; M1149-W1249 HydrophobicContact SD-CD2 4.01Å; M1149-W1249 HydrophobicContact SD-CE3 4.02Å; M1149-W1249 HydrophobicContact SD-CH2 3.61Å; M1149-W1249 HydrophobicContact SD-CZ2 3.59Å; M1149-W1249 VanDerWaalsContact SD-CZ2 3.59Å; M1149-W1249 HydrophobicContact SD-CZ3 3.83Å; F1245-W1249 WeakPolarHBondContact O-CB 3.23Å; F1245-W1249 PolarHBondContact O-N 3.5Å; V1246-W1249 PolarHBondContact O-N 3.25Å; W1249-S1251 PolarHBondContact O-N 3.47Å; W1249-V1252 PolarHBondContact O-N 3.04Å; W1249-T1253 PolarHBondContact O-N 3.23Å; W1249-T1274 WeakPolarHBondContact CZ2-O 3.46Å; W1249-N1277 HydrophobicContact CH2-CB 3.99Å; W1249-N1277 HydrophobicContact CZ2-CB 4.03Å; W1249-L1278 HydrophobicContact CH2-CD2 4.07Å; W1249-L1278 HydrophobicContact CH2-CG 3.96Å; W1249-L1278 HydrophobicContact CZ3-CD2 3.72Å; W1249-L1278 HydrophobicContact CZ3-CG 4.14Å; W1249-L1281 HydrophobicContact CZ3-CD1 3.96Å
1250	I	92.7	Very high	91.3	Very high	34 Å²	34	11.9 Å²	11.9	17%	0.174	7%	0.065	C	C	.	.	H	α-helix	trans	-67.6	-38.1	-177.6	-65.4	170	0	0	0	111.1	V1246 V1252 T1253 I1254 F1311 V1315	V1246-I1250 HydrophobicContact CG1-CD1 3.74Å; V1246-I1250 WeakPolarHBondContact O-CG1 3.43Å; V1246-I1250 PolarHBondContact O-N 3.32Å; I1250-V1252 VanDerWaalsContact C-N 3.28Å; I1250-V1252 PolarHBondContact O-N 3.16Å; I1250-T1253 PolarHBondContact O-N 2.86Å; I1250-T1253 PolarHBondContact O-OG1 3.28Å; I1250-I1254 HydrophobicContact CG2-CD1 3.71Å; I1250-I1254 HydrophobicContact CG2-CG1 4.45Å; I1250-I1254 WeakPolarHBondContact O-CG1 3.39Å; I1250-I1254 PolarHBondContact O-N 3.19Å; I1250-F1311 HydrophobicContact CB-CE2 4.08Å; I1250-F1311 HydrophobicContact CD1-CE2 3.54Å; I1250-F1311 HydrophobicContact CD1-CZ 3.88Å; I1250-F1311 HydrophobicContact CG1-CE2 4.4Å; I1250-F1311 HydrophobicContact CG2-CE2 3.76Å; I1250-F1311 HydrophobicContact CG2-CZ 3.9Å; I1250-V1315 HydrophobicContact CG2-CG2 4.18Å
1251	S	94.3	Very high	91	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-59.8	-40	175	-62	0	0	0	0	111.7	Y1247 L1248 W1249 R1255 N1319	Y1247-S1251 WeakPolarHBondContact O-CB 3.39Å; Y1247-S1251 PolarHBondContact O-N 3.43Å; Y1247-S1251 PolarHBondContact O-OG 2.84Å; L1248-S1251 PolarHBondContact O-N 3.23Å; W1249-S1251 PolarHBondContact O-N 3.47Å; S1251-R1255 VanDerWaalsContact O-CB 3.25Å; S1251-R1255 WeakPolarHBondContact O-CB 3.4Å; S1251-R1255 PolarHBondContact O-N 3.01Å; S1251-N1319 PolarHBondContact O-ND2 3.45Å; S1251-N1319 PolarHBondContact O-OD1 2.62Å
1252	V	93.8	Very high	90.7	Very high	14 Å²	14	15.2 Å²	15.2	9%	0.085	8%	0.079	C	C	.	.	H	α-helix	trans	-73.6	-34.3	178.1	168.9	0	0	0	0	112.8	K1114 T1150 L1248 W1249 I1250 R1255 S1256	K1114-V1252 HydrophobicContact CB-CG1 3.75Å; T1150-V1252 HydrophobicContact CG2-CG1 4.31Å; L1248-V1252 HydrophobicContact CD1-CG2 4.1Å; L1248-V1252 WeakPolarHBondContact O-CB 3.16Å; L1248-V1252 WeakPolarHBondContact O-CG2 3.26Å; L1248-V1252 PolarHBondContact O-N 2.86Å; W1249-V1252 PolarHBondContact O-N 3.04Å; I1250-V1252 VanDerWaalsContact C-N 3.28Å; I1250-V1252 PolarHBondContact O-N 3.16Å; V1252-R1255 WeakPolarHBondContact O-CB 3.36Å; V1252-R1255 PolarHBondContact O-N 2.95Å; V1252-S1256 PolarHBondContact O-N 3.44Å
1253	T	92.6	Very high	90.3	Very high	16 Å²	16	20.5 Å²	20.5	10%	0.098	10%	0.103	C	C	.	.	H	α-helix	trans	-68.5	-39	174.6	58.3	0	0	0	0	111.8	W1249 I1250 S1256 T1257	W1249-T1253 PolarHBondContact O-N 3.23Å; I1250-T1253 PolarHBondContact O-N 2.86Å; I1250-T1253 PolarHBondContact O-OG1 3.28Å; T1253-S1256 WeakPolarHBondContact O-CB 3.4Å; T1253-S1256 PolarHBondContact O-N 3.08Å; T1253-T1257 PolarHBondContact O-N 3.14Å
1254	I	91.8	Very high	90.1	Very high	54 Å²	54	22.3 Å²	22.3	28%	0.277	11%	0.112	S	C	.	.	H	α-helix	trans	-68.1	-35.4	173	-69.1	166.9	0	0	0	111.2	I1250 S1256 T1257 I1258 V1315	I1250-I1254 HydrophobicContact CG2-CD1 3.71Å; I1250-I1254 HydrophobicContact CG2-CG1 4.45Å; I1250-I1254 WeakPolarHBondContact O-CG1 3.39Å; I1250-I1254 PolarHBondContact O-N 3.19Å; I1254-S1256 PolarHBondContact O-N 3.49Å; I1254-S1256 VanDerWaalsContact O-N 3.11Å; I1254-T1257 WeakPolarHBondContact CA-OG1 3.19Å; I1254-T1257 PolarHBondContact O-N 3.23Å; I1254-T1257 PolarHBondContact O-OG1 3.04Å; I1254-I1258 HydrophobicContact CG2-CD1 4.01Å; I1254-I1258 HydrophobicContact CG2-CG1 4.39Å; I1254-I1258 WeakPolarHBondContact O-CG1 3.41Å; I1254-I1258 PolarHBondContact O-N 3.14Å; I1254-V1315 HydrophobicContact CD1-CG1 3.41Å; I1254-V1315 VanDerWaalsContact CD1-CG1 3.41Å
1255	R	92.6	Very high	89.9	Confident	7 Å²	7	28 Å²	28	3%	0.026	14%	0.142	C	C	.	.	H	α-helix	trans	-59.8	-24.5	173.7	-173.3	53.4	-171	67.4	5.1	113.1	D1196 S1251 V1252 N1319	D1196-R1255 IonicContact OD1-NE 2.66Å; D1196-R1255 IonicContact OD2-CZ 2.71Å; D1196-R1255 IonicContact OD2-NE 3.65Å; D1196-R1255 PolarHBondContact OD2-NE 2.75Å; D1196-R1255 IonicContact OD2-NH2 3.67Å; D1196-R1255 PolarHBondContact OD2-NH2 3.36Å; S1251-R1255 VanDerWaalsContact O-CB 3.25Å; S1251-R1255 WeakPolarHBondContact O-CB 3.4Å; S1251-R1255 PolarHBondContact O-N 3.01Å; V1252-R1255 WeakPolarHBondContact O-CB 3.36Å; V1252-R1255 PolarHBondContact O-N 2.95Å; R1255-N1319 VanDerWaalsContact CA-OD1 3.23Å; R1255-N1319 WeakPolarHBondContact CA-OD1 3.43Å; R1255-N1319 WeakPolarHBondContact CB-OD1 3.47Å; R1255-N1319 PolarHBondContact N-OD1 3.36Å
1256	S	89.2	Confident	89.8	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-80	-41.9	169	-166.5	0	0	0	0	113.1	V1153 V1252 T1253 I1254 I1258 W1259 T1260	V1153-S1256 WeakPolarHBondContact CG1-OG 3.43Å; V1252-S1256 PolarHBondContact O-N 3.44Å; T1253-S1256 WeakPolarHBondContact O-CB 3.4Å; T1253-S1256 PolarHBondContact O-N 3.08Å; I1254-S1256 PolarHBondContact O-N 3.49Å; I1254-S1256 VanDerWaalsContact O-N 3.11Å; S1256-I1258 VanDerWaalsContact C-N 3.28Å; S1256-I1258 PolarHBondContact O-N 3.14Å; S1256-W1259 PolarHBondContact O-N 2.82Å; S1256-T1260 PolarHBondContact O-N 3.47Å; S1256-T1260 PolarHBondContact O-OG1 3.01Å
1257	T	88.2	Confident	89.6	Confident	38 Å²	38	31.4 Å²	31.4	23%	0.233	16%	0.158	C	C	.	.	H	α-helix	trans	-60.1	-38.5	178.1	62.4	0	0	0	0	111.9	T1253 I1254 W1259 T1260 F1263 H1271	T1253-T1257 PolarHBondContact O-N 3.14Å; I1254-T1257 WeakPolarHBondContact CA-OG1 3.19Å; I1254-T1257 PolarHBondContact O-N 3.23Å; I1254-T1257 PolarHBondContact O-OG1 3.04Å; T1257-W1259 PolarHBondContact O-N 2.97Å; T1257-T1260 WeakPolarHBondContact O-CB 3.4Å; T1257-T1260 PolarHBondContact O-N 3.46Å; T1257-F1263 WeakPolarHBondContact O-CZ 3.49Å; T1257-H1271 WeakPolarHBondContact CG2-CE1 3.47Å
1258	I	90.2	Very high	89.4	Confident	31 Å²	31	34.8 Å²	34.8	16%	0.159	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-27.5	177.4	-68.3	167.4	0	0	0	112.1	I1254 S1256 N1319 L1323 R1326	I1254-I1258 HydrophobicContact CG2-CD1 4.01Å; I1254-I1258 HydrophobicContact CG2-CG1 4.39Å; I1254-I1258 WeakPolarHBondContact O-CG1 3.41Å; I1254-I1258 PolarHBondContact O-N 3.14Å; S1256-I1258 VanDerWaalsContact C-N 3.28Å; S1256-I1258 PolarHBondContact O-N 3.14Å; I1258-N1319 HydrophobicContact CD1-CB 3.73Å; I1258-L1323 HydrophobicContact CG2-CD1 4.14Å; I1258-R1326 HydrophobicContact CG2-CB 4.24Å; I1258-R1326 HydrophobicContact CG2-CG 4.46Å
1259	W	88	Confident	89.3	Confident	9 Å²	9	39 Å²	39	3%	0.034	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-21.6	-177.3	-93.3	72.3	0	0	0	114.8	F1110 Y1189 W1193 S1256 T1257 K1261 R1326	F1110-W1259 HydrophobicContact CE1-CB 4.38Å; F1110-W1259 HydrophobicContact CZ-CB 3.77Å; F1110-W1259 HydrophobicContact CZ-CG 4.4Å; Y1189-W1259 VanDerWaalsContact OH-CH2 3.27Å; Y1189-W1259 WeakPolarHBondContact OH-CH2 3.1Å; W1193-W1259 HydrophobicContact CH2-CD2 4.05Å; W1193-W1259 AromaticContact CH2-CE2 4Å; W1193-W1259 HydrophobicContact CH2-CG 4.35Å; W1193-W1259 HydrophobicContact CH2-CZ2 4.38Å; W1193-W1259 HydrophobicContact CZ2-CD2 4.19Å; W1193-W1259 AromaticContact CZ2-CE2 3.95Å; W1193-W1259 HydrophobicContact CZ2-CE3 4.34Å; W1193-W1259 HydrophobicContact CZ2-CH2 4.06Å; W1193-W1259 AromaticContact CZ2-CZ2 3.87Å; W1193-W1259 HydrophobicContact CZ2-CZ2 3.87Å; W1193-W1259 HydrophobicContact CZ2-CZ3 4.28Å; S1256-W1259 PolarHBondContact O-N 2.82Å; T1257-W1259 PolarHBondContact O-N 2.97Å; W1259-K1261 PolarHBondContact O-N 3.38Å; W1259-R1326 PolarHBondContact O-NH1 3.45Å; W1259-R1326 PolarHBondContact O-NH2 3.42Å
1260	T	88	Confident	89.2	Confident	6 Å²	6	39.8 Å²	39.8	4%	0.037	20%	0.204	C	C	.	.			trans	-49.8	135.1	166	-59.8	0	0	0	0	110.7	S1256 T1257 D1262 F1263 L1267 R1326	S1256-T1260 PolarHBondContact O-N 3.47Å; S1256-T1260 PolarHBondContact O-OG1 3.01Å; T1257-T1260 WeakPolarHBondContact O-CB 3.4Å; T1257-T1260 PolarHBondContact O-N 3.46Å; T1260-D1262 WeakPolarHBondContact CG2-O 3.22Å; T1260-F1263 HydrophobicContact CG2-CD1 4.3Å; T1260-F1263 HydrophobicContact CG2-CD2 3.92Å; T1260-F1263 HydrophobicContact CG2-CE1 4.29Å; T1260-F1263 HydrophobicContact CG2-CE2 3.91Å; T1260-F1263 HydrophobicContact CG2-CG 4.12Å; T1260-F1263 HydrophobicContact CG2-CZ 4.1Å; T1260-L1267 HydrophobicContact CG2-CD2 3.29Å; T1260-L1267 WeakPolarHBondContact OG1-CD2 3.46Å; T1260-R1326 PolarHBondContact O-NH2 2.98Å; T1260-R1326 VanDerWaalsContact O-NH2 3.09Å
1261	K	82.4	Confident	88.9	Confident	54 Å²	54	39.6 Å²	39.6	24%	0.235	20%	0.202	C	C	.	.	S	Bend	trans	-101.7	-23.6	169.8	-75	-167.8	169.6	-163.7	0	113	E1161 H1163 W1259 D1330 R1366	E1161-K1261 WeakPolarHBondContact OE1-CB 3.29Å; E1161-K1261 PolarHBondContact OE1-N 3.3Å; E1161-K1261 PolarHBondContact OE2-N 3.23Å; E1161-K1261 VanDerWaalsContact OE2-N 3.16Å; H1163-K1261 HydrophobicContact CB-CD 4.16Å; H1163-K1261 VanDerWaalsContact O-CD 3.24Å; H1163-K1261 WeakPolarHBondContact O-CD 3.34Å; W1259-K1261 PolarHBondContact O-N 3.38Å; K1261-D1330 WeakPolarHBondContact CE-OD1 3.34Å; K1261-D1330 IonicContact NZ-OD1 2.83Å; K1261-D1330 PolarHBondContact NZ-OD1 3.18Å; K1261-D1330 IonicContact NZ-OD2 3.59Å; K1261-R1366 PolarHBondContact O-NH2 3.22Å
1262	D	82.3	Confident	88.7	Confident	38 Å²	38	44.1 Å²	44.1	20%	0.203	23%	0.225	C	C	.	.			trans	-134.6	103	-170.9	-175.8	26	0	0	0	110.6	R1162 T1260 N1264	R1162-D1262 HydrophobicContact CB-CB 4.35Å; R1162-D1262 WeakPolarHBondContact CB-OD2 3.38Å; R1162-D1262 IonicContact CZ-OD2 2.81Å; R1162-D1262 IonicContact NE-OD2 3.61Å; R1162-D1262 PolarHBondContact NE-OD2 3.11Å; R1162-D1262 IonicContact NH2-OD1 3.82Å; R1162-D1262 IonicContact NH2-OD2 3.97Å; R1162-D1262 PolarHBondContact NH2-OD2 3.37Å; T1260-D1262 WeakPolarHBondContact CG2-O 3.22Å; D1262-N1264 PolarHBondContact O-N 3.23Å; D1262-N1264 PolarHBondContact OD2-ND2 3.33Å; D1262-N1264 PolarHBondContact OD2-OD1 2.93Å
1263	F	81.7	Confident	88.5	Confident	111 Å²	111	44.3 Å²	44.3	49%	0.487	23%	0.23	S	C	.	.			trans	-79.3	67.6	-177.8	-84.2	-85.6	0	0	0	111.6	T1257 T1260 I1268	T1257-F1263 WeakPolarHBondContact O-CZ 3.49Å; T1260-F1263 HydrophobicContact CG2-CD1 4.3Å; T1260-F1263 HydrophobicContact CG2-CD2 3.92Å; T1260-F1263 HydrophobicContact CG2-CE1 4.29Å; T1260-F1263 HydrophobicContact CG2-CE2 3.91Å; T1260-F1263 HydrophobicContact CG2-CG 4.12Å; T1260-F1263 HydrophobicContact CG2-CZ 4.1Å; F1263-I1268 HydrophobicContact CD1-CG1 4.49Å
1264	N	86	Confident	88.3	Confident	37 Å²	37	43.7 Å²	43.7	20%	0.198	23%	0.226	C	C	.	.			trans	-64.9	147.3	173.4	-69.4	-49.6	0	0	0	111.6	F1160 R1162 D1262 M1266 L1267 I1268	F1160-N1264 PolarHBondContact O-ND2 3.36Å; F1160-N1264 VanDerWaalsContact O-ND2 3.12Å; R1162-N1264 PolarHBondContact NH2-OD1 3.05Å; D1262-N1264 PolarHBondContact O-N 3.23Å; D1262-N1264 PolarHBondContact OD2-ND2 3.33Å; D1262-N1264 PolarHBondContact OD2-OD1 2.93Å; N1264-M1266 PolarHBondContact O-N 2.9Å; N1264-M1266 VanDerWaalsContact O-N 3.14Å; N1264-L1267 WeakPolarHBondContact O-CB 3.3Å; N1264-L1267 PolarHBondContact O-N 2.74Å; N1264-I1268 PolarHBondContact O-N 3.22Å; N1264-I1268 VanDerWaalsContact O-N 3.13Å
1265	L	89.6	Confident	87.9	Confident	120 Å²	120	45 Å²	45	63%	0.628	24%	0.237	S	C	*	.	H	α-helix	trans	-49.3	-43	177.5	-179.6	64.7	0	0	0	112.6	L1267 I1268 L1269	L1265-L1267 VanDerWaalsContact C-N 3.28Å; L1265-L1267 PolarHBondContact O-N 3.26Å; L1265-I1268 WeakPolarHBondContact O-CB 3.46Å; L1265-I1268 PolarHBondContact O-N 3.19Å; L1265-L1269 HydrophobicContact CG-CD1 4.42Å; L1265-L1269 WeakPolarHBondContact O-CG 3.21Å; L1265-L1269 PolarHBondContact O-N 3.21Å
1266	M	89.1	Confident	87.6	Confident	81 Å²	81	50 Å²	50	40%	0.399	26%	0.264	S	S	.	.	H	α-helix	trans	-61.4	-34.7	178.8	-63.2	-60.7	104.7	0	0	113.1	F1160 N1264 L1269 C1270	F1160-M1266 HydrophobicContact CD1-CB 4.05Å; F1160-M1266 HydrophobicContact CD1-CG 4.23Å; F1160-M1266 HydrophobicContact CD2-CB 3.59Å; F1160-M1266 HydrophobicContact CE1-CB 4.06Å; F1160-M1266 HydrophobicContact CE1-CG 3.95Å; F1160-M1266 HydrophobicContact CE2-CB 3.6Å; F1160-M1266 HydrophobicContact CE2-CG 4.25Å; F1160-M1266 HydrophobicContact CG-CB 3.82Å; F1160-M1266 HydrophobicContact CZ-CB 3.83Å; F1160-M1266 HydrophobicContact CZ-CG 3.95Å; N1264-M1266 PolarHBondContact O-N 2.9Å; N1264-M1266 VanDerWaalsContact O-N 3.14Å; M1266-L1269 HydrophobicContact CE-CD1 3.69Å; M1266-L1269 HydrophobicContact SD-CD1 4.37Å; M1266-C1270 PolarHBondContact O-N 3.04Å; M1266-C1270 PolarHBondContact O-SG 3.07Å
1267	L	87.9	Confident	87.4	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-74.8	-38.6	177.2	-170.7	73.2	0	0	0	111.2	G1156 T1260 N1264 L1265 L1269 C1270 H1271	G1156-L1267 VanDerWaalsContact C-CD1 3.48Å; T1260-L1267 HydrophobicContact CG2-CD2 3.29Å; T1260-L1267 WeakPolarHBondContact OG1-CD2 3.46Å; N1264-L1267 WeakPolarHBondContact O-CB 3.3Å; N1264-L1267 PolarHBondContact O-N 2.74Å; L1265-L1267 VanDerWaalsContact C-N 3.28Å; L1265-L1267 PolarHBondContact O-N 3.26Å; L1267-L1269 VanDerWaalsContact C-N 3.3Å; L1267-L1269 PolarHBondContact O-N 3.2Å; L1267-C1270 WeakPolarHBondContact O-CA 3.11Å; L1267-C1270 WeakPolarHBondContact O-CB 3.39Å; L1267-C1270 PolarHBondContact O-N 2.98Å; L1267-H1271 PolarHBondContact O-CD2 3.34Å; L1267-H1271 PolarHBondContact O-N 3.35Å
1268	I	89.9	Confident	87.2	Confident	72 Å²	72	51.8 Å²	51.8	37%	0.369	27%	0.271	S	S	.	.	H	α-helix	trans	-58.7	-44.5	172.2	-61.9	170.3	0	0	0	109.8	F1263 N1264 L1265 C1270 H1271 I1272	F1263-I1268 HydrophobicContact CD1-CG1 4.49Å; N1264-I1268 PolarHBondContact O-N 3.22Å; N1264-I1268 VanDerWaalsContact O-N 3.13Å; L1265-I1268 WeakPolarHBondContact O-CB 3.46Å; L1265-I1268 PolarHBondContact O-N 3.19Å; I1268-C1270 VanDerWaalsContact C-N 3.32Å; I1268-C1270 PolarHBondContact O-N 3.31Å; I1268-H1271 PolarHBondContact O-N 2.9Å; I1268-H1271 VanDerWaalsContact O-N 3.15Å; I1268-I1272 HydrophobicContact CG2-CD1 3.96Å; I1268-I1272 WeakPolarHBondContact O-CG1 3.48Å; I1268-I1272 PolarHBondContact O-N 2.97Å
1269	L	91.7	Very high	87	Confident	88 Å²	88	54.2 Å²	54.2	46%	0.461	29%	0.287	S	S	.	.	H	α-helix	trans	-60.8	-36.6	172.8	-68.3	175.1	0	0	0	112.7	L1265 M1266 L1267 I1272 G1273	L1265-L1269 HydrophobicContact CG-CD1 4.42Å; L1265-L1269 WeakPolarHBondContact O-CG 3.21Å; L1265-L1269 PolarHBondContact O-N 3.21Å; M1266-L1269 HydrophobicContact CE-CD1 3.69Å; M1266-L1269 HydrophobicContact SD-CD1 4.37Å; L1267-L1269 VanDerWaalsContact C-N 3.3Å; L1267-L1269 PolarHBondContact O-N 3.2Å; L1269-I1272 PolarHBondContact O-N 3.49Å; L1269-G1273 PolarHBondContact O-N 2.82Å
1270	C	90.6	Very high	86.6	Confident	22 Å²	22	57.9 Å²	57.9	15%	0.149	31%	0.306	C	S	.	.	H	α-helix	trans	-65.5	-37.8	173.7	-66.2	0	0	0	0	112.4	M1266 L1267 I1268 G1273 T1274	M1266-C1270 PolarHBondContact O-N 3.04Å; M1266-C1270 PolarHBondContact O-SG 3.07Å; L1267-C1270 WeakPolarHBondContact O-CA 3.11Å; L1267-C1270 WeakPolarHBondContact O-CB 3.39Å; L1267-C1270 PolarHBondContact O-N 2.98Å; I1268-C1270 VanDerWaalsContact C-N 3.32Å; I1268-C1270 PolarHBondContact O-N 3.31Å; C1270-G1273 PolarHBondContact O-N 3.09Å; C1270-T1274 PolarHBondContact O-N 3.21Å
1271	H	88.2	Confident	86.4	Confident	29 Å²	29	57.9 Å²	57.9	13%	0.134	31%	0.306	C	S	.	.	H	α-helix	trans	-67	-43.9	173.8	-76.8	-71.4	0	0	0	112.1	V1153 T1257 L1267 I1268 G1273 T1274 T1275	V1153-H1271 VanDerWaalsContact CG1-CE1 3.46Å; V1153-H1271 WeakPolarHBondContact CG1-CE1 3.42Å; V1153-H1271 HydrophobicContact CG2-CB 4.49Å; V1153-H1271 VanDerWaalsContact CG2-CE1 3.45Å; V1153-H1271 WeakPolarHBondContact CG2-CE1 3.38Å; V1153-H1271 VanDerWaalsContact CG2-ND1 3.25Å; V1153-H1271 WeakPolarHBondContact CG2-ND1 3.3Å; T1257-H1271 WeakPolarHBondContact CG2-CE1 3.47Å; L1267-H1271 PolarHBondContact O-CD2 3.34Å; L1267-H1271 PolarHBondContact O-N 3.35Å; I1268-H1271 PolarHBondContact O-N 2.9Å; I1268-H1271 VanDerWaalsContact O-N 3.15Å; H1271-G1273 VanDerWaalsContact C-N 3.3Å; H1271-G1273 PolarHBondContact O-N 3.02Å; H1271-T1274 PolarHBondContact O-N 2.88Å; H1271-T1274 VanDerWaalsContact O-N 3.1Å; H1271-T1274 PolarHBondContact O-OG1 3.06Å; H1271-T1275 PolarHBondContact O-N 2.98Å
1272	I	89.7	Confident	86.5	Confident	95 Å²	95	59.3 Å²	59.3	49%	0.487	31%	0.313	S	S	.	.	H	α-helix	trans	-61.4	-40.6	173.1	-64.8	165	0	0	0	110.7	I1268 L1269 T1274 T1275 L1276	I1268-I1272 HydrophobicContact CG2-CD1 3.96Å; I1268-I1272 WeakPolarHBondContact O-CG1 3.48Å; I1268-I1272 PolarHBondContact O-N 2.97Å; L1269-I1272 PolarHBondContact O-N 3.49Å; I1272-T1274 VanDerWaalsContact C-N 3.28Å; I1272-T1274 PolarHBondContact O-N 3.11Å; I1272-T1275 PolarHBondContact O-N 3.37Å; I1272-T1275 PolarHBondContact O-OG1 3.38Å; I1272-L1276 PolarHBondContact O-N 3.31Å
1273	G	88.8	Confident	86.7	Confident	19 Å²	19	60.7 Å²	60.7	20%	0.196	32%	0.322	C	S	.	.	H	α-helix	trans	-60.1	-36	173.3	0	0	0	0	0	112.7	L1269 C1270 H1271 N1277	L1269-G1273 PolarHBondContact O-N 2.82Å; C1270-G1273 PolarHBondContact O-N 3.09Å; H1271-G1273 VanDerWaalsContact C-N 3.3Å; H1271-G1273 PolarHBondContact O-N 3.02Å; G1273-N1277 PolarHBondContact O-ND2 3.22Å
1274	T	87.7	Confident	86.8	Confident	2 Å²	2	58 Å²	58	1%	0.012	31%	0.311	C	S	.	.	H	α-helix	trans	-67.3	-48.8	170	53.3	0	0	0	0	112.2	M1149 L1152 V1153 W1249 C1270 H1271 I1272 L1276 N1277	M1149-T1274 WeakPolarHBondContact O-CG2 3.28Å; L1152-T1274 HydrophobicContact CB-CG2 3.94Å; V1153-T1274 HydrophobicContact CB-CG2 4.13Å; V1153-T1274 HydrophobicContact CG2-CG2 3.51Å; W1249-T1274 WeakPolarHBondContact CZ2-O 3.46Å; C1270-T1274 PolarHBondContact O-N 3.21Å; H1271-T1274 PolarHBondContact O-N 2.88Å; H1271-T1274 VanDerWaalsContact O-N 3.1Å; H1271-T1274 PolarHBondContact O-OG1 3.06Å; I1272-T1274 VanDerWaalsContact C-N 3.28Å; I1272-T1274 PolarHBondContact O-N 3.11Å; T1274-L1276 PolarHBondContact O-N 3.46Å; T1274-N1277 VanDerWaalsContact O-CB 3.25Å; T1274-N1277 WeakPolarHBondContact O-CB 3.32Å; T1274-N1277 PolarHBondContact O-N 2.77Å; T1274-N1277 PolarHBondContact O-ND2 2.77Å
1275	T	84.3	Confident	86.6	Confident	81 Å²	81	57.1 Å²	57.1	50%	0.497	31%	0.305	S	S	.	.	H	α-helix	trans	-63.5	-28.4	-178.3	58.4	0	0	0	0	113.1	H1271 I1272 N1277 L1278	H1271-T1275 PolarHBondContact O-N 2.98Å; I1272-T1275 PolarHBondContact O-N 3.37Å; I1272-T1275 PolarHBondContact O-OG1 3.38Å; T1275-N1277 PolarHBondContact O-N 2.97Å; T1275-N1277 VanDerWaalsContact O-N 3.14Å; T1275-L1278 VanDerWaalsContact O-CB 3.31Å; T1275-L1278 WeakPolarHBondContact O-CB 3.4Å; T1275-L1278 WeakPolarHBondContact O-CG 3.25Å; T1275-L1278 PolarHBondContact O-N 2.93Å
1276	L	86.4	Confident	86.4	Confident	114 Å²	114	56 Å²	56	60%	0.597	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.6	171.5	-167.1	70.1	0	0	0	113.1	I1272 T1274 L1278 V1279	I1272-L1276 PolarHBondContact O-N 3.31Å; T1274-L1276 PolarHBondContact O-N 3.46Å; L1276-L1278 PolarHBondContact O-N 3.37Å; L1276-L1278 VanDerWaalsContact O-N 3.15Å; L1276-V1279 HydrophobicContact CD1-CG2 4.13Å; L1276-V1279 VanDerWaalsContact O-CB 3.29Å; L1276-V1279 WeakPolarHBondContact O-CB 3.37Å; L1276-V1279 WeakPolarHBondContact O-CG2 3.42Å; L1276-V1279 PolarHBondContact O-N 2.87Å
1277	N	85.4	Confident	86.1	Confident	9 Å²	9	60.1 Å²	60.1	5%	0.048	32%	0.319	C	S	.	.	H	α-helix	trans	-64.5	-14.7	174.4	-69	-96.5	0	0	0	113.5	T1148 M1149 W1249 G1273 T1274 T1275 V1279 I1280 L1281	T1148-N1277 WeakPolarHBondContact CB-OD1 3.28Å; T1148-N1277 PolarHBondContact O-ND2 3.26Å; T1148-N1277 PolarHBondContact OG1-OD1 3.14Å; M1149-N1277 HydrophobicContact CE-CB 3.76Å; M1149-N1277 HydrophobicContact SD-CB 3.39Å; M1149-N1277 WeakPolarHBondContact SD-CB 3.5Å; W1249-N1277 HydrophobicContact CH2-CB 3.99Å; W1249-N1277 HydrophobicContact CZ2-CB 4.03Å; G1273-N1277 PolarHBondContact O-ND2 3.22Å; T1274-N1277 VanDerWaalsContact O-CB 3.25Å; T1274-N1277 WeakPolarHBondContact O-CB 3.32Å; T1274-N1277 PolarHBondContact O-N 2.77Å; T1274-N1277 PolarHBondContact O-ND2 2.77Å; T1275-N1277 PolarHBondContact O-N 2.97Å; T1275-N1277 VanDerWaalsContact O-N 3.14Å; N1277-V1279 PolarHBondContact O-N 3.15Å; N1277-I1280 HydrophobicContact CB-CD1 4.5Å; N1277-I1280 WeakPolarHBondContact O-CA 3.36Å; N1277-I1280 WeakPolarHBondContact O-CB 3.31Å; N1277-I1280 PolarHBondContact O-N 3.28Å; N1277-L1281 PolarHBondContact O-N 3.2Å; N1277-L1281 VanDerWaalsContact O-N 3.13Å
1278	L	84.3	Confident	85.9	Confident	69 Å²	69	60.7 Å²	60.7	36%	0.361	32%	0.323	S	S	.	.	H	α-helix	trans	-57.1	-39.6	167.5	-72.3	168	0	0	0	110.6	W1249 T1275 L1276 I1280 L1281 F1282	W1249-L1278 HydrophobicContact CH2-CD2 4.07Å; W1249-L1278 HydrophobicContact CH2-CG 3.96Å; W1249-L1278 HydrophobicContact CZ3-CD2 3.72Å; W1249-L1278 HydrophobicContact CZ3-CG 4.14Å; T1275-L1278 VanDerWaalsContact O-CB 3.31Å; T1275-L1278 WeakPolarHBondContact O-CB 3.4Å; T1275-L1278 WeakPolarHBondContact O-CG 3.25Å; T1275-L1278 PolarHBondContact O-N 2.93Å; L1276-L1278 PolarHBondContact O-N 3.37Å; L1276-L1278 VanDerWaalsContact O-N 3.15Å; L1278-I1280 PolarHBondContact O-N 3.43Å; L1278-L1281 WeakPolarHBondContact O-CB 3.32Å; L1278-L1281 PolarHBondContact O-N 2.91Å; L1278-L1281 VanDerWaalsContact O-N 3.09Å; L1278-F1282 VanDerWaalsContact O-CD2 3.29Å; L1278-F1282 WeakPolarHBondContact O-CD2 3.45Å; L1278-F1282 PolarHBondContact O-N 3.1Å
1279	V	84.7	Confident	85.6	Confident	81 Å²	81	61.1 Å²	61.1	49%	0.491	33%	0.331	S	S	.	.	H	α-helix	trans	-59.7	-38.7	174.8	-174.9	0	0	0	0	110.6	L1276 N1277 L1281 F1282 V1283	L1276-V1279 HydrophobicContact CD1-CG2 4.13Å; L1276-V1279 VanDerWaalsContact O-CB 3.29Å; L1276-V1279 WeakPolarHBondContact O-CB 3.37Å; L1276-V1279 WeakPolarHBondContact O-CG2 3.42Å; L1276-V1279 PolarHBondContact O-N 2.87Å; N1277-V1279 PolarHBondContact O-N 3.15Å; V1279-L1281 VanDerWaalsContact C-N 3.34Å; V1279-L1281 PolarHBondContact O-N 3.33Å; V1279-F1282 PolarHBondContact O-N 3.01Å; V1279-V1283 HydrophobicContact CG1-CG2 4.12Å; V1279-V1283 WeakPolarHBondContact O-CB 3.49Å; V1279-V1283 VanDerWaalsContact O-CG2 3.25Å; V1279-V1283 WeakPolarHBondContact O-CG2 3.39Å; V1279-V1283 PolarHBondContact O-N 2.91Å
1280	I	80.3	Confident	85.1	Confident	86 Å²	86	61.3 Å²	61.3	44%	0.441	34%	0.339	S	S	.	.	H	α-helix	trans	-63.6	-38.9	176.5	-57.1	-179.2	0	0	0	111.1	N1277 L1278 F1284	N1277-I1280 HydrophobicContact CB-CD1 4.5Å; N1277-I1280 WeakPolarHBondContact O-CA 3.36Å; N1277-I1280 WeakPolarHBondContact O-CB 3.31Å; N1277-I1280 PolarHBondContact O-N 3.28Å; L1278-I1280 PolarHBondContact O-N 3.43Å; I1280-F1284 WeakPolarHBondContact O-CB 3.4Å; I1280-F1284 PolarHBondContact O-N 3.29Å
1281	L	82.9	Confident	84.6	Confident	6 Å²	6	66.4 Å²	66.4	3%	0.031	37%	0.37	C	S	.	.	H	α-helix	trans	-67	-42.3	173.9	-62.8	177.6	0	0	0	112.2	L1141 M1149 W1249 N1277 L1278 V1279 V1283 F1284 Q1285 Y1298	L1141-L1281 HydrophobicContact CD2-CD2 3.6Å; M1149-L1281 HydrophobicContact CE-CD1 4.32Å; M1149-L1281 HydrophobicContact CE-CD2 3.7Å; M1149-L1281 HydrophobicContact CE-CG 3.82Å; W1249-L1281 HydrophobicContact CZ3-CD1 3.96Å; N1277-L1281 PolarHBondContact O-N 3.2Å; N1277-L1281 VanDerWaalsContact O-N 3.13Å; L1278-L1281 WeakPolarHBondContact O-CB 3.32Å; L1278-L1281 PolarHBondContact O-N 2.91Å; L1278-L1281 VanDerWaalsContact O-N 3.09Å; V1279-L1281 VanDerWaalsContact C-N 3.34Å; V1279-L1281 PolarHBondContact O-N 3.33Å; L1281-V1283 VanDerWaalsContact C-N 3.34Å; L1281-V1283 PolarHBondContact O-N 3.11Å; L1281-F1284 PolarHBondContact O-N 3.04Å; L1281-Q1285 PolarHBondContact O-N 3.32Å; L1281-Y1298 HydrophobicContact CB-CD2 4.01Å; L1281-Y1298 HydrophobicContact CB-CE2 4.04Å; L1281-Y1298 HydrophobicContact CB-CG 4.48Å; L1281-Y1298 HydrophobicContact CD1-CE1 4.45Å; L1281-Y1298 HydrophobicContact CD2-CE2 4Å; L1281-Y1298 HydrophobicContact CG-CE2 4.45Å
1282	F	85.6	Confident	84.3	Confident	84 Å²	84	67 Å²	67	37%	0.368	38%	0.377	S	S	.	.	H	α-helix	trans	-68	-29.5	177.5	-85.9	-76.4	0	0	0	113.8	L1278 V1279 Q1285	L1278-F1282 VanDerWaalsContact O-CD2 3.29Å; L1278-F1282 WeakPolarHBondContact O-CD2 3.45Å; L1278-F1282 PolarHBondContact O-N 3.1Å; V1279-F1282 PolarHBondContact O-N 3.01Å; F1282-Q1285 WeakPolarHBondContact O-CG 3.05Å; F1282-Q1285 PolarHBondContact O-NE2 3.28Å
1283	V	85.7	Confident	83.6	Confident	67 Å²	67	67.9 Å²	67.9	41%	0.406	38%	0.383	S	S	.	.	H	α-helix	trans	-82.3	-36.3	173.2	169.9	0	0	0	0	111.1	V1279 L1281 Q1285 T1286 F1287	V1279-V1283 HydrophobicContact CG1-CG2 4.12Å; V1279-V1283 WeakPolarHBondContact O-CB 3.49Å; V1279-V1283 VanDerWaalsContact O-CG2 3.25Å; V1279-V1283 WeakPolarHBondContact O-CG2 3.39Å; V1279-V1283 PolarHBondContact O-N 2.91Å; L1281-V1283 VanDerWaalsContact C-N 3.34Å; L1281-V1283 PolarHBondContact O-N 3.11Å; V1283-Q1285 VanDerWaalsContact C-N 3.35Å; V1283-Q1285 PolarHBondContact O-N 3.38Å; V1283-T1286 PolarHBondContact O-N 3.37Å; V1283-T1286 VanDerWaalsContact O-N 3.09Å; V1283-T1286 PolarHBondContact O-OG1 3.45Å; V1283-F1287 HydrophobicContact CG1-CD2 4.14Å; V1283-F1287 HydrophobicContact CG1-CE2 3.62Å; V1283-F1287 VanDerWaalsContact O-CD2 3.31Å; V1283-F1287 WeakPolarHBondContact O-CD2 3.15Å
1284	F	83.2	Confident	83.1	Confident	56 Å²	56	68.4 Å²	68.4	25%	0.246	38%	0.38	C	S	.	.	H	α-helix	trans	-56.9	-48.1	177.2	171.6	-111.9	0	0	0	111.4	I1140 I1280 L1281 T1286 F1287 V1288	I1140-F1284 HydrophobicContact CD1-CE2 3.98Å; I1140-F1284 HydrophobicContact CG2-CE1 4.03Å; I1140-F1284 HydrophobicContact CG2-CE2 3.87Å; I1140-F1284 HydrophobicContact CG2-CZ 3.57Å; I1280-F1284 WeakPolarHBondContact O-CB 3.4Å; I1280-F1284 PolarHBondContact O-N 3.29Å; L1281-F1284 PolarHBondContact O-N 3.04Å; F1284-T1286 PolarHBondContact O-N 2.98Å; F1284-F1287 PolarHBondContact O-N 2.98Å; F1284-V1288 HydrophobicContact CD1-CG2 3.99Å; F1284-V1288 HydrophobicContact CD2-CG2 4.17Å; F1284-V1288 HydrophobicContact CE1-CG2 3.54Å; F1284-V1288 HydrophobicContact CE2-CG2 3.72Å; F1284-V1288 HydrophobicContact CG-CG2 4.28Å; F1284-V1288 HydrophobicContact CZ-CG2 3.37Å; F1284-V1288 WeakPolarHBondContact O-CG2 3.48Å; F1284-V1288 PolarHBondContact O-N 2.88Å
1285	Q	83.8	Confident	82.9	Confident	17 Å²	17	72.1 Å²	72.1	8%	0.079	40%	0.395	C	S	.	.	H	α-helix	trans	-61.3	-13.2	178.2	61.6	167.3	15.1	0	0	115.1	L1281 F1282 V1283 A1299	L1281-Q1285 PolarHBondContact O-N 3.32Å; F1282-Q1285 WeakPolarHBondContact O-CG 3.05Å; F1282-Q1285 PolarHBondContact O-NE2 3.28Å; V1283-Q1285 VanDerWaalsContact C-N 3.35Å; V1283-Q1285 PolarHBondContact O-N 3.38Å; Q1285-A1299 VanDerWaalsContact OE1-N 3.17Å
1286	T	83.6	Confident	82.8	Confident	98 Å²	98	71.4 Å²	71.4	60%	0.601	39%	0.386	S	S	*	.	H	α-helix	trans	-86.5	-20	174.5	66	0	0	0	0	113.2	V1283 F1284	V1283-T1286 PolarHBondContact O-N 3.37Å; V1283-T1286 VanDerWaalsContact O-N 3.09Å; V1283-T1286 PolarHBondContact O-OG1 3.45Å; F1284-T1286 PolarHBondContact O-N 2.98Å
1287	F	84	Confident	82.6	Confident	166 Å²	166	67.9 Å²	67.9	73%	0.728	36%	0.364	S	S	*	.	H	α-helix	trans	-94.1	-15	174.6	-67	-70.8	0	0	0	113.2	V1283 F1284	V1283-F1287 HydrophobicContact CG1-CD2 4.14Å; V1283-F1287 HydrophobicContact CG1-CE2 3.62Å; V1283-F1287 VanDerWaalsContact O-CD2 3.31Å; V1283-F1287 WeakPolarHBondContact O-CD2 3.15Å; F1284-F1287 PolarHBondContact O-N 2.98Å
1288	V	83.1	Confident	82.6	Confident	13 Å²	13	67.9 Å²	67.9	8%	0.079	36%	0.364	C	S	.	.	S	Bend	trans	-69.6	124.8	176.6	168.8	0	0	0	0	109.6	F1284 S1292 E1294 Y1295	F1284-V1288 HydrophobicContact CD1-CG2 3.99Å; F1284-V1288 HydrophobicContact CD2-CG2 4.17Å; F1284-V1288 HydrophobicContact CE1-CG2 3.54Å; F1284-V1288 HydrophobicContact CE2-CG2 3.72Å; F1284-V1288 HydrophobicContact CG-CG2 4.28Å; F1284-V1288 HydrophobicContact CZ-CG2 3.37Å; F1284-V1288 WeakPolarHBondContact O-CG2 3.48Å; F1284-V1288 PolarHBondContact O-N 2.88Å; V1288-S1292 WeakPolarHBondContact CG1-OG 3.16Å; V1288-E1294 HydrophobicContact CG1-CB 3.91Å; V1288-Y1295 WeakPolarHBondContact O-CD2 3.3Å
1289	P	83.7	Confident	82.7	Confident	82 Å²	82	65.2 Å²	65.2	53%	0.532	35%	0.352	S	S	.	.			trans	-60.2	142.6	178.9	-25	34.6	0	0	0	112.3	T1291 S1292	P1289-T1291 PolarHBondContact O-N 2.89Å; P1289-T1291 VanDerWaalsContact O-N 3.08Å; P1289-S1292 PolarHBondContact O-N 3.21Å; P1289-S1292 PolarHBondContact O-OG 3.48Å
1290	S	80.3	Confident	82.6	Confident	91 Å²	91	63.5 Å²	63.5	64%	0.636	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.7	178.3	53.6	0	0	0	0	114.5	S1292	S1290-S1292 VanDerWaalsContact C-N 3.33Å
1291	T	80.5	Confident	83	Confident	129 Å²	129	59.4 Å²	59.4	79%	0.791	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-9.4	174.8	52.4	0	0	0	0	114	P1289	P1289-T1291 PolarHBondContact O-N 2.89Å; P1289-T1291 VanDerWaalsContact O-N 3.08Å
1292	S	82.1	Confident	83.1	Confident	42 Å²	42	61.3 Å²	61.3	29%	0.294	33%	0.331	S	S	.	.	S	Bend	trans	-100.7	145.6	-175.7	70.7	0	0	0	0	112.1	V1288 P1289 S1290 E1294 Y1295	V1288-S1292 WeakPolarHBondContact CG1-OG 3.16Å; P1289-S1292 PolarHBondContact O-N 3.21Å; P1289-S1292 PolarHBondContact O-OG 3.48Å; S1290-S1292 VanDerWaalsContact C-N 3.33Å; S1292-E1294 PolarHBondContact O-N 3.23Å; S1292-Y1295 WeakPolarHBondContact O-CB 3.45Å; S1292-Y1295 PolarHBondContact O-N 2.84Å
1293	N	75.4	Confident	83	Confident	113 Å²	113	63.2 Å²	63.2	60%	0.604	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-18.5	-173.6	-64	-10.1	0	0	0	114.2	T1238 R1297	T1238-N1293 HydrophobicContact CG2-CB 4.17Å; N1293-R1297 WeakPolarHBondContact O-CG 3.39Å; N1293-R1297 PolarHBondContact O-NE 3.12Å; N1293-R1297 PolarHBondContact O-NH2 3.2Å
1294	E	77.6	Confident	83	Confident	31 Å²	31	60 Å²	60	15%	0.145	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-4.5	179.8	-61.4	-67.8	-179.9	0	0	113.7	G1138 N1242 V1288 S1292 Q1296 R1297	G1138-E1294 WeakPolarHBondContact CA-OE1 3.49Å; G1138-E1294 PolarHBondContact N-OE1 2.86Å; N1242-E1294 PolarHBondContact ND2-OE2 2.63Å; V1288-E1294 HydrophobicContact CG1-CB 3.91Å; S1292-E1294 PolarHBondContact O-N 3.23Å; E1294-Q1296 PolarHBondContact O-N 3.2Å; E1294-R1297 PolarHBondContact O-N 3.35Å
1295	Y	83.2	Confident	83.2	Confident	79 Å²	79	61.1 Å²	61.1	31%	0.31	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	122.4	-176	-177.5	-112.4	0	0	0	112.4	V1288 S1292 R1297	V1288-Y1295 WeakPolarHBondContact O-CD2 3.3Å; S1292-Y1295 WeakPolarHBondContact O-CB 3.45Å; S1292-Y1295 PolarHBondContact O-N 2.84Å; Y1295-R1297 PolarHBondContact O-N 2.89Å
1296	Q	82.1	Confident	83.4	Confident	67 Å²	67	61.5 Å²	61.5	31%	0.313	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	18.3	178.2	-62.4	-168.7	-0.3	0	0	117	E1294 Y1298 A1299 Q1300	E1294-Q1296 PolarHBondContact O-N 3.2Å; Q1296-Y1298 PolarHBondContact O-N 3.44Å; Q1296-A1299 HydrophobicContact CB-CB 4.49Å; Q1296-A1299 PolarHBondContact O-N 3.44Å; Q1296-A1299 VanDerWaalsContact O-N 3.11Å; Q1296-Q1300 PolarHBondContact O-N 2.99Å
1297	R	84	Confident	83.8	Confident	39 Å²	39	57.3 Å²	57.3	15%	0.147	31%	0.308	C	S	.	.	H	α-helix	trans	-63.5	-36.8	-174.2	-61.8	-47.1	-169.1	138.7	19.4	114.2	D1236 N1293 E1294 Y1295 Q1300 L1301	D1236-R1297 IonicContact OD1-NH2 3.76Å; D1236-R1297 IonicContact OD2-CZ 3.16Å; D1236-R1297 IonicContact OD2-NH1 2.74Å; D1236-R1297 PolarHBondContact OD2-NH1 2.96Å; D1236-R1297 IonicContact OD2-NH2 2.92Å; D1236-R1297 PolarHBondContact OD2-NH2 2.91Å; N1293-R1297 WeakPolarHBondContact O-CG 3.39Å; N1293-R1297 PolarHBondContact O-NE 3.12Å; N1293-R1297 PolarHBondContact O-NH2 3.2Å; E1294-R1297 PolarHBondContact O-N 3.35Å; Y1295-R1297 PolarHBondContact O-N 2.89Å; R1297-Q1300 WeakPolarHBondContact O-CB 3.19Å; R1297-Q1300 PolarHBondContact O-N 3.42Å; R1297-L1301 WeakPolarHBondContact O-CG 3.45Å; R1297-L1301 PolarHBondContact O-N 3.49Å
1298	Y	85.5	Confident	84.1	Confident	10 Å²	10	55.8 Å²	55.8	4%	0.039	30%	0.298	C	S	.	.	H	α-helix	trans	-65.8	-39.7	174.1	-60.5	-60.3	0	0	0	112.1	L1141 N1242 V1246 L1281 Q1296 Q1300 L1301 C1302	L1141-Y1298 WeakPolarHBondContact CD1-OH 3.25Å; L1141-Y1298 VanDerWaalsContact CD2-OH 3.29Å; L1141-Y1298 WeakPolarHBondContact CD2-OH 3.4Å; N1242-Y1298 HydrophobicContact CB-CE1 3.9Å; N1242-Y1298 VanDerWaalsContact OD1-CZ 3.27Å; N1242-Y1298 PolarHBondContact OD1-OH 3Å; V1246-Y1298 HydrophobicContact CG2-CE1 4.19Å; L1281-Y1298 HydrophobicContact CB-CD2 4.01Å; L1281-Y1298 HydrophobicContact CB-CE2 4.04Å; L1281-Y1298 HydrophobicContact CB-CG 4.48Å; L1281-Y1298 HydrophobicContact CD1-CE1 4.45Å; L1281-Y1298 HydrophobicContact CD2-CE2 4Å; L1281-Y1298 HydrophobicContact CG-CE2 4.45Å; Q1296-Y1298 PolarHBondContact O-N 3.44Å; Y1298-Q1300 VanDerWaalsContact C-N 3.26Å; Y1298-Q1300 PolarHBondContact O-N 2.68Å; Y1298-L1301 HydrophobicContact CD1-CD1 4.31Å; Y1298-L1301 PolarHBondContact O-N 3.02Å; Y1298-C1302 PolarHBondContact O-N 3.23Å; Y1298-C1302 PolarHBondContact O-SG 3.49Å; Y1298-C1302 VanDerWaalsContact O-SG 3.41Å
1299	A	85	Confident	84.5	Confident	13 Å²	13	62.8 Å²	62.8	11%	0.107	33%	0.327	C	S	.	.	H	α-helix	trans	-67	-24.1	173.8	0	0	0	0	0	113.5	Q1285 Q1296 R1303	Q1285-A1299 VanDerWaalsContact OE1-N 3.17Å; Q1296-A1299 HydrophobicContact CB-CB 4.49Å; Q1296-A1299 PolarHBondContact O-N 3.44Å; Q1296-A1299 VanDerWaalsContact O-N 3.11Å; A1299-R1303 WeakPolarHBondContact O-CG 3.45Å; A1299-R1303 PolarHBondContact O-NH1 3.03Å
1300	Q	83.6	Confident	84.9	Confident	44 Å²	44	59.3 Å²	59.3	21%	0.206	31%	0.305	C	S	.	.	H	α-helix	trans	-76.5	-48.3	170	-67.9	172.2	-2.7	0	0	111.1	F1223 M1239 Q1296 R1297 Y1298 C1302 R1303 S1304	F1223-Q1300 HydrophobicContact CE2-CB 3.91Å; F1223-Q1300 HydrophobicContact CE2-CG 4.09Å; F1223-Q1300 HydrophobicContact CZ-CB 4.31Å; M1239-Q1300 HydrophobicContact CE-CB 3.82Å; Q1296-Q1300 PolarHBondContact O-N 2.99Å; R1297-Q1300 WeakPolarHBondContact O-CB 3.19Å; R1297-Q1300 PolarHBondContact O-N 3.42Å; Y1298-Q1300 VanDerWaalsContact C-N 3.26Å; Y1298-Q1300 PolarHBondContact O-N 2.68Å; Q1300-C1302 PolarHBondContact O-N 3.41Å; Q1300-R1303 PolarHBondContact O-N 3.15Å; Q1300-S1304 PolarHBondContact O-N 2.97Å
1301	L	87.4	Confident	85.5	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-55.9	-47.6	177.6	-73.9	173.4	0	0	0	112.3	Y1235 M1239 N1242 A1243 R1297 Y1298 R1303 S1304 F1307	Y1235-L1301 HydrophobicContact CD1-CD2 4.36Å; Y1235-L1301 HydrophobicContact CE1-CD2 3.57Å; M1239-L1301 HydrophobicContact CB-CD2 4.31Å; M1239-L1301 HydrophobicContact CE-CD2 3.93Å; M1239-L1301 HydrophobicContact CE-CG 4.24Å; N1242-L1301 HydrophobicContact CB-CD1 3.8Å; A1243-L1301 HydrophobicContact CB-CD1 4.34Å; A1243-L1301 HydrophobicContact CB-CD2 4.04Å; R1297-L1301 WeakPolarHBondContact O-CG 3.45Å; R1297-L1301 PolarHBondContact O-N 3.49Å; Y1298-L1301 HydrophobicContact CD1-CD1 4.31Å; Y1298-L1301 PolarHBondContact O-N 3.02Å; L1301-R1303 PolarHBondContact O-N 3.42Å; L1301-R1303 VanDerWaalsContact O-N 3.13Å; L1301-S1304 PolarHBondContact O-N 2.99Å; L1301-F1307 HydrophobicContact CB-CD2 4.17Å; L1301-F1307 HydrophobicContact CB-CE2 4.37Å; L1301-F1307 HydrophobicContact CB-CG 4.35Å; L1301-F1307 HydrophobicContact CD2-CD2 4.11Å; L1301-F1307 WeakPolarHBondContact O-CB 3.44Å
1302	C	85.9	Confident	86.1	Confident	46 Å²	46	54.5 Å²	54.5	31%	0.311	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-15.1	179.2	-69	0	0	0	0	114.5	Y1298 Q1300 W1308	Y1298-C1302 PolarHBondContact O-N 3.23Å; Y1298-C1302 PolarHBondContact O-SG 3.49Å; Y1298-C1302 VanDerWaalsContact O-SG 3.41Å; Q1300-C1302 PolarHBondContact O-N 3.41Å; C1302-W1308 HydrophobicContact CB-CZ2 4.36Å; C1302-W1308 PolarHBondContact O-NE1 3.07Å
1303	R	83.1	Confident	86.6	Confident	124 Å²	124	56.6 Å²	56.6	47%	0.468	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-13	173.5	-71.8	179.3	179.3	107.4	-9.1	113.5	I1226 A1299 Q1300 L1301 P1305	I1226-R1303 VanDerWaalsContact CD1-CZ 3.42Å; I1226-R1303 VanDerWaalsContact CD1-NH2 3.3Å; A1299-R1303 WeakPolarHBondContact O-CG 3.45Å; A1299-R1303 PolarHBondContact O-NH1 3.03Å; Q1300-R1303 PolarHBondContact O-N 3.15Å; L1301-R1303 PolarHBondContact O-N 3.42Å; L1301-R1303 VanDerWaalsContact O-N 3.13Å; R1303-P1305 WeakPolarHBondContact O-CD 3.29Å
1304	S	86.1	Confident	87.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.247	C	C	.	.			trans	-83.6	123.9	179	-174.4	0	0	0	0	111.3	Y1235 Q1300 L1301 A1306 F1307 W1308	Y1235-S1304 WeakPolarHBondContact OH-CB 3.43Å; Y1235-S1304 PolarHBondContact OH-OG 2.8Å; Q1300-S1304 PolarHBondContact O-N 2.97Å; L1301-S1304 PolarHBondContact O-N 2.99Å; S1304-A1306 PolarHBondContact O-N 3.43Å; S1304-A1306 PolarHBondContact OG-N 2.92Å; S1304-F1307 PolarHBondContact O-N 3.23Å; S1304-W1308 VanDerWaalsContact O-CD1 3.31Å
1305	P	87.3	Confident	88.3	Confident	79 Å²	79	50.5 Å²	50.5	51%	0.513	25%	0.245	S	C	.	.	H	α-helix	trans	-60.8	-35	171.5	-23	34.5	0	0	0	112.2	R1303 F1307 W1308 F1309	R1303-P1305 WeakPolarHBondContact O-CD 3.29Å; P1305-F1307 VanDerWaalsContact C-N 3.3Å; P1305-F1307 PolarHBondContact O-N 3.24Å; P1305-W1308 PolarHBondContact O-N 2.66Å; P1305-F1309 HydrophobicContact CB-CD2 4.44Å; P1305-F1309 HydrophobicContact CB-CE2 4.31Å; P1305-F1309 WeakPolarHBondContact O-CD2 3.25Å; P1305-F1309 PolarHBondContact O-N 3.19Å
1306	A	88.9	Confident	88.9	Confident	24 Å²	24	53.4 Å²	53.4	20%	0.198	26%	0.26	C	S	.	.	H	α-helix	trans	-60.8	-38.5	179.6	0	0	0	0	0	112.2	L1212 A1221 S1304 W1308 F1309 T1310	L1212-A1306 HydrophobicContact CD2-CB 3.77Å; A1221-A1306 HydrophobicContact CB-CB 3.69Å; S1304-A1306 PolarHBondContact O-N 3.43Å; S1304-A1306 PolarHBondContact OG-N 2.92Å; A1306-W1308 VanDerWaalsContact C-N 3.32Å; A1306-W1308 PolarHBondContact O-N 3.06Å; A1306-F1309 PolarHBondContact O-N 3.45Å; A1306-T1310 WeakPolarHBondContact O-CB 3.37Å; A1306-T1310 VanDerWaalsContact O-CG2 3.27Å; A1306-T1310 WeakPolarHBondContact O-CG2 3.46Å; A1306-T1310 PolarHBondContact O-N 3.22Å; A1306-T1310 PolarHBondContact O-OG1 2.9Å
1307	F	90.7	Very high	89.5	Confident	10 Å²	10	53 Å²	53	4%	0.044	26%	0.259	C	S	.	.	H	α-helix	trans	-60.8	-39.2	173.9	173.2	-96.7	0	0	0	112.1	A1243 V1246 Y1247 L1301 S1304 P1305 T1310 F1311	A1243-F1307 HydrophobicContact CB-CD2 4.07Å; A1243-F1307 HydrophobicContact CB-CE2 4.15Å; V1246-F1307 HydrophobicContact CG1-CZ 4.22Å; Y1247-F1307 HydrophobicContact CD1-CE2 4.34Å; Y1247-F1307 AromaticContact CE1-CD2 3.84Å; Y1247-F1307 HydrophobicContact CE1-CD2 3.84Å; Y1247-F1307 AromaticContact CE1-CE2 3.39Å; Y1247-F1307 HydrophobicContact CE1-CE2 3.39Å; Y1247-F1307 AromaticContact CE1-CZ 3.9Å; Y1247-F1307 HydrophobicContact CE1-CZ 3.9Å; Y1247-F1307 AromaticContact CZ-CD2 3.76Å; Y1247-F1307 AromaticContact CZ-CE2 3.79Å; Y1247-F1307 WeakPolarHBondContact OH-CA 3.49Å; Y1247-F1307 WeakPolarHBondContact OH-CD2 3.39Å; Y1247-F1307 PolarHBondContact OH-O 3.48Å; L1301-F1307 HydrophobicContact CB-CD2 4.17Å; L1301-F1307 HydrophobicContact CB-CE2 4.37Å; L1301-F1307 HydrophobicContact CB-CG 4.35Å; L1301-F1307 HydrophobicContact CD2-CD2 4.11Å; L1301-F1307 WeakPolarHBondContact O-CB 3.44Å; S1304-F1307 PolarHBondContact O-N 3.23Å; P1305-F1307 VanDerWaalsContact C-N 3.3Å; P1305-F1307 PolarHBondContact O-N 3.24Å; F1307-T1310 PolarHBondContact O-OG1 3.03Å; F1307-F1311 VanDerWaalsContact O-CB 3.22Å; F1307-F1311 WeakPolarHBondContact O-CB 3.31Å; F1307-F1311 PolarHBondContact O-N 3.35Å; F1307-F1311 VanDerWaalsContact O-N 3.13Å
1308	W	90.9	Very high	90	Very high	135 Å²	135	51.1 Å²	51.1	51%	0.511	25%	0.252	S	S	.	.	H	α-helix	trans	-77.7	-30	-179.6	-69.7	110	0	0	0	114.1	C1302 S1304 P1305 A1306 F1311 P1312	C1302-W1308 HydrophobicContact CB-CZ2 4.36Å; C1302-W1308 PolarHBondContact O-NE1 3.07Å; S1304-W1308 VanDerWaalsContact O-CD1 3.31Å; P1305-W1308 PolarHBondContact O-N 2.66Å; A1306-W1308 VanDerWaalsContact C-N 3.32Å; A1306-W1308 PolarHBondContact O-N 3.06Å; W1308-F1311 HydrophobicContact CE3-CD1 4.46Å; W1308-P1312 WeakPolarHBondContact O-CD 3.41Å
1309	F	91.1	Very high	90.5	Very high	159 Å²	159	51 Å²	51	70%	0.697	25%	0.252	S	S	*	.	H	α-helix	trans	-76	-38.3	173.4	-75.6	-65.4	0	0	0	112.9	P1305 A1306 P1312	P1305-F1309 HydrophobicContact CB-CD2 4.44Å; P1305-F1309 HydrophobicContact CB-CE2 4.31Å; P1305-F1309 WeakPolarHBondContact O-CD2 3.25Å; P1305-F1309 PolarHBondContact O-N 3.19Å; A1306-F1309 PolarHBondContact O-N 3.45Å; F1309-P1312 WeakPolarHBondContact O-CD 3.44Å
1310	T	91.8	Very high	90.9	Very high	10 Å²	10	51.6 Å²	51.6	6%	0.061	26%	0.256	C	S	.	.	H	α-helix	trans	-77.5	-25.8	-179	53.4	0	0	0	0	112.9	C1211 L1212 Y1247 A1306 F1307 T1314	C1211-T1310 HydrophobicContact CB-CG2 3.26Å; L1212-T1310 HydrophobicContact CD2-CG2 4.09Å; Y1247-T1310 PolarHBondContact OH-OG1 3.34Å; A1306-T1310 WeakPolarHBondContact O-CB 3.37Å; A1306-T1310 VanDerWaalsContact O-CG2 3.27Å; A1306-T1310 WeakPolarHBondContact O-CG2 3.46Å; A1306-T1310 PolarHBondContact O-N 3.22Å; A1306-T1310 PolarHBondContact O-OG1 2.9Å; F1307-T1310 PolarHBondContact O-OG1 3.03Å; T1310-T1314 WeakPolarHBondContact O-CB 3.44Å; T1310-T1314 PolarHBondContact O-N 3.29Å; T1310-T1314 PolarHBondContact O-OG1 3.21Å
1311	F	92.9	Very high	91.3	Very high	49 Å²	49	52.1 Å²	52.1	22%	0.215	26%	0.264	C	S	.	.	H	α-helix	trans	-53.9	-63.1	175.5	169.3	-119.6	0	0	0	114.5	Y1247 I1250 F1307 W1308 L1313 T1314 V1315	Y1247-F1311 HydrophobicContact CD1-CB 4.32Å; Y1247-F1311 AromaticContact CD1-CD2 3.71Å; Y1247-F1311 HydrophobicContact CD1-CD2 3.71Å; Y1247-F1311 HydrophobicContact CD1-CG 4.5Å; Y1247-F1311 HydrophobicContact CE1-CB 3.64Å; Y1247-F1311 AromaticContact CE1-CD2 3.83Å; Y1247-F1311 HydrophobicContact CE1-CD2 3.83Å; Y1247-F1311 HydrophobicContact CE1-CG 4.19Å; I1250-F1311 HydrophobicContact CB-CE2 4.08Å; I1250-F1311 HydrophobicContact CD1-CE2 3.54Å; I1250-F1311 HydrophobicContact CD1-CZ 3.88Å; I1250-F1311 HydrophobicContact CG1-CE2 4.4Å; I1250-F1311 HydrophobicContact CG2-CE2 3.76Å; I1250-F1311 HydrophobicContact CG2-CZ 3.9Å; F1307-F1311 VanDerWaalsContact O-CB 3.22Å; F1307-F1311 WeakPolarHBondContact O-CB 3.31Å; F1307-F1311 PolarHBondContact O-N 3.35Å; F1307-F1311 VanDerWaalsContact O-N 3.13Å; W1308-F1311 HydrophobicContact CE3-CD1 4.46Å; F1311-L1313 VanDerWaalsContact C-N 3.3Å; F1311-L1313 PolarHBondContact O-N 2.99Å; F1311-T1314 PolarHBondContact O-N 3.19Å; F1311-V1315 HydrophobicContact CD2-CG2 3.92Å; F1311-V1315 HydrophobicContact CE2-CG2 3.64Å; F1311-V1315 HydrophobicContact CZ-CG2 4.37Å; F1311-V1315 WeakPolarHBondContact O-CG2 3.44Å; F1311-V1315 PolarHBondContact O-N 3.13Å
1312	P	93.6	Very high	91.4	Very high	70 Å²	70	52.2 Å²	52.2	46%	0.455	27%	0.265	S	S	.	.	H	α-helix	trans	-65.6	-34.6	-177.2	27.4	-35.3	0	0	0	111.9	W1308 F1309 F1316	W1308-P1312 WeakPolarHBondContact O-CD 3.41Å; F1309-P1312 WeakPolarHBondContact O-CD 3.44Å; P1312-F1316 VanDerWaalsContact O-CB 3.27Å; P1312-F1316 WeakPolarHBondContact O-CB 3.41Å; P1312-F1316 PolarHBondContact O-N 3.14Å
1313	L	93	Very high	91.5	Very high	85 Å²	85	53.7 Å²	53.7	45%	0.445	27%	0.269	S	S	.	.	H	α-helix	trans	-59.8	-50	175.2	-179	65.6	0	0	0	111.3	I1207 F1311 F1316 I1317	I1207-L1313 HydrophobicContact CG2-CD2 4.48Å; F1311-L1313 VanDerWaalsContact C-N 3.3Å; F1311-L1313 PolarHBondContact O-N 2.99Å; L1313-F1316 PolarHBondContact O-N 2.95Å; L1313-I1317 HydrophobicContact CD1-CD1 3.68Å; L1313-I1317 HydrophobicContact CD1-CG1 4.45Å; L1313-I1317 HydrophobicContact CG-CD1 3.99Å; L1313-I1317 WeakPolarHBondContact O-CG1 3.33Å; L1313-I1317 PolarHBondContact O-N 3.24Å
1314	T	94.6	Very high	91.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.6	-47.8	179.3	-53.9	0	0	0	0	111.2	I1203 T1204 I1207 Y1247 T1310 F1311 F1316 I1317 A1318	I1203-T1314 HydrophobicContact CG2-CG2 4.34Å; T1204-T1314 HydrophobicContact CG2-CG2 4.26Å; I1207-T1314 HydrophobicContact CB-CG2 4.33Å; I1207-T1314 HydrophobicContact CD1-CG2 4.48Å; I1207-T1314 WeakPolarHBondContact CG2-OG1 3.39Å; Y1247-T1314 HydrophobicContact CD2-CG2 3.99Å; Y1247-T1314 HydrophobicContact CG-CG2 4.32Å; T1310-T1314 WeakPolarHBondContact O-CB 3.44Å; T1310-T1314 PolarHBondContact O-N 3.29Å; T1310-T1314 PolarHBondContact O-OG1 3.21Å; F1311-T1314 PolarHBondContact O-N 3.19Å; T1314-F1316 VanDerWaalsContact C-N 3.35Å; T1314-F1316 PolarHBondContact O-N 3.45Å; T1314-I1317 PolarHBondContact O-N 2.91Å; T1314-A1318 VanDerWaalsContact O-CB 3.3Å; T1314-A1318 WeakPolarHBondContact O-CB 3.16Å; T1314-A1318 PolarHBondContact O-N 3.42Å
1315	V	94.2	Very high	92	Very high	16 Å²	16	59.4 Å²	59.4	10%	0.097	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-41	-179.1	168.3	0	0	0	0	111.9	I1250 I1254 F1311 N1319	I1250-V1315 HydrophobicContact CG2-CG2 4.18Å; I1254-V1315 HydrophobicContact CD1-CG1 3.41Å; I1254-V1315 VanDerWaalsContact CD1-CG1 3.41Å; F1311-V1315 HydrophobicContact CD2-CG2 3.92Å; F1311-V1315 HydrophobicContact CE2-CG2 3.64Å; F1311-V1315 HydrophobicContact CZ-CG2 4.37Å; F1311-V1315 WeakPolarHBondContact O-CG2 3.44Å; F1311-V1315 PolarHBondContact O-N 3.13Å; V1315-N1319 WeakPolarHBondContact O-CB 3.44Å; V1315-N1319 PolarHBondContact O-N 3.47Å; V1315-N1319 PolarHBondContact O-ND2 3.38Å
1316	F	94.5	Very high	92	Very high	141 Å²	141	56.5 Å²	56.5	62%	0.618	28%	0.278	S	S	*	.	H	α-helix	trans	-66.5	-50.3	177.8	-179.7	-99.6	0	0	0	111.7	P1312 L1313 T1314 A1318 N1319 A1320	P1312-F1316 VanDerWaalsContact O-CB 3.27Å; P1312-F1316 WeakPolarHBondContact O-CB 3.41Å; P1312-F1316 PolarHBondContact O-N 3.14Å; L1313-F1316 PolarHBondContact O-N 2.95Å; T1314-F1316 VanDerWaalsContact C-N 3.35Å; T1314-F1316 PolarHBondContact O-N 3.45Å; F1316-A1318 VanDerWaalsContact C-N 3.33Å; F1316-A1318 PolarHBondContact O-N 3.44Å; F1316-N1319 PolarHBondContact O-N 2.93Å; F1316-A1320 WeakPolarHBondContact O-CB 3.28Å; F1316-A1320 PolarHBondContact O-N 2.76Å
1317	I	95.5	Very high	91.8	Very high	57 Å²	57	59.5 Å²	59.5	29%	0.292	29%	0.291	S	S	.	.	H	α-helix	trans	-64.6	-37.9	-178.7	-66.2	170.4	0	0	0	111.4	W1199 I1203 I1207 L1313 T1314 N1319	W1199-I1317 HydrophobicContact CZ2-CG2 4.14Å; W1199-I1317 PolarHBondContact NE1-O 2.69Å; I1203-I1317 HydrophobicContact CD1-CG2 3.97Å; I1203-I1317 HydrophobicContact CG1-CG2 4.34Å; I1203-I1317 HydrophobicContact CG2-CB 4.26Å; I1203-I1317 HydrophobicContact CG2-CG2 3.94Å; I1207-I1317 HydrophobicContact CD1-CB 4.19Å; I1207-I1317 HydrophobicContact CD1-CD1 3.81Å; I1207-I1317 HydrophobicContact CD1-CG2 4.26Å; L1313-I1317 HydrophobicContact CD1-CD1 3.68Å; L1313-I1317 HydrophobicContact CD1-CG1 4.45Å; L1313-I1317 HydrophobicContact CG-CD1 3.99Å; L1313-I1317 WeakPolarHBondContact O-CG1 3.33Å; L1313-I1317 PolarHBondContact O-N 3.24Å; T1314-I1317 PolarHBondContact O-N 2.91Å; I1317-N1319 PolarHBondContact O-N 3.31Å
1318	A	95.3	Very high	91.6	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60	-46.1	174.5	0	0	0	0	0	111.4	W1199 H1200 I1203 T1314 F1316	W1199-A1318 VanDerWaalsContact CD1-O 3.3Å; W1199-A1318 PolarHBondContact NE1-O 3.44Å; H1200-A1318 PolarHBondContact NE2-O 2.92Å; I1203-A1318 HydrophobicContact CG2-CB 4.05Å; T1314-A1318 VanDerWaalsContact O-CB 3.3Å; T1314-A1318 WeakPolarHBondContact O-CB 3.16Å; T1314-A1318 PolarHBondContact O-N 3.42Å; F1316-A1318 VanDerWaalsContact C-N 3.33Å; F1316-A1318 PolarHBondContact O-N 3.44Å
1319	N	95	Very high	91.2	Very high	8 Å²	8	56.5 Å²	56.5	4%	0.043	30%	0.295	C	S	.	.	H	α-helix	trans	-87.5	-15.7	-173.4	-77.4	-80.1	0	0	0	115.5	S1251 R1255 I1258 V1315 F1316 I1317 G1322 L1323	S1251-N1319 PolarHBondContact O-ND2 3.45Å; S1251-N1319 PolarHBondContact O-OD1 2.62Å; R1255-N1319 VanDerWaalsContact CA-OD1 3.23Å; R1255-N1319 WeakPolarHBondContact CA-OD1 3.43Å; R1255-N1319 WeakPolarHBondContact CB-OD1 3.47Å; R1255-N1319 PolarHBondContact N-OD1 3.36Å; I1258-N1319 HydrophobicContact CD1-CB 3.73Å; V1315-N1319 WeakPolarHBondContact O-CB 3.44Å; V1315-N1319 PolarHBondContact O-N 3.47Å; V1315-N1319 PolarHBondContact O-ND2 3.38Å; F1316-N1319 PolarHBondContact O-N 2.93Å; I1317-N1319 PolarHBondContact O-N 3.31Å; N1319-G1322 PolarHBondContact O-N 3.45Å; N1319-G1322 VanDerWaalsContact O-N 3.16Å; N1319-L1323 PolarHBondContact O-N 2.88Å
1320	A	93.3	Very high	90.6	Very high	25 Å²	25	50.1 Å²	50.1	21%	0.207	27%	0.268	C	S	.	.	H	α-helix	trans	-56.4	-44	-174.8	0	0	0	0	0	114.3	F1316 G1322 L1323 L1324	F1316-A1320 WeakPolarHBondContact O-CB 3.28Å; F1316-A1320 PolarHBondContact O-N 2.76Å; A1320-G1322 PolarHBondContact O-N 3.29Å; A1320-L1323 PolarHBondContact O-N 2.68Å; A1320-L1324 WeakPolarHBondContact O-CG 3.19Å; A1320-L1324 PolarHBondContact O-N 3.01Å
1321	P	92.4	Very high	90	Very high	56 Å²	56	50.3 Å²	50.3	36%	0.364	27%	0.269	S	S	.	.	H	α-helix	trans	-62.9	-41.2	176.2	-23	35.4	0	0	0	112.7	W1199 L1323 L1324 W1325	W1199-P1321 HydrophobicContact CZ2-CG 4.28Å; P1321-L1323 PolarHBondContact O-N 2.97Å; P1321-L1324 PolarHBondContact O-N 2.93Å; P1321-W1325 WeakPolarHBondContact O-CB 3.35Å; P1321-W1325 PolarHBondContact O-N 2.94Å
1322	G	88.5	Confident	89.4	Confident	3 Å²	3	53.7 Å²	53.7	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-64.4	-37.6	177.5	0	0	0	0	0	113	N1319 A1320 R1326	N1319-G1322 PolarHBondContact O-N 3.45Å; N1319-G1322 VanDerWaalsContact O-N 3.16Å; A1320-G1322 PolarHBondContact O-N 3.29Å; G1322-R1326 WeakPolarHBondContact O-CB 3.21Å; G1322-R1326 PolarHBondContact O-N 3.49Å
1323	L	89.5	Confident	88.3	Confident	76 Å²	76	54.5 Å²	54.5	40%	0.398	27%	0.274	S	S	.	.	H	α-helix	trans	-67.3	-48	175.2	-177.7	63.2	0	0	0	111.9	I1258 N1319 A1320 P1321 W1325 R1326 L1327	I1258-L1323 HydrophobicContact CG2-CD1 4.14Å; N1319-L1323 PolarHBondContact O-N 2.88Å; A1320-L1323 PolarHBondContact O-N 2.68Å; P1321-L1323 PolarHBondContact O-N 2.97Å; L1323-W1325 PolarHBondContact O-N 3.3Å; L1323-R1326 PolarHBondContact O-N 3.4Å; L1323-R1326 VanDerWaalsContact O-N 3.17Å; L1323-L1327 WeakPolarHBondContact O-CG 3.35Å; L1323-L1327 PolarHBondContact O-N 3.38Å
1324	L	90.2	Very high	87.4	Confident	120 Å²	120	52.1 Å²	52.1	63%	0.628	26%	0.263	S	S	*	.	H	α-helix	trans	-60.5	-45.1	176.9	-71.3	171.8	0	0	0	111.6	A1320 P1321 R1326 L1327 A1328	A1320-L1324 WeakPolarHBondContact O-CG 3.19Å; A1320-L1324 PolarHBondContact O-N 3.01Å; P1321-L1324 PolarHBondContact O-N 2.93Å; L1324-R1326 VanDerWaalsContact C-N 3.31Å; L1324-R1326 PolarHBondContact O-N 2.97Å; L1324-L1327 PolarHBondContact O-N 2.98Å; L1324-A1328 PolarHBondContact O-N 3.14Å
1325	W	88.6	Confident	86.3	Confident	125 Å²	125	52.6 Å²	52.6	47%	0.473	27%	0.266	S	S	.	.	H	α-helix	trans	-59.6	-41.1	174.3	178	-98.1	0	0	0	112.1	L1192 P1321 L1323 A1328 S1329	L1192-W1325 HydrophobicContact CD1-CH2 4.41Å; L1192-W1325 HydrophobicContact CD1-CZ2 4.27Å; P1321-W1325 WeakPolarHBondContact O-CB 3.35Å; P1321-W1325 PolarHBondContact O-N 2.94Å; L1323-W1325 PolarHBondContact O-N 3.3Å; W1325-A1328 PolarHBondContact O-N 3.2Å; W1325-S1329 VanDerWaalsContact O-CB 3.27Å; W1325-S1329 WeakPolarHBondContact O-CB 3.34Å; W1325-S1329 PolarHBondContact O-N 2.91Å
1326	R	86.7	Confident	85.4	Confident	17 Å²	17	56 Å²	56	6%	0.064	28%	0.28	C	S	.	.	H	α-helix	trans	-63.9	-43.8	178.7	177.7	54.9	-177.7	-104.2	-41	112.1	I1258 W1259 T1260 G1322 L1323 L1324 S1329 D1330	I1258-R1326 HydrophobicContact CG2-CB 4.24Å; I1258-R1326 HydrophobicContact CG2-CG 4.46Å; W1259-R1326 PolarHBondContact O-NH1 3.45Å; W1259-R1326 PolarHBondContact O-NH2 3.42Å; T1260-R1326 PolarHBondContact O-NH2 2.98Å; T1260-R1326 VanDerWaalsContact O-NH2 3.09Å; G1322-R1326 WeakPolarHBondContact O-CB 3.21Å; G1322-R1326 PolarHBondContact O-N 3.49Å; L1323-R1326 PolarHBondContact O-N 3.4Å; L1323-R1326 VanDerWaalsContact O-N 3.17Å; L1324-R1326 VanDerWaalsContact C-N 3.31Å; L1324-R1326 PolarHBondContact O-N 2.97Å; R1326-S1329 PolarHBondContact O-N 3.48Å; R1326-D1330 IonicContact CZ-OD2 2.75Å; R1326-D1330 VanDerWaalsContact NE-CG 3.32Å; R1326-D1330 IonicContact NE-OD1 3.59Å; R1326-D1330 PolarHBondContact NE-OD1 3.01Å; R1326-D1330 IonicContact NE-OD2 3.05Å; R1326-D1330 PolarHBondContact NE-OD2 3.37Å; R1326-D1330 IonicContact NH2-OD2 3.69Å; R1326-D1330 PolarHBondContact O-N 2.94Å
1327	L	86.2	Confident	84.2	Confident	88 Å²	88	51.3 Å²	51.3	46%	0.461	26%	0.26	S	S	.	.	H	α-helix	trans	-62	-45.6	175.9	-67.6	169.5	0	0	0	111.4	L1323 L1324 S1329 T1331	L1323-L1327 WeakPolarHBondContact O-CG 3.35Å; L1323-L1327 PolarHBondContact O-N 3.38Å; L1324-L1327 PolarHBondContact O-N 2.98Å; L1327-S1329 VanDerWaalsContact C-N 3.34Å; L1327-S1329 PolarHBondContact O-N 3.22Å; L1327-T1331 WeakPolarHBondContact O-CB 3.27Å; L1327-T1331 VanDerWaalsContact O-CG2 3.32Å; L1327-T1331 WeakPolarHBondContact O-CG2 3.35Å; L1327-T1331 PolarHBondContact O-N 3.45Å; L1327-T1331 VanDerWaalsContact O-N 3.11Å; L1327-T1331 PolarHBondContact O-OG1 3.24Å
1328	A	85.4	Confident	83	Confident	55 Å²	55	50 Å²	50	46%	0.455	25%	0.253	S	S	.	.	H	α-helix	trans	-63.4	-36.8	175.7	0	0	0	0	0	113	L1324 W1325 T1331 W1332	L1324-A1328 PolarHBondContact O-N 3.14Å; W1325-A1328 PolarHBondContact O-N 3.2Å; A1328-T1331 WeakPolarHBondContact CA-OG1 3.01Å; A1328-T1331 PolarHBondContact O-OG1 3.13Å; A1328-W1332 VanDerWaalsContact O-CB 3.29Å; A1328-W1332 WeakPolarHBondContact O-CB 3.43Å; A1328-W1332 PolarHBondContact O-N 3.4Å; A1328-W1332 VanDerWaalsContact O-N 3.16Å
1329	S	82.7	Confident	81.7	Confident	26 Å²	26	50.7 Å²	50.7	18%	0.182	26%	0.257	C	S	.	.	H	α-helix	trans	-69.9	-50.3	177.4	171.4	0	0	0	0	112.2	W1325 R1326 L1327 T1331 W1332 W1333	W1325-S1329 VanDerWaalsContact O-CB 3.27Å; W1325-S1329 WeakPolarHBondContact O-CB 3.34Å; W1325-S1329 PolarHBondContact O-N 2.91Å; R1326-S1329 PolarHBondContact O-N 3.48Å; L1327-S1329 VanDerWaalsContact C-N 3.34Å; L1327-S1329 PolarHBondContact O-N 3.22Å; S1329-T1331 PolarHBondContact O-N 2.93Å; S1329-W1332 PolarHBondContact O-N 3.23Å; S1329-W1333 PolarHBondContact O-N 3.4Å
1330	D	79.4	Confident	80.3	Confident	25 Å²	25	54.2 Å²	54.2	13%	0.134	27%	0.272	C	S	.	.	H	α-helix	trans	-65.1	-39.5	-178	-86.9	-7.6	0	0	0	111.5	K1261 R1326 W1333 T1334 R1366	K1261-D1330 WeakPolarHBondContact CE-OD1 3.34Å; K1261-D1330 IonicContact NZ-OD1 2.83Å; K1261-D1330 PolarHBondContact NZ-OD1 3.18Å; K1261-D1330 IonicContact NZ-OD2 3.59Å; R1326-D1330 IonicContact CZ-OD2 2.75Å; R1326-D1330 VanDerWaalsContact NE-CG 3.32Å; R1326-D1330 IonicContact NE-OD1 3.59Å; R1326-D1330 PolarHBondContact NE-OD1 3.01Å; R1326-D1330 IonicContact NE-OD2 3.05Å; R1326-D1330 PolarHBondContact NE-OD2 3.37Å; R1326-D1330 IonicContact NH2-OD2 3.69Å; R1326-D1330 PolarHBondContact O-N 2.94Å; D1330-W1333 PolarHBondContact O-N 2.93Å; D1330-T1334 PolarHBondContact O-N 3.36Å; D1330-T1334 PolarHBondContact O-OG1 2.99Å; D1330-R1366 IonicContact OD2-CZ 3.85Å; D1330-R1366 IonicContact OD2-NH1 2.69Å; D1330-R1366 PolarHBondContact OD2-NH1 3.1Å
1331	T	77.6	Confident	79	Confident	14 Å²	14	58.2 Å²	58.2	9%	0.086	29%	0.29	C	S	.	.	H	α-helix	trans	-61.8	-45.3	173.5	48.4	0	0	0	0	112.8	L1327 A1328 S1329 W1333 T1334 I1335 L1362	L1327-T1331 WeakPolarHBondContact O-CB 3.27Å; L1327-T1331 VanDerWaalsContact O-CG2 3.32Å; L1327-T1331 WeakPolarHBondContact O-CG2 3.35Å; L1327-T1331 PolarHBondContact O-N 3.45Å; L1327-T1331 VanDerWaalsContact O-N 3.11Å; L1327-T1331 PolarHBondContact O-OG1 3.24Å; A1328-T1331 WeakPolarHBondContact CA-OG1 3.01Å; A1328-T1331 PolarHBondContact O-OG1 3.13Å; S1329-T1331 PolarHBondContact O-N 2.93Å; T1331-W1333 VanDerWaalsContact C-N 3.3Å; T1331-W1333 PolarHBondContact O-N 3.18Å; T1331-T1334 PolarHBondContact O-N 2.87Å; T1331-I1335 VanDerWaalsContact O-CG1 3.31Å; T1331-I1335 WeakPolarHBondContact O-CG1 3.25Å; T1331-I1335 PolarHBondContact O-N 3.39Å; T1331-I1335 VanDerWaalsContact O-N 3.1Å; T1331-L1362 VanDerWaalsContact CG2-CA 3.41Å; T1331-L1362 HydrophobicContact CG2-CB 3.72Å; T1331-L1362 HydrophobicContact CG2-CD1 4.44Å; T1331-L1362 HydrophobicContact CG2-CG 3.97Å
1332	W	80.6	Confident	77.7	Confident	121 Å²	121	56.4 Å²	56.4	46%	0.458	28%	0.277	S	S	.	.	H	α-helix	trans	-58.8	-41	174.6	-178.3	88.9	0	0	0	112.1	A1328 S1329 F1336	A1328-W1332 VanDerWaalsContact O-CB 3.29Å; A1328-W1332 WeakPolarHBondContact O-CB 3.43Å; A1328-W1332 PolarHBondContact O-N 3.4Å; A1328-W1332 VanDerWaalsContact O-N 3.16Å; S1329-W1332 PolarHBondContact O-N 3.23Å; W1332-F1336 HydrophobicContact CH2-CD2 4.31Å; W1332-F1336 HydrophobicContact CH2-CG 4.35Å; W1332-F1336 HydrophobicContact CZ2-CD2 4.37Å; W1332-F1336 VanDerWaalsContact O-CB 3.25Å; W1332-F1336 WeakPolarHBondContact O-CB 3.33Å; W1332-F1336 PolarHBondContact O-N 3.19Å
1333	W	72.2	Confident	76.4	Confident	86 Å²	86	62 Å²	62	33%	0.326	31%	0.313	S	S	.	.	H	α-helix	trans	-66.5	-44.8	177.8	-85.4	110.6	0	0	0	113.2	A1178 S1329 D1330 T1331 I1335 F1336 I1337	A1178-W1333 HydrophobicContact CB-CH2 4.04Å; A1178-W1333 HydrophobicContact CB-CZ3 4.48Å; S1329-W1333 PolarHBondContact O-N 3.4Å; D1330-W1333 PolarHBondContact O-N 2.93Å; T1331-W1333 VanDerWaalsContact C-N 3.3Å; T1331-W1333 PolarHBondContact O-N 3.18Å; W1333-I1335 PolarHBondContact O-N 3.09Å; W1333-F1336 HydrophobicContact CE3-CD1 4.06Å; W1333-F1336 AromaticContact CZ3-CD1 3.91Å; W1333-F1336 HydrophobicContact CZ3-CD1 3.91Å; W1333-F1336 HydrophobicContact CZ3-CE1 4.18Å; W1333-F1336 PolarHBondContact O-N 3.4Å; W1333-I1337 VanDerWaalsContact O-CG1 3.28Å; W1333-I1337 WeakPolarHBondContact O-CG1 3.38Å; W1333-I1337 PolarHBondContact O-N 3.37Å
1334	T	73.4	Confident	75.2	Confident	35 Å²	35	65.3 Å²	65.3	22%	0.215	32%	0.324	C	S	.	.	H	α-helix	trans	-58.5	-49.9	176.6	-63.8	0	0	0	0	110.6	D1330 T1331 F1336 I1337 E1338 G1365 I1373	D1330-T1334 PolarHBondContact O-N 3.36Å; D1330-T1334 PolarHBondContact O-OG1 2.99Å; T1331-T1334 PolarHBondContact O-N 2.87Å; T1334-F1336 VanDerWaalsContact C-N 3.35Å; T1334-F1336 PolarHBondContact O-N 3.29Å; T1334-I1337 PolarHBondContact O-N 2.93Å; T1334-E1338 PolarHBondContact O-N 3.06Å; T1334-E1338 VanDerWaalsContact O-N 3.12Å; T1334-G1365 WeakPolarHBondContact CG2-O 3.18Å; T1334-G1365 PolarHBondContact OG1-O 2.91Å; T1334-I1373 HydrophobicContact CG2-CD1 3.68Å
1335	I	72	Confident	73.8	Confident	10 Å²	10	63.4 Å²	63.4	5%	0.051	32%	0.321	C	S	.	.	H	α-helix	trans	-57.8	-47.3	175.9	-65.5	168.8	0	0	0	110.5	T1331 W1333 I1337 E1338 M1339 W1358 A1361	T1331-I1335 VanDerWaalsContact O-CG1 3.31Å; T1331-I1335 WeakPolarHBondContact O-CG1 3.25Å; T1331-I1335 PolarHBondContact O-N 3.39Å; T1331-I1335 VanDerWaalsContact O-N 3.1Å; W1333-I1335 PolarHBondContact O-N 3.09Å; I1335-I1337 VanDerWaalsContact C-N 3.33Å; I1335-I1337 PolarHBondContact O-N 3.04Å; I1335-E1338 PolarHBondContact O-N 2.71Å; I1335-M1339 HydrophobicContact CG2-CE 3.54Å; I1335-M1339 HydrophobicContact CG2-CG 3.78Å; I1335-M1339 VanDerWaalsContact O-CB 3.23Å; I1335-M1339 WeakPolarHBondContact O-CB 3.3Å; I1335-M1339 WeakPolarHBondContact O-CG 3.49Å; I1335-M1339 PolarHBondContact O-N 2.73Å; I1335-W1358 HydrophobicContact CD1-CD2 3.47Å; I1335-W1358 VanDerWaalsContact CD1-CD2 3.47Å; I1335-W1358 HydrophobicContact CD1-CE3 3.49Å; I1335-W1358 VanDerWaalsContact CD1-CE3 3.49Å; I1335-W1358 HydrophobicContact CD1-CG 3.94Å; I1335-W1358 HydrophobicContact CD1-CH2 4.34Å; I1335-W1358 HydrophobicContact CD1-CZ2 4.3Å; I1335-W1358 HydrophobicContact CD1-CZ3 3.95Å; I1335-A1361 HydrophobicContact CD1-CB 3.85Å; I1335-A1361 HydrophobicContact CG1-CB 3.57Å
1336	F	73.9	Confident	72.8	Confident	88 Å²	88	63 Å²	63	39%	0.386	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-39.6	-178.9	178.3	-98.4	0	0	0	113.1	W1332 W1333 T1334 K1340	W1332-F1336 HydrophobicContact CH2-CD2 4.31Å; W1332-F1336 HydrophobicContact CH2-CG 4.35Å; W1332-F1336 HydrophobicContact CZ2-CD2 4.37Å; W1332-F1336 VanDerWaalsContact O-CB 3.25Å; W1332-F1336 WeakPolarHBondContact O-CB 3.33Å; W1332-F1336 PolarHBondContact O-N 3.19Å; W1333-F1336 HydrophobicContact CE3-CD1 4.06Å; W1333-F1336 AromaticContact CZ3-CD1 3.91Å; W1333-F1336 HydrophobicContact CZ3-CD1 3.91Å; W1333-F1336 HydrophobicContact CZ3-CE1 4.18Å; W1333-F1336 PolarHBondContact O-N 3.4Å; T1334-F1336 VanDerWaalsContact C-N 3.35Å; T1334-F1336 PolarHBondContact O-N 3.29Å; F1336-K1340 PolarHBondContact O-N 3.03Å
1337	I	69.2	Low	71.8	Confident	42 Å²	42	67.3 Å²	67.3	22%	0.215	35%	0.347	C	S	.	.	H	α-helix	trans	-66.7	-47.7	178.8	-69.4	165.3	0	0	0	110.5	W1333 T1334 I1335 K1340	W1333-I1337 VanDerWaalsContact O-CG1 3.28Å; W1333-I1337 WeakPolarHBondContact O-CG1 3.38Å; W1333-I1337 PolarHBondContact O-N 3.37Å; T1334-I1337 PolarHBondContact O-N 2.93Å; I1335-I1337 VanDerWaalsContact C-N 3.33Å; I1335-I1337 PolarHBondContact O-N 3.04Å; I1337-K1340 WeakPolarHBondContact O-CB 3.29Å; I1337-K1340 PolarHBondContact O-N 3.37Å
1338	E	70.1	Confident	71	Confident	31 Å²	31	67.1 Å²	67.1	15%	0.145	34%	0.341	C	S	.	.	H	α-helix	trans	-66.6	-44.2	177.9	-70.7	-167.4	136.8	0	0	112.9	T1334 I1335 K1340 N1341 I1373 L1374	T1334-E1338 PolarHBondContact O-N 3.06Å; T1334-E1338 VanDerWaalsContact O-N 3.12Å; I1335-E1338 PolarHBondContact O-N 2.71Å; E1338-K1340 PolarHBondContact O-N 2.78Å; E1338-N1341 WeakPolarHBondContact O-CB 3.38Å; E1338-N1341 PolarHBondContact O-N 3.37Å; E1338-I1373 WeakPolarHBondContact OE1-CB 3.44Å; E1338-I1373 WeakPolarHBondContact OE1-CG1 3.49Å; E1338-I1373 PolarHBondContact OE1-N 3.01Å; E1338-I1373 WeakPolarHBondContact OE2-CB 3.33Å; E1338-L1374 HydrophobicContact CB-CD1 4.14Å
1339	M	68.4	Low	70.3	Confident	14 Å²	14	71.4 Å²	71.4	7%	0.069	35%	0.349	C	S	.	.	H	α-helix	trans	-56.4	-25.7	178.2	-72.4	-79.4	178.4	0	0	112.5	I1335 N1341 V1342 R1348 Y1351 I1352	I1335-M1339 HydrophobicContact CG2-CE 3.54Å; I1335-M1339 HydrophobicContact CG2-CG 3.78Å; I1335-M1339 VanDerWaalsContact O-CB 3.23Å; I1335-M1339 WeakPolarHBondContact O-CB 3.3Å; I1335-M1339 WeakPolarHBondContact O-CG 3.49Å; I1335-M1339 PolarHBondContact O-N 2.73Å; M1339-N1341 VanDerWaalsContact C-N 3.35Å; M1339-V1342 PolarHBondContact O-N 3.26Å; M1339-R1348 WeakPolarHBondContact O-CD 3.49Å; M1339-R1348 PolarHBondContact O-NE 3.02Å; M1339-R1348 PolarHBondContact O-NH2 3.13Å; M1339-R1348 HydrophobicContact SD-CB 4.24Å; M1339-R1348 HydrophobicContact SD-CG 4.47Å; M1339-Y1351 VanDerWaalsContact CE-CB 3.4Å; M1339-I1352 HydrophobicContact CE-CB 4.45Å; M1339-I1352 HydrophobicContact CE-CG1 3.58Å; M1339-I1352 HydrophobicContact SD-CD1 4.33Å; M1339-I1352 HydrophobicContact SD-CG1 3.84Å
1340	K	66.4	Low	70	Confident	82 Å²	82	76.5 Å²	76.5	36%	0.357	37%	0.368	S	S	.	.	H	α-helix	trans	-72.3	-29.1	177.9	-153.8	177.1	-178.6	-177	0	112.8	Y1174 F1336 I1337 E1338 R1348	Y1174-K1340 VanDerWaalsContact CB-NZ 3.32Å; Y1174-K1340 HydrophobicContact CD1-CD 4.42Å; Y1174-K1340 HydrophobicContact CD2-CD 3.88Å; Y1174-K1340 HydrophobicContact CE1-CD 4.12Å; Y1174-K1340 HydrophobicContact CE2-CD 3.55Å; Y1174-K1340 HydrophobicContact CG-CD 4.31Å; F1336-K1340 PolarHBondContact O-N 3.03Å; I1337-K1340 WeakPolarHBondContact O-CB 3.29Å; I1337-K1340 PolarHBondContact O-N 3.37Å; E1338-K1340 PolarHBondContact O-N 2.78Å; K1340-R1348 PolarHBondContact O-NH2 3.34Å
1341	N	64.9	Low	69.7	Low	109 Å²	109	77.8 Å²	77.8	58%	0.583	37%	0.371	S	S	*	.	H	α-helix	trans	-73.2	-26.4	175.3	-65	-5.3	0	0	0	112.3	E1338 M1339 P1343	E1338-N1341 WeakPolarHBondContact O-CB 3.38Å; E1338-N1341 PolarHBondContact O-N 3.37Å; M1339-N1341 VanDerWaalsContact C-N 3.35Å; N1341-P1343 VanDerWaalsContact O-CD 3.3Å; N1341-P1343 WeakPolarHBondContact O-CD 3.47Å
1342	V	65.2	Low	69.5	Low	18 Å²	18	81.4 Å²	81.4	11%	0.109	39%	0.389	C	S	.	.			trans	-70.8	115.7	179.3	-179.7	0	0	0	0	110.5	M1339 K1347 R1348 L1374	M1339-V1342 PolarHBondContact O-N 3.26Å; V1342-K1347 HydrophobicContact CG1-CB 3.79Å; V1342-R1348 HydrophobicContact CB-CG 4Å; V1342-R1348 HydrophobicContact CG1-CG 4Å; V1342-R1348 PolarHBondContact O-NE 3.09Å; V1342-R1348 PolarHBondContact O-NH2 3.05Å; V1342-L1374 HydrophobicContact CG2-CD1 3.64Å
1343	P	61	Low	69.3	Low	120 Å²	120	84.4 Å²	84.4	78%	0.779	41%	0.406	S	S	*	.			trans	-73.2	-34.9	-173.1	26.2	-33.9	0	0	0	113.8	N1341	N1341-P1343 VanDerWaalsContact O-CD 3.3Å; N1341-P1343 WeakPolarHBondContact O-CD 3.47Å
1344	K	64.5	Low	69.7	Low	145 Å²	145	82.4 Å²	82.4	63%	0.63	40%	0.401	S	S	*	.			trans	-86.2	122.4	-173.8	-66.5	-175.4	178.2	-178.7	0	112.1	N1346 K1347 R1348	K1344-N1346 VanDerWaalsContact C-N 3.31Å; K1344-N1346 PolarHBondContact O-N 3.28Å; K1344-K1347 HydrophobicContact CB-CB 4.33Å; K1344-K1347 HydrophobicContact CB-CG 4.34Å; K1344-K1347 PolarHBondContact O-N 3.38Å; K1344-R1348 PolarHBondContact O-N 2.81Å
1345	S	62.3	Low	70	Confident	80 Å²	80	85.3 Å²	85.3	56%	0.559	42%	0.421	S	S	*	.	H	α-helix	trans	-57.4	-38.1	178.5	53.1	0	0	0	0	113.7	R1348 K1349	S1345-R1348 WeakPolarHBondContact O-CB 3.26Å; S1345-R1348 PolarHBondContact O-N 2.6Å; S1345-K1349 PolarHBondContact O-N 2.81Å; S1345-K1349 VanDerWaalsContact O-N 3.12Å
1346	N	67	Low	70.3	Confident	117 Å²	117	89.9 Å²	89.9	63%	0.626	44%	0.444	S	S	*	.	H	α-helix	trans	-68.3	-39.5	178.6	-68.3	-6.4	0	0	0	112.1	K1344 R1348 K1349 F1350	K1344-N1346 VanDerWaalsContact C-N 3.31Å; K1344-N1346 PolarHBondContact O-N 3.28Å; N1346-R1348 PolarHBondContact O-N 3.26Å; N1346-K1349 PolarHBondContact O-N 2.83Å; N1346-F1350 PolarHBondContact O-N 3.48Å; N1346-F1350 VanDerWaalsContact O-N 3.16Å
1347	K	65.3	Low	70.3	Confident	108 Å²	108	86.3 Å²	86.3	47%	0.47	43%	0.43	S	S	.	.	H	α-helix	trans	-60.8	-42.9	172.3	-76.6	-161.7	172.6	-165.4	0	111	V1342 K1344 K1349 F1350 Y1351	V1342-K1347 HydrophobicContact CG1-CB 3.79Å; K1344-K1347 HydrophobicContact CB-CB 4.33Å; K1344-K1347 HydrophobicContact CB-CG 4.34Å; K1344-K1347 PolarHBondContact O-N 3.38Å; K1347-K1349 PolarHBondContact O-N 2.86Å; K1347-F1350 WeakPolarHBondContact O-CB 3.38Å; K1347-F1350 PolarHBondContact O-N 3.19Å; K1347-Y1351 HydrophobicContact CB-CE2 4.25Å; K1347-Y1351 WeakPolarHBondContact O-CD2 3.29Å; K1347-Y1351 PolarHBondContact O-N 3Å; K1347-Y1351 VanDerWaalsContact O-N 3.1Å
1348	R	69.1	Low	70.7	Confident	84 Å²	84	89 Å²	89	32%	0.317	44%	0.438	S	S	.	.	H	α-helix	trans	-57	-46.5	174.9	-63.2	-179.7	-170.7	-156.4	-7.6	112.3	M1339 K1340 V1342 K1344 S1345 N1346 F1350 Y1351 I1352	M1339-R1348 WeakPolarHBondContact O-CD 3.49Å; M1339-R1348 PolarHBondContact O-NE 3.02Å; M1339-R1348 PolarHBondContact O-NH2 3.13Å; M1339-R1348 HydrophobicContact SD-CB 4.24Å; M1339-R1348 HydrophobicContact SD-CG 4.47Å; K1340-R1348 PolarHBondContact O-NH2 3.34Å; V1342-R1348 HydrophobicContact CB-CG 4Å; V1342-R1348 HydrophobicContact CG1-CG 4Å; V1342-R1348 PolarHBondContact O-NE 3.09Å; V1342-R1348 PolarHBondContact O-NH2 3.05Å; K1344-R1348 PolarHBondContact O-N 2.81Å; S1345-R1348 WeakPolarHBondContact O-CB 3.26Å; S1345-R1348 PolarHBondContact O-N 2.6Å; N1346-R1348 PolarHBondContact O-N 3.26Å; R1348-F1350 VanDerWaalsContact C-N 3.29Å; R1348-F1350 PolarHBondContact O-N 2.95Å; R1348-Y1351 PolarHBondContact O-N 3.45Å; R1348-I1352 WeakPolarHBondContact O-CB 3.07Å; R1348-I1352 WeakPolarHBondContact O-CD1 3.31Å; R1348-I1352 VanDerWaalsContact O-CG1 3.23Å; R1348-I1352 WeakPolarHBondContact O-CG1 3.4Å; R1348-I1352 PolarHBondContact O-N 3.08Å
1349	K	72.3	Confident	71.1	Confident	144 Å²	144	92.6 Å²	92.6	63%	0.626	46%	0.457	S	S	*	.	H	α-helix	trans	-60.2	-37.3	177.8	-74.3	-177.9	177	179.8	0	112.7	S1345 N1346 K1347 K1353	S1345-K1349 PolarHBondContact O-N 2.81Å; S1345-K1349 VanDerWaalsContact O-N 3.12Å; N1346-K1349 PolarHBondContact O-N 2.83Å; K1347-K1349 PolarHBondContact O-N 2.86Å; K1349-K1353 PolarHBondContact O-N 2.97Å
1350	F	76.1	Confident	71.3	Confident	133 Å²	133	96.4 Å²	96.4	58%	0.583	47%	0.471	S	S	*	.	H	α-helix	trans	-65.1	-53.3	176.5	176.5	-97.8	0	0	0	111.7	N1346 K1347 R1348 I1352 K1353 N1354	N1346-F1350 PolarHBondContact O-N 3.48Å; N1346-F1350 VanDerWaalsContact O-N 3.16Å; K1347-F1350 WeakPolarHBondContact O-CB 3.38Å; K1347-F1350 PolarHBondContact O-N 3.19Å; R1348-F1350 VanDerWaalsContact C-N 3.29Å; R1348-F1350 PolarHBondContact O-N 2.95Å; F1350-I1352 VanDerWaalsContact C-N 3.34Å; F1350-I1352 PolarHBondContact O-N 2.98Å; F1350-K1353 PolarHBondContact O-N 2.99Å; F1350-N1354 PolarHBondContact O-N 2.93Å
1351	Y	71.4	Confident	71.6	Confident	53 Å²	53	92.7 Å²	92.7	21%	0.208	46%	0.456	C	S	.	.	H	α-helix	trans	-62.6	-37.4	-179.7	-67.3	-65.6	0	0	0	112.7	M1339 K1347 R1348 K1353 N1354 V1357 L1374	M1339-Y1351 VanDerWaalsContact CE-CB 3.4Å; K1347-Y1351 HydrophobicContact CB-CE2 4.25Å; K1347-Y1351 WeakPolarHBondContact O-CD2 3.29Å; K1347-Y1351 PolarHBondContact O-N 3Å; K1347-Y1351 VanDerWaalsContact O-N 3.1Å; R1348-Y1351 PolarHBondContact O-N 3.45Å; Y1351-K1353 VanDerWaalsContact C-N 3.27Å; Y1351-K1353 PolarHBondContact O-N 3.15Å; Y1351-N1354 PolarHBondContact O-N 2.9Å; Y1351-V1357 HydrophobicContact CD1-CG2 4.02Å; Y1351-L1374 HydrophobicContact CD1-CD2 3.67Å; Y1351-L1374 HydrophobicContact CD2-CD2 4.23Å; Y1351-L1374 HydrophobicContact CE1-CD2 3.79Å; Y1351-L1374 HydrophobicContact CE2-CD2 4.35Å; Y1351-L1374 HydrophobicContact CG-CD2 3.9Å
1352	I	73.6	Confident	72.1	Confident	90 Å²	90	92.6 Å²	92.6	46%	0.462	45%	0.454	S	S	.	.	H	α-helix	trans	-62.1	-35.2	178.1	-71.1	166.9	0	0	0	111.9	M1339 R1348 F1350 W1358	M1339-I1352 HydrophobicContact CE-CB 4.45Å; M1339-I1352 HydrophobicContact CE-CG1 3.58Å; M1339-I1352 HydrophobicContact SD-CD1 4.33Å; M1339-I1352 HydrophobicContact SD-CG1 3.84Å; R1348-I1352 WeakPolarHBondContact O-CB 3.07Å; R1348-I1352 WeakPolarHBondContact O-CD1 3.31Å; R1348-I1352 VanDerWaalsContact O-CG1 3.23Å; R1348-I1352 WeakPolarHBondContact O-CG1 3.4Å; R1348-I1352 PolarHBondContact O-N 3.08Å; F1350-I1352 VanDerWaalsContact C-N 3.34Å; F1350-I1352 PolarHBondContact O-N 2.98Å; I1352-W1358 PolarHBondContact O-NE1 3.37Å
1353	K	77.9	Confident	72.5	Confident	184 Å²	184	96 Å²	96	80%	0.8	48%	0.475	S	S	*	.	H	α-helix	trans	-79.9	-13.2	179	-77.3	-169.8	172	-164.3	0	114	K1349 F1350 Y1351 P1355	K1349-K1353 PolarHBondContact O-N 2.97Å; F1350-K1353 PolarHBondContact O-N 2.99Å; Y1351-K1353 VanDerWaalsContact C-N 3.27Å; Y1351-K1353 PolarHBondContact O-N 3.15Å; K1353-P1355 WeakPolarHBondContact O-CD 3.37Å
1354	N	79.1	Confident	72.7	Confident	43 Å²	43	97 Å²	97	23%	0.23	46%	0.464	C	S	.	.			trans	-90.6	112.5	-171.3	-171.7	-18.6	0	0	0	110.8	F1350 Y1351 L1356 V1357	F1350-N1354 PolarHBondContact O-N 2.93Å; Y1351-N1354 PolarHBondContact O-N 2.9Å; N1354-L1356 PolarHBondContact O-N 3.02Å; N1354-L1356 WeakPolarHBondContact OD1-CB 3.18Å; N1354-L1356 PolarHBondContact OD1-N 3.32Å; N1354-L1356 VanDerWaalsContact OD1-N 3.15Å; N1354-V1357 HydrophobicContact CB-CG2 3.93Å; N1354-V1357 WeakPolarHBondContact O-CB 3.45Å; N1354-V1357 PolarHBondContact O-N 2.94Å; N1354-V1357 VanDerWaalsContact O-N 3.08Å
1355	P	80.1	Confident	72.4	Confident	97 Å²	97	91 Å²	91	63%	0.63	44%	0.443	S	S	*	.	H	α-helix	trans	-64.2	-25.7	-176.1	26.9	-35.2	0	0	0	113	K1353 V1357 W1358 L1359	K1353-P1355 WeakPolarHBondContact O-CD 3.37Å; P1355-V1357 VanDerWaalsContact C-N 3.25Å; P1355-V1357 PolarHBondContact O-N 2.84Å; P1355-W1358 PolarHBondContact O-N 2.87Å; P1355-L1359 PolarHBondContact O-N 2.86Å
1356	L	77.6	Confident	72	Confident	105 Å²	105	94.2 Å²	94.2	55%	0.55	44%	0.443	S	S	.	.	H	α-helix	trans	-65	-29.3	175.8	-68.2	166.2	0	0	0	112.5	N1354 R1360	N1354-L1356 PolarHBondContact O-N 3.02Å; N1354-L1356 WeakPolarHBondContact OD1-CB 3.18Å; N1354-L1356 PolarHBondContact OD1-N 3.32Å; N1354-L1356 VanDerWaalsContact OD1-N 3.15Å; L1356-R1360 WeakPolarHBondContact O-CB 3.4Å; L1356-R1360 WeakPolarHBondContact O-CG 3.42Å; L1356-R1360 PolarHBondContact O-N 3.43Å
1357	V	74.5	Confident	71.3	Confident	14 Å²	14	93 Å²	93	9%	0.085	44%	0.439	C	S	.	.	H	α-helix	trans	-70.6	-40.5	175.4	180	0	0	0	0	110.1	Y1351 N1354 P1355 A1361 L1374	Y1351-V1357 HydrophobicContact CD1-CG2 4.02Å; N1354-V1357 HydrophobicContact CB-CG2 3.93Å; N1354-V1357 WeakPolarHBondContact O-CB 3.45Å; N1354-V1357 PolarHBondContact O-N 2.94Å; N1354-V1357 VanDerWaalsContact O-N 3.08Å; P1355-V1357 VanDerWaalsContact C-N 3.25Å; P1355-V1357 PolarHBondContact O-N 2.84Å; V1357-A1361 VanDerWaalsContact O-CB 3.31Å; V1357-A1361 WeakPolarHBondContact O-CB 3.44Å; V1357-A1361 PolarHBondContact O-N 2.79Å; V1357-L1374 HydrophobicContact CG1-CD2 4.41Å
1358	W	78	Confident	70.6	Confident	98 Å²	98	91.7 Å²	91.7	37%	0.371	46%	0.457	S	S	.	.	H	α-helix	trans	-65.2	-44.1	174.3	-73.9	87.2	0	0	0	112.1	I1335 I1352 P1355 A1361 L1362	I1335-W1358 HydrophobicContact CD1-CD2 3.47Å; I1335-W1358 VanDerWaalsContact CD1-CD2 3.47Å; I1335-W1358 HydrophobicContact CD1-CE3 3.49Å; I1335-W1358 VanDerWaalsContact CD1-CE3 3.49Å; I1335-W1358 HydrophobicContact CD1-CG 3.94Å; I1335-W1358 HydrophobicContact CD1-CH2 4.34Å; I1335-W1358 HydrophobicContact CD1-CZ2 4.3Å; I1335-W1358 HydrophobicContact CD1-CZ3 3.95Å; I1352-W1358 PolarHBondContact O-NE1 3.37Å; P1355-W1358 PolarHBondContact O-N 2.87Å; W1358-A1361 PolarHBondContact O-N 2.68Å; W1358-L1362 WeakPolarHBondContact O-CB 3.39Å; W1358-L1362 PolarHBondContact O-N 3.06Å
1359	L	77.8	Confident	69.3	Low	107 Å²	107	96.8 Å²	96.8	56%	0.56	48%	0.476	S	S	*	.	H	α-helix	trans	-61.8	-46.6	175.7	-167.6	77.2	0	0	0	111.4	P1355 A1361 L1362 V1363	P1355-L1359 PolarHBondContact O-N 2.86Å; L1359-A1361 PolarHBondContact O-N 3.13Å; L1359-L1362 WeakPolarHBondContact O-CB 3.38Å; L1359-L1362 PolarHBondContact O-N 2.95Å; L1359-L1362 VanDerWaalsContact O-N 3.15Å; L1359-V1363 WeakPolarHBondContact O-CG2 3.27Å; L1359-V1363 PolarHBondContact O-N 2.81Å
1360	R	72.3	Confident	68.1	Low	94 Å²	94	97.4 Å²	97.4	36%	0.355	49%	0.486	S	S	.	.	H	α-helix	trans	-62.6	-39.2	175.2	-77	-178.1	172.7	-155.9	-6.1	112.3	L1356 L1362 V1363 Y1364 I1373 S1376	L1356-R1360 WeakPolarHBondContact O-CB 3.4Å; L1356-R1360 WeakPolarHBondContact O-CG 3.42Å; L1356-R1360 PolarHBondContact O-N 3.43Å; R1360-L1362 VanDerWaalsContact C-N 3.28Å; R1360-L1362 PolarHBondContact O-N 3.09Å; R1360-V1363 PolarHBondContact O-N 3.39Å; R1360-Y1364 HydrophobicContact CB-CD2 4.44Å; R1360-Y1364 HydrophobicContact CG-CD2 4.45Å; R1360-Y1364 WeakPolarHBondContact O-CA 3.22Å; R1360-Y1364 WeakPolarHBondContact O-CB 3.42Å; R1360-Y1364 PolarHBondContact O-N 3.45Å; R1360-I1373 HydrophobicContact CB-CG2 3.65Å; R1360-S1376 PolarHBondContact NH1-OG 3.03Å
1361	A	72.8	Confident	66.6	Low	4 Å²	4	96.4 Å²	96.4	3%	0.033	49%	0.487	C	S	.	.	H	α-helix	trans	-67	-28.8	174.8	0	0	0	0	0	112.9	I1335 V1357 W1358 L1359 G1365 I1373	I1335-A1361 HydrophobicContact CD1-CB 3.85Å; I1335-A1361 HydrophobicContact CG1-CB 3.57Å; V1357-A1361 VanDerWaalsContact O-CB 3.31Å; V1357-A1361 WeakPolarHBondContact O-CB 3.44Å; V1357-A1361 PolarHBondContact O-N 2.79Å; W1358-A1361 PolarHBondContact O-N 2.68Å; L1359-A1361 PolarHBondContact O-N 3.13Å; A1361-G1365 VanDerWaalsContact O-CA 3.22Å; A1361-G1365 WeakPolarHBondContact O-CA 2.97Å; A1361-G1365 PolarHBondContact O-N 3.08Å; A1361-G1365 VanDerWaalsContact O-N 3.17Å; A1361-I1373 HydrophobicContact CB-CD1 4.4Å
1362	L	76.1	Confident	65.8	Low	107 Å²	107	95.6 Å²	95.6	56%	0.56	49%	0.489	S	S	*	.	H	α-helix	trans	-72.9	-43.1	174.2	-164.9	153.4	0	0	0	112.4	T1331 W1358 L1359 R1360	T1331-L1362 VanDerWaalsContact CG2-CA 3.41Å; T1331-L1362 HydrophobicContact CG2-CB 3.72Å; T1331-L1362 HydrophobicContact CG2-CD1 4.44Å; T1331-L1362 HydrophobicContact CG2-CG 3.97Å; W1358-L1362 WeakPolarHBondContact O-CB 3.39Å; W1358-L1362 PolarHBondContact O-N 3.06Å; L1359-L1362 WeakPolarHBondContact O-CB 3.38Å; L1359-L1362 PolarHBondContact O-N 2.95Å; L1359-L1362 VanDerWaalsContact O-N 3.15Å; R1360-L1362 VanDerWaalsContact C-N 3.28Å; R1360-L1362 PolarHBondContact O-N 3.09Å
1363	V	73.4	Confident	65	Low	89 Å²	89	92.5 Å²	92.5	54%	0.539	47%	0.473	S	S	.	.	H	α-helix	trans	-81.7	-47	-178.1	178	0	0	0	0	112.5	L1359 R1360	L1359-V1363 WeakPolarHBondContact O-CG2 3.27Å; L1359-V1363 PolarHBondContact O-N 2.81Å; R1360-V1363 PolarHBondContact O-N 3.39Å
1364	Y	65.1	Low	63.9	Low	142 Å²	142	85.2 Å²	85.2	56%	0.557	44%	0.443	S	S	*	.	H	α-helix	trans	-111.3	-5.1	-169.3	-59.1	-76.1	0	0	0	114.4	R1360 R1366 T1367	R1360-Y1364 HydrophobicContact CB-CD2 4.44Å; R1360-Y1364 HydrophobicContact CG-CD2 4.45Å; R1360-Y1364 WeakPolarHBondContact O-CA 3.22Å; R1360-Y1364 WeakPolarHBondContact O-CB 3.42Å; R1360-Y1364 PolarHBondContact O-N 3.45Å; Y1364-R1366 PolarHBondContact O-N 3.49Å; Y1364-T1367 PolarHBondContact O-N 2.69Å; Y1364-T1367 VanDerWaalsContact O-N 3.15Å; Y1364-T1367 PolarHBondContact O-OG1 3.02Å
1365	G	58.5	Low	62.7	Low	17 Å²	17	90.1 Å²	90.1	18%	0.175	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	16.6	-169.3	0	0	0	0	0	117.2	T1334 A1361	T1334-G1365 WeakPolarHBondContact CG2-O 3.18Å; T1334-G1365 PolarHBondContact OG1-O 2.91Å; A1361-G1365 VanDerWaalsContact O-CA 3.22Å; A1361-G1365 WeakPolarHBondContact O-CA 2.97Å; A1361-G1365 PolarHBondContact O-N 3.08Å; A1361-G1365 VanDerWaalsContact O-N 3.17Å
1366	R	54.7	Low	61.1	Low	149 Å²	149	88 Å²	88	56%	0.562	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.5	-6.7	-180	-146.5	-177.4	-171.8	121.8	-9.9	114.2	K1261 D1330 Y1364 G1368	K1261-R1366 PolarHBondContact O-NH2 3.22Å; D1330-R1366 IonicContact OD2-CZ 3.85Å; D1330-R1366 IonicContact OD2-NH1 2.69Å; D1330-R1366 PolarHBondContact OD2-NH1 3.1Å; Y1364-R1366 PolarHBondContact O-N 3.49Å; R1366-G1368 PolarHBondContact O-N 2.74Å
1367	T	51	Low	59.3	Low	90 Å²	90	89.3 Å²	89.3	55%	0.552	45%	0.453	S	S	*	.			trans	-72.8	109.6	172.9	45.1	0	0	0	0	108.6	Y1364 R1369	Y1364-T1367 PolarHBondContact O-N 2.69Å; Y1364-T1367 VanDerWaalsContact O-N 3.15Å; Y1364-T1367 PolarHBondContact O-OG1 3.02Å; T1367-R1369 PolarHBondContact O-N 3.25Å
1368	G	51	Low	57.7	Low	81 Å²	81	96.1 Å²	96.1	84%	0.835	48%	0.484	S	S	*	.			trans	-69	27.9	-175.5	0	0	0	0	0	116.4	R1366	R1366-G1368 PolarHBondContact O-N 2.74Å
1369	R	41.5	Very low	55.8	Low	191 Å²	191	97.9 Å²	97.9	72%	0.721	50%	0.501	S	S	*	.	S	Bend	trans	-68.2	144.5	159.7	-88.9	-174.7	162.6	128.6	-2.2	108.2	T1367 D1371	T1367-R1369 PolarHBondContact O-N 3.25Å; R1369-D1371 PolarHBondContact O-N 3.46Å
1370	N	46.7	Very low	54.1	Low	157 Å²	157	97.1 Å²	97.1	84%	0.84	50%	0.497	S	S	*	.	S	Bend	trans	-72.6	3.8	-175.9	-74.3	-39.6	0	0	0	114.1	S1372	N1370-S1372 PolarHBondContact O-N 3.37Å
1371	D	46	Very low	52.6	Low	113 Å²	113	95.7 Å²	95.7	60%	0.604	50%	0.499	S	S	*	.			trans	-69.7	97.3	178.5	-47.2	-36.7	0	0	0	109.4	R1369 I1373	R1369-D1371 PolarHBondContact O-N 3.46Å; D1371-I1373 PolarHBondContact O-N 3.01Å
1372	S	55	Low	51	Low	35 Å²	35	100 Å²	100	25%	0.245	52%	0.521	C	S	.	.			trans	-62.5	139	175.2	77.4	0	0	0	0	109.8	N1370 L1374 Q1375	N1370-S1372 PolarHBondContact O-N 3.37Å; S1372-L1374 PolarHBondContact O-N 3.11Å; S1372-Q1375 PolarHBondContact O-N 2.96Å; S1372-Q1375 WeakPolarHBondContact OG-CB 3.31Å; S1372-Q1375 VanDerWaalsContact OG-CD 3.3Å; S1372-Q1375 VanDerWaalsContact OG-CG 3.23Å; S1372-Q1375 WeakPolarHBondContact OG-CG 3.06Å; S1372-Q1375 PolarHBondContact OG-OE1 3.19Å
1373	I	56.3	Low	49.2	Very low	25 Å²	25	98.3 Å²	98.3	13%	0.128	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-16.8	-171.1	-54.9	168.7	0	0	0	111.1	T1334 E1338 R1360 A1361 D1371	T1334-I1373 HydrophobicContact CG2-CD1 3.68Å; E1338-I1373 WeakPolarHBondContact OE1-CB 3.44Å; E1338-I1373 WeakPolarHBondContact OE1-CG1 3.49Å; E1338-I1373 PolarHBondContact OE1-N 3.01Å; E1338-I1373 WeakPolarHBondContact OE2-CB 3.33Å; R1360-I1373 HydrophobicContact CB-CG2 3.65Å; A1361-I1373 HydrophobicContact CB-CD1 4.4Å; D1371-I1373 PolarHBondContact O-N 3.01Å
1374	L	55.3	Low	47.3	Very low	32 Å²	32	100.7 Å²	100.7	17%	0.168	52%	0.519	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-16.2	-178.7	-55.1	177.2	0	0	0	115.2	E1338 V1342 Y1351 V1357 S1372	E1338-L1374 HydrophobicContact CB-CD1 4.14Å; V1342-L1374 HydrophobicContact CG2-CD1 3.64Å; Y1351-L1374 HydrophobicContact CD1-CD2 3.67Å; Y1351-L1374 HydrophobicContact CD2-CD2 4.23Å; Y1351-L1374 HydrophobicContact CE1-CD2 3.79Å; Y1351-L1374 HydrophobicContact CE2-CD2 4.35Å; Y1351-L1374 HydrophobicContact CG-CD2 3.9Å; V1357-L1374 HydrophobicContact CG1-CD2 4.41Å; S1372-L1374 PolarHBondContact O-N 3.11Å
1375	Q	53	Low	46.2	Very low	146 Å²	146	100.7 Å²	100.7	68%	0.682	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-17.4	-169.5	-88.1	174.9	-58.8	0	0	116.4	S1372 K1377	S1372-Q1375 PolarHBondContact O-N 2.96Å; S1372-Q1375 WeakPolarHBondContact OG-CB 3.31Å; S1372-Q1375 VanDerWaalsContact OG-CD 3.3Å; S1372-Q1375 VanDerWaalsContact OG-CG 3.23Å; S1372-Q1375 WeakPolarHBondContact OG-CG 3.06Å; S1372-Q1375 PolarHBondContact OG-OE1 3.19Å; Q1375-K1377 PolarHBondContact O-N 3.33Å
1376	S	45.5	Very low	45.3	Very low	53 Å²	53	105.3 Å²	105.3	37%	0.371	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	32.8	-172.4	88.7	0	0	0	0	115.5	R1360	R1360-S1376 PolarHBondContact NH1-OG 3.03Å
1377	K	40.8	Very low	44.7	Very low	132 Å²	132	104.2 Å²	104.2	57%	0.574	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.5	8	-170.3	-104.5	-161.8	178.2	-160.1	0	118	Q1375 T1381	Q1375-K1377 PolarHBondContact O-N 3.33Å; K1377-T1381 WeakPolarHBondContact O-CG2 3.39Å; K1377-T1381 PolarHBondContact O-OG1 3.4Å
1378	E	41.4	Very low	44.4	Very low	156 Å²	156	104.7 Å²	104.7	73%	0.729	54%	0.538	S	S	*	.	S	Bend	trans	-89.3	-24.5	168.8	-87	171.8	169.3	0	0	112.9	T1381	E1378-T1381 PolarHBondContact O-OG1 3.02Å
1379	N	37.8	Very low	43.9	Very low	136 Å²	136	105.9 Å²	105.9	73%	0.727	53%	0.526	S	S	*	.	S	Bend	trans	-86.9	-46.9	175.7	-67.1	0.2	0	0	0	112.3	T1381 N1382	N1379-T1381 PolarHBondContact O-N 2.73Å; N1379-T1381 VanDerWaalsContact O-N 3.12Å; N1379-N1382 PolarHBondContact O-N 3.41Å; N1379-N1382 VanDerWaalsContact O-N 3.14Å
1380	D	42.4	Very low	44	Very low	91 Å²	91	104 Å²	104	49%	0.487	52%	0.524	S	S	.	.	H	α-helix	trans	-64.2	-18.7	-177.2	-60.4	-2.1	0	0	0	114.3	N1382 T1383 F1384	D1380-N1382 VanDerWaalsContact C-N 3.33Å; D1380-T1383 PolarHBondContact O-OG1 3.34Å; D1380-F1384 WeakPolarHBondContact O-CB 3.38Å; D1380-F1384 PolarHBondContact O-N 2.9Å
1381	T	40.5	Very low	43.8	Very low	64 Å²	64	100.8 Å²	100.8	39%	0.393	52%	0.515	S	S	.	.	H	α-helix	trans	-80.7	-12.5	178	46.6	0	0	0	0	114.2	K1377 E1378 N1379 K1385	K1377-T1381 WeakPolarHBondContact O-CG2 3.39Å; K1377-T1381 PolarHBondContact O-OG1 3.4Å; E1378-T1381 PolarHBondContact O-OG1 3.02Å; N1379-T1381 PolarHBondContact O-N 2.73Å; N1379-T1381 VanDerWaalsContact O-N 3.12Å; T1381-K1385 WeakPolarHBondContact O-CG 3.45Å
1382	N	38	Very low	43.4	Very low	94 Å²	94	99.8 Å²	99.8	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-88.7	-46.5	174.2	-69	-10.3	0	0	0	110.1	N1379 D1380 F1384 K1385 E1386	N1379-N1382 PolarHBondContact O-N 3.41Å; N1379-N1382 VanDerWaalsContact O-N 3.14Å; D1380-N1382 VanDerWaalsContact C-N 3.33Å; N1382-F1384 PolarHBondContact O-N 3.36Å; N1382-K1385 CarbonylContact O-C 3.57Å; N1382-K1385 WeakPolarHBondContact O-CA 3.33Å; N1382-K1385 WeakPolarHBondContact O-CB 3.39Å; N1382-K1385 PolarHBondContact O-N 3.31Å; N1382-E1386 WeakPolarHBondContact O-CG 3.03Å; N1382-E1386 PolarHBondContact O-N 3.13Å
1383	T	38.8	Very low	42.4	Very low	72 Å²	72	109.3 Å²	109.3	44%	0.442	56%	0.557	S	S	.	*	H	α-helix	trans	-59	-43.9	173.5	42.3	0	0	0	0	112.3	D1380 K1385 E1386 E1387	D1380-T1383 PolarHBondContact O-OG1 3.34Å; T1383-K1385 PolarHBondContact O-N 3.42Å; T1383-E1386 PolarHBondContact O-N 3.44Å; T1383-E1386 VanDerWaalsContact O-N 3.15Å; T1383-E1387 WeakPolarHBondContact O-CG 3.22Å; T1383-E1387 PolarHBondContact O-N 3.06Å
1384	F	34.6	Very low	41.7	Very low	138 Å²	138	113.6 Å²	113.6	61%	0.605	58%	0.579	S	S	*	*	H	α-helix	trans	-70.2	-10.9	176.2	-137.3	-91.7	0	0	0	114.2	D1380 N1382 I1388	D1380-F1384 WeakPolarHBondContact O-CB 3.38Å; D1380-F1384 PolarHBondContact O-N 2.9Å; N1382-F1384 PolarHBondContact O-N 3.36Å; F1384-I1388 HydrophobicContact CD1-CD1 3.87Å; F1384-I1388 HydrophobicContact CE1-CD1 4.1Å; F1384-I1388 VanDerWaalsContact O-CD1 3.27Å; F1384-I1388 WeakPolarHBondContact O-CD1 3.46Å; F1384-I1388 VanDerWaalsContact O-CG1 3.26Å; F1384-I1388 WeakPolarHBondContact O-CG1 3.39Å
1385	K	40.7	Very low	40.9	Very low	143 Å²	143	117.8 Å²	117.8	62%	0.622	60%	0.6	S	S	*	*	H	α-helix	trans	-93.8	-32.1	169.4	-86.9	-177.1	169.5	-174.3	0	112.3	T1381 N1382 T1383 N1389	T1381-K1385 WeakPolarHBondContact O-CG 3.45Å; N1382-K1385 CarbonylContact O-C 3.57Å; N1382-K1385 WeakPolarHBondContact O-CA 3.33Å; N1382-K1385 WeakPolarHBondContact O-CB 3.39Å; N1382-K1385 PolarHBondContact O-N 3.31Å; T1383-K1385 PolarHBondContact O-N 3.42Å; K1385-N1389 WeakPolarHBondContact O-CB 3.15Å; K1385-N1389 PolarHBondContact O-N 3.35Å; K1385-N1389 PolarHBondContact O-ND2 2.75Å
1386	E	40.5	Very low	40.3	Very low	114 Å²	114	116.3 Å²	116.3	53%	0.533	60%	0.596	S	S	.	*	H	α-helix	trans	-71.1	-40.5	174.7	-73	166.8	168.3	0	0	110.7	N1382 T1383 I1388 N1389 H1390	N1382-E1386 WeakPolarHBondContact O-CG 3.03Å; N1382-E1386 PolarHBondContact O-N 3.13Å; T1383-E1386 PolarHBondContact O-N 3.44Å; T1383-E1386 VanDerWaalsContact O-N 3.15Å; E1386-I1388 PolarHBondContact O-N 2.87Å; E1386-N1389 PolarHBondContact O-N 3.06Å; E1386-H1390 WeakPolarHBondContact O-CB 3.05Å; E1386-H1390 PolarHBondContact O-CD2 2.81Å; E1386-H1390 PolarHBondContact O-N 3.02Å
1387	E	41.5	Very low	40	Very low	126 Å²	126	120 Å²	120	59%	0.589	61%	0.609	S	S	*	*	H	α-helix	trans	-65.8	-33.8	173.6	-71.1	179.2	154.9	0	0	113.2	T1383 S1391	T1383-E1387 WeakPolarHBondContact O-CG 3.22Å; T1383-E1387 PolarHBondContact O-N 3.06Å; E1387-S1391 PolarHBondContact O-N 2.94Å; E1387-S1391 PolarHBondContact O-OG 2.86Å
1388	I	44.2	Very low	39.9	Very low	99 Å²	99	119.3 Å²	119.3	51%	0.508	61%	0.611	S	S	.	*	H	α-helix	trans	-76.3	-29.4	175.4	-69.2	177.7	0	0	0	111.8	F1384 E1386 S1391	F1384-I1388 HydrophobicContact CD1-CD1 3.87Å; F1384-I1388 HydrophobicContact CE1-CD1 4.1Å; F1384-I1388 VanDerWaalsContact O-CD1 3.27Å; F1384-I1388 WeakPolarHBondContact O-CD1 3.46Å; F1384-I1388 VanDerWaalsContact O-CG1 3.26Å; F1384-I1388 WeakPolarHBondContact O-CG1 3.39Å; E1386-I1388 PolarHBondContact O-N 2.87Å; I1388-S1391 PolarHBondContact O-OG 3.11Å
1389	N	41.4	Very low	39.8	Very low	107 Å²	107	116.8 Å²	116.8	57%	0.572	60%	0.603	S	S	*	*	H	α-helix	trans	-81.8	-26.4	174.5	-72.3	-14.2	0	0	0	112.9	K1385 E1386 S1391 S1392	K1385-N1389 WeakPolarHBondContact O-CB 3.15Å; K1385-N1389 PolarHBondContact O-N 3.35Å; K1385-N1389 PolarHBondContact O-ND2 2.75Å; E1386-N1389 PolarHBondContact O-N 3.06Å; N1389-S1391 VanDerWaalsContact C-N 3.27Å; N1389-S1391 PolarHBondContact O-N 3.43Å; N1389-S1392 PolarHBondContact O-N 3.22Å; N1389-S1392 PolarHBondContact O-OG 3.26Å
1390	H	43.9	Very low	40	Very low	150 Å²	150	115.4 Å²	115.4	69%	0.694	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-2.1	174.1	-87.7	-65.1	0	0	0	114.4	E1386	E1386-H1390 WeakPolarHBondContact O-CB 3.05Å; E1386-H1390 PolarHBondContact O-CD2 2.81Å; E1386-H1390 PolarHBondContact O-N 3.02Å
1391	S	42.1	Very low	39.8	Very low	91 Å²	91	117.3 Å²	117.3	64%	0.636	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	12.3	170.9	42.2	0	0	0	0	113.1	E1387 I1388 N1389	E1387-S1391 PolarHBondContact O-N 2.94Å; E1387-S1391 PolarHBondContact O-OG 2.86Å; I1388-S1391 PolarHBondContact O-OG 3.11Å; N1389-S1391 VanDerWaalsContact C-N 3.27Å; N1389-S1391 PolarHBondContact O-N 3.43Å
1392	S	37.1	Very low	39.7	Very low	92 Å²	92	121.8 Å²	121.8	64%	0.643	62%	0.62	S	S	*	*			trans	-128.9	32.4	176.6	65.4	0	0	0	0	113.4	N1389	N1389-S1392 PolarHBondContact O-N 3.22Å; N1389-S1392 PolarHBondContact O-OG 3.26Å
1393	Q	33.7	Very low	39.9	Very low	235 Å²	235	124.3 Å²	124.3	100%	1.098	63%	0.631	S	S	*	*			trans	-127.8	0	159.3	-77.9	-170.8	-24.7	0	0	108.1

Retrieved 1,393 of 1,393 residues in 2325.5 ms (Link to these results)

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