A0A5K4F258_SCHMA Loading...

TMEM131_like domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F258, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,487 aa.

						>A0A5K4F258_SCHMA|A0A5K4F258
MGLYNTAGKTNHFILSLAFFSIYLLPFGSCYNGFNANNKEVQILVDGIDNFCRLKVFEADRTGDAFFLFSGLSFEPSFLDFGEQPFSHPKHVEVTITNIDADQSIDLVTTFGVSQFIFWSRFNQTALSPASSANFNITFLPYTVGDFETSIYIQTSLGVAKYQVFGSSYISDDYLIPLVNLESLDENKKSFELKLVNPLSCSVKVDNLRVFSDGLLTEYCSYSQVTSNSTSRNDLIDNYAFEPIILHSYEKRSLLKATIDADDMELIQISSLLWEFDPYCKPDQIFSGNSTDGMGFLSSTNKFSKLPAASISINKFINQVLYSRVSLLYLGVINSRSGSISKPIEVLFLGNQLLEITSIEANIYDEALSIDITEKIISPHTTTPKTIAIVTLSSAHLSHSYYLSGIITVFTNDQSIYLRIPFYGRLVYGSLTSSVQTVPNYLNEKNQQDPVFLFRFMLTNRYDFTLFISKIDFLTPSHKYLLQIHHHITNAELIPNQTKLFMSISIVDNRITRLHGIMVVYSSISTFHIPYDIYSGKLHFFIDGARQLQDVYLLGTTLIGQIRNQSITIVNLNPVPVELTSVNIYTESDNNAKCEIMKHKHEGCQLSGPCEKCLFQFTEIQSLSEVNIPFSWGNENVAQHIKGFIQIKTKYTVIEQQFEYFVTRGLINVIPNPLIVNSLFPGKIIMHKITVQNAYPTEINITDIKLHRAIMSSDNFDNEISFDIQFYKIKRNKTSNDTNSPYLFQPIQFSANQSRVIGVVYFDPSASCVDRFEDIAQCDTMSTTATVTTTTTSTTNTTNSTAVYPVPYIVKPLGANKPFCYCGFNLDTSLGMLWLKGVRGTVNQSTEKITHQSFINRLIIEETFKLYNELYNQWLKHLMNKDITSKHPFMNKNILTSISYKLPDENVTFFSDLSVRYMWPQITRARKVPINVSSKHLTFCTIKNVPSSLSVSSESENRSLLTHRLMQIPTVTSSSLLSLSEATNSFECIFQITNPQSTINPLFVQPLLWNEVYKIYATNESELNHLKKLITNISADSTFIDSLFTTQYGEFSIQPFLCSDCQLINHSINLTYPPSYILPSNGSGQYFRLIFTPYQNIFELLNQNKVNNEDNIRSLLIIRNNLTSIEPLWLEIHFGRIGLTLGKLSTTKTISKLTKSISAFVSKFENDPSHIKHSISPNIDLYIRNVPPSSSSSGSSSSSSSSSINGFSTLKDNLISSLKIDQTLYDIDLDFTSLFNNKAIHQKIHQDLSLKFEFTEKTIGTFCEPPKTKSIDNLPSPFQSKHRKQSSDSNHFADIDNHQGLLTTLSLRRRLVLLNTGQVTLSIFMLSLLPSMNGRQKFTENFSLTNNLSIPTSYSWLYSHLSCNLNGFKLDPCILPPTTMTTAKMMSINDPDKNNSSNIITILPGQQIIIELRHYPDFTHTFLTANLIIQLYPTLFQSNILQWWDLQQSNKTDDSHILLIDLPKISLQAIFNANLLGSCLSLLPRPSIESFLSMTVFLFYLLNITAILIISYGDAKEIYTRHIKLRHYIDELPENVLSDSSRRFNLNQPSDKLCINCCINDKNLCNPSNRELFTTSNSQLSYSTITTSNTAILMKKQLTNSIIENDEISTLNSTTTGTKLKWKDKINSDEQKLKYEILTTRLDWINYYFQWLLGLLFLIKYISLHWILIIIKYPYKTMKRYIICLGKCKDWLISSLNLINYGYFHCIRQSSSDVINATNDNSQSTPSSNDTMIINKKNLFGLSKQSSADEVKNQKASLKSYSRNLSKLTNQTSDKGSTSRVNRKKKTMVPLVEISKPSGFNANASDDHANVSNRSRFTKIESVSPLPPAATPTTPTQAVNKDASPPRMAEADIVAAVQASIRLTEDVNSNHHHHEIRRKQAQRISSRKKCYNSSSPSSASGPDVDDDNNKSKLDRVMNVFYQNDNSPAHLNCKSDSIDKISSSSSADNQRVVNHQNKKETSKSTVPRLPHTKQLIDEYNEFIAEECVTSQELLETANHKSISSSLIPSSELDKSIKYPHQSLDTVSNSELFDWPETIQTCPNQIARMHHYVTNDQYPLTIYPLWSGAVTELATYWDQTLLHSDEMLYSSDSPDEAMNRLSEETHTFAQSFMTEPTDPSSFHSQFISSQFETTHFIQPTGIYENGLKDYFSQDKFILNNNIYSGIWNTMKENDNNQSYLSTENSPEYLSSDHLVGQGFLQSDHFCDYHINKITVENAFNTTLPIIYSLIQCNDDRKNSSTALQSSSINFPTNTDELDRIDTPLITQIFLDALRTAHRQIVDEINPSYHYTNSIVNSSSENTTPDYYTNDDDNNTMRIDCNPHDSCRTSFCELSRITESRRLSVLNYEAEMNSSIEGKMEIKEEYFDLVPNPLKNGVSNDQISSEELCGYSSWKCIVDIPQSELFQELGLSETTSEQSNFVSTGFMNYENIFNESSAIAPWTYIFEKVIRRINGVDNNQDSSLNCENKLNKPSSSLSFSTTITLTDMIE
					

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(Predicted Aligned Error values between residue pairs)

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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	24.8	Very low	29	Very low	223 Å²	223	118.5 Å²	118.5	100%	1.099	69%	0.69	S	S	*	*				0	104.4	0	173.5	-177.3	178.8	0	0	105.1	L3	M1-L3 PolarHBondContact N-O 3.07Å; M1-L3 PolarHBondContact O-N 2.92Å
2	G	26	Very low	28.9	Very low	78 Å²	78	117.3 Å²	117.3	80%	0.804	67%	0.672	S	S	*	*			trans	54.5	-131	-150.9	0	0	0	0	0	109.2
3	L	30.3	Very low	28.8	Very low	117 Å²	117	121.9 Å²	121.9	61%	0.613	68%	0.681	S	S	*	*	S	Bend	trans	-31.9	134	168.7	-71.3	162.2	0	0	0	112.8	M1 N5	M1-L3 PolarHBondContact N-O 3.07Å; M1-L3 PolarHBondContact O-N 2.92Å; L3-N5 VanDerWaalsContact C-CB 3.45Å; L3-N5 HydrophobicContact CB-CB 4.25Å; L3-N5 WeakPolarHBondContact CB-ND2 3.32Å; L3-N5 WeakPolarHBondContact O-CB 3.22Å; L3-N5 PolarHBondContact O-ND2 2.81Å
4	Y	57.7	Low	28.6	Very low	229 Å²	229	122.6 Å²	122.6	90%	0.898	68%	0.68	S	S	*	*			cis	66.3	37.3	14.9	-121.3	-102	0	0	0	112.2
5	N	23.2	Very low	28.5	Very low	115 Å²	115	124.9 Å²	124.9	62%	0.615	69%	0.69	S	S	*	*			cis	41.2	134.8	20.8	-54.7	-43.5	0	0	0	115.6	L3	L3-N5 VanDerWaalsContact C-CB 3.45Å; L3-N5 HydrophobicContact CB-CB 4.25Å; L3-N5 WeakPolarHBondContact CB-ND2 3.32Å; L3-N5 WeakPolarHBondContact O-CB 3.22Å; L3-N5 PolarHBondContact O-ND2 2.81Å
6	T	24.1	Very low	28.3	Very low	132 Å²	132	122.3 Å²	122.3	81%	0.81	68%	0.683	S	S	*	*				-159	145.9	64.7	37.3	0	0	0	0	117.1
7	A	24.7	Very low	28	Very low	88 Å²	88	124.5 Å²	124.5	73%	0.727	69%	0.692	S	S	*	*			trans	64.4	71.6	137.7	0	0	0	0	0	121.3
8	G	24.7	Very low	27.9	Very low	66 Å²	66	122.7 Å²	122.7	68%	0.68	70%	0.696	S	S	*	*				73.7	178.5	107.6	0	0	0	0	0	119.9	Q1548	G8-Q1548 PolarHBondContact O-OE1 2.78Å
9	K	27.8	Very low	28	Very low	90 Å²	90	127.3 Å²	127.3	39%	0.391	71%	0.708	S	S	.	*			cis	-155.1	153.1	38.3	-148.7	-164.6	167.6	-63.2	0	109	Q1548 P1549 S1550	K9-Q1548 HydrophobicContact CB-CB 3.55Å; K9-Q1548 HydrophobicContact CB-CG 4.07Å; K9-Q1548 VanDerWaalsContact O-CG 3.27Å; K9-Q1548 WeakPolarHBondContact O-CG 2.8Å; K9-Q1548 PolarHBondContact O-NE2 3.46Å; K9-Q1548 PolarHBondContact O-OE1 3.07Å; K9-P1549 VanDerWaalsContact C-CA 3.46Å; K9-P1549 HydrophobicContact CB-CB 2.29Å; K9-P1549 HydrophobicContact CB-CG 2.29Å; K9-P1549 HydrophobicContact CD-CB 3.84Å; K9-P1549 HydrophobicContact CD-CG 3.74Å; K9-P1549 WeakPolarHBondContact CD-O 3.49Å; K9-P1549 WeakPolarHBondContact CE-O 3.22Å; K9-P1549 HydrophobicContact CG-CB 2.29Å; K9-P1549 HydrophobicContact CG-CG 2.32Å; K9-P1549 WeakPolarHBondContact CG-O 3.42Å; K9-P1549 PolarHBondContact NZ-O 3.35Å; K9-S1550 PolarHBondContact NZ-O 3.36Å; K9-S1550 PolarHBondContact NZ-OG 2.62Å
10	T	29.3	Very low	27.7	Very low	87 Å²	87	131.3 Å²	131.3	53%	0.534	72%	0.718	S	S	.	*			trans	-85.6	-163.2	178.5	58.4	0	0	0	0	113.2	P1549 S1550	T10-P1549 VanDerWaalsContact N-CB 3.26Å; T10-P1549 CarbonylContact O-C 3.51Å; T10-P1549 VanDerWaalsContact O-CA 3.23Å; T10-P1549 WeakPolarHBondContact O-CA 3.18Å; T10-S1550 PolarHBondContact O-N 2.8Å
11	N	26.5	Very low	27.6	Very low	78 Å²	78	129.5 Å²	129.5	42%	0.417	72%	0.715	S	S	.	*			cis	-160.3	-179.1	19.9	-103.1	-17.4	0	0	0	106.7	D1551 K1552	N11-D1551 WeakPolarHBondContact ND2-CA 3.39Å; N11-K1552 PolarHBondContact ND2-N 3.33Å
12	H	27.6	Very low	27.5	Very low	104 Å²	104	125.6 Å²	125.6	48%	0.481	70%	0.697	S	S	.	*			cis	-155	167	-8.6	-100.1	-29.5	0	0	0	105.6	K1552	H12-K1552 WeakPolarHBondContact NE2-CA 3.48Å; H12-K1552 PolarHBondContact NE2-N 3.39Å
13	F	27.4	Very low	27.5	Very low	178 Å²	178	132 Å²	132	78%	0.781	70%	0.698	S	S	*	*			cis	78.6	126	35.2	-95.5	-135.6	0	0	0	114.8
14	I	26.4	Very low	27.2	Very low	131 Å²	131	134.7 Å²	134.7	67%	0.672	71%	0.713	S	S	*	*			cis	-157.6	156.6	-4.9	-21	174	0	0	0	109
15	L	27.1	Very low	25.7	Very low	157 Å²	157	130.5 Å²	130.5	82%	0.822	71%	0.705	S	S	*	*				-174.9	139.4	107.3	-139.4	78.7	0	0	0	115
16	S	24.7	Very low	25.9	Very low	84 Å²	84	130.2 Å²	130.2	59%	0.587	71%	0.71	S	S	*	*			trans	67.9	107.9	142.9	-163.8	0	0	0	0	123.4
17	L	24.5	Very low	26	Very low	159 Å²	159	134 Å²	134	83%	0.832	72%	0.715	S	S	*	*			trans	25.2	120.7	135.8	-63.7	99.4	0	0	0	120.2
18	A	24.9	Very low	26	Very low	92 Å²	92	133.1 Å²	133.1	76%	0.76	71%	0.714	S	S	*	*				173.8	83	102.1	0	0	0	0	0	113.9
19	F	29.9	Very low	26	Very low	211 Å²	211	135.6 Å²	135.6	93%	0.925	72%	0.721	S	S	*	*			trans	-179.4	91.1	136.7	-115.4	-79.2	0	0	0	109.7
20	F	23.1	Very low	25.9	Very low	206 Å²	206	136 Å²	136	90%	0.904	74%	0.735	S	S	*	*			trans	-127	106.3	174.8	-154.1	-77.8	0	0	0	107.6
21	S	24.1	Very low	25.7	Very low	94 Å²	94	140 Å²	140	66%	0.657	74%	0.741	S	S	*	*			trans	-166.2	123	175.3	-83.9	0	0	0	0	112.3
22	I	24.6	Very low	25.6	Very low	142 Å²	142	144.5 Å²	144.5	73%	0.728	77%	0.765	S	S	*	*	S	Bend	trans	66.7	70.9	148.9	-48.7	164.5	0	0	0	115.9
23	Y	25.5	Very low	25.4	Very low	211 Å²	211	142.9 Å²	142.9	83%	0.827	78%	0.777	S	S	*	*	S	Bend		177.1	83.5	105.6	-101.6	-66.2	0	0	0	111.7
24	L	23.7	Very low	25.3	Very low	175 Å²	175	142.7 Å²	142.7	92%	0.916	78%	0.776	S	S	*	*	S	Bend	trans	-162.2	64.7	164.5	-120.5	172.3	0	0	0	110.4
25	L	25.6	Very low	25.2	Very low	141 Å²	141	143 Å²	143	74%	0.738	78%	0.779	S	S	*	*			trans	-164.8	155.9	172.3	-94.5	172.5	0	0	0	106.7
26	P	28.7	Very low	25.2	Very low	109 Å²	109	138.8 Å²	138.8	71%	0.708	77%	0.767	S	S	*	*			cis	-115.5	125	4	35.9	-22.3	0	0	0	114.5
27	F	25.4	Very low	25.2	Very low	211 Å²	211	142.5 Å²	142.5	93%	0.925	78%	0.78	S	S	*	*			trans	-131.2	106	139.6	-96	-78.9	0	0	0	105.6
28	G	24	Very low	25.4	Very low	69 Å²	69	140.8 Å²	140.8	71%	0.711	77%	0.772	S	S	*	*			trans	174.4	39.6	-163.9	0	0	0	0	0	114.6
29	S	24.7	Very low	25.7	Very low	119 Å²	119	145.2 Å²	145.2	83%	0.832	77%	0.774	S	S	*	*			trans	-145.7	37.8	174.9	64.2	0	0	0	0	112.5
30	C	25.6	Very low	25.8	Very low	99 Å²	99	141.4 Å²	141.4	67%	0.669	76%	0.759	S	S	*	*	S	Bend	trans	-112.6	146.1	155.9	-59.6	0	0	0	0	106.8
31	Y	25.8	Very low	26.3	Very low	169 Å²	169	135.2 Å²	135.2	66%	0.663	74%	0.738	S	S	*	*	S	Bend	trans	62.2	83.2	-166.1	-61.7	-84.9	0	0	0	115.4
32	N	23.9	Very low	26.7	Very low	174 Å²	174	137 Å²	137	93%	0.93	74%	0.735	S	S	*	*				-172.1	120.7	117.9	-94.4	-38.9	0	0	0	109.9
33	G	24.5	Very low	27.2	Very low	70 Å²	70	135 Å²	135	72%	0.722	73%	0.725	S	S	*	*			trans	128.6	50.5	168.8	0	0	0	0	0	117.7
34	F	25.4	Very low	27.5	Very low	174 Å²	174	130.6 Å²	130.6	76%	0.763	72%	0.716	S	S	*	*			trans	-147.5	128.1	147.3	-105.9	-75.9	0	0	0	109.5
35	N	23.6	Very low	28.1	Very low	136 Å²	136	125 Å²	125	73%	0.727	69%	0.689	S	S	*	*			trans	-140.6	69.7	179.1	-172.3	25.6	0	0	0	108.9
36	A	27.1	Very low	28.7	Very low	69 Å²	69	122.3 Å²	122.3	57%	0.57	68%	0.675	S	S	*	*			trans	-125.6	132.3	-179.1	0	0	0	0	0	109.5	N38	A36-N38 PolarHBondContact O-N 2.9Å; A36-N38 VanDerWaalsContact O-N 3.14Å
37	N	24.3	Very low	29.2	Very low	162 Å²	162	118.2 Å²	118.2	87%	0.866	65%	0.653	S	S	*	*			trans	-81.5	91.5	-175.4	-71.1	-42.2	0	0	0	111.4
38	N	30	Very low	30	Very low	123 Å²	123	112.2 Å²	112.2	66%	0.658	63%	0.63	S	S	*	*			trans	-145.3	142.2	160.1	-96.5	-25.2	0	0	0	110.8	A36 E40	A36-N38 PolarHBondContact O-N 2.9Å; A36-N38 VanDerWaalsContact O-N 3.14Å; N38-E40 VanDerWaalsContact C-N 3.28Å; N38-E40 PolarHBondContact O-N 2.91Å
39	K	30.6	Very low	30.8	Very low	186 Å²	186	111.2 Å²	111.2	81%	0.809	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-17.1	-169.3	-73.4	-175.9	175.3	-179.3	0	114.5
40	E	31.4	Very low	31.6	Very low	130 Å²	130	107.3 Å²	107.3	61%	0.607	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-27.5	-175.8	-73.5	151.4	145.7	0	0	113.1	N38 Q42 I43	N38-E40 VanDerWaalsContact C-N 3.28Å; N38-E40 PolarHBondContact O-N 2.91Å; E40-Q42 PolarHBondContact O-N 3.26Å; E40-Q42 VanDerWaalsContact O-N 3.13Å; E40-I43 PolarHBondContact O-N 3.41Å
41	V	33.2	Very low	32.4	Very low	76 Å²	76	106.8 Å²	106.8	46%	0.461	56%	0.564	S	S	.	*	H	α-helix	trans	-56.3	-31.3	173.2	-178.2	0	0	0	0	111.3	I43 L44 V45	V41-I43 VanDerWaalsContact C-N 3.33Å; V41-I43 PolarHBondContact O-N 3.03Å; V41-L44 PolarHBondContact O-N 3.13Å; V41-V45 HydrophobicContact CG1-CG2 4.11Å; V41-V45 WeakPolarHBondContact O-CG2 3.4Å; V41-V45 PolarHBondContact O-N 3.31Å
42	Q	32.1	Very low	33.1	Very low	131 Å²	131	101.5 Å²	101.5	61%	0.612	55%	0.551	S	S	*	*	H	α-helix	trans	-64.8	-34.9	179.7	-166	165.4	-2.3	0	0	112.5	E40 V45 D46	E40-Q42 PolarHBondContact O-N 3.26Å; E40-Q42 VanDerWaalsContact O-N 3.13Å; Q42-V45 PolarHBondContact O-N 3.43Å; Q42-D46 WeakPolarHBondContact O-CB 3.33Å; Q42-D46 VanDerWaalsContact O-CG 3.31Å; Q42-D46 PolarHBondContact O-N 3.29Å
43	I	35.2	Very low	33.9	Very low	100 Å²	100	100.1 Å²	100.1	51%	0.513	53%	0.533	S	S	.	.	H	α-helix	trans	-68.9	-39.3	176.2	-57.8	175.3	0	0	0	110.5	E40 V41 G47	E40-I43 PolarHBondContact O-N 3.41Å; V41-I43 VanDerWaalsContact C-N 3.33Å; V41-I43 PolarHBondContact O-N 3.03Å; I43-G47 PolarHBondContact O-N 3.35Å
44	L	33.2	Very low	34.8	Very low	120 Å²	120	99 Å²	99	63%	0.628	51%	0.51	S	S	*	.	H	α-helix	trans	-67.9	-40.5	177	-158.2	82.3	0	0	0	111.6	V41 G47 I48	V41-L44 PolarHBondContact O-N 3.13Å; L44-G47 PolarHBondContact O-N 3.08Å; L44-I48 HydrophobicContact CG-CD1 4.38Å; L44-I48 VanDerWaalsContact O-CG1 3.3Å; L44-I48 WeakPolarHBondContact O-CG1 3.14Å; L44-I48 PolarHBondContact O-N 2.94Å
45	V	36.9	Very low	35.4	Very low	58 Å²	58	96.5 Å²	96.5	35%	0.352	50%	0.499	S	S	.	.	H	α-helix	trans	-67.8	-43.9	176.9	171.5	0	0	0	0	111.5	V41 Q42 G47 I48 D49	V41-V45 HydrophobicContact CG1-CG2 4.11Å; V41-V45 WeakPolarHBondContact O-CG2 3.4Å; V41-V45 PolarHBondContact O-N 3.31Å; Q42-V45 PolarHBondContact O-N 3.43Å; V45-G47 VanDerWaalsContact C-N 3.28Å; V45-G47 PolarHBondContact O-N 3.42Å; V45-I48 PolarHBondContact O-N 3.1Å; V45-D49 PolarHBondContact O-N 3.19Å
46	D	37	Very low	36.1	Very low	83 Å²	83	94.5 Å²	94.5	44%	0.444	49%	0.491	S	S	.	.	H	α-helix	trans	-64.3	-35	174.2	-73.2	-23.5	0	0	0	111.2	Q42 N50	Q42-D46 WeakPolarHBondContact O-CB 3.33Å; Q42-D46 VanDerWaalsContact O-CG 3.31Å; Q42-D46 PolarHBondContact O-N 3.29Å; D46-N50 WeakPolarHBondContact O-CB 3.49Å; D46-N50 PolarHBondContact O-N 3.24Å; D46-N50 PolarHBondContact O-ND2 2.97Å
47	G	38.4	Very low	36.6	Very low	24 Å²	24	97 Å²	97	25%	0.247	49%	0.49	C	S	.	.	H	α-helix	trans	-62.5	-44	171.2	0	0	0	0	0	113	I43 L44 V45 F51	I43-G47 PolarHBondContact O-N 3.35Å; L44-G47 PolarHBondContact O-N 3.08Å; V45-G47 VanDerWaalsContact C-N 3.28Å; V45-G47 PolarHBondContact O-N 3.42Å; G47-F51 VanDerWaalsContact O-CB 3.28Å; G47-F51 WeakPolarHBondContact O-CB 3.49Å; G47-F51 PolarHBondContact O-N 2.95Å
48	I	42.7	Very low	37	Very low	85 Å²	85	96 Å²	96	44%	0.436	48%	0.48	S	S	.	.	H	α-helix	trans	-68.5	-40.5	177.2	-70.4	164.5	0	0	0	111.6	L44 V45 F51 C52	L44-I48 HydrophobicContact CG-CD1 4.38Å; L44-I48 VanDerWaalsContact O-CG1 3.3Å; L44-I48 WeakPolarHBondContact O-CG1 3.14Å; L44-I48 PolarHBondContact O-N 2.94Å; V45-I48 PolarHBondContact O-N 3.1Å; I48-F51 PolarHBondContact O-N 2.93Å; I48-C52 WeakPolarHBondContact O-CB 3.43Å; I48-C52 PolarHBondContact O-N 3.18Å; I48-C52 PolarHBondContact O-SG 3Å
49	D	41.1	Very low	37.4	Very low	48 Å²	48	94.1 Å²	94.1	26%	0.257	48%	0.481	S	S	.	.	H	α-helix	trans	-70.1	-38.6	178.9	-162.3	57.8	0	0	0	111.4	V45 C52 R53	V45-D49 PolarHBondContact O-N 3.19Å; D49-C52 PolarHBondContact O-N 3.26Å; D49-R53 WeakPolarHBondContact O-CB 3.45Å; D49-R53 WeakPolarHBondContact O-CG 3.39Å; D49-R53 PolarHBondContact O-N 3.32Å; D49-R53 IonicContact OD2-CZ 2.86Å; D49-R53 IonicContact OD2-NE 3.88Å; D49-R53 PolarHBondContact OD2-NE 3.32Å; D49-R53 IonicContact OD2-NH2 2.61Å; D49-R53 PolarHBondContact OD2-NH2 2.65Å
50	N	42.1	Very low	37.4	Very low	36 Å²	36	92 Å²	92	19%	0.193	48%	0.479	C	S	.	.	H	α-helix	trans	-66	-40	171.4	-74.9	-54.5	0	0	0	112.4	D46 R53 L54	D46-N50 WeakPolarHBondContact O-CB 3.49Å; D46-N50 PolarHBondContact O-N 3.24Å; D46-N50 PolarHBondContact O-ND2 2.97Å; N50-R53 PolarHBondContact O-N 3.46Å; N50-L54 PolarHBondContact O-N 3.07Å
51	F	41.3	Very low	37.3	Very low	89 Å²	89	94.7 Å²	94.7	39%	0.39	48%	0.483	S	S	.	.	H	α-helix	trans	-64.4	-40.3	174.5	-169.8	-95.7	0	0	0	111.9	G47 I48 L54 K55 V113	G47-F51 VanDerWaalsContact O-CB 3.28Å; G47-F51 WeakPolarHBondContact O-CB 3.49Å; G47-F51 PolarHBondContact O-N 2.95Å; I48-F51 PolarHBondContact O-N 2.93Å; F51-L54 PolarHBondContact O-N 3.3Å; F51-K55 PolarHBondContact O-N 3.14Å; F51-V113 HydrophobicContact CE2-CG2 4.13Å; F51-V113 HydrophobicContact CZ-CG2 4.32Å
52	C	42.3	Very low	37.1	Very low	58 Å²	58	97.2 Å²	97.2	39%	0.392	50%	0.499	S	S	.	.	H	α-helix	trans	-63.8	-41.7	173	-71.7	0	0	0	0	112.2	I48 D49 K55 V56	I48-C52 WeakPolarHBondContact O-CB 3.43Å; I48-C52 PolarHBondContact O-N 3.18Å; I48-C52 PolarHBondContact O-SG 3Å; D49-C52 PolarHBondContact O-N 3.26Å; C52-K55 PolarHBondContact O-N 3.17Å; C52-V56 WeakPolarHBondContact O-CG2 3.25Å; C52-V56 PolarHBondContact O-N 3.47Å; C52-V56 VanDerWaalsContact O-N 3.1Å
53	R	40.1	Very low	37	Very low	145 Å²	145	94.3 Å²	94.3	55%	0.547	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-42.6	174.2	-71.7	168.4	-166.6	-158.7	6.2	112	D49 N50 V56 F57	D49-R53 WeakPolarHBondContact O-CB 3.45Å; D49-R53 WeakPolarHBondContact O-CG 3.39Å; D49-R53 PolarHBondContact O-N 3.32Å; D49-R53 IonicContact OD2-CZ 2.86Å; D49-R53 IonicContact OD2-NE 3.88Å; D49-R53 PolarHBondContact OD2-NE 3.32Å; D49-R53 IonicContact OD2-NH2 2.61Å; D49-R53 PolarHBondContact OD2-NH2 2.65Å; N50-R53 PolarHBondContact O-N 3.46Å; R53-V56 WeakPolarHBondContact O-CB 3.37Å; R53-V56 PolarHBondContact O-N 3.11Å; R53-F57 WeakPolarHBondContact O-CD2 3.43Å; R53-F57 PolarHBondContact O-N 3.1Å
54	L	43.5	Very low	36.9	Very low	45 Å²	45	95.5 Å²	95.5	24%	0.236	51%	0.511	C	S	.	.	H	α-helix	trans	-62.9	-41.2	175.5	-82.7	161.2	0	0	0	112.2	N50 F51 V56 F57 E58 F66 F111	N50-L54 PolarHBondContact O-N 3.07Å; F51-L54 PolarHBondContact O-N 3.3Å; L54-V56 PolarHBondContact O-N 3.37Å; L54-F57 WeakPolarHBondContact O-CB 3.45Å; L54-F57 PolarHBondContact O-N 2.97Å; L54-E58 WeakPolarHBondContact O-CB 3.32Å; L54-E58 PolarHBondContact O-N 2.97Å; L54-F66 HydrophobicContact CD2-CZ 4.25Å; L54-F111 HydrophobicContact CD1-CE1 4.43Å; L54-F111 HydrophobicContact CD1-CE2 3.53Å; L54-F111 HydrophobicContact CD1-CZ 3.32Å
55	K	38	Very low	37	Very low	123 Å²	123	93 Å²	93	54%	0.535	51%	0.509	S	S	.	.	H	α-helix	trans	-67.1	-21.6	176.5	-148.4	170.9	-170.2	175.9	0	113.7	F51 C52	F51-K55 PolarHBondContact O-N 3.14Å; C52-K55 PolarHBondContact O-N 3.17Å
56	V	38.2	Very low	37.1	Very low	93 Å²	93	95.5 Å²	95.5	56%	0.564	52%	0.515	S	S	*	.	H	α-helix	trans	-77.6	-41.1	168.4	170.7	0	0	0	0	111.2	C52 R53 L54 E58 A59 D60	C52-V56 WeakPolarHBondContact O-CG2 3.25Å; C52-V56 PolarHBondContact O-N 3.47Å; C52-V56 VanDerWaalsContact O-N 3.1Å; R53-V56 WeakPolarHBondContact O-CB 3.37Å; R53-V56 PolarHBondContact O-N 3.11Å; L54-V56 PolarHBondContact O-N 3.37Å; V56-E58 VanDerWaalsContact C-N 3.35Å; V56-E58 PolarHBondContact O-N 3.11Å; V56-A59 PolarHBondContact O-N 2.76Å; V56-D60 PolarHBondContact O-N 3.47Å
57	F	36.4	Very low	37.1	Very low	123 Å²	123	98.8 Å²	98.8	54%	0.539	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-40.1	173.8	-93.6	-81.2	0	0	0	113.1	R53 L54 A59 D60 R61	R53-F57 WeakPolarHBondContact O-CD2 3.43Å; R53-F57 PolarHBondContact O-N 3.1Å; L54-F57 WeakPolarHBondContact O-CB 3.45Å; L54-F57 PolarHBondContact O-N 2.97Å; F57-A59 PolarHBondContact O-N 3.41Å; F57-D60 PolarHBondContact O-N 3.13Å; F57-R61 PolarHBondContact O-N 2.84Å
58	E	34.3	Very low	37.2	Very low	141 Å²	141	105.5 Å²	105.5	66%	0.659	56%	0.555	S	S	*	*	H	α-helix	trans	-64.7	-21	178.6	-161.3	172.8	-132.5	0	0	112.9	L54 V56	L54-E58 WeakPolarHBondContact O-CB 3.32Å; L54-E58 PolarHBondContact O-N 2.97Å; V56-E58 VanDerWaalsContact C-N 3.35Å; V56-E58 PolarHBondContact O-N 3.11Å
59	A	37.3	Very low	37.6	Very low	83 Å²	83	104.6 Å²	104.6	69%	0.686	55%	0.548	S	S	*	.	H	α-helix	trans	-90.6	-31.1	176.8	0	0	0	0	0	114.1	V56 F57	V56-A59 PolarHBondContact O-N 2.76Å; F57-A59 PolarHBondContact O-N 3.41Å
60	D	31.6	Very low	38.3	Very low	141 Å²	141	107.6 Å²	107.6	75%	0.754	57%	0.572	S	S	*	*	H	α-helix	trans	-104.5	-5.7	-171.3	-99.6	-23.3	0	0	0	115	V56 F57	V56-D60 PolarHBondContact O-N 3.47Å; F57-D60 PolarHBondContact O-N 3.13Å
61	R	29.4	Very low	39.5	Very low	186 Å²	186	106.1 Å²	106.1	70%	0.702	57%	0.566	S	S	*	*			trans	-138.5	125.2	170.4	-74.4	-168	176	173.5	-0.2	114.3	F57	F57-R61 PolarHBondContact O-N 2.84Å
62	T	28.6	Very low	41.2	Very low	130 Å²	130	102.5 Å²	102.5	80%	0.798	55%	0.551	S	S	*	*			trans	-68.5	127.7	168.8	48.5	0	0	0	0	111.8	D64	T62-D64 VanDerWaalsContact C-N 3.28Å; T62-D64 PolarHBondContact O-N 3.25Å
63	G	30.2	Very low	43.2	Very low	69 Å²	69	102.2 Å²	102.2	71%	0.711	55%	0.549	S	S	*	.	S	Bend	trans	72.9	-57.8	159.9	0	0	0	0	0	117.3	A65	G63-A65 VanDerWaalsContact C-N 3.33Å; G63-A65 PolarHBondContact O-N 3.26Å
64	D	31.8	Very low	45.5	Very low	125 Å²	125	96.8 Å²	96.8	67%	0.668	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	28.7	-144.7	-58.8	-20.3	0	0	0	115	T62 F67	T62-D64 VanDerWaalsContact C-N 3.28Å; T62-D64 PolarHBondContact O-N 3.25Å; D64-F67 HydrophobicContact CB-CE2 3.97Å; D64-F67 WeakPolarHBondContact O-CD2 3.31Å; D64-F67 WeakPolarHBondContact O-CE2 3.48Å
65	A	36.9	Very low	47.6	Very low	69 Å²	69	100.4 Å²	100.4	57%	0.57	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	-16.9	-174.9	0	0	0	0	0	115.3	G63	G63-A65 VanDerWaalsContact C-N 3.33Å; G63-A65 PolarHBondContact O-N 3.26Å
66	F	37.7	Very low	50	Low	110 Å²	110	97 Å²	97	48%	0.482	54%	0.535	S	S	.	.	S	Bend	trans	-101.7	47.8	176.2	-78.9	-78.3	0	0	0	111.6	L54 Y152	L54-F66 HydrophobicContact CD2-CZ 4.25Å; F66-Y152 HydrophobicContact CE1-CE1 4.26Å
67	F	36.6	Very low	52.2	Low	151 Å²	151	96.7 Å²	96.7	66%	0.662	54%	0.538	S	S	*	.			trans	-68.9	146	176.7	-86.5	-77.5	0	0	0	112.2	D64 F69	D64-F67 HydrophobicContact CB-CE2 3.97Å; D64-F67 WeakPolarHBondContact O-CD2 3.31Å; D64-F67 WeakPolarHBondContact O-CE2 3.48Å; F67-F69 PolarHBondContact O-N 3.06Å
68	L	40.3	Very low	54.6	Low	166 Å²	166	96.2 Å²	96.2	87%	0.869	54%	0.535	S	S	*	.			trans	-56	122.3	177.5	-70.6	155	0	0	0	111.1	S70	L68-S70 PolarHBondContact O-N 3.42Å
69	F	52.6	Low	57.2	Low	65 Å²	65	89.7 Å²	89.7	29%	0.285	51%	0.505	S	S	.	.			trans	-73.6	91.7	171.2	-88.1	-74.2	0	0	0	110.7	F67 G71 L72 L157 A160	F67-F69 PolarHBondContact O-N 3.06Å; F69-G71 PolarHBondContact O-N 2.87Å; F69-L72 PolarHBondContact O-N 3.17Å; F69-L72 VanDerWaalsContact O-N 3.16Å; F69-L157 HydrophobicContact CD1-CB 4.37Å; F69-L157 HydrophobicContact CE1-CB 3.59Å; F69-L157 HydrophobicContact CZ-CB 4.26Å; F69-L157 WeakPolarHBondContact CZ-O 3.44Å; F69-A160 HydrophobicContact CD2-CB 4.35Å
70	S	54.6	Low	59.7	Low	111 Å²	111	90 Å²	90	78%	0.776	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-1	174.9	57.1	0	0	0	0	114.9	L68 I99	L68-S70 PolarHBondContact O-N 3.42Å; S70-I99 VanDerWaalsContact O-CD1 3.31Å; S70-I99 WeakPolarHBondContact O-CD1 3.13Å
71	G	67.3	Low	62.3	Low	5 Å²	5	83.3 Å²	83.3	5%	0.052	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-4.5	174.5	0	0	0	0	0	114.9	F69 N98 I99 D100	F69-G71 PolarHBondContact O-N 2.87Å; G71-N98 PolarHBondContact O-OD1 3.35Å; G71-N98 VanDerWaalsContact O-OD1 3.1Å; G71-I99 WeakPolarHBondContact O-CG1 3.19Å; G71-I99 PolarHBondContact O-N 2.95Å; G71-D100 PolarHBondContact O-N 3.44Å
72	L	77.5	Confident	64.9	Low	14 Å²	14	75.8 Å²	75.8	7%	0.073	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	130.6	179.9	-68.3	170.8	0	0	0	111.5	F69 F74 I96 T97 I105 L127 T155	F69-L72 PolarHBondContact O-N 3.17Å; F69-L72 VanDerWaalsContact O-N 3.16Å; L72-F74 HydrophobicContact CB-CE2 4.46Å; L72-I96 HydrophobicContact CD2-CG2 3.95Å; L72-T97 WeakPolarHBondContact CA-O 3.46Å; L72-I105 HydrophobicContact CD1-CG2 4.43Å; L72-I105 HydrophobicContact CD2-CD1 3.8Å; L72-I105 HydrophobicContact CD2-CG2 4.39Å; L72-I105 HydrophobicContact CG-CD1 3.91Å; L72-L127 HydrophobicContact CD2-CD1 4.05Å; L72-T155 HydrophobicContact CD1-CG2 4.04Å
73	S	85	Confident	67.5	Low	51 Å²	51	76.2 Å²	76.2	36%	0.357	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	140.4	173.6	171.3	0	0	0	0	110.5	T97	S73-T97 VanDerWaalsContact CB-OG1 3.31Å; S73-T97 WeakPolarHBondContact CB-OG1 3.4Å; S73-T97 PolarHBondContact N-O 3.01Å; S73-T97 PolarHBondContact O-N 2.96Å; S73-T97 PolarHBondContact O-OG1 3.28Å
74	F	87.2	Confident	70	Confident	31 Å²	31	74.1 Å²	74.1	14%	0.136	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	133.6	-178.5	-63.2	-93.5	0	0	0	109.7	L72 P76 S77 V94 T95 I96 I153 A160 Y162	L72-F74 HydrophobicContact CB-CE2 4.46Å; F74-P76 CarbonylContact C-O 3.55Å; F74-P76 VanDerWaalsContact C-O 3.24Å; F74-P76 WeakPolarHBondContact CB-O 3.36Å; F74-P76 CarbonylContact O-C 3.57Å; F74-P76 VanDerWaalsContact O-C 3.26Å; F74-S77 VanDerWaalsContact O-CA 3.31Å; F74-S77 WeakPolarHBondContact O-CA 3.42Å; F74-S77 PolarHBondContact O-N 2.9Å; F74-V94 HydrophobicContact CD1-CG1 4.42Å; F74-T95 WeakPolarHBondContact CA-O 3.47Å; F74-I96 HydrophobicContact CD1-CD1 4.48Å; F74-I96 HydrophobicContact CD1-CG1 3.9Å; F74-I96 HydrophobicContact CE1-CD1 3.83Å; F74-I96 HydrophobicContact CE1-CG1 3.72Å; F74-I96 HydrophobicContact CE1-CG2 4.21Å; F74-I153 HydrophobicContact CE1-CD1 3.48Å; F74-I153 VanDerWaalsContact CE1-CD1 3.48Å; F74-I153 HydrophobicContact CZ-CD1 3.75Å; F74-A160 HydrophobicContact CZ-CB 4.32Å; F74-Y162 HydrophobicContact CB-CD2 4.15Å; F74-Y162 HydrophobicContact CB-CE2 3.77Å; F74-Y162 AromaticContact CD1-CD2 3.7Å; F74-Y162 HydrophobicContact CD1-CD2 3.7Å; F74-Y162 AromaticContact CD1-CE2 3.95Å; F74-Y162 HydrophobicContact CD1-CE2 3.95Å; F74-Y162 HydrophobicContact CD1-CG 4.45Å; F74-Y162 HydrophobicContact CD2-CD2 4.34Å; F74-Y162 HydrophobicContact CE1-CD2 4.16Å; F74-Y162 AromaticContact CG-CD2 3.81Å; F74-Y162 HydrophobicContact CG-CD2 3.81Å; F74-Y162 AromaticContact CG-CE2 3.94Å; F74-Y162 HydrophobicContact CG-CE2 3.94Å
75	E	87.5	Confident	72.1	Confident	122 Å²	122	68.6 Å²	68.6	57%	0.57	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	115	167.5	-168.9	172.9	172.3	0	0	109.4	T95 K1393	E75-T95 PolarHBondContact N-O 3.44Å; E75-T95 PolarHBondContact O-N 3.17Å; E75-K1393 IonicContact OE1-NZ 2.64Å
76	P	89	Confident	74.1	Confident	50 Å²	50	66 Å²	66	33%	0.325	35%	0.351	S	S	.	.	S	Bend	cis	-65.8	162	-8.3	31.4	-36.1	0	0	0	112.6	F74 F78 L79 Y162	F74-P76 CarbonylContact C-O 3.55Å; F74-P76 VanDerWaalsContact C-O 3.24Å; F74-P76 WeakPolarHBondContact CB-O 3.36Å; F74-P76 CarbonylContact O-C 3.57Å; F74-P76 VanDerWaalsContact O-C 3.26Å; P76-F78 WeakPolarHBondContact CB-O 3.44Å; P76-L79 HydrophobicContact CG-CD1 4.43Å; P76-Y162 WeakPolarHBondContact O-CE2 3.49Å; P76-Y162 PolarHBondContact O-OH 2.91Å; P76-Y162 VanDerWaalsContact O-OH 3.07Å
77	S	83.8	Confident	75.7	Confident	88 Å²	88	61 Å²	61	62%	0.615	33%	0.329	S	S	*	.	S	Bend	trans	-75	-25.1	-174.8	53.8	0	0	0	0	114.1	F74	F74-S77 VanDerWaalsContact O-CA 3.31Å; F74-S77 WeakPolarHBondContact O-CA 3.42Å; F74-S77 PolarHBondContact O-N 2.9Å
78	F	87.1	Confident	77.6	Confident	112 Å²	112	56.3 Å²	56.3	49%	0.491	31%	0.31	S	S	.	.	S	Bend	trans	-142.9	152.1	163.2	58.7	-88.2	0	0	0	106.9	P76 F165	P76-F78 WeakPolarHBondContact CB-O 3.44Å; F78-F165 HydrophobicContact CB-CE2 4.44Å; F78-F165 HydrophobicContact CD2-CD2 4.19Å; F78-F165 HydrophobicContact CD2-CE2 4.23Å
79	L	89	Confident	79.3	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	118.9	179	178	55.3	0	0	0	110.5	P76 F81 V92 V94 I137 Y162 Q163 V164 F165	P76-L79 HydrophobicContact CG-CD1 4.43Å; L79-F81 HydrophobicContact CD1-CE2 4.46Å; L79-F81 HydrophobicContact CD2-CD2 4.23Å; L79-F81 HydrophobicContact CD2-CE1 4.46Å; L79-F81 HydrophobicContact CD2-CE2 3.4Å; L79-F81 HydrophobicContact CD2-CZ 3.55Å; L79-F81 HydrophobicContact CG-CD2 4.03Å; L79-F81 HydrophobicContact CG-CE2 3.7Å; L79-F81 HydrophobicContact CG-CZ 4.18Å; L79-V92 HydrophobicContact CD1-CB 3.88Å; L79-V92 HydrophobicContact CD1-CG1 3.71Å; L79-V92 HydrophobicContact CD1-CG2 4.04Å; L79-V92 HydrophobicContact CD2-CB 4.21Å; L79-V94 HydrophobicContact CD2-CG2 4.17Å; L79-I137 HydrophobicContact CD2-CB 3.77Å; L79-I137 HydrophobicContact CD2-CD1 3.75Å; L79-I137 HydrophobicContact CD2-CG1 4.28Å; L79-I137 HydrophobicContact CD2-CG2 3.92Å; L79-Y162 HydrophobicContact CB-CE1 3.82Å; L79-Y162 WeakPolarHBondContact CB-OH 3.21Å; L79-Y162 PolarHBondContact N-OH 2.99Å; L79-Q163 PolarHBondContact N-O 2.94Å; L79-V164 HydrophobicContact CB-CG1 4.08Å; L79-V164 HydrophobicContact CB-CG2 4.41Å; L79-V164 HydrophobicContact CD2-CG1 4.12Å; L79-V164 HydrophobicContact CG-CG1 4.04Å; L79-V164 CarbonylContact O-C 3.24Å; L79-V164 VanDerWaalsContact O-CA 3.27Å; L79-V164 WeakPolarHBondContact O-CA 3.31Å; L79-F165 PolarHBondContact O-N 2.99Å
80	D	89.1	Confident	80.7	Confident	88 Å²	88	50.4 Å²	50.4	47%	0.471	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	124.2	164.5	-171.5	-1.1	0	0	0	109.2	G82 F165 G166	D80-G82 VanDerWaalsContact C-N 3.31Å; D80-G82 PolarHBondContact OD1-N 3.36Å; D80-F165 HydrophobicContact CB-CB 4.29Å; D80-G166 WeakPolarHBondContact OD1-CA 3.44Å
81	F	86.1	Confident	82	Confident	1 Å²	1	49.8 Å²	49.8	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-14.3	174.5	-77.2	-86.1	0	0	0	112.9	L79 Q84 K90 V92 I137 F139 F147 V164 F165	L79-F81 HydrophobicContact CD1-CE2 4.46Å; L79-F81 HydrophobicContact CD2-CD2 4.23Å; L79-F81 HydrophobicContact CD2-CE1 4.46Å; L79-F81 HydrophobicContact CD2-CE2 3.4Å; L79-F81 HydrophobicContact CD2-CZ 3.55Å; L79-F81 HydrophobicContact CG-CD2 4.03Å; L79-F81 HydrophobicContact CG-CE2 3.7Å; L79-F81 HydrophobicContact CG-CZ 4.18Å; F81-Q84 HydrophobicContact CB-CG 4.46Å; F81-Q84 PolarHBondContact O-NE2 3.01Å; F81-K90 HydrophobicContact CD1-CB 4.07Å; F81-K90 HydrophobicContact CD1-CD 3.94Å; F81-K90 HydrophobicContact CD1-CG 3.81Å; F81-K90 HydrophobicContact CE1-CB 4.39Å; F81-K90 HydrophobicContact CE1-CG 4.17Å; F81-K90 VanDerWaalsContact CE1-O 3.29Å; F81-K90 WeakPolarHBondContact CE1-O 3.38Å; F81-K90 PolarHBondContact O-NZ 3.19Å; F81-V92 HydrophobicContact CD1-CG2 4.19Å; F81-V92 HydrophobicContact CE1-CB 4.28Å; F81-V92 HydrophobicContact CE1-CG2 3.79Å; F81-V92 HydrophobicContact CZ-CG2 4.49Å; F81-I137 HydrophobicContact CE2-CG2 4.09Å; F81-I137 HydrophobicContact CZ-CB 4.36Å; F81-I137 HydrophobicContact CZ-CG2 3.95Å; F81-F139 HydrophobicContact CB-CB 4.39Å; F81-F139 HydrophobicContact CB-CD1 3.69Å; F81-F139 HydrophobicContact CB-CE1 4.36Å; F81-F139 HydrophobicContact CB-CG 4.36Å; F81-F139 HydrophobicContact CD1-CB 3.63Å; F81-F139 HydrophobicContact CD1-CD1 4.24Å; F81-F139 HydrophobicContact CD1-CG 4.42Å; F81-F139 HydrophobicContact CD2-CB 3.54Å; F81-F139 HydrophobicContact CD2-CD1 4.31Å; F81-F139 HydrophobicContact CD2-CG 4.13Å; F81-F139 HydrophobicContact CE1-CB 3.63Å; F81-F139 HydrophobicContact CE2-CB 3.53Å; F81-F139 HydrophobicContact CG-CB 3.58Å; F81-F139 AromaticContact CG-CD1 3.83Å; F81-F139 HydrophobicContact CG-CD1 3.83Å; F81-F139 HydrophobicContact CG-CG 4.05Å; F81-F139 HydrophobicContact CZ-CB 3.57Å; F81-F147 HydrophobicContact CD2-CZ 4.24Å; F81-V164 HydrophobicContact CD2-CG1 3.95Å; F81-V164 HydrophobicContact CE2-CG1 3.65Å; F81-F165 PolarHBondContact N-O 3.1Å
82	G	85.8	Confident	82.9	Confident	28 Å²	28	51.4 Å²	51.4	29%	0.289	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	65.9	-165.1	-170.2	0	0	0	0	0	112.3	D80 Q84 S167	D80-G82 VanDerWaalsContact C-N 3.31Å; D80-G82 PolarHBondContact OD1-N 3.36Å; G82-Q84 PolarHBondContact O-N 3.42Å; G82-S167 PolarHBondContact O-N 2.98Å
83	E	82.3	Confident	83.3	Confident	139 Å²	139	55.4 Å²	55.4	65%	0.65	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.3	128.2	171.3	-64.6	-176.5	167.3	0	0	110.7	Y169	E83-Y169 HydrophobicContact CB-CD1 3.89Å; E83-Y169 HydrophobicContact CB-CE1 3.86Å
84	Q	83.8	Confident	83.4	Confident	26 Å²	26	53 Å²	53	12%	0.121	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	146.3	175.5	-65.7	-60.1	-62.5	0	0	112.3	F81 G82 F86 K90 F139 P141 S167 S168 Y169	F81-Q84 HydrophobicContact CB-CG 4.46Å; F81-Q84 PolarHBondContact O-NE2 3.01Å; G82-Q84 PolarHBondContact O-N 3.42Å; Q84-F86 PolarHBondContact O-N 2.86Å; Q84-K90 HydrophobicContact CG-CB 4.39Å; Q84-K90 HydrophobicContact CG-CD 4.06Å; Q84-F139 HydrophobicContact CB-CD1 4.29Å; Q84-F139 HydrophobicContact CB-CE1 3.85Å; Q84-F139 HydrophobicContact CG-CD1 3.95Å; Q84-F139 HydrophobicContact CG-CE1 3.9Å; Q84-P141 HydrophobicContact CB-CG 4.38Å; Q84-S167 PolarHBondContact N-O 3.1Å; Q84-S168 WeakPolarHBondContact O-CA 3.32Å; Q84-S168 VanDerWaalsContact O-CB 3.3Å; Q84-S168 WeakPolarHBondContact O-CB 3.47Å; Q84-Y169 WeakPolarHBondContact O-CD1 3.42Å; Q84-Y169 PolarHBondContact O-N 3.31Å; Q84-Y169 VanDerWaalsContact O-N 3.08Å
85	P	75.6	Confident	83.4	Confident	8 Å²	8	53.3 Å²	53.3	5%	0.052	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	137.5	174.3	-20.3	32	0	0	0	112.1	S87 H88 P141 Y169 Y174	P85-S87 PolarHBondContact O-N 3.12Å; P85-H88 HydrophobicContact CB-CB 3.96Å; P85-H88 HydrophobicContact CG-CB 4.37Å; P85-H88 WeakPolarHBondContact O-CB 3.48Å; P85-H88 PolarHBondContact O-N 3.4Å; P85-P141 WeakPolarHBondContact O-CG 3.39Å; P85-Y169 CarbonylContact C-O 3.58Å; P85-Y169 WeakPolarHBondContact CA-O 3.05Å; P85-Y169 HydrophobicContact CG-CE1 4.44Å; P85-Y174 HydrophobicContact CB-CD2 3.59Å; P85-Y174 HydrophobicContact CB-CE2 3.54Å; P85-Y174 HydrophobicContact CG-CD2 3.98Å; P85-Y174 HydrophobicContact CG-CE2 3.36Å
86	F	77.4	Confident	83.5	Confident	16 Å²	16	47.5 Å²	47.5	7%	0.07	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	133.5	175.2	-176.9	-88.8	0	0	0	111.3	Q84 H88 Y142 V144 Y169 I170 P177 L327	Q84-F86 PolarHBondContact O-N 2.86Å; F86-H88 PolarHBondContact O-N 1.89Å; F86-Y142 VanDerWaalsContact CE2-C 3.45Å; F86-Y142 WeakPolarHBondContact CE2-O 3.12Å; F86-V144 HydrophobicContact CD2-CG2 3.99Å; F86-V144 HydrophobicContact CE2-CG2 4.39Å; F86-Y169 PolarHBondContact N-O 2.65Å; F86-I170 HydrophobicContact CB-CG1 3.88Å; F86-I170 HydrophobicContact CD2-CG1 4.45Å; F86-I170 HydrophobicContact CG-CG1 4.14Å; F86-P177 HydrophobicContact CE1-CG 4.15Å; F86-L327 HydrophobicContact CE1-CD2 4.37Å; F86-L327 HydrophobicContact CZ-CB 4.4Å; F86-L327 HydrophobicContact CZ-CD2 4.3Å
87	S	72.5	Confident	83.4	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.021	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	11	-174.5	70.3	0	0	0	0	117.3	P85 P141 P177 S310	P85-S87 PolarHBondContact O-N 3.12Å; S87-P141 WeakPolarHBondContact CA-O 3.17Å; S87-P141 PolarHBondContact N-O 3.2Å; S87-P177 WeakPolarHBondContact OG-CD 3.08Å; S87-P177 WeakPolarHBondContact OG-CG 3.42Å; S87-S310 WeakPolarHBondContact CB-O 3.44Å; S87-S310 PolarHBondContact O-N 2.72Å
88	H	75.6	Confident	83.6	Confident	54 Å²	54	43 Å²	43	25%	0.25	22%	0.22	C	C	.	.			trans	-98.1	115.7	173.2	-170.4	59.5	0	0	0	111.9	P85 F86 P141	P85-H88 HydrophobicContact CB-CB 3.96Å; P85-H88 HydrophobicContact CG-CB 4.37Å; P85-H88 WeakPolarHBondContact O-CB 3.48Å; P85-H88 PolarHBondContact O-N 3.4Å; F86-H88 PolarHBondContact O-N 1.89Å; H88-P141 WeakPolarHBondContact O-CD 3.24Å
89	P	76.1	Confident	83.5	Confident	35 Å²	35	42.3 Å²	42.3	23%	0.227	22%	0.221	C	C	.	.			trans	-75.2	129	178.6	27	-31	0	0	0	112.4	T138 F139 L140	P89-T138 HydrophobicContact CB-CG2 4.29Å; P89-F139 WeakPolarHBondContact CA-O 3.23Å; P89-L140 HydrophobicContact CB-CB 4.43Å; P89-L140 HydrophobicContact CB-CD1 3.96Å; P89-L140 HydrophobicContact CB-CD2 4.44Å; P89-L140 HydrophobicContact CB-CG 4.48Å; P89-L140 HydrophobicContact CG-CD1 4.42Å
90	K	82.2	Confident	83	Confident	71 Å²	71	44.4 Å²	44.4	31%	0.309	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.7	168	-179.6	171.4	167.9	-177	0	109.6	F81 Q84 T138 F139	F81-K90 HydrophobicContact CD1-CB 4.07Å; F81-K90 HydrophobicContact CD1-CD 3.94Å; F81-K90 HydrophobicContact CD1-CG 3.81Å; F81-K90 HydrophobicContact CE1-CB 4.39Å; F81-K90 HydrophobicContact CE1-CG 4.17Å; F81-K90 VanDerWaalsContact CE1-O 3.29Å; F81-K90 WeakPolarHBondContact CE1-O 3.38Å; F81-K90 PolarHBondContact O-NZ 3.19Å; Q84-K90 HydrophobicContact CG-CB 4.39Å; Q84-K90 HydrophobicContact CG-CD 4.06Å; K90-T138 CarbonylContact O-C 3.4Å; K90-T138 WeakPolarHBondContact O-CA 3.28Å; K90-F139 PolarHBondContact N-O 3.17Å; K90-F139 PolarHBondContact O-N 3.4Å
91	H	81.9	Confident	82.1	Confident	98 Å²	98	44 Å²	44	45%	0.454	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	146.5	175.3	59	-92.3	0	0	0	110.7	I137	H91-I137 CarbonylContact C-O 3.54Å; H91-I137 WeakPolarHBondContact CA-O 3.23Å
92	V	85.5	Confident	81.6	Confident	39 Å²	39	51.5 Å²	51.5	24%	0.236	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	132.3	172.4	178	0	0	0	0	108.2	L79 F81 I137	L79-V92 HydrophobicContact CD1-CB 3.88Å; L79-V92 HydrophobicContact CD1-CG1 3.71Å; L79-V92 HydrophobicContact CD1-CG2 4.04Å; L79-V92 HydrophobicContact CD2-CB 4.21Å; F81-V92 HydrophobicContact CD1-CG2 4.19Å; F81-V92 HydrophobicContact CE1-CB 4.28Å; F81-V92 HydrophobicContact CE1-CG2 3.79Å; F81-V92 HydrophobicContact CZ-CG2 4.49Å; V92-I137 PolarHBondContact N-O 2.67Å; V92-I137 PolarHBondContact O-N 3.39Å
93	E	86.2	Confident	81.3	Confident	99 Å²	99	54.8 Å²	54.8	46%	0.463	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	135.2	171.9	-174	166.5	-158.9	0	0	109.7	N134 N136	E93-N134 HydrophobicContact CG-CB 3.98Å; E93-N134 WeakPolarHBondContact OE1-CB 3.44Å; E93-N134 PolarHBondContact OE1-ND2 2.84Å; E93-N136 WeakPolarHBondContact CA-OD1 3.43Å; E93-N136 VanDerWaalsContact CB-OD1 3.29Å; E93-N136 WeakPolarHBondContact CB-OD1 3.26Å; E93-N136 WeakPolarHBondContact CG-OD1 3.39Å
94	V	87.9	Confident	81.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	127.6	176.8	-179.8	0	0	0	0	109.1	F74 L79 N134 F135 I137 Y162	F74-V94 HydrophobicContact CD1-CG1 4.42Å; L79-V94 HydrophobicContact CD2-CG2 4.17Å; V94-N134 WeakPolarHBondContact O-CA 3.03Å; V94-F135 HydrophobicContact CB-CD1 4.17Å; V94-F135 HydrophobicContact CB-CE1 3.69Å; V94-F135 HydrophobicContact CB-CZ 4.05Å; V94-F135 HydrophobicContact CG1-CE1 3.67Å; V94-F135 HydrophobicContact CG1-CZ 4.09Å; V94-F135 PolarHBondContact N-O 2.72Å; V94-F135 WeakPolarHBondContact O-CD1 3.31Å; V94-F135 PolarHBondContact O-N 3.33Å; V94-I137 HydrophobicContact CB-CD1 4.47Å; V94-I137 HydrophobicContact CG2-CD1 3.68Å; V94-I137 HydrophobicContact CG2-CG1 4.12Å; V94-Y162 HydrophobicContact CG1-CE1 4.26Å; V94-Y162 HydrophobicContact CG1-CE2 4.25Å; V94-Y162 HydrophobicContact CG2-CE1 4.21Å
95	T	88	Confident	81.2	Confident	37 Å²	37	50 Å²	50	23%	0.227	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.5	179	-58.4	0	0	0	0	109.7	F74 E75 T97 N134	F74-T95 WeakPolarHBondContact CA-O 3.47Å; E75-T95 PolarHBondContact N-O 3.44Å; E75-T95 PolarHBondContact O-N 3.17Å; T95-T97 HydrophobicContact CG2-CG2 4.21Å; T95-N134 PolarHBondContact OG1-OD1 3.35Å
96	I	88.5	Confident	81.5	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	126.1	168.9	-50.5	-176.4	0	0	0	108	L72 F74 L107 F122 L127 S132 A133 F135 I153	L72-I96 HydrophobicContact CD2-CG2 3.95Å; F74-I96 HydrophobicContact CD1-CD1 4.48Å; F74-I96 HydrophobicContact CD1-CG1 3.9Å; F74-I96 HydrophobicContact CE1-CD1 3.83Å; F74-I96 HydrophobicContact CE1-CG1 3.72Å; F74-I96 HydrophobicContact CE1-CG2 4.21Å; I96-L107 HydrophobicContact CD1-CD1 4.24Å; I96-F122 HydrophobicContact CD1-CD1 4.35Å; I96-F122 HydrophobicContact CD1-CE1 3.59Å; I96-F122 HydrophobicContact CD1-CZ 4.22Å; I96-L127 HydrophobicContact CG2-CD1 3.98Å; I96-S132 CarbonylContact O-C 3.56Å; I96-S132 WeakPolarHBondContact O-CA 3.21Å; I96-A133 PolarHBondContact N-O 3.07Å; I96-A133 PolarHBondContact O-N 3.11Å; I96-F135 HydrophobicContact CD1-CD1 3.93Å; I96-F135 HydrophobicContact CD1-CE1 3.66Å; I96-F135 HydrophobicContact CG1-CD1 3.97Å; I96-F135 HydrophobicContact CG1-CE1 3.67Å; I96-I153 HydrophobicContact CD1-CD1 4.02Å
97	T	86.9	Confident	81.7	Confident	42 Å²	42	52.6 Å²	52.6	26%	0.258	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	132.6	174.9	47.3	0	0	0	0	110.5	L72 S73 T95 I99	L72-T97 WeakPolarHBondContact CA-O 3.46Å; S73-T97 VanDerWaalsContact CB-OG1 3.31Å; S73-T97 WeakPolarHBondContact CB-OG1 3.4Å; S73-T97 PolarHBondContact N-O 3.01Å; S73-T97 PolarHBondContact O-N 2.96Å; S73-T97 PolarHBondContact O-OG1 3.28Å; T95-T97 HydrophobicContact CG2-CG2 4.21Å; T97-I99 PolarHBondContact O-N 3.23Å
98	N	88	Confident	82	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	111.1	166.7	-179.7	7.1	0	0	0	108.9	G71 D100 Q103 I105 L127 S128 A130 S131	G71-N98 PolarHBondContact O-OD1 3.35Å; G71-N98 VanDerWaalsContact O-OD1 3.1Å; N98-D100 WeakPolarHBondContact OD1-CB 3.3Å; N98-D100 PolarHBondContact OD1-N 2.94Å; N98-Q103 PolarHBondContact ND2-O 2.89Å; N98-I105 WeakPolarHBondContact OD1-CD1 3.43Å; N98-L127 HydrophobicContact CB-CB 3.79Å; N98-L127 HydrophobicContact CB-CD1 4.28Å; N98-L127 PolarHBondContact ND2-O 3.31Å; N98-S128 PolarHBondContact ND2-O 3.41Å; N98-A130 WeakPolarHBondContact O-CA 3.49Å; N98-A130 PolarHBondContact O-N 3.19Å; N98-S131 PolarHBondContact N-O 3.12Å
99	I	85	Confident	82	Confident	97 Å²	97	56.1 Å²	56.1	50%	0.497	31%	0.313	S	S	.	.			trans	-99.1	1.7	178.5	58	165.8	0	0	0	112.6	S70 G71 T97	S70-I99 VanDerWaalsContact O-CD1 3.31Å; S70-I99 WeakPolarHBondContact O-CD1 3.13Å; G71-I99 WeakPolarHBondContact O-CG1 3.19Å; G71-I99 PolarHBondContact O-N 2.95Å; T97-I99 PolarHBondContact O-N 3.23Å
100	D	78.5	Confident	81.9	Confident	50 Å²	50	56.1 Å²	56.1	27%	0.267	31%	0.313	S	S	.	.			trans	-67.9	135.4	164.2	-160.5	-60.5	0	0	0	109.6	G71 N98 D102 Q103 P129	G71-D100 PolarHBondContact O-N 3.44Å; N98-D100 WeakPolarHBondContact OD1-CB 3.3Å; N98-D100 PolarHBondContact OD1-N 2.94Å; D100-D102 PolarHBondContact OD1-N 2.99Å; D100-Q103 PolarHBondContact OD1-N 2.74Å; D100-P129 WeakPolarHBondContact O-CA 3.23Å; D100-P129 WeakPolarHBondContact O-CB 3.39Å
101	A	69.9	Low	81.6	Confident	80 Å²	80	53.7 Å²	53.7	66%	0.661	30%	0.302	S	S	*	.	S	Bend	trans	-85.3	-26.3	-174.5	0	0	0	0	0	113.2	P129	A101-P129 WeakPolarHBondContact O-CB 2.99Å
102	D	76.9	Confident	80.8	Confident	158 Å²	158	50.2 Å²	50.2	85%	0.845	29%	0.293	S	S	*	.	S	Bend	trans	-120.7	-23.3	-169	-69.4	-44.4	0	0	0	112.7	D100	D100-D102 PolarHBondContact OD1-N 2.99Å
103	Q	78.1	Confident	79.7	Confident	96 Å²	96	53.5 Å²	53.5	45%	0.449	31%	0.313	S	S	.	.			trans	-111.2	132	-173.3	-169.2	159.8	11.1	0	0	114.3	N98 D100	N98-Q103 PolarHBondContact ND2-O 2.89Å; D100-Q103 PolarHBondContact OD1-N 2.74Å
104	S	81.6	Confident	78.7	Confident	65 Å²	65	50 Å²	50	46%	0.455	30%	0.299	S	S	.	.			trans	-80	135	169.3	56.5	0	0	0	0	111.8	L127	S104-L127 CarbonylContact C-O 3.42Å; S104-L127 VanDerWaalsContact CA-O 3.23Å; S104-L127 WeakPolarHBondContact CA-O 3.47Å
105	I	83.2	Confident	77.4	Confident	1 Å²	1	54 Å²	54	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	118	-177.4	-56.3	178	0	0	0	109.3	L72 N98 L127 T155 L157	L72-I105 HydrophobicContact CD1-CG2 4.43Å; L72-I105 HydrophobicContact CD2-CD1 3.8Å; L72-I105 HydrophobicContact CD2-CG2 4.39Å; L72-I105 HydrophobicContact CG-CD1 3.91Å; N98-I105 WeakPolarHBondContact OD1-CD1 3.43Å; I105-L127 PolarHBondContact N-O 3.38Å; I105-L127 WeakPolarHBondContact O-CB 3.49Å; I105-L127 PolarHBondContact O-N 2.8Å; I105-T155 HydrophobicContact CG2-CG2 4.18Å; I105-L157 HydrophobicContact CD1-CD1 3.88Å; I105-L157 HydrophobicContact CG1-CD1 3.81Å; I105-L157 HydrophobicContact CG1-CG 4.44Å
106	D	81.4	Confident	76.6	Confident	73 Å²	73	53.4 Å²	53.4	39%	0.39	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	134.2	174	-59.1	-45.3	0	0	0	109.8	T125 A126 T155 S156	D106-T125 CarbonylContact C-O 3.59Å; D106-T125 VanDerWaalsContact CA-O 3.31Å; D106-T125 WeakPolarHBondContact CA-O 3.38Å; D106-A126 VanDerWaalsContact OD1-CB 3.3Å; D106-A126 WeakPolarHBondContact OD1-CB 3.5Å; D106-T155 CarbonylContact O-C 3.58Å; D106-T155 WeakPolarHBondContact O-CA 3.38Å; D106-T155 VanDerWaalsContact O-CB 3.29Å; D106-T155 WeakPolarHBondContact O-CB 3.05Å; D106-S156 PolarHBondContact N-OG 3.31Å; D106-S156 PolarHBondContact O-N 3Å
107	L	81.7	Confident	75.9	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.026	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	107.4	171.4	-57.9	-179.8	0	0	0	108.2	I96 F122 T125 L127 A133 I153 T155	I96-L107 HydrophobicContact CD1-CD1 4.24Å; L107-F122 HydrophobicContact CB-CD2 3.74Å; L107-F122 HydrophobicContact CB-CE2 3.81Å; L107-F122 HydrophobicContact CB-CG 4.34Å; L107-F122 HydrophobicContact CB-CZ 4.47Å; L107-F122 HydrophobicContact CD1-CB 4.36Å; L107-F122 HydrophobicContact CD1-CD1 3.77Å; L107-F122 HydrophobicContact CD1-CD2 3.99Å; L107-F122 HydrophobicContact CD1-CE1 4Å; L107-F122 HydrophobicContact CD1-CE2 4.19Å; L107-F122 HydrophobicContact CD1-CG 3.78Å; L107-F122 HydrophobicContact CD1-CZ 4.18Å; L107-T125 PolarHBondContact N-O 2.95Å; L107-L127 HydrophobicContact CD1-CD1 4.1Å; L107-L127 HydrophobicContact CD1-CG 4.35Å; L107-L127 HydrophobicContact CD2-CD1 4.15Å; L107-L127 HydrophobicContact CG-CD1 4.17Å; L107-L127 HydrophobicContact CG-CG 4.42Å; L107-A133 HydrophobicContact CD1-CB 4.33Å; L107-I153 HydrophobicContact CD2-CG2 4.11Å; L107-T155 HydrophobicContact CD2-CG2 3.9Å
108	V	78.3	Confident	75.4	Confident	83 Å²	83	53.9 Å²	53.9	50%	0.503	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-54.8	-167.4	-178	0	0	0	0	111.5	Q154	V108-Q154 HydrophobicContact CB-CB 4.42Å; V108-Q154 HydrophobicContact CB-CG 4.4Å; V108-Q154 WeakPolarHBondContact CB-O 3.39Å; V108-Q154 PolarHBondContact N-O 3.02Å
109	T	76.2	Confident	75	Confident	47 Å²	47	57 Å²	57	29%	0.288	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	162.5	179.9	50.1	0	0	0	0	111.3	Q154	T109-Q154 PolarHBondContact N-O 2.97Å; T109-Q154 PolarHBondContact O-N 3.41Å; T109-Q154 WeakPolarHBondContact OG1-CB 2.94Å
110	T	74.8	Confident	74.5	Confident	36 Å²	36	53.5 Å²	53.5	22%	0.221	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.1	164.9	35.6	0	0	0	0	110.9	W119 F122 I151 Y152 I153	T110-W119 VanDerWaalsContact CB-NE1 3.34Å; T110-W119 PolarHBondContact OG1-NE1 3.08Å; T110-F122 HydrophobicContact CG2-CE1 4.42Å; T110-F122 HydrophobicContact CG2-CE2 3.79Å; T110-F122 HydrophobicContact CG2-CZ 3.42Å; T110-F122 VanDerWaalsContact CG2-CZ 3.42Å; T110-I151 HydrophobicContact CG2-CG2 4.2Å; T110-Y152 WeakPolarHBondContact CA-O 3.39Å; T110-I153 HydrophobicContact CG2-CB 4.33Å; T110-I153 HydrophobicContact CG2-CG1 3.71Å; T110-I153 HydrophobicContact CG2-CG2 4.45Å
111	F	74.8	Confident	74	Confident	19 Å²	19	59.4 Å²	59.4	8%	0.083	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	151.6	174.2	58.8	-88.7	0	0	0	110.1	L54 Y152 Q154 V159	L54-F111 HydrophobicContact CD1-CE1 4.43Å; L54-F111 HydrophobicContact CD1-CE2 3.53Å; L54-F111 HydrophobicContact CD1-CZ 3.32Å; F111-Y152 HydrophobicContact CD2-CD2 4.23Å; F111-Y152 HydrophobicContact CD2-CG 4.3Å; F111-Y152 HydrophobicContact CE2-CD2 4.03Å; F111-Y152 AromaticContact CE2-CG 3.76Å; F111-Y152 HydrophobicContact CE2-CG 3.76Å; F111-Y152 VanDerWaalsContact CZ-CB 3.48Å; F111-Y152 HydrophobicContact CZ-CG 4.26Å; F111-Y152 PolarHBondContact N-O 3.01Å; F111-Y152 WeakPolarHBondContact O-CA 2.87Å; F111-Y152 WeakPolarHBondContact O-CB 3.42Å; F111-Y152 PolarHBondContact O-N 3.11Å; F111-Q154 HydrophobicContact CE1-CB 4.2Å; F111-V159 HydrophobicContact CZ-CG1 3.94Å; F111-V159 HydrophobicContact CZ-CG2 4.42Å
112	G	66.2	Low	74.1	Confident	25 Å²	25	56.8 Å²	56.8	26%	0.258	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.4	164.2	-177.1	0	0	0	0	0	110.8
113	V	61.1	Low	73.7	Confident	109 Å²	109	55.5 Å²	55.5	66%	0.661	29%	0.292	S	S	*	.			trans	-118	94.3	-177.5	-173.6	0	0	0	0	108.8	F51 T149	F51-V113 HydrophobicContact CE2-CG2 4.13Å; F51-V113 HydrophobicContact CZ-CG2 4.32Å; V113-T149 PolarHBondContact O-OG1 2.03Å
114	S	65.3	Low	73.2	Confident	25 Å²	25	56 Å²	56	18%	0.175	30%	0.295	C	S	.	.			trans	-140.7	132.2	172.7	-170.5	0	0	0	0	111.8	F116 I117	S114-F116 PolarHBondContact OG-N 3.02Å; S114-I117 PolarHBondContact OG-N 2.79Å; S114-I117 VanDerWaalsContact OG-N 3.12Å
115	Q	62.1	Low	72.9	Confident	83 Å²	83	57.4 Å²	57.4	39%	0.388	30%	0.3	S	S	.	.	S	Bend	trans	-77.8	-29	171.1	-70.7	178.8	-35.5	0	0	111.3	K315	Q115-K315 WeakPolarHBondContact O-CD 3.5Å; Q115-K315 PolarHBondContact O-NZ 2.9Å
116	F	70.1	Confident	72.7	Confident	26 Å²	26	59.7 Å²	59.7	11%	0.114	32%	0.32	C	S	.	.	S	Bend	trans	-106	-10.6	-169.7	-42.3	-60.6	0	0	0	114.1	S114 F139 L140 Y142 T143 F147	S114-F116 PolarHBondContact OG-N 3.02Å; F116-F139 HydrophobicContact CB-CD2 3.8Å; F116-F139 HydrophobicContact CB-CE2 3.62Å; F116-F139 HydrophobicContact CG-CE2 4.43Å; F116-F139 WeakPolarHBondContact O-CA 3.34Å; F116-L140 PolarHBondContact O-N 2.93Å; F116-Y142 HydrophobicContact CD1-CD2 4.35Å; F116-T143 HydrophobicContact CE1-CG2 3.93Å; F116-T143 WeakPolarHBondContact CE2-OG1 3.15Å; F116-T143 HydrophobicContact CZ-CG2 3.68Å; F116-T143 WeakPolarHBondContact CZ-OG1 3.16Å; F116-F147 HydrophobicContact CD2-CB 4.45Å
117	I	74.1	Confident	72.7	Confident	4 Å²	4	56.2 Å²	56.2	2%	0.021	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	140.9	-178.9	-72.1	159.2	0	0	0	111.1	S114 W119 I137 T138 F139 F147 T149 I151 V164	S114-I117 PolarHBondContact OG-N 2.79Å; S114-I117 VanDerWaalsContact OG-N 3.12Å; I117-W119 HydrophobicContact CG2-CE3 4.04Å; I117-W119 HydrophobicContact CG2-CZ3 4.41Å; I117-I137 HydrophobicContact CG2-CG2 3.47Å; I117-I137 VanDerWaalsContact CG2-CG2 3.47Å; I117-T138 WeakPolarHBondContact CA-O 3.2Å; I117-F139 HydrophobicContact CG1-CB 4.11Å; I117-F139 HydrophobicContact CG1-CD2 4.08Å; I117-F147 HydrophobicContact CD1-CD2 4.1Å; I117-F147 HydrophobicContact CD1-CE2 3.23Å; I117-F147 HydrophobicContact CD1-CZ 3.71Å; I117-F147 HydrophobicContact CG1-CE2 4.31Å; I117-F147 HydrophobicContact CG1-CZ 4.48Å; I117-T149 HydrophobicContact CD1-CG2 3.51Å; I117-I151 HydrophobicContact CG2-CD1 4.42Å; I117-V164 HydrophobicContact CD1-CB 3.92Å; I117-V164 HydrophobicContact CD1-CG1 3.4Å; I117-V164 VanDerWaalsContact CD1-CG1 3.4Å
118	F	75.4	Confident	72.8	Confident	48 Å²	48	59.4 Å²	59.4	21%	0.211	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	154.3	173.9	-54.7	-103.8	0	0	0	107.7	I137 T138 L140 K315	F118-I137 WeakPolarHBondContact O-CA 3.2Å; F118-T138 PolarHBondContact N-O 3.32Å; F118-T138 PolarHBondContact O-N 2.88Å; F118-L140 HydrophobicContact CE2-CB 4.25Å; F118-L140 HydrophobicContact CE2-CD2 4.28Å; F118-K315 HydrophobicContact CZ-CD 4.18Å
119	W	79.6	Confident	72.9	Confident	66 Å²	66	58 Å²	58	25%	0.25	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.8	176.6	54.6	82.8	0	0	0	111.8	T110 I117 F135 N136 I137 I151	T110-W119 VanDerWaalsContact CB-NE1 3.34Å; T110-W119 PolarHBondContact OG1-NE1 3.08Å; I117-W119 HydrophobicContact CG2-CE3 4.04Å; I117-W119 HydrophobicContact CG2-CZ3 4.41Å; W119-F135 HydrophobicContact CB-CD2 4.25Å; W119-F135 HydrophobicContact CB-CE2 4.48Å; W119-N136 CarbonylContact C-O 3.46Å; W119-N136 WeakPolarHBondContact CA-O 3.4Å; W119-I137 HydrophobicContact CB-CG1 4.36Å; W119-I151 HydrophobicContact CB-CD1 4.44Å; W119-I151 HydrophobicContact CD2-CD1 4.01Å; W119-I151 HydrophobicContact CD2-CG1 4.41Å; W119-I151 HydrophobicContact CD2-CG2 4.26Å; W119-I151 HydrophobicContact CE3-CD1 3.56Å; W119-I151 HydrophobicContact CE3-CG1 3.82Å; W119-I151 HydrophobicContact CE3-CG2 4.44Å; W119-I151 HydrophobicContact CG-CD1 4.39Å; W119-I151 HydrophobicContact CZ2-CG2 4.49Å; W119-I151 HydrophobicContact CZ3-CD1 4.19Å; W119-I151 HydrophobicContact CZ3-CG1 3.93Å
120	S	74.4	Confident	73.1	Confident	25 Å²	25	60.3 Å²	60.3	18%	0.175	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-72.6	165.7	176.6	75.2	0	0	0	0	111.8	F135 N136	S120-F135 WeakPolarHBondContact OG-CA 3.43Å; S120-N136 PolarHBondContact N-O 3.33Å; S120-N136 PolarHBondContact OG-N 2.81Å
121	R	69	Low	73.5	Confident	173 Å²	173	60 Å²	60	65%	0.653	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-67.4	158.4	158.4	-65.4	-179.2	-177.5	149.1	5.3	109.2
122	F	72.2	Confident	74	Confident	25 Å²	25	62 Å²	62	11%	0.11	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-71.4	138.6	174.4	-58.2	-65.1	0	0	0	111.1	I96 L107 T110 Q124 F135 I153	I96-F122 HydrophobicContact CD1-CD1 4.35Å; I96-F122 HydrophobicContact CD1-CE1 3.59Å; I96-F122 HydrophobicContact CD1-CZ 4.22Å; L107-F122 HydrophobicContact CB-CD2 3.74Å; L107-F122 HydrophobicContact CB-CE2 3.81Å; L107-F122 HydrophobicContact CB-CG 4.34Å; L107-F122 HydrophobicContact CB-CZ 4.47Å; L107-F122 HydrophobicContact CD1-CB 4.36Å; L107-F122 HydrophobicContact CD1-CD1 3.77Å; L107-F122 HydrophobicContact CD1-CD2 3.99Å; L107-F122 HydrophobicContact CD1-CE1 4Å; L107-F122 HydrophobicContact CD1-CE2 4.19Å; L107-F122 HydrophobicContact CD1-CG 3.78Å; L107-F122 HydrophobicContact CD1-CZ 4.18Å; T110-F122 HydrophobicContact CG2-CE1 4.42Å; T110-F122 HydrophobicContact CG2-CE2 3.79Å; T110-F122 HydrophobicContact CG2-CZ 3.42Å; T110-F122 VanDerWaalsContact CG2-CZ 3.42Å; F122-Q124 VanDerWaalsContact C-N 3.25Å; F122-Q124 WeakPolarHBondContact CB-O 3.25Å; F122-Q124 PolarHBondContact O-N 2.88Å; F122-F135 HydrophobicContact CD1-CB 3.85Å; F122-F135 HydrophobicContact CD1-CD1 4.23Å; F122-F135 HydrophobicContact CD1-CG 4.1Å; F122-F135 HydrophobicContact CE1-CB 4.1Å; F122-F135 AromaticContact CE1-CD1 3.84Å; F122-F135 HydrophobicContact CE1-CD1 3.84Å; F122-F135 HydrophobicContact CE1-CD2 4.35Å; F122-F135 HydrophobicContact CE1-CE1 4.37Å; F122-F135 AromaticContact CE1-CG 3.84Å; F122-F135 HydrophobicContact CE1-CG 3.84Å; F122-I153 HydrophobicContact CE2-CG2 4.37Å; F122-I153 HydrophobicContact CZ-CG1 4.36Å; F122-I153 HydrophobicContact CZ-CG2 3.85Å
123	N	69	Low	74.9	Confident	131 Å²	131	61 Å²	61	70%	0.701	35%	0.345	S	S	*	.	S	Bend	trans	-70.9	-21.8	174.3	-70.9	-22.5	0	0	0	112.9
124	Q	67.1	Low	76.1	Confident	108 Å²	108	57.8 Å²	57.8	51%	0.505	32%	0.324	S	S	.	.			trans	-139	135.2	171.5	-64.3	-176.4	2.9	0	0	109.4	F122 A133	F122-Q124 VanDerWaalsContact C-N 3.25Å; F122-Q124 WeakPolarHBondContact CB-O 3.25Å; F122-Q124 PolarHBondContact O-N 2.88Å; Q124-A133 HydrophobicContact CB-CB 4.15Å
125	T	74.2	Confident	77	Confident	93 Å²	93	56.7 Å²	56.7	57%	0.571	32%	0.316	S	S	*	.	S	Bend	trans	-100.8	-0.1	-177.7	58.4	0	0	0	0	113.9	D106 L107	D106-T125 CarbonylContact C-O 3.59Å; D106-T125 VanDerWaalsContact CA-O 3.31Å; D106-T125 WeakPolarHBondContact CA-O 3.38Å; L107-T125 PolarHBondContact N-O 2.95Å
126	A	79.5	Confident	78.1	Confident	50 Å²	50	56 Å²	56	41%	0.413	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	106.9	-177.8	0	0	0	0	0	109.7	D106	D106-A126 VanDerWaalsContact OD1-CB 3.3Å; D106-A126 WeakPolarHBondContact OD1-CB 3.5Å
127	L	82.4	Confident	78.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	103.7	179.6	-67.1	173	0	0	0	110.5	L72 I96 N98 S104 I105 L107 S131 A133	L72-L127 HydrophobicContact CD2-CD1 4.05Å; I96-L127 HydrophobicContact CG2-CD1 3.98Å; N98-L127 HydrophobicContact CB-CB 3.79Å; N98-L127 HydrophobicContact CB-CD1 4.28Å; N98-L127 PolarHBondContact ND2-O 3.31Å; S104-L127 CarbonylContact C-O 3.42Å; S104-L127 VanDerWaalsContact CA-O 3.23Å; S104-L127 WeakPolarHBondContact CA-O 3.47Å; I105-L127 PolarHBondContact N-O 3.38Å; I105-L127 WeakPolarHBondContact O-CB 3.49Å; I105-L127 PolarHBondContact O-N 2.8Å; L107-L127 HydrophobicContact CD1-CD1 4.1Å; L107-L127 HydrophobicContact CD1-CG 4.35Å; L107-L127 HydrophobicContact CD2-CD1 4.15Å; L107-L127 HydrophobicContact CG-CD1 4.17Å; L107-L127 HydrophobicContact CG-CG 4.42Å; L127-S131 WeakPolarHBondContact CA-OG 3.12Å; L127-A133 HydrophobicContact CD2-CB 3.61Å; L127-A133 HydrophobicContact CG-CB 4.5Å
128	S	83.2	Confident	79.3	Confident	72 Å²	72	55.6 Å²	55.6	50%	0.503	32%	0.315	S	S	.	.			trans	-57.3	158.9	162.6	-62.2	0	0	0	0	111.8	N98 A130 S131	N98-S128 PolarHBondContact ND2-O 3.41Å; S128-A130 PolarHBondContact O-N 3.38Å; S128-S131 PolarHBondContact N-OG 2.79Å; S128-S131 WeakPolarHBondContact O-CB 2.99Å; S128-S131 PolarHBondContact O-N 3.46Å; S128-S131 PolarHBondContact O-OG 3.16Å
129	P	81.2	Confident	79.7	Confident	52 Å²	52	53.5 Å²	53.5	34%	0.338	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	136.9	169.8	-31.5	38.1	0	0	0	112.7	D100 A101 S131	D100-P129 WeakPolarHBondContact O-CA 3.23Å; D100-P129 WeakPolarHBondContact O-CB 3.39Å; A101-P129 WeakPolarHBondContact O-CB 2.99Å; P129-S131 PolarHBondContact O-N 3.48Å; P129-S131 VanDerWaalsContact O-N 3.1Å
130	A	79.7	Confident	79.6	Confident	96 Å²	96	50.7 Å²	50.7	79%	0.793	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	14.8	-176.1	0	0	0	0	0	116.6	N98 S128	N98-A130 WeakPolarHBondContact O-CA 3.49Å; N98-A130 PolarHBondContact O-N 3.19Å; S128-A130 PolarHBondContact O-N 3.38Å
131	S	83.8	Confident	79.6	Confident	29 Å²	29	49.5 Å²	49.5	20%	0.203	29%	0.288	C	S	.	.			trans	-93.8	161.1	174.9	73.5	0	0	0	0	113	N98 L127 S128 P129	N98-S131 PolarHBondContact N-O 3.12Å; L127-S131 WeakPolarHBondContact CA-OG 3.12Å; S128-S131 PolarHBondContact N-OG 2.79Å; S128-S131 WeakPolarHBondContact O-CB 2.99Å; S128-S131 PolarHBondContact O-N 3.46Å; S128-S131 PolarHBondContact O-OG 3.16Å; P129-S131 PolarHBondContact O-N 3.48Å; P129-S131 VanDerWaalsContact O-N 3.1Å
132	S	85.2	Confident	79.7	Confident	62 Å²	62	43 Å²	43	43%	0.434	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	139.7	-175.9	59.4	0	0	0	0	112.8	I96	I96-S132 CarbonylContact O-C 3.56Å; I96-S132 WeakPolarHBondContact O-CA 3.21Å
133	A	85.1	Confident	79.4	Confident	3 Å²	3	43.4 Å²	43.4	3%	0.025	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	136.3	170.8	0	0	0	0	0	110.7	I96 L107 Q124 L127	I96-A133 PolarHBondContact N-O 3.07Å; I96-A133 PolarHBondContact O-N 3.11Å; L107-A133 HydrophobicContact CD1-CB 4.33Å; Q124-A133 HydrophobicContact CB-CB 4.15Å; L127-A133 HydrophobicContact CD2-CB 3.61Å; L127-A133 HydrophobicContact CG-CB 4.5Å
134	N	84.6	Confident	79.5	Confident	43 Å²	43	37.5 Å²	37.5	23%	0.23	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	151.4	-178.2	-59.1	12.3	0	0	0	110.9	E93 V94 T95	E93-N134 HydrophobicContact CG-CB 3.98Å; E93-N134 WeakPolarHBondContact OE1-CB 3.44Å; E93-N134 PolarHBondContact OE1-ND2 2.84Å; V94-N134 WeakPolarHBondContact O-CA 3.03Å; T95-N134 PolarHBondContact OG1-OD1 3.35Å
135	F	85.4	Confident	79.7	Confident	1 Å²	1	33.3 Å²	33.3	0%	0.004	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	144.3	167.3	71.8	-67.4	0	0	0	110.2	V94 I96 W119 S120 F122 I137	V94-F135 HydrophobicContact CB-CD1 4.17Å; V94-F135 HydrophobicContact CB-CE1 3.69Å; V94-F135 HydrophobicContact CB-CZ 4.05Å; V94-F135 HydrophobicContact CG1-CE1 3.67Å; V94-F135 HydrophobicContact CG1-CZ 4.09Å; V94-F135 PolarHBondContact N-O 2.72Å; V94-F135 WeakPolarHBondContact O-CD1 3.31Å; V94-F135 PolarHBondContact O-N 3.33Å; I96-F135 HydrophobicContact CD1-CD1 3.93Å; I96-F135 HydrophobicContact CD1-CE1 3.66Å; I96-F135 HydrophobicContact CG1-CD1 3.97Å; I96-F135 HydrophobicContact CG1-CE1 3.67Å; W119-F135 HydrophobicContact CB-CD2 4.25Å; W119-F135 HydrophobicContact CB-CE2 4.48Å; S120-F135 WeakPolarHBondContact OG-CA 3.43Å; F122-F135 HydrophobicContact CD1-CB 3.85Å; F122-F135 HydrophobicContact CD1-CD1 4.23Å; F122-F135 HydrophobicContact CD1-CG 4.1Å; F122-F135 HydrophobicContact CE1-CB 4.1Å; F122-F135 AromaticContact CE1-CD1 3.84Å; F122-F135 HydrophobicContact CE1-CD1 3.84Å; F122-F135 HydrophobicContact CE1-CD2 4.35Å; F122-F135 HydrophobicContact CE1-CE1 4.37Å; F122-F135 AromaticContact CE1-CG 3.84Å; F122-F135 HydrophobicContact CE1-CG 3.84Å; F135-I137 HydrophobicContact CD2-CG1 4.05Å; F135-I137 HydrophobicContact CE2-CD1 3.67Å; F135-I137 HydrophobicContact CE2-CG1 3.62Å; F135-I137 HydrophobicContact CZ-CD1 3.92Å; F135-I137 HydrophobicContact CZ-CG1 4.29Å
136	N	83.9	Confident	79.7	Confident	69 Å²	69	35.5 Å²	35.5	37%	0.369	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	137.5	-179.4	-70.5	-16.4	0	0	0	110.3	E93 W119 S120	E93-N136 WeakPolarHBondContact CA-OD1 3.43Å; E93-N136 VanDerWaalsContact CB-OD1 3.29Å; E93-N136 WeakPolarHBondContact CB-OD1 3.26Å; E93-N136 WeakPolarHBondContact CG-OD1 3.39Å; W119-N136 CarbonylContact C-O 3.46Å; W119-N136 WeakPolarHBondContact CA-O 3.4Å; S120-N136 PolarHBondContact N-O 3.33Å; S120-N136 PolarHBondContact OG-N 2.81Å
137	I	86.8	Confident	79.6	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.6	170.7	-54.6	-179.7	0	0	0	108	L79 F81 H91 V92 V94 I117 F118 W119 F135 I151 Y162 V164	L79-I137 HydrophobicContact CD2-CB 3.77Å; L79-I137 HydrophobicContact CD2-CD1 3.75Å; L79-I137 HydrophobicContact CD2-CG1 4.28Å; L79-I137 HydrophobicContact CD2-CG2 3.92Å; F81-I137 HydrophobicContact CE2-CG2 4.09Å; F81-I137 HydrophobicContact CZ-CB 4.36Å; F81-I137 HydrophobicContact CZ-CG2 3.95Å; H91-I137 CarbonylContact C-O 3.54Å; H91-I137 WeakPolarHBondContact CA-O 3.23Å; V92-I137 PolarHBondContact N-O 2.67Å; V92-I137 PolarHBondContact O-N 3.39Å; V94-I137 HydrophobicContact CB-CD1 4.47Å; V94-I137 HydrophobicContact CG2-CD1 3.68Å; V94-I137 HydrophobicContact CG2-CG1 4.12Å; I117-I137 HydrophobicContact CG2-CG2 3.47Å; I117-I137 VanDerWaalsContact CG2-CG2 3.47Å; F118-I137 WeakPolarHBondContact O-CA 3.2Å; W119-I137 HydrophobicContact CB-CG1 4.36Å; F135-I137 HydrophobicContact CD2-CG1 4.05Å; F135-I137 HydrophobicContact CE2-CD1 3.67Å; F135-I137 HydrophobicContact CE2-CG1 3.62Å; F135-I137 HydrophobicContact CZ-CD1 3.92Å; F135-I137 HydrophobicContact CZ-CG1 4.29Å; I137-I151 HydrophobicContact CD1-CD1 3.69Å; I137-I151 HydrophobicContact CG1-CD1 4.2Å; I137-I151 HydrophobicContact CG2-CD1 4.35Å; I137-Y162 HydrophobicContact CD1-CD1 4.08Å; I137-Y162 HydrophobicContact CD1-CE1 3.68Å; I137-V164 HydrophobicContact CD1-CG2 4.38Å
138	T	83.1	Confident	79.6	Confident	22 Å²	22	40 Å²	40	14%	0.135	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119.2	176.8	-57	0	0	0	0	109.5	P89 K90 I117 F118	P89-T138 HydrophobicContact CB-CG2 4.29Å; K90-T138 CarbonylContact O-C 3.4Å; K90-T138 WeakPolarHBondContact O-CA 3.28Å; I117-T138 WeakPolarHBondContact CA-O 3.2Å; F118-T138 PolarHBondContact N-O 3.32Å; F118-T138 PolarHBondContact O-N 2.88Å
139	F	83.6	Confident	79.5	Confident	3 Å²	3	37.3 Å²	37.3	1%	0.013	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	133.7	166.4	170.5	-130.2	0	0	0	109.8	F81 Q84 P89 K90 F116 I117 P141 F147	F81-F139 HydrophobicContact CB-CB 4.39Å; F81-F139 HydrophobicContact CB-CD1 3.69Å; F81-F139 HydrophobicContact CB-CE1 4.36Å; F81-F139 HydrophobicContact CB-CG 4.36Å; F81-F139 HydrophobicContact CD1-CB 3.63Å; F81-F139 HydrophobicContact CD1-CD1 4.24Å; F81-F139 HydrophobicContact CD1-CG 4.42Å; F81-F139 HydrophobicContact CD2-CB 3.54Å; F81-F139 HydrophobicContact CD2-CD1 4.31Å; F81-F139 HydrophobicContact CD2-CG 4.13Å; F81-F139 HydrophobicContact CE1-CB 3.63Å; F81-F139 HydrophobicContact CE2-CB 3.53Å; F81-F139 HydrophobicContact CG-CB 3.58Å; F81-F139 AromaticContact CG-CD1 3.83Å; F81-F139 HydrophobicContact CG-CD1 3.83Å; F81-F139 HydrophobicContact CG-CG 4.05Å; F81-F139 HydrophobicContact CZ-CB 3.57Å; Q84-F139 HydrophobicContact CB-CD1 4.29Å; Q84-F139 HydrophobicContact CB-CE1 3.85Å; Q84-F139 HydrophobicContact CG-CD1 3.95Å; Q84-F139 HydrophobicContact CG-CE1 3.9Å; P89-F139 WeakPolarHBondContact CA-O 3.23Å; K90-F139 PolarHBondContact N-O 3.17Å; K90-F139 PolarHBondContact O-N 3.4Å; F116-F139 HydrophobicContact CB-CD2 3.8Å; F116-F139 HydrophobicContact CB-CE2 3.62Å; F116-F139 HydrophobicContact CG-CE2 4.43Å; F116-F139 WeakPolarHBondContact O-CA 3.34Å; I117-F139 HydrophobicContact CG1-CB 4.11Å; I117-F139 HydrophobicContact CG1-CD2 4.08Å; F139-P141 HydrophobicContact CE1-CB 4.18Å; F139-P141 HydrophobicContact CE1-CG 4.11Å; F139-P141 HydrophobicContact CE2-CB 3.92Å; F139-P141 HydrophobicContact CE2-CG 4.5Å; F139-P141 HydrophobicContact CZ-CB 3.54Å; F139-P141 HydrophobicContact CZ-CG 3.97Å; F139-F147 AromaticContact CD1-CE1 3.96Å; F139-F147 HydrophobicContact CD1-CE1 3.96Å; F139-F147 HydrophobicContact CD1-CZ 4.36Å; F139-F147 HydrophobicContact CD2-CD1 4.28Å; F139-F147 AromaticContact CD2-CE1 3.58Å; F139-F147 HydrophobicContact CD2-CE1 3.58Å; F139-F147 AromaticContact CD2-CZ 3.77Å; F139-F147 HydrophobicContact CD2-CZ 3.77Å; F139-F147 HydrophobicContact CE1-CD1 4.33Å; F139-F147 AromaticContact CE1-CE1 3.55Å; F139-F147 HydrophobicContact CE1-CE1 3.55Å; F139-F147 HydrophobicContact CE1-CZ 4.38Å; F139-F147 AromaticContact CE2-CD1 3.48Å; F139-F147 HydrophobicContact CE2-CD1 3.48Å; F139-F147 VanDerWaalsContact CE2-CD1 3.48Å; F139-F147 AromaticContact CE2-CE1 3.15Å; F139-F147 HydrophobicContact CE2-CE1 3.15Å; F139-F147 HydrophobicContact CE2-CG 4.37Å; F139-F147 AromaticContact CE2-CZ 3.83Å; F139-F147 HydrophobicContact CE2-CZ 3.83Å; F139-F147 AromaticContact CG-CE1 3.97Å; F139-F147 HydrophobicContact CG-CE1 3.97Å; F139-F147 HydrophobicContact CG-CZ 4.06Å; F139-F147 AromaticContact CZ-CD1 3.51Å; F139-F147 HydrophobicContact CZ-CD1 3.51Å; F139-F147 AromaticContact CZ-CE1 3.12Å; F139-F147 HydrophobicContact CZ-CE1 3.12Å; F139-F147 HydrophobicContact CZ-CZ 4.13Å
140	L	78.1	Confident	79.7	Confident	7 Å²	7	35.4 Å²	35.4	4%	0.037	21%	0.211	C	C	.	.			trans	-142.3	92.3	-175.5	176	43.5	0	0	0	108.4	P89 F116 F118 Y142 L266	P89-L140 HydrophobicContact CB-CB 4.43Å; P89-L140 HydrophobicContact CB-CD1 3.96Å; P89-L140 HydrophobicContact CB-CD2 4.44Å; P89-L140 HydrophobicContact CB-CG 4.48Å; P89-L140 HydrophobicContact CG-CD1 4.42Å; F116-L140 PolarHBondContact O-N 2.93Å; F118-L140 HydrophobicContact CE2-CB 4.25Å; F118-L140 HydrophobicContact CE2-CD2 4.28Å; L140-Y142 HydrophobicContact CD1-CE1 4.16Å; L140-Y142 HydrophobicContact CD1-CE2 4.45Å; L140-Y142 WeakPolarHBondContact CD1-OH 3.05Å; L140-Y142 HydrophobicContact CD2-CE2 4.3Å; L140-Y142 WeakPolarHBondContact CD2-OH 3.2Å; L140-Y142 HydrophobicContact CG-CE1 4.34Å; L140-Y142 HydrophobicContact CG-CE2 3.75Å; L140-Y142 WeakPolarHBondContact CG-OH 3.43Å; L140-L266 HydrophobicContact CD2-CD1 4.21Å; L140-L266 HydrophobicContact CD2-CD2 4.45Å
141	P	75.2	Confident	80	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.006	17%	0.173	C	C	.	.			trans	-73.2	130.4	-170.2	22.6	-30.6	0	0	0	114.5	Q84 P85 S87 H88 F139 S168	Q84-P141 HydrophobicContact CB-CG 4.38Å; P85-P141 WeakPolarHBondContact O-CG 3.39Å; S87-P141 WeakPolarHBondContact CA-O 3.17Å; S87-P141 PolarHBondContact N-O 3.2Å; H88-P141 WeakPolarHBondContact O-CD 3.24Å; F139-P141 HydrophobicContact CE1-CB 4.18Å; F139-P141 HydrophobicContact CE1-CG 4.11Å; F139-P141 HydrophobicContact CE2-CB 3.92Å; F139-P141 HydrophobicContact CE2-CG 4.5Å; F139-P141 HydrophobicContact CZ-CB 3.54Å; F139-P141 HydrophobicContact CZ-CG 3.97Å; P141-S168 WeakPolarHBondContact CB-OG 3.4Å
142	Y	69.4	Low	79.9	Confident	36 Å²	36	32.2 Å²	32.2	14%	0.141	17%	0.174	C	C	.	.			trans	-124	5.6	171.5	-60.4	-55.3	0	0	0	114.2	F86 F116 L140 S310 I311 S312	F86-Y142 VanDerWaalsContact CE2-C 3.45Å; F86-Y142 WeakPolarHBondContact CE2-O 3.12Å; F116-Y142 HydrophobicContact CD1-CD2 4.35Å; L140-Y142 HydrophobicContact CD1-CE1 4.16Å; L140-Y142 HydrophobicContact CD1-CE2 4.45Å; L140-Y142 WeakPolarHBondContact CD1-OH 3.05Å; L140-Y142 HydrophobicContact CD2-CE2 4.3Å; L140-Y142 WeakPolarHBondContact CD2-OH 3.2Å; L140-Y142 HydrophobicContact CG-CE1 4.34Å; L140-Y142 HydrophobicContact CG-CE2 3.75Å; L140-Y142 WeakPolarHBondContact CG-OH 3.43Å; Y142-S310 VanDerWaalsContact CE1-O 3.25Å; Y142-S310 WeakPolarHBondContact CE1-O 2.86Å; Y142-S310 PolarHBondContact OH-O 3.03Å; Y142-I311 WeakPolarHBondContact OH-CA 3.3Å; Y142-I311 PolarHBondContact OH-N 3.24Å; Y142-S312 VanDerWaalsContact CE2-CB 3.43Å; Y142-S312 PolarHBondContact OH-N 2.64Å
143	T	67.4	Low	80	Confident	33 Å²	33	29.3 Å²	29.3	20%	0.202	15%	0.154	C	C	.	.	S	Bend	trans	-138.8	126.8	173.8	54.7	0	0	0	0	110.2	F116 S168 P421	F116-T143 HydrophobicContact CE1-CG2 3.93Å; F116-T143 WeakPolarHBondContact CE2-OG1 3.15Å; F116-T143 HydrophobicContact CZ-CG2 3.68Å; F116-T143 WeakPolarHBondContact CZ-OG1 3.16Å; T143-S168 PolarHBondContact O-OG 3.33Å; T143-P421 HydrophobicContact CG2-CG 4.42Å
144	V	70.2	Confident	79.8	Confident	7 Å²	7	31.3 Å²	31.3	4%	0.042	16%	0.163	C	C	.	.	S	Bend	trans	-63	139.5	174.9	-175.7	0	0	0	0	110.3	F86 S168 I170 I406 P421	F86-V144 HydrophobicContact CD2-CG2 3.99Å; F86-V144 HydrophobicContact CE2-CG2 4.39Å; V144-S168 CarbonylContact C-O 3.51Å; V144-S168 WeakPolarHBondContact CA-O 3.16Å; V144-S168 WeakPolarHBondContact CG1-O 3.5Å; V144-I170 HydrophobicContact CG2-CD1 3.55Å; V144-I170 HydrophobicContact CG2-CG1 3.83Å; V144-I406 WeakPolarHBondContact O-CD1 3.41Å; V144-I406 WeakPolarHBondContact O-CG1 3.44Å; V144-P421 HydrophobicContact CB-CB 4.31Å; V144-P421 HydrophobicContact CG2-CB 4.26Å
145	G	71	Confident	79.7	Confident	20 Å²	20	29.7 Å²	29.7	21%	0.206	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	103.2	-177.4	-177.1	0	0	0	0	0	113.9	S167 S168	G145-S167 PolarHBondContact O-OG 3.06Å; G145-S168 PolarHBondContact N-O 3.02Å; G145-S168 PolarHBondContact O-N 3.25Å; G145-S168 VanDerWaalsContact O-N 3.08Å
146	D	75.1	Confident	79.5	Confident	139 Å²	139	32.5 Å²	32.5	74%	0.743	17%	0.174	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77	150.1	-172.4	-42.6	-49.5	0	0	0	112.6	S167	D146-S167 PolarHBondContact N-OG 3.44Å; D146-S167 WeakPolarHBondContact OD1-CB 3.24Å; D146-S167 PolarHBondContact OD1-OG 3.04Å
147	F	76.7	Confident	79	Confident	26 Å²	26	32.3 Å²	32.3	11%	0.114	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.3	170.4	79.2	-88.5	0	0	0	111.6	F81 F116 I117 F139 V164 F165 G166	F81-F147 HydrophobicContact CD2-CZ 4.24Å; F116-F147 HydrophobicContact CD2-CB 4.45Å; I117-F147 HydrophobicContact CD1-CD2 4.1Å; I117-F147 HydrophobicContact CD1-CE2 3.23Å; I117-F147 HydrophobicContact CD1-CZ 3.71Å; I117-F147 HydrophobicContact CG1-CE2 4.31Å; I117-F147 HydrophobicContact CG1-CZ 4.48Å; F139-F147 AromaticContact CD1-CE1 3.96Å; F139-F147 HydrophobicContact CD1-CE1 3.96Å; F139-F147 HydrophobicContact CD1-CZ 4.36Å; F139-F147 HydrophobicContact CD2-CD1 4.28Å; F139-F147 AromaticContact CD2-CE1 3.58Å; F139-F147 HydrophobicContact CD2-CE1 3.58Å; F139-F147 AromaticContact CD2-CZ 3.77Å; F139-F147 HydrophobicContact CD2-CZ 3.77Å; F139-F147 HydrophobicContact CE1-CD1 4.33Å; F139-F147 AromaticContact CE1-CE1 3.55Å; F139-F147 HydrophobicContact CE1-CE1 3.55Å; F139-F147 HydrophobicContact CE1-CZ 4.38Å; F139-F147 AromaticContact CE2-CD1 3.48Å; F139-F147 HydrophobicContact CE2-CD1 3.48Å; F139-F147 VanDerWaalsContact CE2-CD1 3.48Å; F139-F147 AromaticContact CE2-CE1 3.15Å; F139-F147 HydrophobicContact CE2-CE1 3.15Å; F139-F147 HydrophobicContact CE2-CG 4.37Å; F139-F147 AromaticContact CE2-CZ 3.83Å; F139-F147 HydrophobicContact CE2-CZ 3.83Å; F139-F147 AromaticContact CG-CE1 3.97Å; F139-F147 HydrophobicContact CG-CE1 3.97Å; F139-F147 HydrophobicContact CG-CZ 4.06Å; F139-F147 AromaticContact CZ-CD1 3.51Å; F139-F147 HydrophobicContact CZ-CD1 3.51Å; F139-F147 AromaticContact CZ-CE1 3.12Å; F139-F147 HydrophobicContact CZ-CE1 3.12Å; F139-F147 HydrophobicContact CZ-CZ 4.13Å; F147-V164 HydrophobicContact CE2-CG1 4.39Å; F147-F165 WeakPolarHBondContact CZ-O 2.98Å; F147-G166 WeakPolarHBondContact CD1-O 3.4Å; F147-G166 VanDerWaalsContact CE1-N 3.34Å; F147-G166 VanDerWaalsContact CZ-N 3.33Å; F147-G166 PolarHBondContact N-O 3.45Å; F147-G166 PolarHBondContact O-N 2.87Å
148	E	82.5	Confident	78.6	Confident	120 Å²	120	33.7 Å²	33.7	56%	0.561	19%	0.187	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.1	162.8	177	179.3	-176.1	0	0	107.9	Q163 F165	E148-Q163 PolarHBondContact OE1-NE2 3.47Å; E148-F165 HydrophobicContact CB-CD1 4.07Å; E148-F165 HydrophobicContact CB-CE1 4.2Å; E148-F165 HydrophobicContact CG-CD1 3.91Å; E148-F165 HydrophobicContact CG-CE1 3.63Å
149	T	82.5	Confident	78.4	Confident	15 Å²	15	34 Å²	34	9%	0.092	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	177.9	166.1	-168.9	0	0	0	0	110.6	V113 I117 V164	V113-T149 PolarHBondContact O-OG1 2.03Å; I117-T149 HydrophobicContact CD1-CG2 3.51Å; T149-V164 HydrophobicContact CG2-CB 3.96Å; T149-V164 PolarHBondContact N-O 3.01Å; T149-V164 PolarHBondContact O-N 2.89Å; T149-V164 VanDerWaalsContact O-N 3.08Å
150	S	83.7	Confident	78.2	Confident	12 Å²	12	34.3 Å²	34.3	8%	0.084	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	131.4	172	-58.9	0	0	0	0	110.6	K161 Y162	S150-K161 VanDerWaalsContact CB-CE 3.45Å; S150-K161 WeakPolarHBondContact OG-CE 3.17Å; S150-Y162 CarbonylContact C-O 3.5Å; S150-Y162 VanDerWaalsContact CA-O 3.26Å; S150-Y162 WeakPolarHBondContact CA-O 3.46Å
151	I	85.7	Confident	78.6	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	127.7	169.9	-54.6	176.4	0	0	0	106.6	T110 I117 W119 I137 I153 Y162 V164	T110-I151 HydrophobicContact CG2-CG2 4.2Å; I117-I151 HydrophobicContact CG2-CD1 4.42Å; W119-I151 HydrophobicContact CB-CD1 4.44Å; W119-I151 HydrophobicContact CD2-CD1 4.01Å; W119-I151 HydrophobicContact CD2-CG1 4.41Å; W119-I151 HydrophobicContact CD2-CG2 4.26Å; W119-I151 HydrophobicContact CE3-CD1 3.56Å; W119-I151 HydrophobicContact CE3-CG1 3.82Å; W119-I151 HydrophobicContact CE3-CG2 4.44Å; W119-I151 HydrophobicContact CG-CD1 4.39Å; W119-I151 HydrophobicContact CZ2-CG2 4.49Å; W119-I151 HydrophobicContact CZ3-CD1 4.19Å; W119-I151 HydrophobicContact CZ3-CG1 3.93Å; I137-I151 HydrophobicContact CD1-CD1 3.69Å; I137-I151 HydrophobicContact CG1-CD1 4.2Å; I137-I151 HydrophobicContact CG2-CD1 4.35Å; I151-I153 HydrophobicContact CG2-CG1 4.48Å; I151-Y162 PolarHBondContact N-O 2.86Å; I151-Y162 PolarHBondContact O-N 2.92Å; I151-V164 HydrophobicContact CD1-CG2 4.06Å; I151-V164 HydrophobicContact CG1-CG2 4.2Å
152	Y	83.5	Confident	79.1	Confident	57 Å²	57	39 Å²	39	22%	0.224	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.7	174.1	-61	-87.9	0	0	0	108.8	F66 T110 F111 V159 A160 K161	F66-Y152 HydrophobicContact CE1-CE1 4.26Å; T110-Y152 WeakPolarHBondContact CA-O 3.39Å; F111-Y152 HydrophobicContact CD2-CD2 4.23Å; F111-Y152 HydrophobicContact CD2-CG 4.3Å; F111-Y152 HydrophobicContact CE2-CD2 4.03Å; F111-Y152 AromaticContact CE2-CG 3.76Å; F111-Y152 HydrophobicContact CE2-CG 3.76Å; F111-Y152 VanDerWaalsContact CZ-CB 3.48Å; F111-Y152 HydrophobicContact CZ-CG 4.26Å; F111-Y152 PolarHBondContact N-O 3.01Å; F111-Y152 WeakPolarHBondContact O-CA 2.87Å; F111-Y152 WeakPolarHBondContact O-CB 3.42Å; F111-Y152 PolarHBondContact O-N 3.11Å; Y152-V159 HydrophobicContact CD1-CG1 4.06Å; Y152-V159 HydrophobicContact CG-CG1 4.44Å; Y152-A160 CarbonylContact C-O 3.5Å; Y152-A160 WeakPolarHBondContact CA-O 2.98Å; Y152-K161 HydrophobicContact CD1-CB 4.06Å; Y152-K161 HydrophobicContact CD1-CG 4.11Å; Y152-K161 HydrophobicContact CE1-CB 3.98Å; Y152-K161 HydrophobicContact CE1-CD 3.96Å; Y152-K161 HydrophobicContact CE1-CG 3.67Å
153	I	85.5	Confident	80	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	111.3	-177.5	-60.4	156.1	0	0	0	106.9	F74 I96 L107 T110 F122 I151 T155 V159 A160	F74-I153 HydrophobicContact CE1-CD1 3.48Å; F74-I153 VanDerWaalsContact CE1-CD1 3.48Å; F74-I153 HydrophobicContact CZ-CD1 3.75Å; I96-I153 HydrophobicContact CD1-CD1 4.02Å; L107-I153 HydrophobicContact CD2-CG2 4.11Å; T110-I153 HydrophobicContact CG2-CB 4.33Å; T110-I153 HydrophobicContact CG2-CG1 3.71Å; T110-I153 HydrophobicContact CG2-CG2 4.45Å; F122-I153 HydrophobicContact CE2-CG2 4.37Å; F122-I153 HydrophobicContact CZ-CG1 4.36Å; F122-I153 HydrophobicContact CZ-CG2 3.85Å; I151-I153 HydrophobicContact CG2-CG1 4.48Å; I153-T155 HydrophobicContact CG2-CG2 4.08Å; I153-V159 CarbonylContact O-C 3.5Å; I153-V159 WeakPolarHBondContact O-CA 3.35Å; I153-A160 HydrophobicContact CB-CB 4.46Å; I153-A160 PolarHBondContact N-O 3Å; I153-A160 PolarHBondContact O-N 3.01Å
154	Q	81.5	Confident	81	Confident	46 Å²	46	39.3 Å²	39.3	22%	0.215	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	132.8	174.7	-166.5	162.8	-15.9	0	0	109.6	V108 T109 F111 G158 V159	V108-Q154 HydrophobicContact CB-CB 4.42Å; V108-Q154 HydrophobicContact CB-CG 4.4Å; V108-Q154 WeakPolarHBondContact CB-O 3.39Å; V108-Q154 PolarHBondContact N-O 3.02Å; T109-Q154 PolarHBondContact N-O 2.97Å; T109-Q154 PolarHBondContact O-N 3.41Å; T109-Q154 WeakPolarHBondContact OG1-CB 2.94Å; F111-Q154 HydrophobicContact CE1-CB 4.2Å; Q154-G158 WeakPolarHBondContact CA-O 3.01Å; Q154-V159 HydrophobicContact CB-CG2 4.48Å; Q154-V159 HydrophobicContact CG-CG2 4.26Å
155	T	83.1	Confident	81.9	Confident	8 Å²	8	41.7 Å²	41.7	5%	0.049	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	172.3	-178.5	72.3	0	0	0	0	111.2	L72 I105 D106 L107 I153 L157 G158	L72-T155 HydrophobicContact CD1-CG2 4.04Å; I105-T155 HydrophobicContact CG2-CG2 4.18Å; D106-T155 CarbonylContact O-C 3.58Å; D106-T155 WeakPolarHBondContact O-CA 3.38Å; D106-T155 VanDerWaalsContact O-CB 3.29Å; D106-T155 WeakPolarHBondContact O-CB 3.05Å; L107-T155 HydrophobicContact CD2-CG2 3.9Å; I153-T155 HydrophobicContact CG2-CG2 4.08Å; T155-L157 PolarHBondContact O-N 3.1Å; T155-L157 VanDerWaalsContact O-N 3.12Å; T155-L157 PolarHBondContact OG1-N 2.91Å; T155-G158 PolarHBondContact N-O 3.16Å; T155-G158 PolarHBondContact O-N 3.28Å; T155-G158 PolarHBondContact OG1-N 3.18Å
156	S	80.6	Confident	82.5	Confident	60 Å²	60	41.1 Å²	41.1	42%	0.42	22%	0.216	S	C	.	.	S	Bend	trans	-60	-15.8	171.7	56.9	0	0	0	0	114.1	D106	D106-S156 PolarHBondContact N-OG 3.31Å; D106-S156 PolarHBondContact O-N 3Å
157	L	73.9	Confident	82.9	Confident	65 Å²	65	35.3 Å²	35.3	34%	0.34	19%	0.186	S	C	.	.	S	Bend	trans	-105.6	-18	-179.7	-56.1	-177.5	0	0	0	114.1	F69 I105 T155	F69-L157 HydrophobicContact CD1-CB 4.37Å; F69-L157 HydrophobicContact CE1-CB 3.59Å; F69-L157 HydrophobicContact CZ-CB 4.26Å; F69-L157 WeakPolarHBondContact CZ-O 3.44Å; I105-L157 HydrophobicContact CD1-CD1 3.88Å; I105-L157 HydrophobicContact CG1-CD1 3.81Å; I105-L157 HydrophobicContact CG1-CG 4.44Å; T155-L157 PolarHBondContact O-N 3.1Å; T155-L157 VanDerWaalsContact O-N 3.12Å; T155-L157 PolarHBondContact OG1-N 2.91Å
158	G	77.7	Confident	83.1	Confident	29 Å²	29	34.2 Å²	34.2	30%	0.299	18%	0.182	S	C	.	.			trans	158	-135.1	177.8	0	0	0	0	0	113.7	Q154 T155	Q154-G158 WeakPolarHBondContact CA-O 3.01Å; T155-G158 PolarHBondContact N-O 3.16Å; T155-G158 PolarHBondContact O-N 3.28Å; T155-G158 PolarHBondContact OG1-N 3.18Å
159	V	79.5	Confident	82.8	Confident	30 Å²	30	32.8 Å²	32.8	18%	0.182	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	117.6	178.5	-179.7	0	0	0	0	110	F111 Y152 I153 Q154	F111-V159 HydrophobicContact CZ-CG1 3.94Å; F111-V159 HydrophobicContact CZ-CG2 4.42Å; Y152-V159 HydrophobicContact CD1-CG1 4.06Å; Y152-V159 HydrophobicContact CG-CG1 4.44Å; I153-V159 CarbonylContact O-C 3.5Å; I153-V159 WeakPolarHBondContact O-CA 3.35Å; Q154-V159 HydrophobicContact CB-CG2 4.48Å; Q154-V159 HydrophobicContact CG-CG2 4.26Å
160	A	80.5	Confident	82.4	Confident	8 Å²	8	33 Å²	33	7%	0.066	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	147.5	169.5	0	0	0	0	0	110.5	F69 F74 Y152 I153	F69-A160 HydrophobicContact CD2-CB 4.35Å; F74-A160 HydrophobicContact CZ-CB 4.32Å; Y152-A160 CarbonylContact C-O 3.5Å; Y152-A160 WeakPolarHBondContact CA-O 2.98Å; I153-A160 HydrophobicContact CB-CB 4.46Å; I153-A160 PolarHBondContact N-O 3Å; I153-A160 PolarHBondContact O-N 3.01Å
161	K	84.5	Confident	81.8	Confident	105 Å²	105	32.9 Å²	32.9	46%	0.457	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.9	176.9	-178.7	-170.9	177	-168.3	0	109.5	S150 Y152	S150-K161 VanDerWaalsContact CB-CE 3.45Å; S150-K161 WeakPolarHBondContact OG-CE 3.17Å; Y152-K161 HydrophobicContact CD1-CB 4.06Å; Y152-K161 HydrophobicContact CD1-CG 4.11Å; Y152-K161 HydrophobicContact CE1-CB 3.98Å; Y152-K161 HydrophobicContact CE1-CD 3.96Å; Y152-K161 HydrophobicContact CE1-CG 3.67Å
162	Y	87.3	Confident	80.9	Confident	3 Å²	3	34 Å²	34	1%	0.012	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	122	176.2	-172.2	-108.8	0	0	0	109.9	F74 P76 L79 V94 I137 S150 I151 V164	F74-Y162 HydrophobicContact CB-CD2 4.15Å; F74-Y162 HydrophobicContact CB-CE2 3.77Å; F74-Y162 AromaticContact CD1-CD2 3.7Å; F74-Y162 HydrophobicContact CD1-CD2 3.7Å; F74-Y162 AromaticContact CD1-CE2 3.95Å; F74-Y162 HydrophobicContact CD1-CE2 3.95Å; F74-Y162 HydrophobicContact CD1-CG 4.45Å; F74-Y162 HydrophobicContact CD2-CD2 4.34Å; F74-Y162 HydrophobicContact CE1-CD2 4.16Å; F74-Y162 AromaticContact CG-CD2 3.81Å; F74-Y162 HydrophobicContact CG-CD2 3.81Å; F74-Y162 AromaticContact CG-CE2 3.94Å; F74-Y162 HydrophobicContact CG-CE2 3.94Å; P76-Y162 WeakPolarHBondContact O-CE2 3.49Å; P76-Y162 PolarHBondContact O-OH 2.91Å; P76-Y162 VanDerWaalsContact O-OH 3.07Å; L79-Y162 HydrophobicContact CB-CE1 3.82Å; L79-Y162 WeakPolarHBondContact CB-OH 3.21Å; L79-Y162 PolarHBondContact N-OH 2.99Å; V94-Y162 HydrophobicContact CG1-CE1 4.26Å; V94-Y162 HydrophobicContact CG1-CE2 4.25Å; V94-Y162 HydrophobicContact CG2-CE1 4.21Å; I137-Y162 HydrophobicContact CD1-CD1 4.08Å; I137-Y162 HydrophobicContact CD1-CE1 3.68Å; S150-Y162 CarbonylContact C-O 3.5Å; S150-Y162 VanDerWaalsContact CA-O 3.26Å; S150-Y162 WeakPolarHBondContact CA-O 3.46Å; I151-Y162 PolarHBondContact N-O 2.86Å; I151-Y162 PolarHBondContact O-N 2.92Å; Y162-V164 HydrophobicContact CD1-CG2 3.84Å; Y162-V164 HydrophobicContact CE1-CG2 4Å
163	Q	87.9	Confident	80.1	Confident	75 Å²	75	35 Å²	35	35%	0.35	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	141.3	179.3	-87	176	-63.7	0	0	111.6	L79 E148 F165	L79-Q163 PolarHBondContact N-O 2.94Å; E148-Q163 PolarHBondContact OE1-NE2 3.47Å; Q163-F165 HydrophobicContact CB-CE2 3.77Å; Q163-F165 HydrophobicContact CB-CZ 3.96Å; Q163-F165 HydrophobicContact CG-CZ 4.28Å
164	V	88.4	Confident	79.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	128.9	177.6	-167.8	0	0	0	0	110.3	L79 F81 I117 I137 F147 T149 I151 Y162	L79-V164 HydrophobicContact CB-CG1 4.08Å; L79-V164 HydrophobicContact CB-CG2 4.41Å; L79-V164 HydrophobicContact CD2-CG1 4.12Å; L79-V164 HydrophobicContact CG-CG1 4.04Å; L79-V164 CarbonylContact O-C 3.24Å; L79-V164 VanDerWaalsContact O-CA 3.27Å; L79-V164 WeakPolarHBondContact O-CA 3.31Å; F81-V164 HydrophobicContact CD2-CG1 3.95Å; F81-V164 HydrophobicContact CE2-CG1 3.65Å; I117-V164 HydrophobicContact CD1-CB 3.92Å; I117-V164 HydrophobicContact CD1-CG1 3.4Å; I117-V164 VanDerWaalsContact CD1-CG1 3.4Å; I137-V164 HydrophobicContact CD1-CG2 4.38Å; F147-V164 HydrophobicContact CE2-CG1 4.39Å; T149-V164 HydrophobicContact CG2-CB 3.96Å; T149-V164 PolarHBondContact N-O 3.01Å; T149-V164 PolarHBondContact O-N 2.89Å; T149-V164 VanDerWaalsContact O-N 3.08Å; I151-V164 HydrophobicContact CD1-CG2 4.06Å; I151-V164 HydrophobicContact CG1-CG2 4.2Å; Y162-V164 HydrophobicContact CD1-CG2 3.84Å; Y162-V164 HydrophobicContact CE1-CG2 4Å
165	F	88.6	Confident	79.1	Confident	57 Å²	57	36 Å²	36	25%	0.25	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	167.2	-174.7	-54.5	-83.2	0	0	0	111.9	F78 L79 D80 F81 F147 E148 Q163	F78-F165 HydrophobicContact CB-CE2 4.44Å; F78-F165 HydrophobicContact CD2-CD2 4.19Å; F78-F165 HydrophobicContact CD2-CE2 4.23Å; L79-F165 PolarHBondContact O-N 2.99Å; D80-F165 HydrophobicContact CB-CB 4.29Å; F81-F165 PolarHBondContact N-O 3.1Å; F147-F165 WeakPolarHBondContact CZ-O 2.98Å; E148-F165 HydrophobicContact CB-CD1 4.07Å; E148-F165 HydrophobicContact CB-CE1 4.2Å; E148-F165 HydrophobicContact CG-CD1 3.91Å; E148-F165 HydrophobicContact CG-CE1 3.63Å; Q163-F165 HydrophobicContact CB-CE2 3.77Å; Q163-F165 HydrophobicContact CB-CZ 3.96Å; Q163-F165 HydrophobicContact CG-CZ 4.28Å
166	G	84.7	Confident	78.9	Confident	8 Å²	8	35.8 Å²	35.8	8%	0.082	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.6	-176.2	166.2	0	0	0	0	0	110.8	D80 F147	D80-G166 WeakPolarHBondContact OD1-CA 3.44Å; F147-G166 WeakPolarHBondContact CD1-O 3.4Å; F147-G166 VanDerWaalsContact CE1-N 3.34Å; F147-G166 VanDerWaalsContact CZ-N 3.33Å; F147-G166 PolarHBondContact N-O 3.45Å; F147-G166 PolarHBondContact O-N 2.87Å
167	S	82	Confident	78.7	Confident	16 Å²	16	33.1 Å²	33.1	11%	0.112	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	162.2	178	-163.3	0	0	0	0	110.9	G82 Q84 G145 D146	G82-S167 PolarHBondContact O-N 2.98Å; Q84-S167 PolarHBondContact N-O 3.1Å; G145-S167 PolarHBondContact O-OG 3.06Å; D146-S167 PolarHBondContact N-OG 3.44Å; D146-S167 WeakPolarHBondContact OD1-CB 3.24Å; D146-S167 PolarHBondContact OD1-OG 3.04Å
168	S	81	Confident	78.8	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.021	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	143.1	168.8	87.8	0	0	0	0	114.7	Q84 P141 T143 V144 G145	Q84-S168 WeakPolarHBondContact O-CA 3.32Å; Q84-S168 VanDerWaalsContact O-CB 3.3Å; Q84-S168 WeakPolarHBondContact O-CB 3.47Å; P141-S168 WeakPolarHBondContact CB-OG 3.4Å; T143-S168 PolarHBondContact O-OG 3.33Å; V144-S168 CarbonylContact C-O 3.51Å; V144-S168 WeakPolarHBondContact CA-O 3.16Å; V144-S168 WeakPolarHBondContact CG1-O 3.5Å; G145-S168 PolarHBondContact N-O 3.02Å; G145-S168 PolarHBondContact O-N 3.25Å; G145-S168 VanDerWaalsContact O-N 3.08Å
169	Y	77.6	Confident	78.7	Confident	91 Å²	91	29.7 Å²	29.7	36%	0.357	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	153.8	-178.1	67.4	-76	0	0	0	110	E83 Q84 P85 F86 S171	E83-Y169 HydrophobicContact CB-CD1 3.89Å; E83-Y169 HydrophobicContact CB-CE1 3.86Å; Q84-Y169 WeakPolarHBondContact O-CD1 3.42Å; Q84-Y169 PolarHBondContact O-N 3.31Å; Q84-Y169 VanDerWaalsContact O-N 3.08Å; P85-Y169 CarbonylContact C-O 3.58Å; P85-Y169 WeakPolarHBondContact CA-O 3.05Å; P85-Y169 HydrophobicContact CG-CE1 4.44Å; F86-Y169 PolarHBondContact N-O 2.65Å; Y169-S171 VanDerWaalsContact CE2-CB 3.43Å
170	I	74.3	Confident	78.8	Confident	18 Å²	18	29.1 Å²	29.1	9%	0.092	14%	0.141	C	C	.	.			trans	-88.6	112.3	167.7	-70.3	159.1	0	0	0	106.1	F86 V144 I176 L327 Y423	F86-I170 HydrophobicContact CB-CG1 3.88Å; F86-I170 HydrophobicContact CD2-CG1 4.45Å; F86-I170 HydrophobicContact CG-CG1 4.14Å; V144-I170 HydrophobicContact CG2-CD1 3.55Å; V144-I170 HydrophobicContact CG2-CG1 3.83Å; I170-I176 HydrophobicContact CG2-CD1 3.51Å; I170-I176 HydrophobicContact CG2-CG1 3.92Å; I170-L327 HydrophobicContact CD1-CD1 3.96Å; I170-L327 HydrophobicContact CD1-CD2 3.57Å; I170-L327 HydrophobicContact CD1-CG 4.43Å; I170-Y423 HydrophobicContact CB-CD2 3.71Å; I170-Y423 HydrophobicContact CB-CE2 3.81Å; I170-Y423 HydrophobicContact CD1-CD2 3.65Å; I170-Y423 HydrophobicContact CD1-CG 3.77Å; I170-Y423 HydrophobicContact CG1-CD2 4.3Å; I170-Y423 HydrophobicContact CG2-CD2 3.73Å; I170-Y423 HydrophobicContact CG2-CE2 3.48Å; I170-Y423 VanDerWaalsContact CG2-CE2 3.48Å; I170-Y423 HydrophobicContact CG2-CG 4.39Å
171	S	70.8	Confident	78.6	Confident	10 Å²	10	29.7 Å²	29.7	7%	0.07	14%	0.143	C	C	.	.			trans	-89.3	150.7	168.3	114.4	0	0	0	0	109.9	Y169 D173 Y174	Y169-S171 VanDerWaalsContact CE2-CB 3.43Å; S171-D173 VanDerWaalsContact CB-OD2 3.31Å; S171-D173 WeakPolarHBondContact CB-OD2 3.15Å; S171-D173 PolarHBondContact O-N 2.96Å; S171-D173 WeakPolarHBondContact OG-CB 3.01Å; S171-D173 PolarHBondContact OG-N 3.4Å; S171-D173 PolarHBondContact OG-OD2 2.81Å; S171-Y174 WeakPolarHBondContact OG-CD2 3.49Å; S171-Y174 WeakPolarHBondContact OG-CE2 3.49Å
172	D	66.4	Low	78.4	Confident	25 Å²	25	27 Å²	27	13%	0.134	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	1.6	176.8	-79.2	23.8	0	0	0	111.9	P198 L199 Y402 Y423 R425	D172-P198 HydrophobicContact CB-CB 4.24Å; D172-P198 CarbonylContact O-C 3.59Å; D172-P198 WeakPolarHBondContact O-CG 3.39Å; D172-L199 PolarHBondContact O-N 2.9Å; D172-Y402 WeakPolarHBondContact OD1-CE1 3.47Å; D172-Y402 WeakPolarHBondContact OD2-CE1 3.2Å; D172-Y402 PolarHBondContact OD2-OH 2.88Å; D172-Y402 VanDerWaalsContact OD2-OH 3.12Å; D172-Y423 PolarHBondContact OD1-OH 3.31Å; D172-R425 IonicContact OD2-CZ 2.73Å; D172-R425 IonicContact OD2-NH1 2.67Å; D172-R425 PolarHBondContact OD2-NH1 3.41Å
173	D	66.3	Low	77.8	Confident	77 Å²	77	29.2 Å²	29.2	41%	0.412	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-11.1	-175.1	-40.3	-76.1	0	0	0	113.7	S171 L306	S171-D173 VanDerWaalsContact CB-OD2 3.31Å; S171-D173 WeakPolarHBondContact CB-OD2 3.15Å; S171-D173 PolarHBondContact O-N 2.96Å; S171-D173 WeakPolarHBondContact OG-CB 3.01Å; S171-D173 PolarHBondContact OG-N 3.4Å; S171-D173 PolarHBondContact OG-OD2 2.81Å; D173-L306 WeakPolarHBondContact O-CD2 3.4Å
174	Y	70.3	Confident	77	Confident	55 Å²	55	25.9 Å²	25.9	22%	0.216	13%	0.133	C	C	.	.	S	Bend	trans	-124.8	150.3	-176.1	-54.5	-72.2	0	0	0	112.1	P85 S171 I176 P198 P307	P85-Y174 HydrophobicContact CB-CD2 3.59Å; P85-Y174 HydrophobicContact CB-CE2 3.54Å; P85-Y174 HydrophobicContact CG-CD2 3.98Å; P85-Y174 HydrophobicContact CG-CE2 3.36Å; S171-Y174 WeakPolarHBondContact OG-CD2 3.49Å; S171-Y174 WeakPolarHBondContact OG-CE2 3.49Å; Y174-I176 PolarHBondContact O-N 3.22Å; Y174-P198 WeakPolarHBondContact O-CD 3.32Å; Y174-P198 WeakPolarHBondContact O-CG 3.22Å; Y174-P307 HydrophobicContact CE1-CB 4.42Å; Y174-P307 HydrophobicContact CE1-CG 3.87Å
175	L	75.8	Confident	76.1	Confident	12 Å²	12	30.6 Å²	30.6	6%	0.063	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-64.6	128.3	173.3	-62	-177.8	0	0	0	110.5	P177 L195 N197 V203 V205 L246	L175-P177 VanDerWaalsContact O-CD 3.31Å; L175-P177 WeakPolarHBondContact O-CD 3.37Å; L175-L195 HydrophobicContact CD1-CD1 3.89Å; L175-N197 HydrophobicContact CD2-CB 3.72Å; L175-N197 WeakPolarHBondContact CD2-OD1 3.49Å; L175-V203 HydrophobicContact CD1-CG1 3.9Å; L175-V203 HydrophobicContact CD2-CB 4.15Å; L175-V203 HydrophobicContact CD2-CG1 4.05Å; L175-V203 HydrophobicContact CD2-CG2 4.21Å; L175-V203 HydrophobicContact CG-CG1 4.25Å; L175-V205 HydrophobicContact CD1-CG2 4.03Å; L175-L246 HydrophobicContact CD1-CD1 4.08Å; L175-L246 HydrophobicContact CD2-CD1 3.92Å
176	I	78	Confident	75	Confident	5 Å²	5	35 Å²	35	3%	0.026	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	116.3	-179.2	-55.1	165.8	0	0	0	109.3	I170 Y174 L178 V196 P198 L327 Y329	I170-I176 HydrophobicContact CG2-CD1 3.51Å; I170-I176 HydrophobicContact CG2-CG1 3.92Å; Y174-I176 PolarHBondContact O-N 3.22Å; I176-L178 HydrophobicContact CG2-CD2 4.17Å; I176-V196 HydrophobicContact CB-CB 4.29Å; I176-V196 PolarHBondContact N-O 2.99Å; I176-V196 PolarHBondContact O-N 2.71Å; I176-P198 HydrophobicContact CD1-CB 4.12Å; I176-P198 HydrophobicContact CD1-CG 3.93Å; I176-P198 HydrophobicContact CG1-CG 4.02Å; I176-L327 HydrophobicContact CG2-CD2 3.67Å; I176-Y329 HydrophobicContact CD1-CE2 3.97Å
177	P	76.7	Confident	74.1	Confident	4 Å²	4	40 Å²	40	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	132.9	175.8	32.6	-32	0	0	0	112.6	F86 S87 L175 L193 L195 I311	F86-P177 HydrophobicContact CE1-CG 4.15Å; S87-P177 WeakPolarHBondContact OG-CD 3.08Å; S87-P177 WeakPolarHBondContact OG-CG 3.42Å; L175-P177 VanDerWaalsContact O-CD 3.31Å; L175-P177 WeakPolarHBondContact O-CD 3.37Å; P177-L193 HydrophobicContact CB-CD1 4.3Å; P177-L195 HydrophobicContact CB-CD2 3.9Å; P177-I311 HydrophobicContact CB-CD1 3.37Å; P177-I311 HydrophobicContact CB-CG1 3.84Å; P177-I311 HydrophobicContact CG-CD1 4.05Å; P177-I311 HydrophobicContact CG-CG1 3.94Å
178	L	76	Confident	73.5	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.016	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	94.3	177.8	-58.1	179	0	0	0	109.7	I176 N180 K194 V196 K251 L327 Y329	I176-L178 HydrophobicContact CG2-CD2 4.17Å; L178-N180 PolarHBondContact O-ND2 3.46Å; L178-K194 HydrophobicContact CB-CB 4.33Å; L178-K194 PolarHBondContact N-O 3.39Å; L178-K194 PolarHBondContact O-N 2.94Å; L178-V196 HydrophobicContact CD1-CG2 3.58Å; L178-V196 HydrophobicContact CG-CG2 4.27Å; L178-K251 HydrophobicContact CD1-CD 4.38Å; L178-L327 HydrophobicContact CD2-CB 3.75Å; L178-L327 HydrophobicContact CD2-CD2 3.72Å; L178-L327 HydrophobicContact CD2-CG 3.89Å; L178-Y329 HydrophobicContact CD1-CD1 4.46Å; L178-Y329 HydrophobicContact CD1-CG 4.14Å
179	V	77.2	Confident	73	Confident	18 Å²	18	44.9 Å²	44.9	11%	0.109	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	127.4	168.8	-175.6	0	0	0	0	109	F191 L193 I311 S326	V179-F191 HydrophobicContact CG1-CB 4.13Å; V179-F191 HydrophobicContact CG1-CD2 4.13Å; V179-F191 HydrophobicContact CG1-CG 4.33Å; V179-L193 HydrophobicContact CG2-CD1 4.31Å; V179-I311 HydrophobicContact CG2-CG2 3.57Å; V179-S326 PolarHBondContact N-OG 3.09Å; V179-S326 PolarHBondContact O-N 3.04Å; V179-S326 PolarHBondContact O-OG 2.81Å
180	N	80	Confident	72.9	Confident	19 Å²	19	41 Å²	41	10%	0.102	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	115.3	175.4	-40.1	-101.6	0	0	0	107.7	L178 F191 E192 K194 R324	L178-N180 PolarHBondContact O-ND2 3.46Å; N180-F191 CarbonylContact O-C 3.48Å; N180-F191 WeakPolarHBondContact O-CA 3.39Å; N180-F191 WeakPolarHBondContact O-CB 3.49Å; N180-E192 HydrophobicContact CB-CB 4.49Å; N180-E192 PolarHBondContact N-O 3.39Å; N180-E192 PolarHBondContact ND2-O 2.65Å; N180-E192 PolarHBondContact O-N 3.25Å; N180-K194 PolarHBondContact ND2-NZ 3.38Å; N180-K194 VanDerWaalsContact ND2-NZ 3.11Å; N180-K194 PolarHBondContact OD1-NZ 3.47Å; N180-R324 CarbonylContact C-O 3.57Å; N180-R324 VanDerWaalsContact CA-O 3.24Å; N180-R324 WeakPolarHBondContact CA-O 3.41Å
181	L	77	Confident	72.9	Confident	20 Å²	20	40.2 Å²	40.2	11%	0.105	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	130.8	167.7	-79.9	159	0	0	0	108.8	F316 Y322 R324 L347	L181-F316 HydrophobicContact CD1-CE2 4.44Å; L181-Y322 HydrophobicContact CD1-CD1 4.21Å; L181-R324 PolarHBondContact N-O 3.4Å; L181-R324 WeakPolarHBondContact O-CG 3.22Å; L181-L347 HydrophobicContact CB-CD1 3.85Å
182	E	80.6	Confident	73.4	Confident	49 Å²	49	40.6 Å²	40.6	23%	0.229	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-43.4	177	-74.1	-162.3	-168.9	0	0	112.5	S190 K256 P384	E182-S190 PolarHBondContact N-O 3.39Å; E182-K256 VanDerWaalsContact CD-CE 3.48Å; E182-K256 WeakPolarHBondContact OE1-CE 3.49Å; E182-K256 IonicContact OE1-NZ 2.78Å; E182-K256 PolarHBondContact OE1-NZ 3.29Å; E182-K256 WeakPolarHBondContact OE2-CE 2.9Å; E182-K256 IonicContact OE2-NZ 2.73Å; E182-K256 PolarHBondContact OE2-NZ 2.89Å; E182-P384 VanDerWaalsContact O-CD 3.27Å; E182-P384 WeakPolarHBondContact O-CD 3.47Å; E182-P384 WeakPolarHBondContact O-CG 3.45Å
183	S	75	Confident	73.9	Confident	49 Å²	49	39.4 Å²	39.4	34%	0.343	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	148.2	177.3	61.7	0	0	0	0	110.4	S190	S183-S190 PolarHBondContact O-N 3.27Å; S183-S190 VanDerWaalsContact OG-CB 3.28Å; S183-S190 WeakPolarHBondContact OG-CB 3.37Å
184	L	71	Confident	74.7	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	114.1	178.6	-173.1	64.7	0	0	0	108.4	K189 Y322 L347 L349 T382	L184-K189 HydrophobicContact CD1-CG 3.67Å; L184-Y322 HydrophobicContact CD2-CD1 3.78Å; L184-Y322 HydrophobicContact CD2-CD2 3.65Å; L184-Y322 HydrophobicContact CD2-CE1 3.68Å; L184-Y322 HydrophobicContact CD2-CE2 3.63Å; L184-Y322 HydrophobicContact CD2-CG 3.78Å; L184-L347 HydrophobicContact CB-CD1 4.43Å; L184-L347 HydrophobicContact CB-CD2 4.37Å; L184-L349 HydrophobicContact CD2-CD1 3.66Å; L184-L349 HydrophobicContact CD2-CD2 4.29Å; L184-L349 HydrophobicContact CD2-CG 3.81Å; L184-L349 HydrophobicContact CG-CD1 3.97Å; L184-L349 HydrophobicContact CG-CD2 4.27Å; L184-L349 HydrophobicContact CG-CG 4.26Å; L184-T382 PolarHBondContact N-O 2.64Å; L184-T382 WeakPolarHBondContact O-CB 2.88Å; L184-T382 VanDerWaalsContact O-CG2 3.23Å; L184-T382 WeakPolarHBondContact O-CG2 3.35Å
185	D	68.7	Low	75.1	Confident	99 Å²	99	35.4 Å²	35.4	53%	0.529	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	157.9	176.5	-166.6	5.5	0	0	0	108.4	N187 K188	D185-N187 PolarHBondContact O-N 2.77Å; D185-K188 HydrophobicContact CB-CB 4.44Å; D185-K188 PolarHBondContact N-O 3.45Å; D185-K188 PolarHBondContact O-N 2.79Å; D185-K188 VanDerWaalsContact O-O 3.12Å
186	E	65.6	Low	75.2	Confident	149 Å²	149	34.9 Å²	34.9	70%	0.696	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-35.7	-168.7	-68.1	-172.6	154.5	0	0	112.8
187	N	66.7	Low	75.2	Confident	113 Å²	113	34.6 Å²	34.6	60%	0.604	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-5	179.5	-56.7	-47.4	0	0	0	114	D185 D260 A261	D185-N187 PolarHBondContact O-N 2.77Å; N187-D260 CarbonylContact O-C 3.56Å; N187-D260 WeakPolarHBondContact O-CA 3.44Å; N187-A261 PolarHBondContact O-N 3.39Å
188	K	68.6	Low	74.9	Confident	98 Å²	98	34.5 Å²	34.5	43%	0.426	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	135.8	-168.3	-75.8	-172.2	172.6	179.8	0	114.9	D185 T258 D260	D185-K188 HydrophobicContact CB-CB 4.44Å; D185-K188 PolarHBondContact N-O 3.45Å; D185-K188 PolarHBondContact O-N 2.79Å; D185-K188 VanDerWaalsContact O-O 3.12Å; K188-T258 HydrophobicContact CB-CG2 4.47Å; K188-D260 WeakPolarHBondContact CE-OD1 2.94Å; K188-D260 WeakPolarHBondContact CG-OD1 3.33Å; K188-D260 IonicContact NZ-OD1 3.93Å
189	K	70.3	Confident	74.4	Confident	25 Å²	25	35.5 Å²	35.5	11%	0.109	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.3	179.3	-65.8	166.9	-178.7	159.6	0	109.1	L184 T258 I259 A261 N314	L184-K189 HydrophobicContact CD1-CG 3.67Å; K189-T258 WeakPolarHBondContact O-CA 3.47Å; K189-I259 PolarHBondContact N-O 3.09Å; K189-I259 PolarHBondContact O-N 3.14Å; K189-A261 HydrophobicContact CD-CB 4.33Å; K189-A261 HydrophobicContact CG-CB 4.47Å; K189-A261 PolarHBondContact NZ-O 2.84Å; K189-N314 WeakPolarHBondContact CD-OD1 3.35Å; K189-N314 PolarHBondContact NZ-OD1 2.7Å
190	S	74.9	Confident	73.4	Confident	9 Å²	9	37.7 Å²	37.7	6%	0.063	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.2	172.3	-157.7	0	0	0	0	110.5	E182 S183 A257 T258	E182-S190 PolarHBondContact N-O 3.39Å; S183-S190 PolarHBondContact O-N 3.27Å; S183-S190 VanDerWaalsContact OG-CB 3.28Å; S183-S190 WeakPolarHBondContact OG-CB 3.37Å; S190-A257 WeakPolarHBondContact CA-O 2.96Å; S190-A257 PolarHBondContact OG-O 2.77Å; S190-T258 PolarHBondContact OG-OG1 2.82Å
191	F	75.6	Confident	72.5	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.009	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	157.4	-178.8	70.3	-91.3	0	0	0	113.6	V179 N180 L255 K256 A257 I259 I267 I313	V179-F191 HydrophobicContact CG1-CB 4.13Å; V179-F191 HydrophobicContact CG1-CD2 4.13Å; V179-F191 HydrophobicContact CG1-CG 4.33Å; N180-F191 CarbonylContact O-C 3.48Å; N180-F191 WeakPolarHBondContact O-CA 3.39Å; N180-F191 WeakPolarHBondContact O-CB 3.49Å; F191-L255 HydrophobicContact CE2-CD2 4.45Å; F191-K256 WeakPolarHBondContact O-CA 3.37Å; F191-A257 HydrophobicContact CE1-CB 4.1Å; F191-A257 HydrophobicContact CE2-CB 4.33Å; F191-A257 HydrophobicContact CZ-CB 3.89Å; F191-A257 PolarHBondContact N-O 2.82Å; F191-A257 PolarHBondContact O-N 2.98Å; F191-I259 HydrophobicContact CE1-CD1 3.62Å; F191-I259 HydrophobicContact CE1-CG1 3.95Å; F191-I259 HydrophobicContact CZ-CD1 4Å; F191-I267 HydrophobicContact CE2-CD1 3.89Å; F191-I267 HydrophobicContact CZ-CD1 4.11Å; F191-I313 HydrophobicContact CD1-CG2 4.02Å; F191-I313 HydrophobicContact CE1-CD1 3.86Å; F191-I313 HydrophobicContact CE1-CG1 4.34Å; F191-I313 HydrophobicContact CE1-CG2 3.8Å; F191-I313 HydrophobicContact CZ-CD1 3.6Å; F191-I313 HydrophobicContact CZ-CG1 4.14Å; F191-I313 HydrophobicContact CZ-CG2 4.42Å
192	E	80.1	Confident	72	Confident	18 Å²	18	37.4 Å²	37.4	8%	0.084	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	124	173.5	-168.4	-156.7	168.6	0	0	110	N180 K194 S253 L255 K256	N180-E192 HydrophobicContact CB-CB 4.49Å; N180-E192 PolarHBondContact N-O 3.39Å; N180-E192 PolarHBondContact ND2-O 2.65Å; N180-E192 PolarHBondContact O-N 3.25Å; E192-K194 VanDerWaalsContact CD-NZ 3.27Å; E192-K194 WeakPolarHBondContact OE1-CE 3Å; E192-K194 IonicContact OE1-NZ 2.74Å; E192-K194 VanDerWaalsContact OE2-CE 3.24Å; E192-K194 WeakPolarHBondContact OE2-CE 3.01Å; E192-K194 IonicContact OE2-NZ 3.11Å; E192-K194 PolarHBondContact OE2-NZ 2.78Å; E192-S253 WeakPolarHBondContact OE1-CB 3.28Å; E192-S253 PolarHBondContact OE1-OG 3.48Å; E192-L255 CarbonylContact C-O 3.59Å; E192-L255 WeakPolarHBondContact CA-O 3.31Å; E192-K256 HydrophobicContact CG-CB 4.43Å
193	L	78.4	Confident	71.5	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	114.9	172.4	174.2	63.6	0	0	0	109.8	P177 V179 L195 L208 L254 L255 I267 I269 I311	P177-L193 HydrophobicContact CB-CD1 4.3Å; V179-L193 HydrophobicContact CG2-CD1 4.31Å; L193-L195 HydrophobicContact CD1-CD2 4.5Å; L193-L208 HydrophobicContact CD2-CD1 4.17Å; L193-L208 HydrophobicContact CD2-CD2 4.22Å; L193-L254 PolarHBondContact O-N 2.66Å; L193-L255 HydrophobicContact CB-CB 4.16Å; L193-L255 HydrophobicContact CD2-CB 4.5Å; L193-L255 PolarHBondContact N-O 3.45Å; L193-L255 PolarHBondContact O-N 2.67Å; L193-I267 HydrophobicContact CD2-CD1 4.34Å; L193-I267 HydrophobicContact CD2-CG2 4.49Å; L193-I269 HydrophobicContact CD1-CD1 4.46Å; L193-I269 HydrophobicContact CD2-CD1 3.93Å; L193-I311 HydrophobicContact CD1-CD1 3.76Å
194	K	81.6	Confident	71.5	Confident	45 Å²	45	35.1 Å²	35.1	20%	0.196	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	141.2	165.9	-55.3	-175.8	-175.9	76	0	109.3	L178 N180 E192 R252	L178-K194 HydrophobicContact CB-CB 4.33Å; L178-K194 PolarHBondContact N-O 3.39Å; L178-K194 PolarHBondContact O-N 2.94Å; N180-K194 PolarHBondContact ND2-NZ 3.38Å; N180-K194 VanDerWaalsContact ND2-NZ 3.11Å; N180-K194 PolarHBondContact OD1-NZ 3.47Å; E192-K194 VanDerWaalsContact CD-NZ 3.27Å; E192-K194 WeakPolarHBondContact OE1-CE 3Å; E192-K194 IonicContact OE1-NZ 2.74Å; E192-K194 VanDerWaalsContact OE2-CE 3.24Å; E192-K194 WeakPolarHBondContact OE2-CE 3.01Å; E192-K194 IonicContact OE2-NZ 3.11Å; E192-K194 PolarHBondContact OE2-NZ 2.78Å; K194-R252 CarbonylContact C-O 3.52Å; K194-R252 VanDerWaalsContact CA-O 3.29Å; K194-R252 WeakPolarHBondContact CA-O 3.49Å
195	L	79.1	Confident	71.6	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	149.2	163.6	-69.6	-171.4	0	0	0	110.3	L175 P177 L193 V205 L246 K251 R252 L254 I269	L175-L195 HydrophobicContact CD1-CD1 3.89Å; P177-L195 HydrophobicContact CB-CD2 3.9Å; L193-L195 HydrophobicContact CD1-CD2 4.5Å; L195-V205 HydrophobicContact CD1-CG2 4.12Å; L195-L246 HydrophobicContact CB-CD1 3.84Å; L195-L246 HydrophobicContact CD1-CD1 4.05Å; L195-K251 CarbonylContact O-C 3.59Å; L195-K251 WeakPolarHBondContact O-CA 3.13Å; L195-R252 PolarHBondContact N-O 2.91Å; L195-R252 PolarHBondContact O-N 3.01Å; L195-L254 HydrophobicContact CB-CD1 4.4Å; L195-L254 HydrophobicContact CD1-CD1 3.52Å; L195-L254 HydrophobicContact CG-CD1 3.72Å; L195-L254 HydrophobicContact CG-CG 4.44Å; L195-I269 HydrophobicContact CD1-CD1 4.13Å; L195-I269 HydrophobicContact CD1-CG2 4Å; L195-I269 HydrophobicContact CD2-CD1 3.69Å; L195-I269 HydrophobicContact CG-CD1 4.3Å
196	V	78	Confident	71.6	Confident	1 Å²	1	33 Å²	33	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	137.8	161.7	-170.7	0	0	0	0	107.9	I176 L178 P198 E250 K251 Y329	I176-V196 HydrophobicContact CB-CB 4.29Å; I176-V196 PolarHBondContact N-O 2.99Å; I176-V196 PolarHBondContact O-N 2.71Å; L178-V196 HydrophobicContact CD1-CG2 3.58Å; L178-V196 HydrophobicContact CG-CG2 4.27Å; V196-P198 VanDerWaalsContact O-CD 3.3Å; V196-P198 WeakPolarHBondContact O-CD 3.3Å; V196-E250 WeakPolarHBondContact CA-O 3.41Å; V196-K251 HydrophobicContact CG2-CB 4.11Å; V196-K251 HydrophobicContact CG2-CD 3.85Å; V196-K251 HydrophobicContact CG2-CG 3.89Å; V196-Y329 HydrophobicContact CG1-CE1 4.14Å; V196-Y329 HydrophobicContact CG1-CE2 4.43Å; V196-Y329 HydrophobicContact CG2-CD1 4.29Å; V196-Y329 HydrophobicContact CG2-CE1 4.15Å
197	N	78.3	Confident	71.6	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.			trans	-102.7	96.4	171.9	178.9	28.7	0	0	0	110.2	L175 L199 C201 V203 L246 H247 Y249 E250	L175-N197 HydrophobicContact CD2-CB 3.72Å; L175-N197 WeakPolarHBondContact CD2-OD1 3.49Å; N197-L199 PolarHBondContact O-N 3.26Å; N197-L199 WeakPolarHBondContact OD1-CB 3.2Å; N197-L199 PolarHBondContact OD1-N 2.69Å; N197-C201 PolarHBondContact ND2-O 2.72Å; N197-V203 WeakPolarHBondContact OD1-CG2 3.43Å; N197-L246 HydrophobicContact CB-CB 3.86Å; N197-L246 HydrophobicContact CB-CD1 4.31Å; N197-L246 PolarHBondContact ND2-O 2.6Å; N197-H247 PolarHBondContact ND2-O 3.49Å; N197-Y249 WeakPolarHBondContact O-CA 3.43Å; N197-Y249 PolarHBondContact O-N 2.05Å; N197-E250 PolarHBondContact N-O 3.5Å
198	P	69.7	Low	71.5	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.013	13%	0.134	C	C	.	.			trans	-76.4	-9	179.4	33.2	-37	0	0	0	113.9	D172 Y174 I176 V196 Y249	D172-P198 HydrophobicContact CB-CB 4.24Å; D172-P198 CarbonylContact O-C 3.59Å; D172-P198 WeakPolarHBondContact O-CG 3.39Å; Y174-P198 WeakPolarHBondContact O-CD 3.32Å; Y174-P198 WeakPolarHBondContact O-CG 3.22Å; I176-P198 HydrophobicContact CD1-CB 4.12Å; I176-P198 HydrophobicContact CD1-CG 3.93Å; I176-P198 HydrophobicContact CG1-CG 4.02Å; V196-P198 VanDerWaalsContact O-CD 3.3Å; V196-P198 WeakPolarHBondContact O-CD 3.3Å; P198-Y249 WeakPolarHBondContact O-CE1 3.26Å; P198-Y249 VanDerWaalsContact O-CZ 3.23Å; P198-Y249 PolarHBondContact O-OH 2.88Å; P198-Y249 VanDerWaalsContact O-OH 3.11Å
199	L	65.7	Low	71.2	Confident	24 Å²	24	28 Å²	28	13%	0.126	14%	0.141	C	C	.	.	S	Bend	trans	-65.4	150.4	178.6	-71.4	152.7	0	0	0	111.7	D172 N197 C201 V203 S248 L306	D172-L199 PolarHBondContact O-N 2.9Å; N197-L199 PolarHBondContact O-N 3.26Å; N197-L199 WeakPolarHBondContact OD1-CB 3.2Å; N197-L199 PolarHBondContact OD1-N 2.69Å; L199-C201 HydrophobicContact CB-CB 4.45Å; L199-C201 PolarHBondContact O-N 3.42Å; L199-V203 HydrophobicContact CD1-CG2 3.56Å; L199-S248 WeakPolarHBondContact O-CA 2.96Å; L199-S248 WeakPolarHBondContact O-CB 3.23Å; L199-S248 PolarHBondContact O-OG 2.71Å; L199-L306 HydrophobicContact CD1-CD1 4.16Å; L199-L306 HydrophobicContact CD1-CD2 4.2Å
200	S	56.8	Low	70.7	Confident	64 Å²	64	28.4 Å²	28.4	45%	0.448	15%	0.145	S	C	.	.	S	Bend	trans	-64.3	-10	166.1	52.9	0	0	0	0	113.7	S248	S200-S248 VanDerWaalsContact CA-OG 3.25Å; S200-S248 WeakPolarHBondContact CA-OG 3.24Å; S200-S248 WeakPolarHBondContact O-CB 3.34Å; S200-S248 PolarHBondContact O-OG 3.4Å
201	C	60.4	Low	69.9	Low	7 Å²	7	31.2 Å²	31.2	5%	0.047	16%	0.156	C	C	.	.	S	Bend	trans	-110.4	154.4	-172.1	-67.9	0	0	0	0	112.7	N197 L199 L273 C280	N197-C201 PolarHBondContact ND2-O 2.72Å; L199-C201 HydrophobicContact CB-CB 4.45Å; L199-C201 PolarHBondContact O-N 3.42Å; C201-L273 HydrophobicContact CB-CD2 4.19Å; C201-C280 HydrophobicContact CB-CB 4.2Å; C201-C280 WeakPolarHBondContact CB-SG 3.14Å; C201-C280 VanDerWaalsContact SG-CA 3.51Å; C201-C280 WeakPolarHBondContact SG-CB 3.12Å; C201-C280 CovalentContact SG-SG 2.03Å; C201-C280 PolarHBondContact SG-SG 3.04Å
202	S	65.8	Low	68.7	Low	25 Å²	25	33.7 Å²	33.7	18%	0.175	17%	0.173	C	C	.	.			trans	-75.7	135.7	168	-62.4	0	0	0	0	110.6	L246 H247 W274	S202-L246 CarbonylContact C-O 3.58Å; S202-L246 WeakPolarHBondContact CA-O 3.45Å; S202-H247 PolarHBondContact OG-ND1 2.59Å; S202-H247 VanDerWaalsContact OG-ND1 3.17Å; S202-W274 VanDerWaalsContact O-CB 3.3Å; S202-W274 WeakPolarHBondContact O-CB 3.06Å; S202-W274 PolarHBondContact O-N 2.69Å
203	V	71	Confident	66.9	Low	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.8	-178.9	177.7	0	0	0	0	110.2	L175 N197 L199 L246 L272 L306	L175-V203 HydrophobicContact CD1-CG1 3.9Å; L175-V203 HydrophobicContact CD2-CB 4.15Å; L175-V203 HydrophobicContact CD2-CG1 4.05Å; L175-V203 HydrophobicContact CD2-CG2 4.21Å; L175-V203 HydrophobicContact CG-CG1 4.25Å; N197-V203 WeakPolarHBondContact OD1-CG2 3.43Å; L199-V203 HydrophobicContact CD1-CG2 3.56Å; V203-L246 PolarHBondContact N-O 2.65Å; V203-L246 PolarHBondContact O-N 2.74Å; V203-L272 WeakPolarHBondContact CG1-O 3.07Å; V203-L306 HydrophobicContact CB-CD1 4.41Å; V203-L306 HydrophobicContact CG1-CD1 3.62Å; V203-L306 HydrophobicContact CG2-CD1 3.84Å
204	K	76.1	Confident	65.2	Low	51 Å²	51	41.4 Å²	41.4	22%	0.222	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	111.9	177.9	-167.8	168.7	170.4	-86.4	0	109.1	D206 P243 S271 L272 W274	K204-D206 WeakPolarHBondContact CE-OD1 3.4Å; K204-D206 WeakPolarHBondContact CG-OD1 3.37Å; K204-D206 IonicContact NZ-OD1 3.63Å; K204-D206 PolarHBondContact NZ-OD1 2.69Å; K204-D206 IonicContact NZ-OD2 3.65Å; K204-D206 PolarHBondContact NZ-OD2 2.72Å; K204-P243 HydrophobicContact CG-CB 4.24Å; K204-S271 CarbonylContact O-C 3.53Å; K204-S271 VanDerWaalsContact O-CA 3.28Å; K204-S271 WeakPolarHBondContact O-CA 3.46Å; K204-S271 WeakPolarHBondContact O-CB 3.5Å; K204-L272 PolarHBondContact N-O 3.07Å; K204-L272 PolarHBondContact O-N 3.26Å; K204-W274 HydrophobicContact CB-CB 4.41Å; K204-W274 HydrophobicContact CB-CD2 4.31Å; K204-W274 HydrophobicContact CB-CE3 3.51Å; K204-W274 HydrophobicContact CB-CZ3 4.1Å; K204-W274 HydrophobicContact CD-CD2 4.2Å; K204-W274 HydrophobicContact CD-CE3 3.64Å; K204-W274 HydrophobicContact CD-CH2 4.29Å; K204-W274 HydrophobicContact CD-CZ3 3.66Å; K204-W274 HydrophobicContact CG-CD2 4.47Å; K204-W274 HydrophobicContact CG-CE3 3.52Å; K204-W274 HydrophobicContact CG-CZ3 3.58Å
205	V	73	Confident	63.1	Low	11 Å²	11	42.9 Å²	42.9	7%	0.067	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	109.6	174.5	-176.6	0	0	0	0	108.2	L175 L195 P243 I244 L246 L254 I269	L175-V205 HydrophobicContact CD1-CG2 4.03Å; L195-V205 HydrophobicContact CD1-CG2 4.12Å; V205-P243 WeakPolarHBondContact O-CA 3.48Å; V205-I244 PolarHBondContact N-O 2.63Å; V205-I244 PolarHBondContact O-N 2.77Å; V205-I244 VanDerWaalsContact O-N 3.08Å; V205-L246 HydrophobicContact CG2-CD1 3.68Å; V205-L246 HydrophobicContact CG2-CG 4.02Å; V205-L254 HydrophobicContact CG1-CD1 4.23Å; V205-I269 HydrophobicContact CG1-CG2 4.17Å
206	D	67.6	Low	61.3	Low	48 Å²	48	45.7 Å²	45.7	26%	0.257	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-39.6	-167	-101.6	14.4	0	0	0	114.4	K204 P243 S270 L272	K204-D206 WeakPolarHBondContact CE-OD1 3.4Å; K204-D206 WeakPolarHBondContact CG-OD1 3.37Å; K204-D206 IonicContact NZ-OD1 3.63Å; K204-D206 PolarHBondContact NZ-OD1 2.69Å; K204-D206 IonicContact NZ-OD2 3.65Å; K204-D206 PolarHBondContact NZ-OD2 2.72Å; D206-P243 WeakPolarHBondContact OD1-CB 3.22Å; D206-S270 PolarHBondContact N-O 3.04Å; D206-L272 HydrophobicContact CB-CD1 3.91Å; D206-L272 WeakPolarHBondContact OD2-CD1 3.35Å
207	N	65.7	Low	59.4	Low	83 Å²	83	50.8 Å²	50.8	44%	0.444	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	139.5	177.2	-81.9	-88.2	0	0	0	111.1	S270	N207-S270 WeakPolarHBondContact CB-OG 3.42Å; N207-S270 PolarHBondContact N-O 2.75Å; N207-S270 PolarHBondContact N-OG 2.91Å; N207-S270 PolarHBondContact O-N 2.98Å; N207-S270 PolarHBondContact O-OG 3.48Å
208	L	65.8	Low	57.4	Low	23 Å²	23	57.2 Å²	57.2	12%	0.12	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	115.2	-178.7	-144.6	170.9	0	0	0	107	L193 L254 I267 I269	L193-L208 HydrophobicContact CD2-CD1 4.17Å; L193-L208 HydrophobicContact CD2-CD2 4.22Å; L208-L254 HydrophobicContact CD1-CB 4.18Å; L208-L254 HydrophobicContact CD1-CD1 3.91Å; L208-I267 HydrophobicContact CD2-CG2 3.43Å; L208-I267 VanDerWaalsContact CD2-CG2 3.43Å; L208-I269 HydrophobicContact CD2-CG1 4.26Å; L208-I269 HydrophobicContact CG-CG1 4.19Å
209	R	61.8	Low	55.6	Low	149 Å²	149	65.5 Å²	65.5	56%	0.562	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	152	-175	-66.4	-176.6	177.1	-174.1	-2.6	110.6	F211 I267 Q268	R209-F211 HydrophobicContact CB-CE2 3.86Å; R209-F211 HydrophobicContact CB-CZ 4Å; R209-I267 CarbonylContact O-C 3.55Å; R209-I267 WeakPolarHBondContact O-CA 3.4Å; R209-I267 WeakPolarHBondContact O-CG2 3.17Å; R209-Q268 PolarHBondContact N-O 2.8Å; R209-Q268 PolarHBondContact O-N 2.97Å
210	V	59.6	Low	54.1	Low	32 Å²	32	67.4 Å²	67.4	19%	0.194	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	137.7	176.5	-166.3	0	0	0	0	108.1	M264 I267 I313	V210-M264 HydrophobicContact CB-CE 4.17Å; V210-M264 HydrophobicContact CG1-CE 3.64Å; V210-M264 HydrophobicContact CG1-CG 4.46Å; V210-M264 HydrophobicContact CG1-SD 3.73Å; V210-I267 HydrophobicContact CG1-CG1 4.31Å; V210-I267 HydrophobicContact CG2-CG1 4.4Å; V210-I267 HydrophobicContact CG2-CG2 4.46Å; V210-I313 HydrophobicContact CG1-CD1 4.24Å
211	F	58.1	Low	52.6	Low	69 Å²	69	68.3 Å²	68.3	30%	0.303	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	136.6	-172.4	-59.6	-83.6	0	0	0	110.9	R209 M264 E265 L266 Q268	R209-F211 HydrophobicContact CB-CE2 3.86Å; R209-F211 HydrophobicContact CB-CZ 4Å; F211-M264 VanDerWaalsContact C-SD 3.51Å; F211-E265 PolarHBondContact O-N 3Å; F211-L266 PolarHBondContact N-O 2.72Å; F211-L266 PolarHBondContact O-N 2.8Å; F211-Q268 HydrophobicContact CD2-CB 4.44Å; F211-Q268 HydrophobicContact CE2-CB 3.76Å
212	S	49.7	Very low	50.9	Low	53 Å²	53	79.3 Å²	79.3	37%	0.371	41%	0.414	S	S	.	.			trans	-89.6	167.3	167.6	56.5	0	0	0	0	111.3	G214 D263	S212-G214 VanDerWaalsContact C-N 3.27Å; S212-G214 PolarHBondContact O-N 3.45Å; S212-D263 WeakPolarHBondContact CB-O 3.18Å
213	D	43.8	Very low	48.9	Very low	105 Å²	105	82.2 Å²	82.2	56%	0.561	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-60.8	-22.8	-158.5	-164	28	0	0	0	116	L215 E265	D213-L215 PolarHBondContact O-N 2.73Å; D213-E265 HydrophobicContact CB-CG 4.22Å
214	G	42.7	Very low	46.7	Very low	75 Å²	75	91.6 Å²	91.6	77%	0.773	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-69.3	4.4	-168.1	0	0	0	0	0	118.4	S212	S212-G214 VanDerWaalsContact C-N 3.27Å; S212-G214 PolarHBondContact O-N 3.45Å
215	L	37.2	Very low	44.2	Very low	76 Å²	76	94.1 Å²	94.1	40%	0.398	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-130.1	-1.3	-171.8	-78.8	166.4	0	0	0	115.7	D213 T217 E218 Y219	D213-L215 PolarHBondContact O-N 2.73Å; L215-T217 PolarHBondContact O-N 2.72Å; L215-T217 VanDerWaalsContact O-N 3.09Å; L215-E218 PolarHBondContact O-N 2.62Å; L215-E218 VanDerWaalsContact O-N 3.16Å; L215-Y219 HydrophobicContact CD2-CD2 3.97Å; L215-Y219 HydrophobicContact CD2-CE2 4.01Å
216	L	39.9	Very low	41.8	Very low	62 Å²	62	100.5 Å²	100.5	33%	0.325	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.8	-170.6	-69.5	174.7	0	0	0	114.8	E265 L266	L216-E265 HydrophobicContact CD1-CB 4.31Å; L216-L266 HydrophobicContact CD2-CD1 3.54Å
217	T	39.3	Very low	39.7	Very low	108 Å²	108	102.1 Å²	102.1	66%	0.663	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-13.2	178	49.4	0	0	0	0	115.2	L215	L215-T217 PolarHBondContact O-N 2.72Å; L215-T217 VanDerWaalsContact O-N 3.09Å
218	E	34.9	Very low	37.7	Very low	135 Å²	135	106.5 Å²	106.5	63%	0.631	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	-22.2	-174	-67.1	-169.9	151.9	0	0	114.3	L215 S221	L215-E218 PolarHBondContact O-N 2.62Å; L215-E218 VanDerWaalsContact O-N 3.16Å; E218-S221 PolarHBondContact O-OG 3.47Å
219	Y	33.5	Very low	35.8	Very low	176 Å²	176	110.6 Å²	110.6	69%	0.69	61%	0.606	S	S	*	*	S	Bend	trans	-105.7	15.1	-165.1	-94.2	-90.4	0	0	0	117.2	L215	L215-Y219 HydrophobicContact CD2-CD2 3.97Å; L215-Y219 HydrophobicContact CD2-CE2 4.01Å
220	C	33.3	Very low	34.1	Very low	63 Å²	63	110.1 Å²	110.1	43%	0.426	62%	0.62	S	S	.	*			trans	-100.8	-6.2	173.3	-72.3	0	0	0	0	114.8	Y222	C220-Y222 PolarHBondContact O-N 3.28Å
221	S	25.5	Very low	32.5	Very low	84 Å²	84	114 Å²	114	59%	0.587	65%	0.648	S	S	*	*	S	Bend	trans	-79.5	112.9	173.3	48.5	0	0	0	0	111.1	E218 S223	E218-S221 PolarHBondContact O-OG 3.47Å; S221-S223 PolarHBondContact O-N 2.72Å
222	Y	25.5	Very low	31	Very low	237 Å²	237	122.5 Å²	122.5	93%	0.929	68%	0.678	S	S	*	*			trans	-79.1	78.8	-178.1	-129.1	-85.4	0	0	0	111.6	C220	C220-Y222 PolarHBondContact O-N 3.28Å
223	S	23.4	Very low	29.9	Very low	87 Å²	87	126.7 Å²	126.7	61%	0.608	70%	0.697	S	S	*	*			trans	-132.2	152.7	171.1	65.7	0	0	0	0	111.7	S221 V225	S221-S223 PolarHBondContact O-N 2.72Å; S223-V225 PolarHBondContact O-N 3.16Å; S223-V225 VanDerWaalsContact O-N 3.16Å
224	Q	24.2	Very low	28.9	Very low	196 Å²	196	129 Å²	129	92%	0.916	71%	0.709	S	S	*	*			trans	-72.5	106.2	-177.1	-68.9	173.8	-36	0	0	110.8
225	V	23.1	Very low	28.2	Very low	105 Å²	105	132.3 Å²	132.3	64%	0.636	71%	0.708	S	S	*	*			trans	-115.9	82.9	171	-173.7	0	0	0	0	110.5	S223 S227	S223-V225 PolarHBondContact O-N 3.16Å; S223-V225 VanDerWaalsContact O-N 3.16Å; V225-S227 WeakPolarHBondContact CG1-OG 3.5Å; V225-S227 PolarHBondContact O-N 2.79Å
226	T	23.4	Very low	27.9	Very low	145 Å²	145	132.7 Å²	132.7	89%	0.89	71%	0.71	S	S	*	*			trans	-83	91.5	160.5	48.1	0	0	0	0	109.2
227	S	24.2	Very low	27.3	Very low	82 Å²	82	136.5 Å²	136.5	57%	0.573	73%	0.731	S	S	*	*			trans	-136.8	121.7	174.6	62.3	0	0	0	0	112.5	V225 S229	V225-S227 WeakPolarHBondContact CG1-OG 3.5Å; V225-S227 PolarHBondContact O-N 2.79Å; S227-S229 PolarHBondContact O-N 3.24Å
228	N	23.7	Very low	26.9	Very low	175 Å²	175	137.4 Å²	137.4	94%	0.936	73%	0.732	S	S	*	*			trans	-73.3	114.9	172.8	-69.9	-37.2	0	0	0	110.6
229	S	25.6	Very low	27.3	Very low	108 Å²	108	138.6 Å²	138.6	76%	0.755	73%	0.731	S	S	*	*			trans	-140.6	83.9	168.7	61.7	0	0	0	0	111.8	S227 S231	S227-S229 PolarHBondContact O-N 3.24Å; S229-S231 PolarHBondContact O-N 3.03Å
230	T	25.2	Very low	27.4	Very low	139 Å²	139	134.1 Å²	134.1	85%	0.853	73%	0.731	S	S	*	*			trans	-76.1	111.5	175.1	49.3	0	0	0	0	111.5
231	S	26	Very low	28.2	Very low	113 Å²	113	135.4 Å²	135.4	79%	0.79	73%	0.729	S	S	*	*			trans	172.5	72.8	144	46.8	0	0	0	0	115.5	S229	S229-S231 PolarHBondContact O-N 3.03Å
232	R	26.6	Very low	29.6	Very low	248 Å²	248	139.5 Å²	139.5	94%	0.936	74%	0.739	S	S	*	*			trans	-162.3	102.7	141.6	-122.6	174.4	178.7	133.6	-0.8	110.7
233	N	26.2	Very low	31.1	Very low	141 Å²	141	131.3 Å²	131.3	75%	0.754	72%	0.715	S	S	*	*			trans	-80.8	174	171.7	-63.5	9.5	0	0	0	109.7
234	D	24.6	Very low	33.3	Very low	155 Å²	155	128.7 Å²	128.7	83%	0.829	69%	0.694	S	S	*	*			trans	73.3	56.2	171.2	-51.4	-19.3	0	0	0	116
235	L	26.6	Very low	35.5	Very low	143 Å²	143	121.8 Å²	121.8	75%	0.749	66%	0.663	S	S	*	*	S	Bend	trans	-166.1	117.6	141	-104.9	157.4	0	0	0	112.1
236	I	30.6	Very low	37.6	Very low	85 Å²	85	116.8 Å²	116.8	44%	0.436	63%	0.632	S	S	.	*			trans	51.2	78.3	174.8	-43.2	107.3	0	0	0	116.3	M264	I236-M264 HydrophobicContact CB-CE 4.16Å; I236-M264 HydrophobicContact CD1-CE 3.38Å; I236-M264 HydrophobicContact CD1-SD 4.34Å; I236-M264 HydrophobicContact CG1-CE 3.46Å; I236-M264 VanDerWaalsContact CG1-CE 3.46Å; I236-M264 HydrophobicContact CG2-CE 4.01Å
237	D	27.7	Very low	39.6	Very low	141 Å²	141	114.4 Å²	114.4	75%	0.754	61%	0.611	S	S	*	*			trans	-108	133.2	169	-131.9	-27.8	0	0	0	111.4
238	N	32.1	Very low	41.4	Very low	128 Å²	128	112 Å²	112	68%	0.684	59%	0.594	S	S	*	*			trans	56.4	86.2	163.6	-58	-65.2	0	0	0	120.4	A240	N238-A240 VanDerWaalsContact C-N 3.31Å; N238-A240 PolarHBondContact O-N 3.19Å
239	Y	43	Very low	43.4	Very low	159 Å²	159	106.2 Å²	106.2	62%	0.624	56%	0.559	S	S	*	*			trans	-89.9	66.9	142.2	-81.3	-70.5	0	0	0	110.8	F241	Y239-F241 HydrophobicContact CD1-CE2 4.46Å; Y239-F241 WeakPolarHBondContact O-CD2 3.37Å; Y239-F241 PolarHBondContact O-N 3Å
240	A	35.3	Very low	45.4	Very low	82 Å²	82	103.3 Å²	103.3	68%	0.678	53%	0.534	S	S	*	.			trans	-73.2	93	171.7	0	0	0	0	0	110	N238	N238-A240 VanDerWaalsContact C-N 3.31Å; N238-A240 PolarHBondContact O-N 3.19Å
241	F	50	Low	47.7	Very low	91 Å²	91	101.2 Å²	101.2	40%	0.399	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-72.6	152.2	167.2	-74.7	-91.7	0	0	0	110.3	Y239 I244 L255	Y239-F241 HydrophobicContact CD1-CE2 4.46Å; Y239-F241 WeakPolarHBondContact O-CD2 3.37Å; Y239-F241 PolarHBondContact O-N 3Å; F241-I244 HydrophobicContact CD1-CD1 4.37Å; F241-L255 HydrophobicContact CE2-CD1 4Å; F241-L255 HydrophobicContact CZ-CD1 4.05Å
242	E	54.1	Low	50	Low	170 Å²	170	100.3 Å²	100.3	79%	0.794	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-58	143.4	157.8	-68.1	-174.8	145.9	0	0	108.9	I244	E242-I244 PolarHBondContact O-N 3.02Å; E242-I244 VanDerWaalsContact O-N 3.17Å
243	P	58.7	Low	52.2	Low	65 Å²	65	89.8 Å²	89.8	42%	0.422	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-64.3	119.8	-175.5	25.9	-34.8	0	0	0	110.8	K204 V205 D206	K204-P243 HydrophobicContact CG-CB 4.24Å; V205-P243 WeakPolarHBondContact O-CA 3.48Å; D206-P243 WeakPolarHBondContact OD1-CB 3.22Å
244	I	68.1	Low	54.2	Low	31 Å²	31	83.4 Å²	83.4	16%	0.159	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	125.8	-170.6	-79.1	164.4	0	0	0	110.2	V205 F241 E242 L246 L254	V205-I244 PolarHBondContact N-O 2.63Å; V205-I244 PolarHBondContact O-N 2.77Å; V205-I244 VanDerWaalsContact O-N 3.08Å; F241-I244 HydrophobicContact CD1-CD1 4.37Å; E242-I244 PolarHBondContact O-N 3.02Å; E242-I244 VanDerWaalsContact O-N 3.17Å; I244-L246 HydrophobicContact CG2-CD2 4.36Å; I244-L246 PolarHBondContact O-N 2.7Å; I244-L254 HydrophobicContact CB-CD2 4.42Å; I244-L254 HydrophobicContact CD1-CD2 3.7Å; I244-L254 HydrophobicContact CG2-CD2 3.91Å
245	I	70.1	Confident	56.3	Low	52 Å²	52	76.6 Å²	76.6	27%	0.267	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	127.7	163.7	-22.3	-163.1	0	0	0	108.5	R252 W274	I245-R252 PolarHBondContact O-NH1 2.96Å; I245-W274 HydrophobicContact CB-CE3 4.16Å; I245-W274 HydrophobicContact CB-CZ3 4.06Å; I245-W274 HydrophobicContact CD1-CE3 4.3Å; I245-W274 HydrophobicContact CD1-CH2 3.73Å; I245-W274 HydrophobicContact CD1-CZ2 4.07Å; I245-W274 HydrophobicContact CD1-CZ3 3.86Å; I245-W274 HydrophobicContact CG1-CE3 4Å; I245-W274 HydrophobicContact CG1-CH2 3.78Å; I245-W274 HydrophobicContact CG1-CZ3 3.46Å; I245-W274 VanDerWaalsContact CG1-CZ3 3.46Å; I245-W274 HydrophobicContact CG2-CD2 4.21Å; I245-W274 HydrophobicContact CG2-CE3 3.71Å; I245-W274 HydrophobicContact CG2-CZ3 4.12Å
246	L	67.8	Low	58.4	Low	0 Å²	0	74.4 Å²	74.4	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	113.5	153.4	-61.5	175.5	0	0	0	106.6	L175 L195 N197 S202 V203 V205 I244 R252	L175-L246 HydrophobicContact CD1-CD1 4.08Å; L175-L246 HydrophobicContact CD2-CD1 3.92Å; L195-L246 HydrophobicContact CB-CD1 3.84Å; L195-L246 HydrophobicContact CD1-CD1 4.05Å; N197-L246 HydrophobicContact CB-CB 3.86Å; N197-L246 HydrophobicContact CB-CD1 4.31Å; N197-L246 PolarHBondContact ND2-O 2.6Å; S202-L246 CarbonylContact C-O 3.58Å; S202-L246 WeakPolarHBondContact CA-O 3.45Å; V203-L246 PolarHBondContact N-O 2.65Å; V203-L246 PolarHBondContact O-N 2.74Å; V205-L246 HydrophobicContact CG2-CD1 3.68Å; V205-L246 HydrophobicContact CG2-CG 4.02Å; I244-L246 HydrophobicContact CG2-CD2 4.36Å; I244-L246 PolarHBondContact O-N 2.7Å; L246-R252 HydrophobicContact CD2-CB 3.44Å; L246-R252 VanDerWaalsContact CD2-CB 3.44Å; L246-R252 HydrophobicContact CD2-CG 4.29Å
247	H	66.1	Low	60.2	Low	95 Å²	95	71.2 Å²	71.2	44%	0.44	36%	0.356	S	S	.	.			trans	-68.4	165.3	170.5	-66.4	-63.2	0	0	0	111	N197 S202 Y249 E250	N197-H247 PolarHBondContact ND2-O 3.49Å; S202-H247 PolarHBondContact OG-ND1 2.59Å; S202-H247 VanDerWaalsContact OG-ND1 3.17Å; H247-Y249 PolarHBondContact O-N 3.22Å; H247-E250 HydrophobicContact CB-CB 4.26Å; H247-E250 IonicContact CD2-OE2 2.82Å; H247-E250 PolarHBondContact CD2-OE2 3.29Å; H247-E250 IonicContact CG-OE2 2.64Å; H247-E250 PolarHBondContact N-OE2 3.37Å; H247-E250 WeakPolarHBondContact O-CB 3.47Å; H247-E250 PolarHBondContact O-N 2.83Å
248	S	61.6	Low	62	Low	30 Å²	30	68.6 Å²	68.6	21%	0.21	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	131.2	175.5	178.8	0	0	0	0	111	L199 S200 E250	L199-S248 WeakPolarHBondContact O-CA 2.96Å; L199-S248 WeakPolarHBondContact O-CB 3.23Å; L199-S248 PolarHBondContact O-OG 2.71Å; S200-S248 VanDerWaalsContact CA-OG 3.25Å; S200-S248 WeakPolarHBondContact CA-OG 3.24Å; S200-S248 WeakPolarHBondContact O-CB 3.34Å; S200-S248 PolarHBondContact O-OG 3.4Å; S248-E250 PolarHBondContact O-N 3.08Å; S248-E250 VanDerWaalsContact O-N 3.14Å
249	Y	65.9	Low	63.6	Low	55 Å²	55	64 Å²	64	22%	0.216	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	11.6	-173.4	-52.4	-75.7	0	0	0	115.9	N197 P198 H247 S523	N197-Y249 WeakPolarHBondContact O-CA 3.43Å; N197-Y249 PolarHBondContact O-N 2.05Å; P198-Y249 WeakPolarHBondContact O-CE1 3.26Å; P198-Y249 VanDerWaalsContact O-CZ 3.23Å; P198-Y249 PolarHBondContact O-OH 2.88Å; P198-Y249 VanDerWaalsContact O-OH 3.11Å; H247-Y249 PolarHBondContact O-N 3.22Å; Y249-S523 VanDerWaalsContact CE2-CA 3.45Å; Y249-S523 WeakPolarHBondContact CE2-O 3.46Å
250	E	67.5	Low	64.5	Low	47 Å²	47	60 Å²	60	22%	0.22	31%	0.31	C	S	.	.			trans	-71.7	136.9	176.1	-167.5	-177.1	156.1	0	0	111.5	V196 N197 H247 S248 R252	V196-E250 WeakPolarHBondContact CA-O 3.41Å; N197-E250 PolarHBondContact N-O 3.5Å; H247-E250 HydrophobicContact CB-CB 4.26Å; H247-E250 IonicContact CD2-OE2 2.82Å; H247-E250 PolarHBondContact CD2-OE2 3.29Å; H247-E250 IonicContact CG-OE2 2.64Å; H247-E250 PolarHBondContact N-OE2 3.37Å; H247-E250 WeakPolarHBondContact O-CB 3.47Å; H247-E250 PolarHBondContact O-N 2.83Å; S248-E250 PolarHBondContact O-N 3.08Å; S248-E250 VanDerWaalsContact O-N 3.14Å; E250-R252 VanDerWaalsContact OE1-CD 3.3Å; E250-R252 WeakPolarHBondContact OE1-CD 3.44Å; E250-R252 IonicContact OE1-CZ 3.71Å; E250-R252 IonicContact OE1-NE 3.92Å; E250-R252 IonicContact OE1-NH1 3.51Å; E250-R252 PolarHBondContact OE1-NH1 3.04Å; E250-R252 IonicContact OE2-NH1 3.67Å
251	K	72.9	Confident	65.6	Low	95 Å²	95	56.5 Å²	56.5	41%	0.413	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	113.3	169.4	175.4	166.2	-177.8	160.6	0	109.8	L178 L195 V196	L178-K251 HydrophobicContact CD1-CD 4.38Å; L195-K251 CarbonylContact O-C 3.59Å; L195-K251 WeakPolarHBondContact O-CA 3.13Å; V196-K251 HydrophobicContact CG2-CB 4.11Å; V196-K251 HydrophobicContact CG2-CD 3.85Å; V196-K251 HydrophobicContact CG2-CG 3.89Å
252	R	73.8	Confident	65.9	Low	94 Å²	94	58 Å²	58	36%	0.355	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.7	-171.8	-157.7	-179.1	-177.1	132.1	-14.9	112.1	K194 L195 I245 L246 E250	K194-R252 CarbonylContact C-O 3.52Å; K194-R252 VanDerWaalsContact CA-O 3.29Å; K194-R252 WeakPolarHBondContact CA-O 3.49Å; L195-R252 PolarHBondContact N-O 2.91Å; L195-R252 PolarHBondContact O-N 3.01Å; I245-R252 PolarHBondContact O-NH1 2.96Å; L246-R252 HydrophobicContact CD2-CB 3.44Å; L246-R252 VanDerWaalsContact CD2-CB 3.44Å; L246-R252 HydrophobicContact CD2-CG 4.29Å; E250-R252 VanDerWaalsContact OE1-CD 3.3Å; E250-R252 WeakPolarHBondContact OE1-CD 3.44Å; E250-R252 IonicContact OE1-CZ 3.71Å; E250-R252 IonicContact OE1-NE 3.92Å; E250-R252 IonicContact OE1-NH1 3.51Å; E250-R252 PolarHBondContact OE1-NH1 3.04Å; E250-R252 IonicContact OE2-NH1 3.67Å
253	S	73	Confident	65.7	Low	27 Å²	27	54.5 Å²	54.5	19%	0.189	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	120.9	170.9	177.6	0	0	0	0	110	E192 K886	E192-S253 WeakPolarHBondContact OE1-CB 3.28Å; E192-S253 PolarHBondContact OE1-OG 3.48Å; S253-K886 PolarHBondContact O-NZ 3.08Å; S253-K886 PolarHBondContact OG-NZ 2.91Å
254	L	68.9	Low	65.4	Low	7 Å²	7	52 Å²	52	4%	0.037	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-72.8	178.1	-61	-172.5	0	0	0	110.9	L193 L195 V205 L208 I244 K886	L193-L254 PolarHBondContact O-N 2.66Å; L195-L254 HydrophobicContact CB-CD1 4.4Å; L195-L254 HydrophobicContact CD1-CD1 3.52Å; L195-L254 HydrophobicContact CG-CD1 3.72Å; L195-L254 HydrophobicContact CG-CG 4.44Å; V205-L254 HydrophobicContact CG1-CD1 4.23Å; L208-L254 HydrophobicContact CD1-CB 4.18Å; L208-L254 HydrophobicContact CD1-CD1 3.91Å; I244-L254 HydrophobicContact CB-CD2 4.42Å; I244-L254 HydrophobicContact CD1-CD2 3.7Å; I244-L254 HydrophobicContact CG2-CD2 3.91Å; L254-K886 VanDerWaalsContact C-NZ 3.33Å; L254-K886 PolarHBondContact O-NZ 2.92Å
255	L	69.2	Low	65.1	Low	11 Å²	11	51.8 Å²	51.8	6%	0.058	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	142.7	-175.9	-166.1	72.4	0	0	0	111	F191 E192 L193 F241 A257	F191-L255 HydrophobicContact CE2-CD2 4.45Å; E192-L255 CarbonylContact C-O 3.59Å; E192-L255 WeakPolarHBondContact CA-O 3.31Å; L193-L255 HydrophobicContact CB-CB 4.16Å; L193-L255 HydrophobicContact CD2-CB 4.5Å; L193-L255 PolarHBondContact N-O 3.45Å; L193-L255 PolarHBondContact O-N 2.67Å; F241-L255 HydrophobicContact CE2-CD1 4Å; F241-L255 HydrophobicContact CZ-CD1 4.05Å; L255-A257 HydrophobicContact CD2-CB 3.96Å; L255-A257 HydrophobicContact CG-CB 4.12Å
256	K	71.1	Confident	64.5	Low	98 Å²	98	50.1 Å²	50.1	43%	0.426	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	118.5	160.4	177.3	167.4	175.7	153.8	0	106.5	E182 F191 E192	E182-K256 VanDerWaalsContact CD-CE 3.48Å; E182-K256 WeakPolarHBondContact OE1-CE 3.49Å; E182-K256 IonicContact OE1-NZ 2.78Å; E182-K256 PolarHBondContact OE1-NZ 3.29Å; E182-K256 WeakPolarHBondContact OE2-CE 2.9Å; E182-K256 IonicContact OE2-NZ 2.73Å; E182-K256 PolarHBondContact OE2-NZ 2.89Å; F191-K256 WeakPolarHBondContact O-CA 3.37Å; E192-K256 HydrophobicContact CG-CB 4.43Å
257	A	66.7	Low	64.3	Low	17 Å²	17	50.1 Å²	50.1	14%	0.14	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	151.4	-169.3	0	0	0	0	0	110.7	S190 F191 L255 I259	S190-A257 WeakPolarHBondContact CA-O 2.96Å; S190-A257 PolarHBondContact OG-O 2.77Å; F191-A257 HydrophobicContact CE1-CB 4.1Å; F191-A257 HydrophobicContact CE2-CB 4.33Å; F191-A257 HydrophobicContact CZ-CB 3.89Å; F191-A257 PolarHBondContact N-O 2.82Å; F191-A257 PolarHBondContact O-N 2.98Å; L255-A257 HydrophobicContact CD2-CB 3.96Å; L255-A257 HydrophobicContact CG-CB 4.12Å; A257-I259 HydrophobicContact CB-CG1 4.48Å
258	T	65.7	Low	64.1	Low	87 Å²	87	49 Å²	49	53%	0.534	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	127.5	169.8	-53	0	0	0	0	107.2	K188 K189 S190	K188-T258 HydrophobicContact CB-CG2 4.47Å; K189-T258 WeakPolarHBondContact O-CA 3.47Å; S190-T258 PolarHBondContact OG-OG1 2.82Å
259	I	65.5	Low	64.3	Low	32 Å²	32	47.7 Å²	47.7	16%	0.164	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	143.6	-172.4	-48.3	-169.7	0	0	0	107.8	K189 F191 A257 M264 I313	K189-I259 PolarHBondContact N-O 3.09Å; K189-I259 PolarHBondContact O-N 3.14Å; F191-I259 HydrophobicContact CE1-CD1 3.62Å; F191-I259 HydrophobicContact CE1-CG1 3.95Å; F191-I259 HydrophobicContact CZ-CD1 4Å; A257-I259 HydrophobicContact CB-CG1 4.48Å; I259-M264 HydrophobicContact CD1-CB 4.23Å; I259-M264 HydrophobicContact CD1-CG 3.97Å; I259-M264 HydrophobicContact CG2-CB 3.98Å; I259-M264 HydrophobicContact CG2-CG 3.58Å; I259-I313 HydrophobicContact CD1-CD1 4.03Å
260	D	62.6	Low	64	Low	73 Å²	73	47 Å²	47	39%	0.39	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	143.6	170	-72.1	-72.9	0	0	0	110.2	N187 K188 D262 D263	N187-D260 CarbonylContact O-C 3.56Å; N187-D260 WeakPolarHBondContact O-CA 3.44Å; K188-D260 WeakPolarHBondContact CE-OD1 2.94Å; K188-D260 WeakPolarHBondContact CG-OD1 3.33Å; K188-D260 IonicContact NZ-OD1 3.93Å; D260-D262 PolarHBondContact O-N 3.07Å; D260-D262 VanDerWaalsContact O-N 3.07Å; D260-D263 PolarHBondContact O-N 3.06Å
261	A	58.5	Low	63.8	Low	9 Å²	9	45.2 Å²	45.2	7%	0.074	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.3	-161.7	0	0	0	0	0	113.7	N187 K189 N314	N187-A261 PolarHBondContact O-N 3.39Å; K189-A261 HydrophobicContact CD-CB 4.33Å; K189-A261 HydrophobicContact CG-CB 4.47Å; K189-A261 PolarHBondContact NZ-O 2.84Å; A261-N314 PolarHBondContact O-ND2 2.66Å; A261-N314 PolarHBondContact O-OD1 2.75Å
262	D	56.5	Low	63.2	Low	123 Å²	123	41.7 Å²	41.7	66%	0.658	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-13.8	-170.8	-56.9	-30.9	0	0	0	113.6	D260	D260-D262 PolarHBondContact O-N 3.07Å; D260-D262 VanDerWaalsContact O-N 3.07Å
263	D	50.4	Low	62.2	Low	96 Å²	96	38.4 Å²	38.4	51%	0.513	21%	0.209	S	C	.	.	S	Bend	trans	-97.3	-7.6	-155.5	-95.9	-9.2	0	0	0	117.4	S212 D260	S212-D263 WeakPolarHBondContact CB-O 3.18Å; D260-D263 PolarHBondContact O-N 3.06Å
264	M	51.1	Low	61	Low	13 Å²	13	41.3 Å²	41.3	6%	0.064	22%	0.216	C	C	.	.			trans	-144.5	122	-172	-73.2	-72	-150.9	0	0	115.3	V210 F211 I236 I259 I313 N314	V210-M264 HydrophobicContact CB-CE 4.17Å; V210-M264 HydrophobicContact CG1-CE 3.64Å; V210-M264 HydrophobicContact CG1-CG 4.46Å; V210-M264 HydrophobicContact CG1-SD 3.73Å; F211-M264 VanDerWaalsContact C-SD 3.51Å; I236-M264 HydrophobicContact CB-CE 4.16Å; I236-M264 HydrophobicContact CD1-CE 3.38Å; I236-M264 HydrophobicContact CD1-SD 4.34Å; I236-M264 HydrophobicContact CG1-CE 3.46Å; I236-M264 VanDerWaalsContact CG1-CE 3.46Å; I236-M264 HydrophobicContact CG2-CE 4.01Å; I259-M264 HydrophobicContact CD1-CB 4.23Å; I259-M264 HydrophobicContact CD1-CG 3.97Å; I259-M264 HydrophobicContact CG2-CB 3.98Å; I259-M264 HydrophobicContact CG2-CG 3.58Å; M264-I313 HydrophobicContact CB-CD1 4.35Å; M264-N314 VanDerWaalsContact O-CB 3.28Å; M264-N314 WeakPolarHBondContact O-CB 3.03Å; M264-N314 PolarHBondContact O-N 3.25Å; M264-N314 PolarHBondContact O-ND2 2.71Å
265	E	61.7	Low	59.8	Low	26 Å²	26	44.4 Å²	44.4	12%	0.121	23%	0.23	C	C	.	.			trans	-102.9	-26.2	-179.4	-77.2	-86	133.8	0	0	114.3	F211 D213 L216 S312 I313 N314	F211-E265 PolarHBondContact O-N 3Å; D213-E265 HydrophobicContact CB-CG 4.22Å; L216-E265 HydrophobicContact CD1-CB 4.31Å; E265-S312 WeakPolarHBondContact O-CA 3.08Å; E265-I313 PolarHBondContact O-N 2.8Å; E265-N314 HydrophobicContact CG-CB 4.32Å; E265-N314 WeakPolarHBondContact OE1-CB 3.33Å
266	L	58.2	Low	58.6	Low	18 Å²	18	53.1 Å²	53.1	9%	0.094	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	137.8	-171.8	-113	153.9	0	0	0	117.4	L140 F211 L216 I311	L140-L266 HydrophobicContact CD2-CD1 4.21Å; L140-L266 HydrophobicContact CD2-CD2 4.45Å; F211-L266 PolarHBondContact N-O 2.72Å; F211-L266 PolarHBondContact O-N 2.8Å; L216-L266 HydrophobicContact CD2-CD1 3.54Å; L266-I311 CarbonylContact C-O 3.58Å; L266-I311 WeakPolarHBondContact CA-O 3.34Å; L266-I311 WeakPolarHBondContact CD2-O 3.42Å
267	I	63.9	Low	57.4	Low	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	139.5	165.4	-50.7	176.4	0	0	0	108.8	F191 L193 L208 R209 V210 I269 S310 I311 I313	F191-I267 HydrophobicContact CE2-CD1 3.89Å; F191-I267 HydrophobicContact CZ-CD1 4.11Å; L193-I267 HydrophobicContact CD2-CD1 4.34Å; L193-I267 HydrophobicContact CD2-CG2 4.49Å; L208-I267 HydrophobicContact CD2-CG2 3.43Å; L208-I267 VanDerWaalsContact CD2-CG2 3.43Å; R209-I267 CarbonylContact O-C 3.55Å; R209-I267 WeakPolarHBondContact O-CA 3.4Å; R209-I267 WeakPolarHBondContact O-CG2 3.17Å; V210-I267 HydrophobicContact CG1-CG1 4.31Å; V210-I267 HydrophobicContact CG2-CG1 4.4Å; V210-I267 HydrophobicContact CG2-CG2 4.46Å; I267-I269 HydrophobicContact CG2-CG1 4.23Å; I267-S310 CarbonylContact O-C 3.55Å; I267-S310 WeakPolarHBondContact O-CA 3.23Å; I267-I311 HydrophobicContact CB-CB 4.24Å; I267-I311 PolarHBondContact N-O 2.65Å; I267-I311 PolarHBondContact O-N 2.69Å; I267-I313 HydrophobicContact CD1-CD1 3.89Å; I267-I313 HydrophobicContact CD1-CG1 3.89Å; I267-I313 HydrophobicContact CG1-CD1 3.61Å; I267-I313 HydrophobicContact CG1-CG1 3.78Å
268	Q	62.3	Low	56.2	Low	70 Å²	70	54.7 Å²	54.7	33%	0.327	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.1	167.3	-168.7	-176.4	40.8	0	0	110.7	R209 F211 A308	R209-Q268 PolarHBondContact N-O 2.8Å; R209-Q268 PolarHBondContact O-N 2.97Å; F211-Q268 HydrophobicContact CD2-CB 4.44Å; F211-Q268 HydrophobicContact CE2-CB 3.76Å; Q268-A308 HydrophobicContact CG-CB 4Å
269	I	64.4	Low	55.1	Low	3 Å²	3	57.4 Å²	57.4	2%	0.015	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	125.6	179.2	-53.5	-175.8	0	0	0	108.5	L193 L195 V205 L208 I267 A308 A309 I311	L193-I269 HydrophobicContact CD1-CD1 4.46Å; L193-I269 HydrophobicContact CD2-CD1 3.93Å; L195-I269 HydrophobicContact CD1-CD1 4.13Å; L195-I269 HydrophobicContact CD1-CG2 4Å; L195-I269 HydrophobicContact CD2-CD1 3.69Å; L195-I269 HydrophobicContact CG-CD1 4.3Å; V205-I269 HydrophobicContact CG1-CG2 4.17Å; L208-I269 HydrophobicContact CD2-CG1 4.26Å; L208-I269 HydrophobicContact CG-CG1 4.19Å; I267-I269 HydrophobicContact CG2-CG1 4.23Å; I269-A308 CarbonylContact O-C 3.45Å; I269-A308 VanDerWaalsContact O-CA 3.24Å; I269-A308 WeakPolarHBondContact O-CA 3.1Å; I269-A309 PolarHBondContact N-O 2.69Å; I269-A309 PolarHBondContact O-N 2.66Å; I269-A309 VanDerWaalsContact O-N 3.07Å; I269-I311 HydrophobicContact CD1-CD1 3.53Å; I269-I311 HydrophobicContact CG1-CD1 4.17Å
270	S	59.7	Low	54	Low	42 Å²	42	57.5 Å²	57.5	29%	0.294	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	133.9	174.9	62.7	0	0	0	0	110.7	D206 N207	D206-S270 PolarHBondContact N-O 3.04Å; N207-S270 WeakPolarHBondContact CB-OG 3.42Å; N207-S270 PolarHBondContact N-O 2.75Å; N207-S270 PolarHBondContact N-OG 2.91Å; N207-S270 PolarHBondContact O-N 2.98Å; N207-S270 PolarHBondContact O-OG 3.48Å
271	S	63.6	Low	52.9	Low	8 Å²	8	61.8 Å²	61.8	6%	0.056	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	158.1	-175.9	62.9	0	0	0	0	111.6	K204 L306	K204-S271 CarbonylContact O-C 3.53Å; K204-S271 VanDerWaalsContact O-CA 3.28Å; K204-S271 WeakPolarHBondContact O-CA 3.46Å; K204-S271 WeakPolarHBondContact O-CB 3.5Å; S271-L306 PolarHBondContact O-N 3.21Å; S271-L306 VanDerWaalsContact O-N 3.07Å; S271-L306 WeakPolarHBondContact OG-CB 3.46Å
272	L	59.6	Low	52	Low	22 Å²	22	64.2 Å²	64.2	12%	0.115	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	152	176.3	-63.5	107.2	0	0	0	108.7	V203 K204 D206 W274 F303 K305	V203-L272 WeakPolarHBondContact CG1-O 3.07Å; K204-L272 PolarHBondContact N-O 3.07Å; K204-L272 PolarHBondContact O-N 3.26Å; D206-L272 HydrophobicContact CB-CD1 3.91Å; D206-L272 WeakPolarHBondContact OD2-CD1 3.35Å; L272-W274 PolarHBondContact O-N 3.34Å; L272-F303 HydrophobicContact CD2-CB 3.57Å; L272-F303 HydrophobicContact CD2-CD1 4.38Å; L272-F303 HydrophobicContact CD2-CG 4.21Å; L272-K305 HydrophobicContact CD2-CB 4.49Å; L272-K305 HydrophobicContact CD2-CG 3.49Å; L272-K305 VanDerWaalsContact CD2-CG 3.49Å; L272-K305 HydrophobicContact CG-CG 3.92Å
273	L	52.9	Low	50.8	Low	24 Å²	24	64.4 Å²	64.4	13%	0.126	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	140.1	166.3	-82.9	91.2	0	0	0	109.6	C201 E275 C280 S304 L306	C201-L273 HydrophobicContact CB-CD2 4.19Å; L273-E275 PolarHBondContact O-N 3.24Å; L273-C280 HydrophobicContact CD2-CB 3.87Å; L273-S304 PolarHBondContact N-O 2.99Å; L273-L306 HydrophobicContact CD1-CD1 3.91Å; L273-L306 HydrophobicContact CD1-CD2 4.39Å; L273-L306 HydrophobicContact CD1-CG 3.87Å; L273-L306 HydrophobicContact CG-CD1 4.42Å
274	W	48.7	Very low	49.9	Very low	88 Å²	88	69 Å²	69	33%	0.333	34%	0.339	S	S	.	.			trans	-75.9	110.4	175.3	-167.6	-68.1	0	0	0	108.6	S202 K204 I245 L272 F276	S202-W274 VanDerWaalsContact O-CB 3.3Å; S202-W274 WeakPolarHBondContact O-CB 3.06Å; S202-W274 PolarHBondContact O-N 2.69Å; K204-W274 HydrophobicContact CB-CB 4.41Å; K204-W274 HydrophobicContact CB-CD2 4.31Å; K204-W274 HydrophobicContact CB-CE3 3.51Å; K204-W274 HydrophobicContact CB-CZ3 4.1Å; K204-W274 HydrophobicContact CD-CD2 4.2Å; K204-W274 HydrophobicContact CD-CE3 3.64Å; K204-W274 HydrophobicContact CD-CH2 4.29Å; K204-W274 HydrophobicContact CD-CZ3 3.66Å; K204-W274 HydrophobicContact CG-CD2 4.47Å; K204-W274 HydrophobicContact CG-CE3 3.52Å; K204-W274 HydrophobicContact CG-CZ3 3.58Å; I245-W274 HydrophobicContact CB-CE3 4.16Å; I245-W274 HydrophobicContact CB-CZ3 4.06Å; I245-W274 HydrophobicContact CD1-CE3 4.3Å; I245-W274 HydrophobicContact CD1-CH2 3.73Å; I245-W274 HydrophobicContact CD1-CZ2 4.07Å; I245-W274 HydrophobicContact CD1-CZ3 3.86Å; I245-W274 HydrophobicContact CG1-CE3 4Å; I245-W274 HydrophobicContact CG1-CH2 3.78Å; I245-W274 HydrophobicContact CG1-CZ3 3.46Å; I245-W274 VanDerWaalsContact CG1-CZ3 3.46Å; I245-W274 HydrophobicContact CG2-CD2 4.21Å; I245-W274 HydrophobicContact CG2-CE3 3.71Å; I245-W274 HydrophobicContact CG2-CZ3 4.12Å; L272-W274 PolarHBondContact O-N 3.34Å; W274-F276 PolarHBondContact O-N 2.92Å
275	E	43	Very low	49	Very low	72 Å²	72	70.9 Å²	70.9	34%	0.336	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	104.3	171.9	-75.3	-169.5	147.6	0	0	110.2	L273 N301 F303	L273-E275 PolarHBondContact O-N 3.24Å; E275-N301 VanDerWaalsContact CD-ND2 3.3Å; E275-N301 VanDerWaalsContact OE1-CB 3.24Å; E275-N301 WeakPolarHBondContact OE1-CB 3.08Å; E275-N301 PolarHBondContact OE1-ND2 3.24Å; E275-N301 VanDerWaalsContact OE1-ND2 3.12Å; E275-N301 PolarHBondContact OE2-ND2 3.12Å; E275-F303 HydrophobicContact CB-CE1 4.15Å; E275-F303 VanDerWaalsContact CD-CZ 3.45Å; E275-F303 HydrophobicContact CG-CD1 3.67Å; E275-F303 HydrophobicContact CG-CE1 3.48Å; E275-F303 VanDerWaalsContact CG-CE1 3.48Å; E275-F303 HydrophobicContact CG-CG 4.48Å; E275-F303 HydrophobicContact CG-CZ 4.14Å; E275-F303 VanDerWaalsContact OE2-CE1 3.25Å; E275-F303 WeakPolarHBondContact OE2-CE1 3.05Å; E275-F303 WeakPolarHBondContact OE2-CZ 3.12Å
276	F	44.6	Very low	47.4	Very low	195 Å²	195	78.3 Å²	78.3	86%	0.855	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-178.3	-5.5	143.3	-102.7	-62	0	0	0	113.7	W274 P278	W274-F276 PolarHBondContact O-N 2.92Å; F276-P278 WeakPolarHBondContact O-CD 3.48Å
277	D	45.6	Very low	45.8	Very low	42 Å²	42	83.3 Å²	83.3	23%	0.225	42%	0.418	C	S	.	.			trans	-89.5	110.2	174	-115.2	-49	0	0	0	111.8	Y279 C280 N490	D277-Y279 PolarHBondContact O-N 2.92Å; D277-C280 PolarHBondContact O-N 2.81Å; D277-N490 PolarHBondContact OD1-ND2 2.86Å
278	P	40.8	Very low	44	Very low	106 Å²	106	86.6 Å²	86.6	69%	0.688	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-3.7	-177.2	32.2	-36.8	0	0	0	113.8	F276	F276-P278 WeakPolarHBondContact O-CD 3.48Å
279	Y	43.6	Very low	42.3	Very low	144 Å²	144	90.9 Å²	90.9	57%	0.565	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-6	178.4	-59.4	-74.7	0	0	0	113.2	D277 K281 F467 N490	D277-Y279 PolarHBondContact O-N 2.92Å; Y279-K281 VanDerWaalsContact C-N 3.3Å; Y279-K281 PolarHBondContact O-N 3.43Å; Y279-F467 AromaticContact CD2-CE2 3.89Å; Y279-F467 HydrophobicContact CD2-CE2 3.89Å; Y279-F467 HydrophobicContact CD2-CZ 4.08Å; Y279-F467 HydrophobicContact CE2-CE2 4.4Å; Y279-F467 HydrophobicContact CG-CE2 4.24Å; Y279-N490 HydrophobicContact CD2-CB 4.35Å; Y279-N490 HydrophobicContact CE2-CB 3.94Å
280	C	43.3	Very low	40.5	Very low	33 Å²	33	96.4 Å²	96.4	22%	0.223	52%	0.515	C	S	.	.			trans	-76.5	75.9	177.7	-66.9	0	0	0	0	112	C201 L273 D277 P282	C201-C280 HydrophobicContact CB-CB 4.2Å; C201-C280 WeakPolarHBondContact CB-SG 3.14Å; C201-C280 VanDerWaalsContact SG-CA 3.51Å; C201-C280 WeakPolarHBondContact SG-CB 3.12Å; C201-C280 CovalentContact SG-SG 2.03Å; C201-C280 PolarHBondContact SG-SG 3.04Å; L273-C280 HydrophobicContact CD2-CB 3.87Å; D277-C280 PolarHBondContact O-N 2.81Å; C280-P282 VanDerWaalsContact O-CD 3.31Å; C280-P282 WeakPolarHBondContact O-CD 3.45Å
281	K	38.3	Very low	38.9	Very low	163 Å²	163	100.6 Å²	100.6	71%	0.709	54%	0.539	S	S	*	.			trans	-79.8	116.7	161.8	-73.3	-174.5	176.4	-178.1	0	109.6	Y279 D283	Y279-K281 VanDerWaalsContact C-N 3.3Å; Y279-K281 PolarHBondContact O-N 3.43Å; K281-D283 VanDerWaalsContact C-N 3.27Å; K281-D283 PolarHBondContact O-N 2.87Å; K281-D283 VanDerWaalsContact O-N 3.08Å
282	P	39.5	Very low	37.1	Very low	61 Å²	61	108.5 Å²	108.5	40%	0.396	58%	0.581	S	S	.	*			trans	-79.4	81.5	165.3	33.2	-31.8	0	0	0	108.2	C280 Q284 I285	C280-P282 VanDerWaalsContact O-CD 3.31Å; C280-P282 WeakPolarHBondContact O-CD 3.45Å; P282-Q284 PolarHBondContact O-N 2.96Å; P282-I285 HydrophobicContact CB-CB 4.32Å; P282-I285 HydrophobicContact CB-CD1 4.08Å; P282-I285 HydrophobicContact CB-CG1 4.18Å
283	D	31.5	Very low	35.6	Very low	127 Å²	127	111.1 Å²	111.1	68%	0.679	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	122.8	176.2	-74.4	-26.8	0	0	0	109.3	K281 I285	K281-D283 VanDerWaalsContact C-N 3.27Å; K281-D283 PolarHBondContact O-N 2.87Å; K281-D283 VanDerWaalsContact O-N 3.08Å; D283-I285 PolarHBondContact O-N 2.83Å
284	Q	32.4	Very low	34.3	Very low	193 Å²	193	117.6 Å²	117.6	90%	0.902	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.3	16.5	177.1	-52.9	-169.5	-3	0	0	119	P282	P282-Q284 PolarHBondContact O-N 2.96Å
285	I	31	Very low	33.2	Very low	52 Å²	52	116.8 Å²	116.8	27%	0.267	66%	0.663	S	S	.	*	S	Bend	trans	-85.1	119.6	162.3	-49.6	-175.6	0	0	0	109.5	P282 D283	P282-I285 HydrophobicContact CB-CB 4.32Å; P282-I285 HydrophobicContact CB-CD1 4.08Å; P282-I285 HydrophobicContact CB-CG1 4.18Å; D283-I285 PolarHBondContact O-N 2.83Å
286	F	28.2	Very low	32.3	Very low	182 Å²	182	121.5 Å²	121.5	80%	0.798	68%	0.683	S	S	*	*			trans	76.8	89	-172	-61.2	-81.3	0	0	0	116.8
287	S	25.4	Very low	31.4	Very low	123 Å²	123	120.1 Å²	120.1	86%	0.86	68%	0.684	S	S	*	*			trans	-118.3	92	150.6	62.3	0	0	0	0	110
288	G	26.2	Very low	30.4	Very low	68 Å²	68	122.4 Å²	122.4	70%	0.701	70%	0.703	S	S	*	*			trans	-157.8	123.4	176.2	0	0	0	0	0	109.3
289	N	26.1	Very low	29.7	Very low	160 Å²	160	123.3 Å²	123.3	86%	0.856	71%	0.712	S	S	*	*			trans	-85	133.8	-165.2	-71.4	-21.4	0	0	0	113
290	S	26	Very low	28.8	Very low	120 Å²	120	121.3 Å²	121.3	84%	0.839	72%	0.715	S	S	*	*			trans	-152.1	88.9	150.4	55.9	0	0	0	0	109.9
291	T	26.1	Very low	28	Very low	130 Å²	130	124.7 Å²	124.7	80%	0.798	73%	0.731	S	S	*	*			trans	-109.9	97.9	176.2	50.2	0	0	0	0	110.4
292	D	27.4	Very low	27.6	Very low	174 Å²	174	126.3 Å²	126.3	93%	0.93	74%	0.738	S	S	*	*			trans	-155.9	140.3	155.4	-112.8	-32.2	0	0	0	110.3
293	G	27.8	Very low	27.3	Very low	77 Å²	77	128 Å²	128	79%	0.794	74%	0.739	S	S	*	*			trans	101.7	94.4	-179.8	0	0	0	0	0	115.8
294	M	25	Very low	27.9	Very low	160 Å²	160	124.1 Å²	124.1	79%	0.788	72%	0.722	S	S	*	*			trans	-78	137.7	168.3	-109.2	-178.5	171.1	0	0	111.4
295	G	24.8	Very low	28.6	Very low	70 Å²	70	122.1 Å²	122.1	72%	0.722	71%	0.71	S	S	*	*			trans	-174.9	82.4	179.1	0	0	0	0	0	116.8
296	F	24.7	Very low	29.8	Very low	171 Å²	171	120.1 Å²	120.1	75%	0.75	70%	0.7	S	S	*	*			trans	27.3	119.5	153.7	-79	-95.6	0	0	0	122.3
297	L	25.1	Very low	31.1	Very low	166 Å²	166	113.3 Å²	113.3	87%	0.869	67%	0.674	S	S	*	*			trans	45	94.4	137.6	-83.2	167.5	0	0	0	119.9
298	S	25.8	Very low	32.6	Very low	91 Å²	91	108.8 Å²	108.8	64%	0.636	64%	0.644	S	S	*	*			trans	-148.7	145.5	131.7	62.5	0	0	0	0	110.8	T300	S298-T300 VanDerWaalsContact C-N 3.27Å; S298-T300 PolarHBondContact O-N 2.86Å
299	S	24.6	Very low	34.3	Very low	124 Å²	124	106.3 Å²	106.3	87%	0.867	62%	0.617	S	S	*	*			trans	-75	78.2	178.8	56.3	0	0	0	0	110.7
300	T	25.3	Very low	36.2	Very low	102 Å²	102	99.4 Å²	99.4	63%	0.626	58%	0.581	S	S	*	*			trans	-97.7	114	177.1	41.3	0	0	0	0	110.5	S298 K302	S298-T300 VanDerWaalsContact C-N 3.27Å; S298-T300 PolarHBondContact O-N 2.86Å; T300-K302 PolarHBondContact O-N 2.64Å
301	N	27.7	Very low	38	Very low	104 Å²	104	94 Å²	94	56%	0.556	54%	0.543	S	S	*	.			trans	-55.5	102.9	168.3	-78.2	22	0	0	0	109.5	E275 F303	E275-N301 VanDerWaalsContact CD-ND2 3.3Å; E275-N301 VanDerWaalsContact OE1-CB 3.24Å; E275-N301 WeakPolarHBondContact OE1-CB 3.08Å; E275-N301 PolarHBondContact OE1-ND2 3.24Å; E275-N301 VanDerWaalsContact OE1-ND2 3.12Å; E275-N301 PolarHBondContact OE2-ND2 3.12Å; N301-F303 HydrophobicContact CB-CD2 3.97Å; N301-F303 HydrophobicContact CB-CE2 3.77Å; N301-F303 WeakPolarHBondContact O-CD2 3.14Å; N301-F303 PolarHBondContact O-N 3Å
302	K	28.9	Very low	39.7	Very low	197 Å²	197	88.8 Å²	88.8	86%	0.857	51%	0.512	S	S	*	.			trans	-74.9	72.6	170.7	-84.8	-170.4	172.5	-177.5	0	109.2	T300 S304	T300-K302 PolarHBondContact O-N 2.64Å; K302-S304 PolarHBondContact O-N 3.26Å
303	F	33.4	Very low	41.3	Very low	97 Å²	97	81.4 Å²	81.4	43%	0.425	47%	0.472	S	S	.	.			trans	-51.9	112.2	165.9	-70.3	-95	0	0	0	109	L272 E275 N301 K305	L272-F303 HydrophobicContact CD2-CB 3.57Å; L272-F303 HydrophobicContact CD2-CD1 4.38Å; L272-F303 HydrophobicContact CD2-CG 4.21Å; E275-F303 HydrophobicContact CB-CE1 4.15Å; E275-F303 VanDerWaalsContact CD-CZ 3.45Å; E275-F303 HydrophobicContact CG-CD1 3.67Å; E275-F303 HydrophobicContact CG-CE1 3.48Å; E275-F303 VanDerWaalsContact CG-CE1 3.48Å; E275-F303 HydrophobicContact CG-CG 4.48Å; E275-F303 HydrophobicContact CG-CZ 4.14Å; E275-F303 VanDerWaalsContact OE2-CE1 3.25Å; E275-F303 WeakPolarHBondContact OE2-CE1 3.05Å; E275-F303 WeakPolarHBondContact OE2-CZ 3.12Å; N301-F303 HydrophobicContact CB-CD2 3.97Å; N301-F303 HydrophobicContact CB-CE2 3.77Å; N301-F303 WeakPolarHBondContact O-CD2 3.14Å; N301-F303 PolarHBondContact O-N 3Å; F303-K305 PolarHBondContact O-N 3.04Å
304	S	43.5	Very low	42.2	Very low	46 Å²	46	78 Å²	78	32%	0.322	44%	0.436	S	S	.	.			trans	-66.8	99.9	170.1	33.8	0	0	0	0	108.7	L273 K302 L306	L273-S304 PolarHBondContact N-O 2.99Å; K302-S304 PolarHBondContact O-N 3.26Å; S304-L306 PolarHBondContact O-N 2.76Å
305	K	48.5	Very low	43.4	Very low	150 Å²	150	73.1 Å²	73.1	65%	0.652	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.5	121.7	166.9	-80.4	-176.3	174.6	-179.9	0	108.3	L272 F303	L272-K305 HydrophobicContact CD2-CB 4.49Å; L272-K305 HydrophobicContact CD2-CG 3.49Å; L272-K305 VanDerWaalsContact CD2-CG 3.49Å; L272-K305 HydrophobicContact CG-CG 3.92Å; F303-K305 PolarHBondContact O-N 3.04Å
306	L	56.3	Low	44.5	Very low	10 Å²	10	72.7 Å²	72.7	5%	0.052	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	138.6	164.7	-81.1	150.4	0	0	0	107.7	D173 L199 V203 S271 L273 S304	D173-L306 WeakPolarHBondContact O-CD2 3.4Å; L199-L306 HydrophobicContact CD1-CD1 4.16Å; L199-L306 HydrophobicContact CD1-CD2 4.2Å; V203-L306 HydrophobicContact CB-CD1 4.41Å; V203-L306 HydrophobicContact CG1-CD1 3.62Å; V203-L306 HydrophobicContact CG2-CD1 3.84Å; S271-L306 PolarHBondContact O-N 3.21Å; S271-L306 VanDerWaalsContact O-N 3.07Å; S271-L306 WeakPolarHBondContact OG-CB 3.46Å; L273-L306 HydrophobicContact CD1-CD1 3.91Å; L273-L306 HydrophobicContact CD1-CD2 4.39Å; L273-L306 HydrophobicContact CD1-CG 3.87Å; L273-L306 HydrophobicContact CG-CD1 4.42Å; S304-L306 PolarHBondContact O-N 2.76Å
307	P	55.4	Low	45.5	Very low	40 Å²	40	70.7 Å²	70.7	26%	0.26	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	142.6	176.2	-29.4	37.9	0	0	0	111.9	Y174 A309	Y174-P307 HydrophobicContact CE1-CB 4.42Å; Y174-P307 HydrophobicContact CE1-CG 3.87Å; P307-A309 PolarHBondContact O-N 3.26Å
308	A	56.4	Low	46.6	Very low	27 Å²	27	70.4 Å²	70.4	22%	0.223	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	125.3	-178.3	0	0	0	0	0	110.4	Q268 I269	Q268-A308 HydrophobicContact CG-CB 4Å; I269-A308 CarbonylContact O-C 3.45Å; I269-A308 VanDerWaalsContact O-CA 3.24Å; I269-A308 WeakPolarHBondContact O-CA 3.1Å
309	A	61.4	Low	48.2	Very low	16 Å²	16	68.5 Å²	68.5	13%	0.132	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	131.9	172.9	0	0	0	0	0	109.2	I269 P307	I269-A309 PolarHBondContact N-O 2.69Å; I269-A309 PolarHBondContact O-N 2.66Å; I269-A309 VanDerWaalsContact O-N 3.07Å; P307-A309 PolarHBondContact O-N 3.26Å
310	S	65.2	Low	50.6	Low	15 Å²	15	65.3 Å²	65.3	11%	0.105	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	136.8	-178	-71	0	0	0	0	109.4	S87 Y142 I267	S87-S310 WeakPolarHBondContact CB-O 3.44Å; S87-S310 PolarHBondContact O-N 2.72Å; Y142-S310 VanDerWaalsContact CE1-O 3.25Å; Y142-S310 WeakPolarHBondContact CE1-O 2.86Å; Y142-S310 PolarHBondContact OH-O 3.03Å; I267-S310 CarbonylContact O-C 3.55Å; I267-S310 WeakPolarHBondContact O-CA 3.23Å
311	I	65.3	Low	53.2	Low	7 Å²	7	60.5 Å²	60.5	4%	0.036	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	118.6	-171.6	-45.8	160.8	0	0	0	111.1	Y142 P177 V179 L193 L266 I267 I269	Y142-I311 WeakPolarHBondContact OH-CA 3.3Å; Y142-I311 PolarHBondContact OH-N 3.24Å; P177-I311 HydrophobicContact CB-CD1 3.37Å; P177-I311 HydrophobicContact CB-CG1 3.84Å; P177-I311 HydrophobicContact CG-CD1 4.05Å; P177-I311 HydrophobicContact CG-CG1 3.94Å; V179-I311 HydrophobicContact CG2-CG2 3.57Å; L193-I311 HydrophobicContact CD1-CD1 3.76Å; L266-I311 CarbonylContact C-O 3.58Å; L266-I311 WeakPolarHBondContact CA-O 3.34Å; L266-I311 WeakPolarHBondContact CD2-O 3.42Å; I267-I311 HydrophobicContact CB-CB 4.24Å; I267-I311 PolarHBondContact N-O 2.65Å; I267-I311 PolarHBondContact O-N 2.69Å; I269-I311 HydrophobicContact CD1-CD1 3.53Å; I269-I311 HydrophobicContact CG1-CD1 4.17Å
312	S	62.1	Low	55.6	Low	20 Å²	20	56.4 Å²	56.4	14%	0.14	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	135.2	173.2	163.7	0	0	0	0	110.9	Y142 E265 N314	Y142-S312 VanDerWaalsContact CE2-CB 3.43Å; Y142-S312 PolarHBondContact OH-N 2.64Å; E265-S312 WeakPolarHBondContact O-CA 3.08Å; S312-N314 PolarHBondContact OG-O 2.68Å
313	I	59.9	Low	58.2	Low	20 Å²	20	47.5 Å²	47.5	10%	0.103	25%	0.25	C	C	.	.	S	Bend	trans	-98.5	-52.5	173.1	-52.6	164.3	0	0	0	109.2	F191 V210 I259 M264 E265 I267	F191-I313 HydrophobicContact CD1-CG2 4.02Å; F191-I313 HydrophobicContact CE1-CD1 3.86Å; F191-I313 HydrophobicContact CE1-CG1 4.34Å; F191-I313 HydrophobicContact CE1-CG2 3.8Å; F191-I313 HydrophobicContact CZ-CD1 3.6Å; F191-I313 HydrophobicContact CZ-CG1 4.14Å; F191-I313 HydrophobicContact CZ-CG2 4.42Å; V210-I313 HydrophobicContact CG1-CD1 4.24Å; I259-I313 HydrophobicContact CD1-CD1 4.03Å; M264-I313 HydrophobicContact CB-CD1 4.35Å; E265-I313 PolarHBondContact O-N 2.8Å; I267-I313 HydrophobicContact CD1-CD1 3.89Å; I267-I313 HydrophobicContact CD1-CG1 3.89Å; I267-I313 HydrophobicContact CG1-CD1 3.61Å; I267-I313 HydrophobicContact CG1-CG1 3.78Å
314	N	46.5	Very low	60.6	Low	6 Å²	6	46.7 Å²	46.7	3%	0.032	24%	0.244	C	C	.	.			trans	-86.2	116.4	170.9	-79.1	-10.8	0	0	0	110.2	K189 A261 M264 E265 S312	K189-N314 WeakPolarHBondContact CD-OD1 3.35Å; K189-N314 PolarHBondContact NZ-OD1 2.7Å; A261-N314 PolarHBondContact O-ND2 2.66Å; A261-N314 PolarHBondContact O-OD1 2.75Å; M264-N314 VanDerWaalsContact O-CB 3.28Å; M264-N314 WeakPolarHBondContact O-CB 3.03Å; M264-N314 PolarHBondContact O-N 3.25Å; M264-N314 PolarHBondContact O-ND2 2.71Å; E265-N314 HydrophobicContact CG-CB 4.32Å; E265-N314 WeakPolarHBondContact OE1-CB 3.33Å; S312-N314 PolarHBondContact OG-O 2.68Å
315	K	49.8	Very low	62.4	Low	56 Å²	56	45.9 Å²	45.9	24%	0.243	24%	0.237	C	C	.	.			trans	-158.3	29.5	149.1	-117.9	178.3	176.7	-174.9	0	114	Q115 F118	Q115-K315 WeakPolarHBondContact O-CD 3.5Å; Q115-K315 PolarHBondContact O-NZ 2.9Å; F118-K315 HydrophobicContact CZ-CD 4.18Å
316	F	48.9	Very low	63.6	Low	62 Å²	62	41 Å²	41	27%	0.272	22%	0.221	S	C	.	.			trans	-103.9	11.6	-177.8	-70.8	-75.1	0	0	0	114.5	L181 N318 Q319 Y322	L181-F316 HydrophobicContact CD1-CE2 4.44Å; F316-N318 PolarHBondContact O-N 3.14Å; F316-Q319 HydrophobicContact CD1-CB 4.27Å; F316-Q319 PolarHBondContact O-N 2.77Å; F316-Y322 HydrophobicContact CB-CD1 4.07Å; F316-Y322 HydrophobicContact CB-CE1 3.29Å; F316-Y322 AromaticContact CD1-CD1 3.88Å; F316-Y322 HydrophobicContact CD1-CD1 3.88Å; F316-Y322 AromaticContact CD1-CE1 3.97Å; F316-Y322 HydrophobicContact CD1-CE1 3.97Å; F316-Y322 HydrophobicContact CD2-CD1 4.07Å; F316-Y322 AromaticContact CD2-CE1 3.98Å; F316-Y322 HydrophobicContact CD2-CE1 3.98Å; F316-Y322 HydrophobicContact CE1-CD1 4.31Å; F316-Y322 HydrophobicContact CE2-CD1 4.47Å; F316-Y322 AromaticContact CG-CD1 3.76Å; F316-Y322 HydrophobicContact CG-CD1 3.76Å; F316-Y322 AromaticContact CG-CE1 3.5Å; F316-Y322 HydrophobicContact CG-CE1 3.5Å; F316-Y322 VanDerWaalsContact CG-CE1 3.5Å; F316-Y322 PolarHBondContact O-OH 3.41Å
317	I	44.9	Very low	64.7	Low	128 Å²	128	40.7 Å²	40.7	66%	0.656	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	-27.9	-168.7	-61.2	172.9	0	0	0	113.7
318	N	48.6	Very low	66.1	Low	160 Å²	160	39.2 Å²	39.2	86%	0.856	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.4	10.9	178.1	-67.9	-32.9	0	0	0	114.9	F316	F316-N318 PolarHBondContact O-N 3.14Å
319	Q	60.2	Low	67.4	Low	51 Å²	51	39.3 Å²	39.3	24%	0.238	20%	0.204	C	C	.	.			trans	-106.8	135.6	177	-80.5	-173.6	-22.5	0	0	111.9	F316 Y322	F316-Q319 HydrophobicContact CD1-CB 4.27Å; F316-Q319 PolarHBondContact O-N 2.77Å; Q319-Y322 WeakPolarHBondContact O-CE2 3.35Å; Q319-Y322 VanDerWaalsContact O-CZ 3.31Å; Q319-Y322 PolarHBondContact O-OH 2.85Å; Q319-Y322 VanDerWaalsContact O-OH 3.05Å
320	V	74.5	Confident	68.4	Low	57 Å²	57	38.8 Å²	38.8	35%	0.345	20%	0.199	S	C	.	.	S	Bend	trans	-99.2	-22.8	-177.4	-171.9	0	0	0	0	111.7	F348 L349 G350	V320-F348 HydrophobicContact CB-CE2 4.38Å; V320-F348 HydrophobicContact CG1-CD2 4.07Å; V320-F348 HydrophobicContact CG1-CE2 3.65Å; V320-F348 HydrophobicContact CG1-CZ 4.23Å; V320-F348 WeakPolarHBondContact O-CA 3.23Å; V320-F348 WeakPolarHBondContact O-CD2 3.5Å; V320-L349 PolarHBondContact O-N 2.73Å; V320-G350 VanDerWaalsContact CG1-N 3.27Å
321	L	79.3	Confident	69	Low	2 Å²	2	38.5 Å²	38.5	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.3	178.4	179.5	67.2	0	0	0	109.2	V346 F348 L354 I377 T411 I416 L418	L321-V346 HydrophobicContact CD1-CB 4.05Å; L321-V346 HydrophobicContact CD1-CG2 4.22Å; L321-F348 HydrophobicContact CB-CD2 4.08Å; L321-F348 HydrophobicContact CD1-CB 4.11Å; L321-F348 HydrophobicContact CD1-CD2 4.08Å; L321-L354 HydrophobicContact CB-CD2 4.48Å; L321-L354 HydrophobicContact CD1-CD2 4.22Å; L321-L354 HydrophobicContact CD2-CD2 3.94Å; L321-L354 HydrophobicContact CG-CD2 4.45Å; L321-I377 HydrophobicContact CD1-CD1 3.68Å; L321-T411 HydrophobicContact CD2-CG2 4.12Å; L321-I416 HydrophobicContact CB-CG2 3.92Å; L321-I416 HydrophobicContact CD2-CG2 4.36Å; L321-L418 HydrophobicContact CD2-CB 3.86Å; L321-L418 HydrophobicContact CG-CB 4.25Å; L321-L418 HydrophobicContact CG-CD2 4.31Å
322	Y	78.7	Confident	69.6	Low	18 Å²	18	40.1 Å²	40.1	7%	0.071	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	143.1	-171.6	-66	-115.6	0	0	0	110.1	L181 L184 F316 Q319 V346 L347 L349	L181-Y322 HydrophobicContact CD1-CD1 4.21Å; L184-Y322 HydrophobicContact CD2-CD1 3.78Å; L184-Y322 HydrophobicContact CD2-CD2 3.65Å; L184-Y322 HydrophobicContact CD2-CE1 3.68Å; L184-Y322 HydrophobicContact CD2-CE2 3.63Å; L184-Y322 HydrophobicContact CD2-CG 3.78Å; F316-Y322 HydrophobicContact CB-CD1 4.07Å; F316-Y322 HydrophobicContact CB-CE1 3.29Å; F316-Y322 AromaticContact CD1-CD1 3.88Å; F316-Y322 HydrophobicContact CD1-CD1 3.88Å; F316-Y322 AromaticContact CD1-CE1 3.97Å; F316-Y322 HydrophobicContact CD1-CE1 3.97Å; F316-Y322 HydrophobicContact CD2-CD1 4.07Å; F316-Y322 AromaticContact CD2-CE1 3.98Å; F316-Y322 HydrophobicContact CD2-CE1 3.98Å; F316-Y322 HydrophobicContact CE1-CD1 4.31Å; F316-Y322 HydrophobicContact CE2-CD1 4.47Å; F316-Y322 AromaticContact CG-CD1 3.76Å; F316-Y322 HydrophobicContact CG-CD1 3.76Å; F316-Y322 AromaticContact CG-CE1 3.5Å; F316-Y322 HydrophobicContact CG-CE1 3.5Å; F316-Y322 VanDerWaalsContact CG-CE1 3.5Å; F316-Y322 PolarHBondContact O-OH 3.41Å; Q319-Y322 WeakPolarHBondContact O-CE2 3.35Å; Q319-Y322 VanDerWaalsContact O-CZ 3.31Å; Q319-Y322 PolarHBondContact O-OH 2.85Å; Q319-Y322 VanDerWaalsContact O-OH 3.05Å; Y322-V346 CarbonylContact O-C 3.59Å; Y322-V346 WeakPolarHBondContact O-CA 3.46Å; Y322-V346 VanDerWaalsContact O-CB 3.26Å; Y322-V346 WeakPolarHBondContact O-CB 3.01Å; Y322-L347 PolarHBondContact N-O 2.87Å; Y322-L347 PolarHBondContact O-N 3.41Å; Y322-L349 HydrophobicContact CE2-CD1 4.28Å
323	S	83	Confident	70.4	Confident	10 Å²	10	39.1 Å²	39.1	7%	0.07	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	144.3	165	-178.1	0	0	0	0	110.4	V325	S323-V325 VanDerWaalsContact CB-O 3.31Å; S323-V325 WeakPolarHBondContact CB-O 3.43Å; S323-V325 PolarHBondContact O-N 3.28Å; S323-V325 PolarHBondContact OG-N 3.45Å; S323-V325 PolarHBondContact OG-O 2.88Å
324	R	84.1	Confident	71.2	Confident	80 Å²	80	39.1 Å²	39.1	30%	0.302	20%	0.202	S	C	.	.	S	Bend	trans	-63.6	-31.2	165.8	-164.8	-166.4	179.6	169.2	4.4	111.7	N180 L181 E345 P384	N180-R324 CarbonylContact C-O 3.57Å; N180-R324 VanDerWaalsContact CA-O 3.24Å; N180-R324 WeakPolarHBondContact CA-O 3.41Å; L181-R324 PolarHBondContact N-O 3.4Å; L181-R324 WeakPolarHBondContact O-CG 3.22Å; R324-E345 HydrophobicContact CB-CB 3.76Å; R324-E345 VanDerWaalsContact CB-O 3.3Å; R324-E345 WeakPolarHBondContact CB-O 3.08Å; R324-E345 WeakPolarHBondContact CD-OE2 3.41Å; R324-E345 HydrophobicContact CG-CB 4.38Å; R324-E345 IonicContact CZ-OE2 2.68Å; R324-E345 PolarHBondContact N-O 3.26Å; R324-E345 IonicContact NE-OE2 3.16Å; R324-E345 VanDerWaalsContact NH1-CD 3.29Å; R324-E345 IonicContact NH1-OE1 2.69Å; R324-E345 PolarHBondContact NH1-OE1 2.99Å; R324-E345 VanDerWaalsContact NH1-OE1 3.16Å; R324-E345 IonicContact NH1-OE2 2.75Å; R324-E345 PolarHBondContact NH1-OE2 3.24Å; R324-P384 HydrophobicContact CB-CB 4.24Å; R324-P384 HydrophobicContact CG-CB 3.87Å; R324-P384 HydrophobicContact CG-CG 3.83Å
325	V	82.6	Confident	72.5	Confident	28 Å²	28	41 Å²	41	17%	0.17	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-121.8	135.5	-175.4	-62.2	0	0	0	0	112	S323 L327 L328 I420	S323-V325 VanDerWaalsContact CB-O 3.31Å; S323-V325 WeakPolarHBondContact CB-O 3.43Å; S323-V325 PolarHBondContact O-N 3.28Å; S323-V325 PolarHBondContact OG-N 3.45Å; S323-V325 PolarHBondContact OG-O 2.88Å; V325-L327 VanDerWaalsContact C-N 3.34Å; V325-L328 HydrophobicContact CG2-CD1 4.17Å; V325-I420 HydrophobicContact CG2-CG2 4.43Å
326	S	73.7	Confident	73.4	Confident	47 Å²	47	46.7 Å²	46.7	33%	0.329	24%	0.236	S	C	.	.	S	Bend	trans	-65.2	-35.7	171.7	43.9	0	0	0	0	112.8	V179 P421	V179-S326 PolarHBondContact N-OG 3.09Å; V179-S326 PolarHBondContact O-N 3.04Å; V179-S326 PolarHBondContact O-OG 2.81Å; S326-P421 WeakPolarHBondContact O-CD 3.23Å; S326-P421 WeakPolarHBondContact O-CG 3.5Å
327	L	78.9	Confident	74.2	Confident	5 Å²	5	45.5 Å²	45.5	3%	0.026	24%	0.236	C	C	.	.	S	Bend	trans	-143.4	125.6	178.7	170	64	0	0	0	110	F86 I170 I176 L178 V325 Y329 P421	F86-L327 HydrophobicContact CE1-CD2 4.37Å; F86-L327 HydrophobicContact CZ-CB 4.4Å; F86-L327 HydrophobicContact CZ-CD2 4.3Å; I170-L327 HydrophobicContact CD1-CD1 3.96Å; I170-L327 HydrophobicContact CD1-CD2 3.57Å; I170-L327 HydrophobicContact CD1-CG 4.43Å; I176-L327 HydrophobicContact CG2-CD2 3.67Å; L178-L327 HydrophobicContact CD2-CB 3.75Å; L178-L327 HydrophobicContact CD2-CD2 3.72Å; L178-L327 HydrophobicContact CD2-CG 3.89Å; V325-L327 VanDerWaalsContact C-N 3.34Å; L327-Y329 VanDerWaalsContact C-N 3.29Å; L327-Y329 PolarHBondContact O-N 2.85Å; L327-P421 HydrophobicContact CD1-CB 4.03Å; L327-P421 HydrophobicContact CD1-CG 4.15Å
328	L	85.3	Confident	75.5	Confident	8 Å²	8	42 Å²	42	4%	0.042	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	77.4	176.8	-169.2	78.6	0	0	0	110.2	V325 L330 K342 V390 I407 I420 P421 F422 Y423	V325-L328 HydrophobicContact CG2-CD1 4.17Å; L328-L330 PolarHBondContact O-N 2.78Å; L328-K342 HydrophobicContact CD1-CB 3.92Å; L328-K342 HydrophobicContact CG-CB 4.47Å; L328-V390 HydrophobicContact CD2-CB 3.87Å; L328-V390 HydrophobicContact CD2-CG1 4.07Å; L328-V390 HydrophobicContact CD2-CG2 3.72Å; L328-I407 HydrophobicContact CD2-CD1 4.11Å; L328-I420 HydrophobicContact CB-CG2 4.22Å; L328-P421 PolarHBondContact N-O 3.48Å; L328-F422 HydrophobicContact CB-CB 3.84Å; L328-F422 HydrophobicContact CD2-CB 4.11Å; L328-F422 HydrophobicContact CG-CB 4.45Å; L328-F422 WeakPolarHBondContact O-CA 3.21Å; L328-Y423 PolarHBondContact O-N 3.47Å
329	Y	83.3	Confident	77.1	Confident	29 Å²	29	37.5 Å²	37.5	11%	0.114	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	103.5	177.5	-171.6	-94.6	0	0	0	111.3	I176 L178 V196 L327 G331 Y423	I176-Y329 HydrophobicContact CD1-CE2 3.97Å; L178-Y329 HydrophobicContact CD1-CD1 4.46Å; L178-Y329 HydrophobicContact CD1-CG 4.14Å; V196-Y329 HydrophobicContact CG1-CE1 4.14Å; V196-Y329 HydrophobicContact CG1-CE2 4.43Å; V196-Y329 HydrophobicContact CG2-CD1 4.29Å; V196-Y329 HydrophobicContact CG2-CE1 4.15Å; L327-Y329 VanDerWaalsContact C-N 3.29Å; L327-Y329 PolarHBondContact O-N 2.85Å; Y329-G331 VanDerWaalsContact CE1-CA 3.48Å; Y329-Y423 AromaticContact CD2-CD1 3.74Å; Y329-Y423 HydrophobicContact CD2-CD1 3.74Å; Y329-Y423 HydrophobicContact CD2-CE1 4.31Å; Y329-Y423 AromaticContact CE2-CD1 3.55Å; Y329-Y423 HydrophobicContact CE2-CD1 3.55Å; Y329-Y423 AromaticContact CE2-CE1 3.64Å; Y329-Y423 HydrophobicContact CE2-CE1 3.64Å
330	L	82.3	Confident	78.2	Confident	5 Å²	5	37.5 Å²	37.5	3%	0.026	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-30	179.4	-67.1	159.5	0	0	0	111.6	L328 K342 V390 L392 F422 Y423	L328-L330 PolarHBondContact O-N 2.78Å; L330-K342 HydrophobicContact CD2-CB 4.14Å; L330-K342 HydrophobicContact CD2-CG 3.77Å; L330-V390 HydrophobicContact CD2-CG1 4.31Å; L330-L392 HydrophobicContact CB-CD2 4.11Å; L330-L392 HydrophobicContact CD1-CB 4.26Å; L330-L392 HydrophobicContact CD1-CD2 4Å; L330-L392 HydrophobicContact CD2-CB 4.45Å; L330-F422 HydrophobicContact CD1-CD2 4.02Å; L330-Y423 PolarHBondContact N-O 3.08Å
331	G	77.1	Confident	78.8	Confident	10 Å²	10	37.6 Å²	37.6	10%	0.103	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	95.5	-162.7	178.7	0	0	0	0	0	113.8	Y329 G424 R425	Y329-G331 VanDerWaalsContact CE1-CA 3.48Å; G331-G424 CarbonylContact O-C 3.51Å; G331-G424 VanDerWaalsContact O-CA 3.3Å; G331-G424 WeakPolarHBondContact O-CA 3.39Å; G331-R425 PolarHBondContact O-N 2.99Å
332	V	77.8	Confident	79.2	Confident	40 Å²	40	41.4 Å²	41.4	24%	0.242	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	128.3	177.4	-168	0	0	0	0	109.3	R425 V427 I524	V332-R425 CarbonylContact C-O 3.38Å; V332-R425 VanDerWaalsContact CA-O 3.3Å; V332-R425 WeakPolarHBondContact CA-O 3.4Å; V332-R425 HydrophobicContact CG1-CB 4.35Å; V332-R425 HydrophobicContact CG1-CG 4.45Å; V332-R425 HydrophobicContact CG2-CB 4.3Å; V332-V427 HydrophobicContact CG1-CG2 3.64Å; V332-I524 HydrophobicContact CG1-CG2 3.96Å
333	I	78.6	Confident	79.7	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.7	177.5	-52.5	-175.5	0	0	0	108.6	S337 I340 L392 R425 L426 V427	I333-S337 WeakPolarHBondContact CG2-OG 3.28Å; I333-I340 HydrophobicContact CD1-CB 3.77Å; I333-I340 HydrophobicContact CD1-CD1 4.06Å; I333-I340 HydrophobicContact CD1-CG1 3.8Å; I333-I340 HydrophobicContact CG1-CB 4.43Å; I333-I340 HydrophobicContact CG1-CD1 3.74Å; I333-I340 HydrophobicContact CG1-CG1 3.99Å; I333-L392 HydrophobicContact CD1-CB 3.74Å; I333-L392 HydrophobicContact CD1-CD2 3.69Å; I333-L392 HydrophobicContact CD1-CG 3.77Å; I333-L392 WeakPolarHBondContact CD1-O 3.34Å; I333-L392 HydrophobicContact CG1-CD2 4.43Å; I333-R425 PolarHBondContact N-O 2.86Å; I333-L426 CarbonylContact O-C 3.47Å; I333-L426 WeakPolarHBondContact O-CA 3.43Å; I333-V427 PolarHBondContact O-N 3.3Å
334	N	77	Confident	80	Confident	19 Å²	19	42.6 Å²	42.6	10%	0.102	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	165.3	170.8	68.8	68.3	0	0	0	112.4	R336 S337 V427 Y462	N334-R336 PolarHBondContact O-N 2.73Å; N334-R336 WeakPolarHBondContact OD1-CA 2.88Å; N334-R336 PolarHBondContact OD1-N 2.67Å; N334-S337 PolarHBondContact N-OG 2.73Å; N334-S337 PolarHBondContact O-N 3.4Å; N334-S337 VanDerWaalsContact O-N 3.15Å; N334-S337 PolarHBondContact O-OG 3.27Å; N334-S337 PolarHBondContact OD1-N 3.37Å; N334-S337 PolarHBondContact OD1-OG 3.16Å; N334-V427 CarbonylContact C-O 3.52Å; N334-V427 VanDerWaalsContact CA-O 3.23Å; N334-V427 WeakPolarHBondContact CA-O 3.49Å; N334-V427 HydrophobicContact CB-CB 4.37Å; N334-V427 HydrophobicContact CB-CG1 4.38Å; N334-Y462 HydrophobicContact CB-CE1 4Å
335	S	73.8	Confident	80.2	Confident	47 Å²	47	40.6 Å²	40.6	33%	0.329	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-15.7	-177.4	73.3	0	0	0	0	115.9	V427 G429	S335-V427 PolarHBondContact N-O 2.71Å; S335-G429 PolarHBondContact OG-N 3.08Å; S335-G429 PolarHBondContact OG-O 2.86Å
336	R	69.7	Low	80.5	Confident	174 Å²	174	39.3 Å²	39.3	66%	0.657	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-23.9	176	-66.1	-171.1	-175.9	-145.4	-0.6	114.1	N334 S430 T432	N334-R336 PolarHBondContact O-N 2.73Å; N334-R336 WeakPolarHBondContact OD1-CA 2.88Å; N334-R336 PolarHBondContact OD1-N 2.67Å; R336-S430 PolarHBondContact NE-OG 3.5Å; R336-S430 PolarHBondContact NH2-OG 3.16Å; R336-T432 VanDerWaalsContact NH2-CG2 3.3Å
337	S	66.1	Low	81.1	Confident	38 Å²	38	37 Å²	37	27%	0.266	21%	0.213	S	C	.	.	S	Bend	trans	-68.6	131.8	166.1	38.4	0	0	0	0	109.2	I333 N334 S394	I333-S337 WeakPolarHBondContact CG2-OG 3.28Å; N334-S337 PolarHBondContact N-OG 2.73Å; N334-S337 PolarHBondContact O-N 3.4Å; N334-S337 VanDerWaalsContact O-N 3.15Å; N334-S337 PolarHBondContact O-OG 3.27Å; N334-S337 PolarHBondContact OD1-N 3.37Å; N334-S337 PolarHBondContact OD1-OG 3.16Å; S337-S394 WeakPolarHBondContact O-CB 3.14Å; S337-S394 PolarHBondContact O-OG 3.5Å
338	G	71.3	Confident	81.5	Confident	53 Å²	53	37 Å²	37	55%	0.546	21%	0.213	S	C	.	.			trans	-68	-179.2	171.5	0	0	0	0	0	112.4	I340	G338-I340 PolarHBondContact O-N 2.92Å
339	S	81.5	Confident	81.2	Confident	67 Å²	67	38.7 Å²	38.7	47%	0.469	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-58.7	134.1	-177.9	57	0	0	0	0	113.5	L392	S339-L392 CarbonylContact C-O 3.59Å; S339-L392 WeakPolarHBondContact CA-O 3.29Å; S339-L392 WeakPolarHBondContact CB-O 3.29Å
340	I	83.7	Confident	81	Confident	50 Å²	50	37.7 Å²	37.7	26%	0.256	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	126.5	169.8	-64.7	-173.7	0	0	0	109.3	I333 G338 T391 L392	I333-I340 HydrophobicContact CD1-CB 3.77Å; I333-I340 HydrophobicContact CD1-CD1 4.06Å; I333-I340 HydrophobicContact CD1-CG1 3.8Å; I333-I340 HydrophobicContact CG1-CB 4.43Å; I333-I340 HydrophobicContact CG1-CD1 3.74Å; I333-I340 HydrophobicContact CG1-CG1 3.99Å; G338-I340 PolarHBondContact O-N 2.92Å; I340-T391 WeakPolarHBondContact O-CA 3.1Å; I340-L392 PolarHBondContact N-O 2.92Å; I340-L392 PolarHBondContact O-N 3.38Å
341	S	86.3	Confident	80.8	Confident	60 Å²	60	43.8 Å²	43.8	42%	0.42	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	142.2	170.9	-56.9	0	0	0	0	111.6	V390 T391	S341-V390 CarbonylContact C-O 3.49Å; S341-V390 VanDerWaalsContact CA-O 3.32Å; S341-V390 WeakPolarHBondContact CA-O 3.39Å; S341-T391 WeakPolarHBondContact OG-CG2 3.49Å; S341-T391 PolarHBondContact OG-OG1 2.91Å
342	K	88.1	Confident	81	Confident	82 Å²	82	51 Å²	51	36%	0.357	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	132.2	169.7	-65.5	-62.6	176.4	-155.9	0	110.6	L328 L330 V390	L328-K342 HydrophobicContact CD1-CB 3.92Å; L328-K342 HydrophobicContact CG-CB 4.47Å; L330-K342 HydrophobicContact CD2-CB 4.14Å; L330-K342 HydrophobicContact CD2-CG 3.77Å; K342-V390 PolarHBondContact N-O 3.36Å; K342-V390 PolarHBondContact O-N 2.9Å
343	P	89.9	Confident	81.3	Confident	52 Å²	52	54.4 Å²	54.4	34%	0.338	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	140.4	174.1	32.2	-34.8	0	0	0	110.6	E345 T386 A388	P343-E345 HydrophobicContact CB-CG 3.96Å; P343-E345 HydrophobicContact CG-CG 4.12Å; P343-T386 HydrophobicContact CB-CG2 3.56Å; P343-A388 CarbonylContact C-O 3.49Å; P343-A388 WeakPolarHBondContact CA-O 3.38Å
344	I	89	Confident	81.5	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	112.1	157.9	-63.1	179.2	0	0	0	106.4	V346 I359 T386 I387 A388 V390 I407 I420	I344-V346 HydrophobicContact CG2-CG1 4.31Å; I344-I359 HydrophobicContact CD1-CG2 4.46Å; I344-T386 WeakPolarHBondContact O-CA 3.4Å; I344-I387 HydrophobicContact CB-CG1 4.23Å; I344-I387 HydrophobicContact CG2-CD1 3.86Å; I344-I387 HydrophobicContact CG2-CG1 3.75Å; I344-I387 WeakPolarHBondContact O-CG1 3.05Å; I344-I387 PolarHBondContact O-N 2.95Å; I344-A388 HydrophobicContact CB-CB 4.39Å; I344-A388 HydrophobicContact CD1-CB 4.36Å; I344-A388 PolarHBondContact N-O 3.03Å; I344-V390 HydrophobicContact CD1-CG2 3.64Å; I344-V390 HydrophobicContact CG1-CG2 3.8Å; I344-I407 HydrophobicContact CD1-CD1 4.32Å; I344-I407 HydrophobicContact CD1-CG2 3.91Å; I344-I420 HydrophobicContact CG2-CD1 3.5Å
345	E	88.9	Confident	82	Confident	38 Å²	38	58.4 Å²	58.4	18%	0.178	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	138.2	177.2	-61.9	172.3	115.4	0	0	109.4	R324 P343 P384 K385	R324-E345 HydrophobicContact CB-CB 3.76Å; R324-E345 VanDerWaalsContact CB-O 3.3Å; R324-E345 WeakPolarHBondContact CB-O 3.08Å; R324-E345 WeakPolarHBondContact CD-OE2 3.41Å; R324-E345 HydrophobicContact CG-CB 4.38Å; R324-E345 IonicContact CZ-OE2 2.68Å; R324-E345 PolarHBondContact N-O 3.26Å; R324-E345 IonicContact NE-OE2 3.16Å; R324-E345 VanDerWaalsContact NH1-CD 3.29Å; R324-E345 IonicContact NH1-OE1 2.69Å; R324-E345 PolarHBondContact NH1-OE1 2.99Å; R324-E345 VanDerWaalsContact NH1-OE1 3.16Å; R324-E345 IonicContact NH1-OE2 2.75Å; R324-E345 PolarHBondContact NH1-OE2 3.24Å; P343-E345 HydrophobicContact CB-CG 3.96Å; P343-E345 HydrophobicContact CG-CG 4.12Å; E345-P384 HydrophobicContact CB-CB 3.97Å; E345-K385 VanDerWaalsContact CA-O 3.31Å; E345-K385 WeakPolarHBondContact CA-O 3.29Å
346	V	89	Confident	82.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	154.7	-176.2	-65.3	0	0	0	0	112.3	L321 Y322 I344 I377 K385 I387 L418	L321-V346 HydrophobicContact CD1-CB 4.05Å; L321-V346 HydrophobicContact CD1-CG2 4.22Å; Y322-V346 CarbonylContact O-C 3.59Å; Y322-V346 WeakPolarHBondContact O-CA 3.46Å; Y322-V346 VanDerWaalsContact O-CB 3.26Å; Y322-V346 WeakPolarHBondContact O-CB 3.01Å; I344-V346 HydrophobicContact CG2-CG1 4.31Å; V346-I377 HydrophobicContact CG2-CD1 3.77Å; V346-I377 HydrophobicContact CG2-CG1 4.46Å; V346-K385 PolarHBondContact N-O 2.85Å; V346-K385 PolarHBondContact O-N 3.28Å; V346-I387 HydrophobicContact CB-CD1 4.5Å; V346-I387 HydrophobicContact CG1-CD1 3.65Å; V346-I387 HydrophobicContact CG1-CG1 4.15Å; V346-I387 HydrophobicContact CG2-CB 4.48Å; V346-I387 HydrophobicContact CG2-CD1 3.98Å; V346-I387 HydrophobicContact CG2-CG1 4.09Å; V346-I387 HydrophobicContact CG2-CG2 3.6Å; V346-L418 HydrophobicContact CG1-CD2 3.55Å
347	L	86.7	Confident	83.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	146.9	171.6	-61.1	139.9	0	0	0	108	L181 L184 Y322 T381 T382 T383 P384	L181-L347 HydrophobicContact CB-CD1 3.85Å; L184-L347 HydrophobicContact CB-CD1 4.43Å; L184-L347 HydrophobicContact CB-CD2 4.37Å; Y322-L347 PolarHBondContact N-O 2.87Å; Y322-L347 PolarHBondContact O-N 3.41Å; L347-T381 WeakPolarHBondContact CA-O 3.03Å; L347-T382 WeakPolarHBondContact CD2-O 3.26Å; L347-T383 VanDerWaalsContact CD2-C 3.43Å; L347-P384 HydrophobicContact CD1-CG 4.49Å; L347-P384 HydrophobicContact CD2-CG 4.09Å; L347-P384 HydrophobicContact CG-CG 4.32Å
348	F	86	Confident	84.3	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.018	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	115.9	-175.3	176	-103.4	0	0	0	111.9	V320 L321 G350 Q352 L354 I377 S378 H380 T381	V320-F348 HydrophobicContact CB-CE2 4.38Å; V320-F348 HydrophobicContact CG1-CD2 4.07Å; V320-F348 HydrophobicContact CG1-CE2 3.65Å; V320-F348 HydrophobicContact CG1-CZ 4.23Å; V320-F348 WeakPolarHBondContact O-CA 3.23Å; V320-F348 WeakPolarHBondContact O-CD2 3.5Å; L321-F348 HydrophobicContact CB-CD2 4.08Å; L321-F348 HydrophobicContact CD1-CB 4.11Å; L321-F348 HydrophobicContact CD1-CD2 4.08Å; F348-G350 VanDerWaalsContact CE1-O 3.23Å; F348-G350 WeakPolarHBondContact CE1-O 2.96Å; F348-G350 VanDerWaalsContact CZ-CA 3.48Å; F348-Q352 WeakPolarHBondContact CE1-O 3.35Å; F348-Q352 WeakPolarHBondContact CZ-O 3.38Å; F348-L354 HydrophobicContact CD2-CD2 3.89Å; F348-L354 HydrophobicContact CE1-CB 4.3Å; F348-L354 HydrophobicContact CE2-CB 4.1Å; F348-L354 HydrophobicContact CE2-CD1 4.12Å; F348-L354 HydrophobicContact CE2-CD2 3.62Å; F348-L354 HydrophobicContact CE2-CG 4.18Å; F348-L354 HydrophobicContact CZ-CB 3.89Å; F348-L354 HydrophobicContact CZ-CD1 4.23Å; F348-L354 HydrophobicContact CZ-CD2 4.27Å; F348-L354 HydrophobicContact CZ-CG 4.37Å; F348-I377 HydrophobicContact CB-CG2 3.71Å; F348-I377 HydrophobicContact CD1-CG2 4.24Å; F348-I377 HydrophobicContact CG-CG2 4.14Å; F348-S378 WeakPolarHBondContact CD1-O 3.18Å; F348-H380 CarbonylContact O-C 3.47Å; F348-H380 VanDerWaalsContact O-CA 3.26Å; F348-H380 WeakPolarHBondContact O-CA 3.07Å; F348-H380 PolarHBondContact O-N 2.9Å; F348-T381 PolarHBondContact N-O 2.96Å; F348-T381 PolarHBondContact O-N 2.7Å
349	L	79.5	Confident	85.2	Confident	44 Å²	44	49.3 Å²	49.3	23%	0.23	27%	0.268	C	S	.	.			trans	-90.6	-1.9	-177.7	-68.6	178.9	0	0	0	113.9	L184 V320 Y322 H380 T382	L184-L349 HydrophobicContact CD2-CD1 3.66Å; L184-L349 HydrophobicContact CD2-CD2 4.29Å; L184-L349 HydrophobicContact CD2-CG 3.81Å; L184-L349 HydrophobicContact CG-CD1 3.97Å; L184-L349 HydrophobicContact CG-CD2 4.27Å; L184-L349 HydrophobicContact CG-CG 4.26Å; V320-L349 PolarHBondContact O-N 2.73Å; Y322-L349 HydrophobicContact CE2-CD1 4.28Å; L349-H380 PolarHBondContact O-CE1 2.74Å; L349-H380 PolarHBondContact O-ND1 2.88Å; L349-T382 HydrophobicContact CD2-CG2 4.39Å
350	G	78.5	Confident	85.5	Confident	8 Å²	8	51.1 Å²	51.1	8%	0.082	27%	0.269	C	S	.	.			trans	-73.6	150.2	-171.5	0	0	0	0	0	114.4	V320 F348 Q352 P379 H380	V320-G350 VanDerWaalsContact CG1-N 3.27Å; F348-G350 VanDerWaalsContact CE1-O 3.23Å; F348-G350 WeakPolarHBondContact CE1-O 2.96Å; F348-G350 VanDerWaalsContact CZ-CA 3.48Å; G350-Q352 VanDerWaalsContact C-N 3.27Å; G350-Q352 PolarHBondContact O-N 2.83Å; G350-P379 WeakPolarHBondContact O-CA 3.35Å; G350-P379 WeakPolarHBondContact O-CB 3.27Å; G350-H380 PolarHBondContact O-N 2.73Å
351	N	79.3	Confident	85.7	Confident	132 Å²	132	50.2 Å²	50.2	71%	0.706	27%	0.269	S	S	*	.	S	Bend	trans	-81.3	0.7	-172.2	-53.7	15.7	0	0	0	113.9	H380	N351-H380 PolarHBondContact OD1-CE1 3.18Å
352	Q	80.6	Confident	85.5	Confident	161 Å²	161	51.8 Å²	51.8	75%	0.752	27%	0.273	S	S	*	.	S	Bend	trans	-137	150.4	-176.1	-64.1	-170	10.4	0	0	111.4	F348 G350 L354	F348-Q352 WeakPolarHBondContact CE1-O 3.35Å; F348-Q352 WeakPolarHBondContact CZ-O 3.38Å; G350-Q352 VanDerWaalsContact C-N 3.27Å; G350-Q352 PolarHBondContact O-N 2.83Å; Q352-L354 PolarHBondContact O-N 2.92Å
353	L	83.1	Confident	85.3	Confident	112 Å²	112	51.2 Å²	51.2	59%	0.586	27%	0.273	S	S	*	.			trans	-60.4	125.8	179.6	-76.3	153.9	0	0	0	111.2	I376 P379	L353-I376 HydrophobicContact CD2-CG2 3.78Å; L353-P379 HydrophobicContact CG-CG 4.31Å
354	L	84	Confident	85	Confident	7 Å²	7	58.8 Å²	58.8	4%	0.037	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	128.9	-179.7	-158.8	74.3	0	0	0	109.8	L321 F348 Q352 I376 I377 T411 I416	L321-L354 HydrophobicContact CB-CD2 4.48Å; L321-L354 HydrophobicContact CD1-CD2 4.22Å; L321-L354 HydrophobicContact CD2-CD2 3.94Å; L321-L354 HydrophobicContact CG-CD2 4.45Å; F348-L354 HydrophobicContact CD2-CD2 3.89Å; F348-L354 HydrophobicContact CE1-CB 4.3Å; F348-L354 HydrophobicContact CE2-CB 4.1Å; F348-L354 HydrophobicContact CE2-CD1 4.12Å; F348-L354 HydrophobicContact CE2-CD2 3.62Å; F348-L354 HydrophobicContact CE2-CG 4.18Å; F348-L354 HydrophobicContact CZ-CB 3.89Å; F348-L354 HydrophobicContact CZ-CD1 4.23Å; F348-L354 HydrophobicContact CZ-CD2 4.27Å; F348-L354 HydrophobicContact CZ-CG 4.37Å; Q352-L354 PolarHBondContact O-N 2.92Å; L354-I376 WeakPolarHBondContact O-CA 2.93Å; L354-I377 HydrophobicContact CB-CB 4.33Å; L354-I377 HydrophobicContact CD2-CD1 4.24Å; L354-I377 PolarHBondContact N-O 3.16Å; L354-I377 PolarHBondContact O-N 2.76Å; L354-T411 HydrophobicContact CD1-CG2 4.46Å; L354-T411 HydrophobicContact CD2-CG2 3.7Å; L354-T411 HydrophobicContact CG-CG2 4.01Å; L354-I416 HydrophobicContact CD1-CB 4.47Å; L354-I416 HydrophobicContact CD1-CD1 4Å; L354-I416 HydrophobicContact CD1-CG2 4.3Å; L354-I416 HydrophobicContact CD2-CG2 4.09Å
355	E	86.6	Confident	84.8	Confident	97 Å²	97	60.3 Å²	60.3	45%	0.453	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.6	178.3	-174.6	178.9	-168.9	0	0	110.4	K375 T411 N412	E355-K375 CarbonylContact C-O 3.59Å; E355-K375 VanDerWaalsContact CA-O 3.3Å; E355-K375 WeakPolarHBondContact CA-O 3.41Å; E355-T411 CarbonylContact O-C 3.6Å; E355-T411 VanDerWaalsContact O-C 3.31Å; E355-T411 WeakPolarHBondContact O-CA 3.18Å; E355-T411 WeakPolarHBondContact O-CB 3.47Å; E355-N412 HydrophobicContact CB-CB 4.09Å; E355-N412 PolarHBondContact N-OD1 3.31Å; E355-N412 PolarHBondContact O-N 2.96Å; E355-N412 PolarHBondContact O-OD1 2.87Å
356	I	87.4	Confident	84.5	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	114.6	178.2	-60.2	169	0	0	0	109.2	I359 K375 I377 I387 V409	I356-I359 HydrophobicContact CG2-CD1 4.03Å; I356-I359 HydrophobicContact CG2-CG1 3.68Å; I356-K375 PolarHBondContact N-O 3.22Å; I356-K375 PolarHBondContact O-NZ 3.42Å; I356-I377 HydrophobicContact CD1-CD1 4.15Å; I356-I377 HydrophobicContact CD1-CG1 4.26Å; I356-I377 HydrophobicContact CG1-CD1 4.37Å; I356-I387 HydrophobicContact CD1-CB 3.64Å; I356-I387 HydrophobicContact CD1-CD1 3.79Å; I356-I387 HydrophobicContact CD1-CG1 4.32Å; I356-I387 HydrophobicContact CD1-CG2 3.66Å; I356-V409 HydrophobicContact CD1-CG1 4.43Å; I356-V409 HydrophobicContact CG1-CG1 4.27Å; I356-V409 HydrophobicContact CG2-CG1 4.07Å
357	T	85.3	Confident	84.2	Confident	75 Å²	75	65.4 Å²	65.4	46%	0.46	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-55.2	-178	46.1	0	0	0	0	110.5	K375 F410 T411 N412	T357-K375 PolarHBondContact O-NZ 2.8Å; T357-F410 PolarHBondContact N-O 2.83Å; T357-F410 WeakPolarHBondContact OG1-CB 3.37Å; T357-F410 PolarHBondContact OG1-O 2.83Å; T357-F410 VanDerWaalsContact OG1-O 3.14Å; T357-T411 VanDerWaalsContact CG2-O 3.26Å; T357-T411 WeakPolarHBondContact CG2-O 3.35Å; T357-T411 PolarHBondContact OG1-N 3.43Å; T357-T411 PolarHBondContact OG1-O 2.87Å; T357-N412 HydrophobicContact CG2-CB 4.47Å
358	S	85.7	Confident	84.3	Confident	30 Å²	30	66.7 Å²	66.7	21%	0.21	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	163	171	61.3	0	0	0	0	112.7	E360 F410	S358-E360 WeakPolarHBondContact CB-OE1 3.27Å; S358-E360 PolarHBondContact OG-OE1 2.78Å; S358-F410 PolarHBondContact O-N 3.37Å; S358-F410 WeakPolarHBondContact OG-CD2 3.49Å
359	I	90	Very high	84.5	Confident	16 Å²	16	69 Å²	69	8%	0.082	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	120	169.8	-58.4	-178.7	0	0	0	106.2	I344 I356 I370 I372 I387 A388 I407 T408 V409	I344-I359 HydrophobicContact CD1-CG2 4.46Å; I356-I359 HydrophobicContact CG2-CD1 4.03Å; I356-I359 HydrophobicContact CG2-CG1 3.68Å; I359-I370 HydrophobicContact CG2-CG2 4.01Å; I359-I372 HydrophobicContact CB-CD1 4.15Å; I359-I372 HydrophobicContact CB-CG1 4.43Å; I359-I372 HydrophobicContact CD1-CD1 4.38Å; I359-I372 HydrophobicContact CD1-CG1 4.21Å; I359-I372 HydrophobicContact CD1-CG2 4.47Å; I359-I372 HydrophobicContact CG1-CD1 4.12Å; I359-I372 HydrophobicContact CG1-CG1 4.43Å; I359-I387 HydrophobicContact CD1-CD1 4.19Å; I359-A388 HydrophobicContact CD1-CB 3.78Å; I359-I407 HydrophobicContact CG2-CG2 3.51Å; I359-T408 WeakPolarHBondContact CA-O 3.45Å; I359-V409 HydrophobicContact CD1-CG1 4.39Å; I359-V409 HydrophobicContact CD1-CG2 4.2Å; I359-V409 HydrophobicContact CG1-CB 4.41Å; I359-V409 HydrophobicContact CG1-CG1 4.14Å; I359-V409 HydrophobicContact CG1-CG2 4.13Å; I359-V409 HydrophobicContact CG2-CG2 4.19Å
360	E	89.1	Confident	85	Confident	104 Å²	104	68.9 Å²	68.9	49%	0.486	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	134.2	-168.4	-68.8	168.8	-146.4	0	0	110.1	S358 T408 F410	S358-E360 WeakPolarHBondContact CB-OE1 3.27Å; S358-E360 PolarHBondContact OG-OE1 2.78Å; E360-T408 PolarHBondContact N-O 3.11Å; E360-T408 PolarHBondContact O-N 3.32Å; E360-F410 HydrophobicContact CB-CE2 4.29Å
361	A	86.6	Confident	85.4	Confident	31 Å²	31	73.5 Å²	73.5	26%	0.256	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	147.8	169.8	0	0	0	0	0	110.3	I363 L368 I370 I406 I407 F422	A361-I363 WeakPolarHBondContact CB-O 3.41Å; A361-I363 PolarHBondContact O-N 2.82Å; A361-L368 HydrophobicContact CB-CD2 4.09Å; A361-I370 HydrophobicContact CB-CD1 4.23Å; A361-I406 WeakPolarHBondContact CA-O 3.39Å; A361-I407 HydrophobicContact CB-CG1 4.23Å; A361-F422 HydrophobicContact CB-CE1 4.44Å
362	N	82.7	Confident	85.9	Confident	93 Å²	93	70.4 Å²	70.4	50%	0.497	36%	0.357	S	S	.	.	S	Bend	trans	-69.1	-12.7	173.3	69.8	-31.1	0	0	0	113.7	G405 I406	N362-G405 WeakPolarHBondContact OD1-CA 3.41Å; N362-I406 PolarHBondContact N-O 2.81Å; N362-I406 PolarHBondContact OD1-N 3.08Å; N362-I406 PolarHBondContact OD1-O 3.19Å
363	I	83.9	Confident	86.2	Confident	70 Å²	70	66.1 Å²	66.1	36%	0.359	34%	0.342	S	S	.	.	S	Bend	trans	-125.6	144.2	-178.9	-67.2	161	0	0	0	108.7	A361 L403 S404	A361-I363 WeakPolarHBondContact CB-O 3.41Å; A361-I363 PolarHBondContact O-N 2.82Å; I363-L403 HydrophobicContact CG2-CD1 4.22Å; I363-S404 WeakPolarHBondContact CD1-O 3.28Å
364	Y	82.3	Confident	86	Confident	212 Å²	212	64.1 Å²	64.1	83%	0.831	33%	0.33	S	S	*	.			trans	-109.4	124	172.2	-176.7	-93.1	0	0	0	109
365	D	85.4	Confident	85.9	Confident	32 Å²	32	68.5 Å²	68.5	17%	0.171	35%	0.349	C	S	.	.			trans	-145.5	136.8	-177.8	-171.5	-59	0	0	0	108.6	A367 L368 Y401 L403	D365-A367 PolarHBondContact O-N 2.88Å; D365-A367 VanDerWaalsContact OD1-CB 3.22Å; D365-A367 WeakPolarHBondContact OD1-CB 3.44Å; D365-A367 PolarHBondContact OD1-N 2.86Å; D365-L368 HydrophobicContact CB-CB 4.31Å; D365-L368 PolarHBondContact O-N 2.84Å; D365-L368 VanDerWaalsContact O-N 3.1Å; D365-Y401 PolarHBondContact OD1-OH 2.87Å; D365-Y401 WeakPolarHBondContact OD2-CE2 3.21Å; D365-Y401 PolarHBondContact OD2-OH 3.18Å; D365-L403 HydrophobicContact CB-CD1 3.99Å; D365-L403 HydrophobicContact CB-CD2 4.24Å; D365-L403 WeakPolarHBondContact OD2-CD1 3.4Å
366	E	82.1	Confident	85.9	Confident	142 Å²	142	68.2 Å²	68.2	66%	0.664	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-20.9	-178.1	-62.3	-167.4	165.6	0	0	113.5	L368 H396	E366-L368 VanDerWaalsContact C-N 3.33Å; E366-H396 HydrophobicContact CB-CB 4.41Å
367	A	83.9	Confident	85.8	Confident	4 Å²	4	68.2 Å²	68.2	3%	0.033	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-20.9	172.9	0	0	0	0	0	112.8	D365 L392 S393 L426	D365-A367 PolarHBondContact O-N 2.88Å; D365-A367 VanDerWaalsContact OD1-CB 3.22Å; D365-A367 WeakPolarHBondContact OD1-CB 3.44Å; D365-A367 PolarHBondContact OD1-N 2.86Å; A367-L392 HydrophobicContact CB-CD1 3.97Å; A367-L392 CarbonylContact O-C 3.54Å; A367-L392 WeakPolarHBondContact O-CA 3.37Å; A367-S393 VanDerWaalsContact CB-O 3.27Å; A367-S393 WeakPolarHBondContact CB-O 3.46Å; A367-S393 PolarHBondContact O-N 3.38Å; A367-L426 HydrophobicContact CB-CD2 3.73Å
368	L	89	Confident	85.8	Confident	26 Å²	26	67.2 Å²	67.2	14%	0.136	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	115.6	-170.3	-173.6	70.6	0	0	0	112.5	A361 D365 E366 V390 L392 L403 F422	A361-L368 HydrophobicContact CB-CD2 4.09Å; D365-L368 HydrophobicContact CB-CB 4.31Å; D365-L368 PolarHBondContact O-N 2.84Å; D365-L368 VanDerWaalsContact O-N 3.1Å; E366-L368 VanDerWaalsContact C-N 3.33Å; L368-V390 HydrophobicContact CD1-CG1 3.6Å; L368-L392 HydrophobicContact CB-CD1 4.49Å; L368-L392 HydrophobicContact CD1-CD1 4.25Å; L368-L403 HydrophobicContact CB-CD2 4.1Å; L368-L403 HydrophobicContact CD1-CD2 4.47Å; L368-L403 HydrophobicContact CD2-CD2 4.46Å; L368-F422 HydrophobicContact CD1-CE2 4.21Å; L368-F422 HydrophobicContact CD2-CE1 4.48Å; L368-F422 HydrophobicContact CD2-CE2 3.8Å; L368-F422 HydrophobicContact CD2-CZ 3.61Å
369	S	89.2	Confident	85.7	Confident	54 Å²	54	68.1 Å²	68.1	38%	0.378	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	151.8	168.6	75.6	0	0	0	0	112.6	V390 T391	S369-V390 CarbonylContact O-C 3.49Å; S369-V390 WeakPolarHBondContact O-CA 3.23Å; S369-T391 PolarHBondContact N-O 2.81Å; S369-T391 PolarHBondContact O-N 2.87Å
370	I	89.9	Confident	85.3	Confident	41 Å²	41	71.7 Å²	71.7	21%	0.21	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	104.6	178.2	-52.4	-177.4	0	0	0	108.8	I359 A361 A388 V390 I407	I359-I370 HydrophobicContact CG2-CG2 4.01Å; A361-I370 HydrophobicContact CB-CD1 4.23Å; I370-A388 HydrophobicContact CG2-CB 4.18Å; I370-V390 HydrophobicContact CG1-CG2 4.26Å; I370-V390 HydrophobicContact CG2-CG2 4.41Å; I370-I407 HydrophobicContact CD1-CD1 3.9Å; I370-I407 HydrophobicContact CD1-CG1 4Å; I370-I407 HydrophobicContact CD1-CG2 4.17Å
371	D	88.5	Confident	85	Confident	104 Å²	104	67.4 Å²	67.4	56%	0.556	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	113.2	177.5	-76.4	-45.4	0	0	0	110.3	T373 A388 I389	D371-T373 PolarHBondContact O-N 3Å; D371-A388 CarbonylContact O-C 3.55Å; D371-A388 WeakPolarHBondContact O-CA 3.34Å; D371-A388 WeakPolarHBondContact O-CB 3.22Å; D371-I389 PolarHBondContact N-O 2.61Å; D371-I389 PolarHBondContact O-N 3.07Å
372	I	88.7	Confident	84.5	Confident	67 Å²	67	68.8 Å²	68.8	34%	0.344	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	117.1	179	-53.3	-177.8	0	0	0	109.6	I359 E374 K375	I359-I372 HydrophobicContact CB-CD1 4.15Å; I359-I372 HydrophobicContact CB-CG1 4.43Å; I359-I372 HydrophobicContact CD1-CD1 4.38Å; I359-I372 HydrophobicContact CD1-CG1 4.21Å; I359-I372 HydrophobicContact CD1-CG2 4.47Å; I359-I372 HydrophobicContact CG1-CD1 4.12Å; I359-I372 HydrophobicContact CG1-CG1 4.43Å; I372-E374 WeakPolarHBondContact CG2-O 3.42Å; I372-K375 HydrophobicContact CG2-CG 4.16Å
373	T	86.1	Confident	84.3	Confident	71 Å²	71	68.9 Å²	68.9	44%	0.436	36%	0.357	S	S	.	.			trans	-89.8	-37.3	-177.6	51.9	0	0	0	0	112.7	D371 T386 I387 A388 I389	D371-T373 PolarHBondContact O-N 3Å; T373-T386 PolarHBondContact OG1-O 2.91Å; T373-T386 VanDerWaalsContact OG1-O 3.08Å; T373-I387 PolarHBondContact N-O 3.26Å; T373-I387 PolarHBondContact OG1-O 2.89Å; T373-I387 VanDerWaalsContact OG1-O 3.13Å; T373-A388 PolarHBondContact OG1-N 2.82Å; T373-I389 HydrophobicContact CG2-CD1 3.86Å; T373-I389 HydrophobicContact CG2-CG1 3.88Å
374	E	79.2	Confident	84.3	Confident	70 Å²	70	67.1 Å²	67.1	33%	0.327	35%	0.35	S	S	.	.			trans	-135.6	149.2	177.7	-69	-166.8	136.3	0	0	111.2	I372 K385 I387	I372-E374 WeakPolarHBondContact CG2-O 3.42Å; E374-K385 WeakPolarHBondContact OE1-CE 3.38Å; E374-K385 IonicContact OE1-NZ 3.16Å; E374-K385 PolarHBondContact OE1-NZ 3.35Å; E374-K385 WeakPolarHBondContact OE2-CD 3.33Å; E374-K385 WeakPolarHBondContact OE2-CE 3.19Å; E374-K385 IonicContact OE2-NZ 3.3Å; E374-K385 PolarHBondContact OE2-NZ 3.23Å; E374-I387 PolarHBondContact N-O 3.47Å; E374-I387 VanDerWaalsContact N-O 3.14Å
375	K	83	Confident	84.5	Confident	99 Å²	99	59.7 Å²	59.7	43%	0.43	32%	0.322	S	S	.	.	S	Bend	trans	-113.3	-4.8	175.9	-74.3	-172.7	163.5	-98.8	0	114.7	E355 I356 T357 I372	E355-K375 CarbonylContact C-O 3.59Å; E355-K375 VanDerWaalsContact CA-O 3.3Å; E355-K375 WeakPolarHBondContact CA-O 3.41Å; I356-K375 PolarHBondContact N-O 3.22Å; I356-K375 PolarHBondContact O-NZ 3.42Å; T357-K375 PolarHBondContact O-NZ 2.8Å; I372-K375 HydrophobicContact CG2-CG 4.16Å
376	I	86.6	Confident	84.7	Confident	92 Å²	92	60.4 Å²	60.4	47%	0.472	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	119.7	-174.5	-53.8	179.1	0	0	0	109.6	L353 L354	L353-I376 HydrophobicContact CD2-CG2 3.78Å; L354-I376 WeakPolarHBondContact O-CA 2.93Å
377	I	84.9	Confident	85.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	131.8	176.5	-51.3	171.3	0	0	0	108.5	L321 V346 F348 L354 I356 I387	L321-I377 HydrophobicContact CD1-CD1 3.68Å; V346-I377 HydrophobicContact CG2-CD1 3.77Å; V346-I377 HydrophobicContact CG2-CG1 4.46Å; F348-I377 HydrophobicContact CB-CG2 3.71Å; F348-I377 HydrophobicContact CD1-CG2 4.24Å; F348-I377 HydrophobicContact CG-CG2 4.14Å; L354-I377 HydrophobicContact CB-CB 4.33Å; L354-I377 HydrophobicContact CD2-CD1 4.24Å; L354-I377 PolarHBondContact N-O 3.16Å; L354-I377 PolarHBondContact O-N 2.76Å; I356-I377 HydrophobicContact CD1-CD1 4.15Å; I356-I377 HydrophobicContact CD1-CG1 4.26Å; I356-I377 HydrophobicContact CG1-CD1 4.37Å; I377-I387 HydrophobicContact CD1-CG2 4.19Å; I377-I387 HydrophobicContact CG1-CG2 4.02Å
378	S	85	Confident	85.5	Confident	54 Å²	54	53.5 Å²	53.5	38%	0.378	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-74.4	148.2	179	-59.8	0	0	0	0	111.7	F348 T381	F348-S378 WeakPolarHBondContact CD1-O 3.18Å; S378-T381 PolarHBondContact O-OG1 2.71Å
379	P	83.1	Confident	85.6	Confident	48 Å²	48	55 Å²	55	31%	0.312	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	145.6	168.3	-24.2	33.8	0	0	0	112	G350 L353 T381	G350-P379 WeakPolarHBondContact O-CA 3.35Å; G350-P379 WeakPolarHBondContact O-CB 3.27Å; L353-P379 HydrophobicContact CG-CG 4.31Å; P379-T381 VanDerWaalsContact C-N 3.3Å; P379-T381 PolarHBondContact O-N 3.23Å
380	H	82.2	Confident	85.7	Confident	91 Å²	91	52.4 Å²	52.4	42%	0.421	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	46.5	177.1	-46.4	-74.4	0	0	0	113.8	F348 L349 G350 N351 T382	F348-H380 CarbonylContact O-C 3.47Å; F348-H380 VanDerWaalsContact O-CA 3.26Å; F348-H380 WeakPolarHBondContact O-CA 3.07Å; F348-H380 PolarHBondContact O-N 2.9Å; L349-H380 PolarHBondContact O-CE1 2.74Å; L349-H380 PolarHBondContact O-ND1 2.88Å; G350-H380 PolarHBondContact O-N 2.73Å; N351-H380 PolarHBondContact OD1-CE1 3.18Å; H380-T382 VanDerWaalsContact C-N 3.34Å; H380-T382 PolarHBondContact O-N 2.78Å
381	T	81.9	Confident	85.6	Confident	15 Å²	15	51.3 Å²	51.3	9%	0.092	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	85.4	171.3	-64.3	0	0	0	0	109.1	L347 F348 S378 P379 T383 K385	L347-T381 WeakPolarHBondContact CA-O 3.03Å; F348-T381 PolarHBondContact N-O 2.96Å; F348-T381 PolarHBondContact O-N 2.7Å; S378-T381 PolarHBondContact O-OG1 2.71Å; P379-T381 VanDerWaalsContact C-N 3.3Å; P379-T381 PolarHBondContact O-N 3.23Å; T381-T383 WeakPolarHBondContact CG2-O 3.39Å; T381-K385 HydrophobicContact CG2-CB 3.85Å; T381-K385 HydrophobicContact CG2-CD 4.46Å
382	T	76.2	Confident	85.5	Confident	59 Å²	59	46.3 Å²	46.3	36%	0.362	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-9.7	-176.9	56	0	0	0	0	114.5	L184 L347 L349 H380	L184-T382 PolarHBondContact N-O 2.64Å; L184-T382 WeakPolarHBondContact O-CB 2.88Å; L184-T382 VanDerWaalsContact O-CG2 3.23Å; L184-T382 WeakPolarHBondContact O-CG2 3.35Å; L347-T382 WeakPolarHBondContact CD2-O 3.26Å; L349-T382 HydrophobicContact CD2-CG2 4.39Å; H380-T382 VanDerWaalsContact C-N 3.34Å; H380-T382 PolarHBondContact O-N 2.78Å
383	T	79.5	Confident	85.4	Confident	96 Å²	96	44.7 Å²	44.7	59%	0.589	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	146.3	169.1	52.9	0	0	0	0	110.7	L347 T381 K385	L347-T383 VanDerWaalsContact CD2-C 3.43Å; T381-T383 WeakPolarHBondContact CG2-O 3.39Å; T383-K385 PolarHBondContact O-N 3.33Å
384	P	82.6	Confident	85.2	Confident	32 Å²	32	42 Å²	42	21%	0.208	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	130.7	-173	-21	33.1	0	0	0	112.4	E182 R324 E345 L347	E182-P384 VanDerWaalsContact O-CD 3.27Å; E182-P384 WeakPolarHBondContact O-CD 3.47Å; E182-P384 WeakPolarHBondContact O-CG 3.45Å; R324-P384 HydrophobicContact CB-CB 4.24Å; R324-P384 HydrophobicContact CG-CB 3.87Å; R324-P384 HydrophobicContact CG-CG 3.83Å; E345-P384 HydrophobicContact CB-CB 3.97Å; L347-P384 HydrophobicContact CD1-CG 4.49Å; L347-P384 HydrophobicContact CD2-CG 4.09Å; L347-P384 HydrophobicContact CG-CG 4.32Å
385	K	86.8	Confident	85	Confident	56 Å²	56	42.2 Å²	42.2	24%	0.243	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.9	-178.8	-159.7	-176.1	-169	-132.4	0	111.3	E345 V346 E374 T381 T383 I387	E345-K385 VanDerWaalsContact CA-O 3.31Å; E345-K385 WeakPolarHBondContact CA-O 3.29Å; V346-K385 PolarHBondContact N-O 2.85Å; V346-K385 PolarHBondContact O-N 3.28Å; E374-K385 WeakPolarHBondContact OE1-CE 3.38Å; E374-K385 IonicContact OE1-NZ 3.16Å; E374-K385 PolarHBondContact OE1-NZ 3.35Å; E374-K385 WeakPolarHBondContact OE2-CD 3.33Å; E374-K385 WeakPolarHBondContact OE2-CE 3.19Å; E374-K385 IonicContact OE2-NZ 3.3Å; E374-K385 PolarHBondContact OE2-NZ 3.23Å; T381-K385 HydrophobicContact CG2-CB 3.85Å; T381-K385 HydrophobicContact CG2-CD 4.46Å; T383-K385 PolarHBondContact O-N 3.33Å; K385-I387 PolarHBondContact O-N 3.26Å
386	T	90.5	Very high	84.4	Confident	48 Å²	48	43.2 Å²	43.2	29%	0.294	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	114.2	-177.1	-47.1	0	0	0	0	112.5	P343 I344 T373 I389	P343-T386 HydrophobicContact CB-CG2 3.56Å; I344-T386 WeakPolarHBondContact O-CA 3.4Å; T373-T386 PolarHBondContact OG1-O 2.91Å; T373-T386 VanDerWaalsContact OG1-O 3.08Å; T386-I389 HydrophobicContact CG2-CG1 4.47Å
387	I	91	Very high	83.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-25.6	-179.9	54.9	163.4	0	0	0	113.7	I344 V346 I356 I359 T373 E374 I377 K385 V409	I344-I387 HydrophobicContact CB-CG1 4.23Å; I344-I387 HydrophobicContact CG2-CD1 3.86Å; I344-I387 HydrophobicContact CG2-CG1 3.75Å; I344-I387 WeakPolarHBondContact O-CG1 3.05Å; I344-I387 PolarHBondContact O-N 2.95Å; V346-I387 HydrophobicContact CB-CD1 4.5Å; V346-I387 HydrophobicContact CG1-CD1 3.65Å; V346-I387 HydrophobicContact CG1-CG1 4.15Å; V346-I387 HydrophobicContact CG2-CB 4.48Å; V346-I387 HydrophobicContact CG2-CD1 3.98Å; V346-I387 HydrophobicContact CG2-CG1 4.09Å; V346-I387 HydrophobicContact CG2-CG2 3.6Å; I356-I387 HydrophobicContact CD1-CB 3.64Å; I356-I387 HydrophobicContact CD1-CD1 3.79Å; I356-I387 HydrophobicContact CD1-CG1 4.32Å; I356-I387 HydrophobicContact CD1-CG2 3.66Å; I359-I387 HydrophobicContact CD1-CD1 4.19Å; T373-I387 PolarHBondContact N-O 3.26Å; T373-I387 PolarHBondContact OG1-O 2.89Å; T373-I387 VanDerWaalsContact OG1-O 3.13Å; E374-I387 PolarHBondContact N-O 3.47Å; E374-I387 VanDerWaalsContact N-O 3.14Å; I377-I387 HydrophobicContact CD1-CG2 4.19Å; I377-I387 HydrophobicContact CG1-CG2 4.02Å; K385-I387 PolarHBondContact O-N 3.26Å; I387-V409 HydrophobicContact CD1-CG1 4.04Å; I387-V409 HydrophobicContact CD1-CG2 4.05Å
388	A	91.1	Very high	83.3	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	169	175.3	0	0	0	0	0	111.4	P343 I344 I359 I370 D371 T373	P343-A388 CarbonylContact C-O 3.49Å; P343-A388 WeakPolarHBondContact CA-O 3.38Å; I344-A388 HydrophobicContact CB-CB 4.39Å; I344-A388 HydrophobicContact CD1-CB 4.36Å; I344-A388 PolarHBondContact N-O 3.03Å; I359-A388 HydrophobicContact CD1-CB 3.78Å; I370-A388 HydrophobicContact CG2-CB 4.18Å; D371-A388 CarbonylContact O-C 3.55Å; D371-A388 WeakPolarHBondContact O-CA 3.34Å; D371-A388 WeakPolarHBondContact O-CB 3.22Å; T373-A388 PolarHBondContact OG1-N 2.82Å
389	I	91.3	Very high	83	Confident	58 Å²	58	45.7 Å²	45.7	30%	0.297	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	119.9	171.6	-60.9	173.3	0	0	0	107.9	D371 T373 T386	D371-I389 PolarHBondContact N-O 2.61Å; D371-I389 PolarHBondContact O-N 3.07Å; T373-I389 HydrophobicContact CG2-CD1 3.86Å; T373-I389 HydrophobicContact CG2-CG1 3.88Å; T386-I389 HydrophobicContact CG2-CG1 4.47Å
390	V	91.1	Very high	82.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	128.2	171.3	-179.5	0	0	0	0	107.6	L328 L330 S341 K342 I344 L368 S369 I370 I407	L328-V390 HydrophobicContact CD2-CB 3.87Å; L328-V390 HydrophobicContact CD2-CG1 4.07Å; L328-V390 HydrophobicContact CD2-CG2 3.72Å; L330-V390 HydrophobicContact CD2-CG1 4.31Å; S341-V390 CarbonylContact C-O 3.49Å; S341-V390 VanDerWaalsContact CA-O 3.32Å; S341-V390 WeakPolarHBondContact CA-O 3.39Å; K342-V390 PolarHBondContact N-O 3.36Å; K342-V390 PolarHBondContact O-N 2.9Å; I344-V390 HydrophobicContact CD1-CG2 3.64Å; I344-V390 HydrophobicContact CG1-CG2 3.8Å; L368-V390 HydrophobicContact CD1-CG1 3.6Å; S369-V390 CarbonylContact O-C 3.49Å; S369-V390 WeakPolarHBondContact O-CA 3.23Å; I370-V390 HydrophobicContact CG1-CG2 4.26Å; I370-V390 HydrophobicContact CG2-CG2 4.41Å; V390-I407 HydrophobicContact CG1-CD1 4.21Å; V390-I407 HydrophobicContact CG2-CD1 3.53Å
391	T	88.2	Confident	83	Confident	17 Å²	17	42.9 Å²	42.9	10%	0.104	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	131.2	178.7	-59	0	0	0	0	109.7	I340 S341 S369	I340-T391 WeakPolarHBondContact O-CA 3.1Å; S341-T391 WeakPolarHBondContact OG-CG2 3.49Å; S341-T391 PolarHBondContact OG-OG1 2.91Å; S369-T391 PolarHBondContact N-O 2.81Å; S369-T391 PolarHBondContact O-N 2.87Å
392	L	87.2	Confident	82.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.8	177.3	-169	67.1	0	0	0	109	L330 I333 S339 I340 A367 L368 L403 L426	L330-L392 HydrophobicContact CB-CD2 4.11Å; L330-L392 HydrophobicContact CD1-CB 4.26Å; L330-L392 HydrophobicContact CD1-CD2 4Å; L330-L392 HydrophobicContact CD2-CB 4.45Å; I333-L392 HydrophobicContact CD1-CB 3.74Å; I333-L392 HydrophobicContact CD1-CD2 3.69Å; I333-L392 HydrophobicContact CD1-CG 3.77Å; I333-L392 WeakPolarHBondContact CD1-O 3.34Å; I333-L392 HydrophobicContact CG1-CD2 4.43Å; S339-L392 CarbonylContact C-O 3.59Å; S339-L392 WeakPolarHBondContact CA-O 3.29Å; S339-L392 WeakPolarHBondContact CB-O 3.29Å; I340-L392 PolarHBondContact N-O 2.92Å; I340-L392 PolarHBondContact O-N 3.38Å; A367-L392 HydrophobicContact CB-CD1 3.97Å; A367-L392 CarbonylContact O-C 3.54Å; A367-L392 WeakPolarHBondContact O-CA 3.37Å; L368-L392 HydrophobicContact CB-CD1 4.49Å; L368-L392 HydrophobicContact CD1-CD1 4.25Å; L392-L403 HydrophobicContact CD1-CD2 3.61Å; L392-L426 HydrophobicContact CD1-CD1 4.23Å; L392-L426 HydrophobicContact CD1-CD2 4.14Å; L392-L426 HydrophobicContact CD2-CD1 4.11Å; L392-L426 HydrophobicContact CD2-CD2 4.26Å; L392-L426 HydrophobicContact CD2-CG 4.09Å; L392-L426 HydrophobicContact CG-CD1 4.48Å; L392-L426 HydrophobicContact CG-CD2 4Å; L392-L426 HydrophobicContact CG-CG 4.38Å
393	S	86.4	Confident	83.3	Confident	33 Å²	33	45.1 Å²	45.1	23%	0.231	25%	0.25	C	S	.	.			trans	-113.9	129.2	-168.9	-173.9	0	0	0	0	112.3	A367 A395	A367-S393 VanDerWaalsContact CB-O 3.27Å; A367-S393 WeakPolarHBondContact CB-O 3.46Å; A367-S393 PolarHBondContact O-N 3.38Å; S393-A395 VanDerWaalsContact C-N 3.27Å; S393-A395 PolarHBondContact O-N 2.95Å; S393-A395 PolarHBondContact OG-N 2.93Å
394	S	82	Confident	83.4	Confident	14 Å²	14	42.5 Å²	42.5	10%	0.098	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-77	-8.1	174.9	46.8	0	0	0	0	114.5	S337 H396 L397	S337-S394 WeakPolarHBondContact O-CB 3.14Å; S337-S394 PolarHBondContact O-OG 3.5Å; S394-H396 PolarHBondContact O-N 2.79Å; S394-H396 VanDerWaalsContact O-N 3.12Å; S394-L397 PolarHBondContact O-N 2.76Å
395	A	74.7	Confident	83.3	Confident	75 Å²	75	41.1 Å²	41.1	62%	0.62	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-65.3	-18.8	-166.2	0	0	0	0	0	115.4	S393	S393-A395 VanDerWaalsContact C-N 3.27Å; S393-A395 PolarHBondContact O-N 2.95Å; S393-A395 PolarHBondContact OG-N 2.93Å
396	H	70.5	Confident	83.1	Confident	119 Å²	119	39.5 Å²	39.5	55%	0.551	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-113.7	12.8	-176.5	-58.4	-67.7	0	0	0	113	E366 S394 S398	E366-H396 HydrophobicContact CB-CB 4.41Å; S394-H396 PolarHBondContact O-N 2.79Å; S394-H396 VanDerWaalsContact O-N 3.12Å; H396-S398 PolarHBondContact O-N 3.28Å
397	L	74	Confident	83	Confident	21 Å²	21	37.2 Å²	37.2	11%	0.11	21%	0.207	C	C	.	.			trans	-72.5	126.2	-177.3	-76.9	167.4	0	0	0	113.6	S394 Y401 L426 Y428	S394-L397 PolarHBondContact O-N 2.76Å; L397-Y401 HydrophobicContact CD2-CD1 4.17Å; L397-Y401 HydrophobicContact CD2-CE1 3.55Å; L397-L426 HydrophobicContact CD1-CB 4.01Å; L397-L426 HydrophobicContact CD1-CD2 4.18Å; L397-L426 HydrophobicContact CD2-CB 3.5Å; L397-L426 HydrophobicContact CD2-CD2 3.97Å; L397-L426 HydrophobicContact CD2-CG 4.33Å; L397-L426 HydrophobicContact CG-CB 4.32Å; L397-L426 HydrophobicContact CG-CD2 4.26Å; L397-Y428 HydrophobicContact CB-CD2 4.32Å; L397-Y428 WeakPolarHBondContact O-CD2 3.39Å; L397-Y428 WeakPolarHBondContact O-CE2 3.3Å
398	S	73.6	Confident	82.8	Confident	85 Å²	85	38 Å²	38	59%	0.594	21%	0.213	S	C	*	.	S	Bend	trans	-109.6	-21.5	170.8	57	0	0	0	0	114.1	H396	H396-S398 PolarHBondContact O-N 3.28Å
399	H	79.3	Confident	82.7	Confident	93 Å²	93	38 Å²	38	43%	0.431	21%	0.213	S	C	.	.	S	Bend	trans	-154.5	160.8	-178.3	59.8	-73.6	0	0	0	109.8	Y401	H399-Y401 AromaticContact CD2-CD1 3.85Å; H399-Y401 AromaticContact CE1-CD1 3.97Å; H399-Y401 AromaticContact NE2-CD1 3.56Å; H399-Y401 WeakPolarHBondContact O-CD1 3.31Å
400	S	81.5	Confident	82.5	Confident	29 Å²	29	39 Å²	39	20%	0.203	22%	0.215	C	C	.	.			trans	-73.8	133.7	171.3	-67.4	0	0	0	0	111.3	L426 V427 Y428 D463	S400-L426 CarbonylContact C-O 3.52Å; S400-L426 WeakPolarHBondContact CA-O 3.49Å; S400-V427 WeakPolarHBondContact OG-CA 3.49Å; S400-Y428 PolarHBondContact OG-N 2.84Å; S400-D463 VanDerWaalsContact CB-OD1 3.3Å; S400-D463 WeakPolarHBondContact CB-OD1 3.48Å; S400-D463 VanDerWaalsContact CB-OD2 3.28Å; S400-D463 WeakPolarHBondContact CB-OD2 3.35Å; S400-D463 PolarHBondContact N-OD2 3.27Å; S400-D463 VanDerWaalsContact OG-CG 3.24Å; S400-D463 PolarHBondContact OG-OD1 2.95Å; S400-D463 PolarHBondContact OG-OD2 2.82Å; S400-D463 VanDerWaalsContact OG-OD2 3.11Å
401	Y	83.1	Confident	82.3	Confident	51 Å²	51	39.6 Å²	39.6	20%	0.2	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	161.9	173.3	64.2	-91.2	0	0	0	112.5	D365 L397 H399 L403 L426	D365-Y401 PolarHBondContact OD1-OH 2.87Å; D365-Y401 WeakPolarHBondContact OD2-CE2 3.21Å; D365-Y401 PolarHBondContact OD2-OH 3.18Å; L397-Y401 HydrophobicContact CD2-CD1 4.17Å; L397-Y401 HydrophobicContact CD2-CE1 3.55Å; H399-Y401 AromaticContact CD2-CD1 3.85Å; H399-Y401 AromaticContact CE1-CD1 3.97Å; H399-Y401 AromaticContact NE2-CD1 3.56Å; H399-Y401 WeakPolarHBondContact O-CD1 3.31Å; Y401-L403 HydrophobicContact CE2-CB 4.27Å; Y401-L426 HydrophobicContact CD2-CD1 4.19Å; Y401-L426 HydrophobicContact CE2-CD1 3.7Å; Y401-L426 PolarHBondContact N-O 2.9Å; Y401-L426 PolarHBondContact O-N 2.94Å; Y401-L426 VanDerWaalsContact O-O 3.05Å
402	Y	80.5	Confident	82.1	Confident	111 Å²	111	42.8 Å²	42.8	44%	0.435	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	134	173.8	-59.9	-97.8	0	0	0	109.4	D172 Y423 R425	D172-Y402 WeakPolarHBondContact OD1-CE1 3.47Å; D172-Y402 WeakPolarHBondContact OD2-CE1 3.2Å; D172-Y402 PolarHBondContact OD2-OH 2.88Å; D172-Y402 VanDerWaalsContact OD2-OH 3.12Å; Y402-Y423 HydrophobicContact CD1-CE2 4.11Å; Y402-Y423 AromaticContact CD1-CZ 4Å; Y402-R425 HydrophobicContact CD1-CB 4.06Å; Y402-R425 HydrophobicContact CD1-CG 3.84Å; Y402-R425 HydrophobicContact CE1-CB 4.27Å; Y402-R425 VanDerWaalsContact CE1-CD 3.48Å; Y402-R425 HydrophobicContact CE1-CG 3.73Å; Y402-R425 HydrophobicContact CG-CG 4.5Å; Y402-R425 PolarHBondContact OH-NH1 2.86Å
403	L	83.6	Confident	81.8	Confident	9 Å²	9	46.3 Å²	46.3	5%	0.047	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	111.7	173.8	-174.1	69.6	0	0	0	109.3	I363 D365 L368 L392 Y401 F422 Y423 G424 L426	I363-L403 HydrophobicContact CG2-CD1 4.22Å; D365-L403 HydrophobicContact CB-CD1 3.99Å; D365-L403 HydrophobicContact CB-CD2 4.24Å; D365-L403 WeakPolarHBondContact OD2-CD1 3.4Å; L368-L403 HydrophobicContact CB-CD2 4.1Å; L368-L403 HydrophobicContact CD1-CD2 4.47Å; L368-L403 HydrophobicContact CD2-CD2 4.46Å; L392-L403 HydrophobicContact CD1-CD2 3.61Å; Y401-L403 HydrophobicContact CE2-CB 4.27Å; L403-F422 HydrophobicContact CD2-CE2 4.07Å; L403-F422 HydrophobicContact CG-CE2 3.95Å; L403-Y423 CarbonylContact O-C 3.57Å; L403-Y423 WeakPolarHBondContact O-CA 3.2Å; L403-G424 PolarHBondContact N-O 2.86Å; L403-G424 PolarHBondContact O-N 2.97Å; L403-L426 HydrophobicContact CB-CD1 3.69Å; L403-L426 HydrophobicContact CD2-CD1 4.46Å
404	S	82.8	Confident	81.2	Confident	41 Å²	41	53.8 Å²	53.8	29%	0.287	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	149.5	177.7	65.1	0	0	0	0	110.8	I363 F422	I363-S404 WeakPolarHBondContact CD1-O 3.28Å; S404-F422 VanDerWaalsContact CA-O 3.23Å; S404-F422 WeakPolarHBondContact CA-O 3.46Å
405	G	80.5	Confident	80.8	Confident	4 Å²	4	57.6 Å²	57.6	4%	0.041	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.3	-161.4	-176.1	0	0	0	0	0	113.1	N362 P421 F422	N362-G405 WeakPolarHBondContact OD1-CA 3.41Å; G405-P421 CarbonylContact O-C 3.6Å; G405-P421 WeakPolarHBondContact O-CA 3.48Å; G405-F422 VanDerWaalsContact CA-CE1 3.49Å; G405-F422 PolarHBondContact N-O 3.44Å; G405-F422 VanDerWaalsContact N-O 3.07Å; G405-F422 VanDerWaalsContact O-CD1 3.29Å; G405-F422 WeakPolarHBondContact O-CD1 3.16Å; G405-F422 PolarHBondContact O-N 2.76Å
406	I	83	Confident	81	Confident	21 Å²	21	55.5 Å²	55.5	11%	0.108	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.2	179.8	-52.7	177.2	0	0	0	109.7	V144 A361 N362 R419	V144-I406 WeakPolarHBondContact O-CD1 3.41Å; V144-I406 WeakPolarHBondContact O-CG1 3.44Å; A361-I406 WeakPolarHBondContact CA-O 3.39Å; N362-I406 PolarHBondContact N-O 2.81Å; N362-I406 PolarHBondContact OD1-N 3.08Å; N362-I406 PolarHBondContact OD1-O 3.19Å; I406-R419 HydrophobicContact CG2-CB 3.79Å; I406-R419 HydrophobicContact CG2-CG 4.03Å
407	I	87	Confident	81.6	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	127.4	165.9	-63.8	169	0	0	0	108.3	L328 I344 I359 A361 I370 V390 R419 I420 F422	L328-I407 HydrophobicContact CD2-CD1 4.11Å; I344-I407 HydrophobicContact CD1-CD1 4.32Å; I344-I407 HydrophobicContact CD1-CG2 3.91Å; I359-I407 HydrophobicContact CG2-CG2 3.51Å; A361-I407 HydrophobicContact CB-CG1 4.23Å; I370-I407 HydrophobicContact CD1-CD1 3.9Å; I370-I407 HydrophobicContact CD1-CG1 4Å; I370-I407 HydrophobicContact CD1-CG2 4.17Å; V390-I407 HydrophobicContact CG1-CD1 4.21Å; V390-I407 HydrophobicContact CG2-CD1 3.53Å; I407-R419 WeakPolarHBondContact O-CA 3.29Å; I407-I420 PolarHBondContact N-O 2.82Å; I407-I420 PolarHBondContact O-N 3.24Å; I407-F422 HydrophobicContact CD1-CD1 4.05Å; I407-F422 HydrophobicContact CD1-CG 4.36Å; I407-F422 HydrophobicContact CG1-CD1 3.73Å; I407-F422 HydrophobicContact CG1-CE1 3.97Å
408	T	87.6	Confident	82	Confident	18 Å²	18	54 Å²	54	11%	0.11	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.2	178.5	-49.3	0	0	0	0	109.7	I359 E360 F410 L418 R419	I359-T408 WeakPolarHBondContact CA-O 3.45Å; E360-T408 PolarHBondContact N-O 3.11Å; E360-T408 PolarHBondContact O-N 3.32Å; T408-F410 HydrophobicContact CG2-CD1 4.16Å; T408-F410 HydrophobicContact CG2-CD2 4.29Å; T408-F410 HydrophobicContact CG2-CE1 3.68Å; T408-F410 HydrophobicContact CG2-CE2 3.84Å; T408-F410 HydrophobicContact CG2-CG 4.45Å; T408-F410 HydrophobicContact CG2-CZ 3.51Å; T408-L418 CarbonylContact C-O 3.6Å; T408-L418 WeakPolarHBondContact CA-O 3.36Å; T408-R419 HydrophobicContact CG2-CG 4.21Å
409	V	88.3	Confident	82.3	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	111.9	171.8	-179.8	0	0	0	0	107.7	I356 I359 I387 Y417 L418	I356-V409 HydrophobicContact CD1-CG1 4.43Å; I356-V409 HydrophobicContact CG1-CG1 4.27Å; I356-V409 HydrophobicContact CG2-CG1 4.07Å; I359-V409 HydrophobicContact CD1-CG1 4.39Å; I359-V409 HydrophobicContact CD1-CG2 4.2Å; I359-V409 HydrophobicContact CG1-CB 4.41Å; I359-V409 HydrophobicContact CG1-CG1 4.14Å; I359-V409 HydrophobicContact CG1-CG2 4.13Å; I359-V409 HydrophobicContact CG2-CG2 4.19Å; I387-V409 HydrophobicContact CD1-CG1 4.04Å; I387-V409 HydrophobicContact CD1-CG2 4.05Å; V409-Y417 WeakPolarHBondContact O-CA 3.42Å; V409-L418 HydrophobicContact CB-CB 4.25Å; V409-L418 PolarHBondContact N-O 3.2Å; V409-L418 PolarHBondContact O-N 2.74Å; V409-L418 VanDerWaalsContact O-N 3.11Å
410	F	88.3	Confident	82.5	Confident	79 Å²	79	52.5 Å²	52.5	35%	0.346	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	142.3	174.5	-62.2	-76.3	0	0	0	110.2	T357 S358 E360 T408	T357-F410 PolarHBondContact N-O 2.83Å; T357-F410 WeakPolarHBondContact OG1-CB 3.37Å; T357-F410 PolarHBondContact OG1-O 2.83Å; T357-F410 VanDerWaalsContact OG1-O 3.14Å; S358-F410 PolarHBondContact O-N 3.37Å; S358-F410 WeakPolarHBondContact OG-CD2 3.49Å; E360-F410 HydrophobicContact CB-CE2 4.29Å; T408-F410 HydrophobicContact CG2-CD1 4.16Å; T408-F410 HydrophobicContact CG2-CD2 4.29Å; T408-F410 HydrophobicContact CG2-CE1 3.68Å; T408-F410 HydrophobicContact CG2-CE2 3.84Å; T408-F410 HydrophobicContact CG2-CG 4.45Å; T408-F410 HydrophobicContact CG2-CZ 3.51Å
411	T	87.2	Confident	82.4	Confident	11 Å²	11	51.3 Å²	51.3	7%	0.067	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-175.7	-179.4	81.4	0	0	0	0	111.5	L321 L354 E355 T357 D413 I416	L321-T411 HydrophobicContact CD2-CG2 4.12Å; L354-T411 HydrophobicContact CD1-CG2 4.46Å; L354-T411 HydrophobicContact CD2-CG2 3.7Å; L354-T411 HydrophobicContact CG-CG2 4.01Å; E355-T411 CarbonylContact O-C 3.6Å; E355-T411 VanDerWaalsContact O-C 3.31Å; E355-T411 WeakPolarHBondContact O-CA 3.18Å; E355-T411 WeakPolarHBondContact O-CB 3.47Å; T357-T411 VanDerWaalsContact CG2-O 3.26Å; T357-T411 WeakPolarHBondContact CG2-O 3.35Å; T357-T411 PolarHBondContact OG1-N 3.43Å; T357-T411 PolarHBondContact OG1-O 2.87Å; T411-D413 VanDerWaalsContact C-N 3.28Å; T411-D413 PolarHBondContact OG1-N 3.24Å; T411-D413 VanDerWaalsContact OG1-N 3.16Å; T411-D413 PolarHBondContact OG1-O 3.21Å; T411-I416 WeakPolarHBondContact CB-O 3.4Å; T411-I416 HydrophobicContact CG2-CG2 4.42Å; T411-I416 WeakPolarHBondContact CG2-O 3.35Å; T411-I416 PolarHBondContact OG1-O 3.29Å
412	N	83.8	Confident	82.6	Confident	85 Å²	85	48.9 Å²	48.9	46%	0.455	24%	0.238	S	C	.	.	S	Bend	trans	-74.6	-16.5	172.4	57.7	-23.7	0	0	0	113.2	E355 T357	E355-N412 HydrophobicContact CB-CB 4.09Å; E355-N412 PolarHBondContact N-OD1 3.31Å; E355-N412 PolarHBondContact O-N 2.96Å; E355-N412 PolarHBondContact O-OD1 2.87Å; T357-N412 HydrophobicContact CG2-CB 4.47Å
413	D	80	Confident	82.8	Confident	73 Å²	73	43.9 Å²	43.9	39%	0.39	22%	0.219	S	C	.	.	S	Bend	trans	-102.6	120.9	170.7	-167.5	-38.5	0	0	0	109.9	T411 S415 I416	T411-D413 VanDerWaalsContact C-N 3.28Å; T411-D413 PolarHBondContact OG1-N 3.24Å; T411-D413 VanDerWaalsContact OG1-N 3.16Å; T411-D413 PolarHBondContact OG1-O 3.21Å; D413-S415 VanDerWaalsContact CG-OG 3.28Å; D413-S415 PolarHBondContact O-N 2.64Å; D413-S415 WeakPolarHBondContact OD1-CB 3.46Å; D413-S415 PolarHBondContact OD1-N 2.93Å; D413-S415 PolarHBondContact OD1-OG 3.46Å; D413-I416 HydrophobicContact CB-CB 4.26Å; D413-I416 HydrophobicContact CB-CD1 4.2Å; D413-I416 HydrophobicContact CB-CG1 4.13Å; D413-I416 PolarHBondContact O-N 3.1Å; D413-I416 VanDerWaalsContact O-O 3.13Å
414	Q	74.7	Confident	82.8	Confident	191 Å²	191	43.5 Å²	43.5	89%	0.893	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.1	-179.5	-68.3	-176.2	-25	0	0	113.6
415	S	73.3	Confident	82.8	Confident	93 Å²	93	43 Å²	43	65%	0.65	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-18.3	173.4	70.7	0	0	0	0	113.4	D413	D413-S415 VanDerWaalsContact CG-OG 3.28Å; D413-S415 PolarHBondContact O-N 2.64Å; D413-S415 WeakPolarHBondContact OD1-CB 3.46Å; D413-S415 PolarHBondContact OD1-N 2.93Å; D413-S415 PolarHBondContact OD1-OG 3.46Å
416	I	78.2	Confident	83	Confident	31 Å²	31	42.9 Å²	42.9	16%	0.159	21%	0.207	C	C	.	.			trans	-110.6	102.9	-177.2	-52.1	178.6	0	0	0	109.5	L321 L354 T411 D413	L321-I416 HydrophobicContact CB-CG2 3.92Å; L321-I416 HydrophobicContact CD2-CG2 4.36Å; L354-I416 HydrophobicContact CD1-CB 4.47Å; L354-I416 HydrophobicContact CD1-CD1 4Å; L354-I416 HydrophobicContact CD1-CG2 4.3Å; L354-I416 HydrophobicContact CD2-CG2 4.09Å; T411-I416 WeakPolarHBondContact CB-O 3.4Å; T411-I416 HydrophobicContact CG2-CG2 4.42Å; T411-I416 WeakPolarHBondContact CG2-O 3.35Å; T411-I416 PolarHBondContact OG1-O 3.29Å; D413-I416 HydrophobicContact CB-CB 4.26Å; D413-I416 HydrophobicContact CB-CD1 4.2Å; D413-I416 HydrophobicContact CB-CG1 4.13Å; D413-I416 PolarHBondContact O-N 3.1Å; D413-I416 VanDerWaalsContact O-O 3.13Å
417	Y	82.4	Confident	82.9	Confident	105 Å²	105	41.9 Å²	41.9	41%	0.412	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	154.8	170.1	65.8	-87.7	0	0	0	109.7	V409 R419	V409-Y417 WeakPolarHBondContact O-CA 3.42Å; Y417-R419 HydrophobicContact CD2-CG 4.19Å; Y417-R419 HydrophobicContact CE2-CG 4.17Å
418	L	83	Confident	82.7	Confident	5 Å²	5	46.9 Å²	46.9	3%	0.026	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.1	177.9	175.4	67.6	0	0	0	109.3	L321 V346 T408 V409 I420	L321-L418 HydrophobicContact CD2-CB 3.86Å; L321-L418 HydrophobicContact CG-CB 4.25Å; L321-L418 HydrophobicContact CG-CD2 4.31Å; V346-L418 HydrophobicContact CG1-CD2 3.55Å; T408-L418 CarbonylContact C-O 3.6Å; T408-L418 WeakPolarHBondContact CA-O 3.36Å; V409-L418 HydrophobicContact CB-CB 4.25Å; V409-L418 PolarHBondContact N-O 3.2Å; V409-L418 PolarHBondContact O-N 2.74Å; V409-L418 VanDerWaalsContact O-N 3.11Å; L418-I420 HydrophobicContact CD2-CD1 3.9Å; L418-I420 HydrophobicContact CD2-CG1 4.09Å; L418-I420 HydrophobicContact CG-CD1 4.3Å; L418-I420 HydrophobicContact CG-CG1 3.94Å
419	R	79.6	Confident	82.3	Confident	144 Å²	144	46.3 Å²	46.3	54%	0.543	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131.5	172.3	-72.7	-178.9	179.6	-175.2	0.4	109	I406 I407 T408 Y417	I406-R419 HydrophobicContact CG2-CB 3.79Å; I406-R419 HydrophobicContact CG2-CG 4.03Å; I407-R419 WeakPolarHBondContact O-CA 3.29Å; T408-R419 HydrophobicContact CG2-CG 4.21Å; Y417-R419 HydrophobicContact CD2-CG 4.19Å; Y417-R419 HydrophobicContact CE2-CG 4.17Å
420	I	83.5	Confident	82	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	110.8	-179.9	-49.9	179.1	0	0	0	107.3	V325 L328 I344 I407 L418	V325-I420 HydrophobicContact CG2-CG2 4.43Å; L328-I420 HydrophobicContact CB-CG2 4.22Å; I344-I420 HydrophobicContact CG2-CD1 3.5Å; I407-I420 PolarHBondContact N-O 2.82Å; I407-I420 PolarHBondContact O-N 3.24Å; L418-I420 HydrophobicContact CD2-CD1 3.9Å; L418-I420 HydrophobicContact CD2-CG1 4.09Å; L418-I420 HydrophobicContact CG-CD1 4.3Å; L418-I420 HydrophobicContact CG-CG1 3.94Å
421	P	80.8	Confident	81.7	Confident	4 Å²	4	44 Å²	44	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	150.2	173.2	30.3	-33.7	0	0	0	109.9	T143 V144 S326 L327 L328 G405	T143-P421 HydrophobicContact CG2-CG 4.42Å; V144-P421 HydrophobicContact CB-CB 4.31Å; V144-P421 HydrophobicContact CG2-CB 4.26Å; S326-P421 WeakPolarHBondContact O-CD 3.23Å; S326-P421 WeakPolarHBondContact O-CG 3.5Å; L327-P421 HydrophobicContact CD1-CB 4.03Å; L327-P421 HydrophobicContact CD1-CG 4.15Å; L328-P421 PolarHBondContact N-O 3.48Å; G405-P421 CarbonylContact O-C 3.6Å; G405-P421 WeakPolarHBondContact O-CA 3.48Å
422	F	86.4	Confident	81.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	155.2	176.5	72.9	-83.2	0	0	0	111.2	L328 L330 A361 L368 L403 S404 G405 I407	L328-F422 HydrophobicContact CB-CB 3.84Å; L328-F422 HydrophobicContact CD2-CB 4.11Å; L328-F422 HydrophobicContact CG-CB 4.45Å; L328-F422 WeakPolarHBondContact O-CA 3.21Å; L330-F422 HydrophobicContact CD1-CD2 4.02Å; A361-F422 HydrophobicContact CB-CE1 4.44Å; L368-F422 HydrophobicContact CD1-CE2 4.21Å; L368-F422 HydrophobicContact CD2-CE1 4.48Å; L368-F422 HydrophobicContact CD2-CE2 3.8Å; L368-F422 HydrophobicContact CD2-CZ 3.61Å; L403-F422 HydrophobicContact CD2-CE2 4.07Å; L403-F422 HydrophobicContact CG-CE2 3.95Å; S404-F422 VanDerWaalsContact CA-O 3.23Å; S404-F422 WeakPolarHBondContact CA-O 3.46Å; G405-F422 VanDerWaalsContact CA-CE1 3.49Å; G405-F422 PolarHBondContact N-O 3.44Å; G405-F422 VanDerWaalsContact N-O 3.07Å; G405-F422 VanDerWaalsContact O-CD1 3.29Å; G405-F422 WeakPolarHBondContact O-CD1 3.16Å; G405-F422 PolarHBondContact O-N 2.76Å; I407-F422 HydrophobicContact CD1-CD1 4.05Å; I407-F422 HydrophobicContact CD1-CG 4.36Å; I407-F422 HydrophobicContact CG1-CD1 3.73Å; I407-F422 HydrophobicContact CG1-CE1 3.97Å
423	Y	84.7	Confident	81.4	Confident	6 Å²	6	43.6 Å²	43.6	2%	0.024	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	135.9	176.8	170.4	-77	0	0	0	110.2	I170 D172 L328 Y329 L330 Y402 L403	I170-Y423 HydrophobicContact CB-CD2 3.71Å; I170-Y423 HydrophobicContact CB-CE2 3.81Å; I170-Y423 HydrophobicContact CD1-CD2 3.65Å; I170-Y423 HydrophobicContact CD1-CG 3.77Å; I170-Y423 HydrophobicContact CG1-CD2 4.3Å; I170-Y423 HydrophobicContact CG2-CD2 3.73Å; I170-Y423 HydrophobicContact CG2-CE2 3.48Å; I170-Y423 VanDerWaalsContact CG2-CE2 3.48Å; I170-Y423 HydrophobicContact CG2-CG 4.39Å; D172-Y423 PolarHBondContact OD1-OH 3.31Å; L328-Y423 PolarHBondContact O-N 3.47Å; Y329-Y423 AromaticContact CD2-CD1 3.74Å; Y329-Y423 HydrophobicContact CD2-CD1 3.74Å; Y329-Y423 HydrophobicContact CD2-CE1 4.31Å; Y329-Y423 AromaticContact CE2-CD1 3.55Å; Y329-Y423 HydrophobicContact CE2-CD1 3.55Å; Y329-Y423 AromaticContact CE2-CE1 3.64Å; Y329-Y423 HydrophobicContact CE2-CE1 3.64Å; L330-Y423 PolarHBondContact N-O 3.08Å; Y402-Y423 HydrophobicContact CD1-CE2 4.11Å; Y402-Y423 AromaticContact CD1-CZ 4Å; L403-Y423 CarbonylContact O-C 3.57Å; L403-Y423 WeakPolarHBondContact O-CA 3.2Å
424	G	84.4	Confident	81.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	152.7	165.9	0	0	0	0	0	110.7	G331 L403	G331-G424 CarbonylContact O-C 3.51Å; G331-G424 VanDerWaalsContact O-CA 3.3Å; G331-G424 WeakPolarHBondContact O-CA 3.39Å; L403-G424 PolarHBondContact N-O 2.86Å; L403-G424 PolarHBondContact O-N 2.97Å
425	R	82.9	Confident	81.4	Confident	32 Å²	32	36.7 Å²	36.7	12%	0.121	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	113.8	176.1	-176	179.8	175.1	163.9	-8.4	108.3	D172 G331 V332 I333 Y402 V427	D172-R425 IonicContact OD2-CZ 2.73Å; D172-R425 IonicContact OD2-NH1 2.67Å; D172-R425 PolarHBondContact OD2-NH1 3.41Å; G331-R425 PolarHBondContact O-N 2.99Å; V332-R425 CarbonylContact C-O 3.38Å; V332-R425 VanDerWaalsContact CA-O 3.3Å; V332-R425 WeakPolarHBondContact CA-O 3.4Å; V332-R425 HydrophobicContact CG1-CB 4.35Å; V332-R425 HydrophobicContact CG1-CG 4.45Å; V332-R425 HydrophobicContact CG2-CB 4.3Å; I333-R425 PolarHBondContact N-O 2.86Å; Y402-R425 HydrophobicContact CD1-CB 4.06Å; Y402-R425 HydrophobicContact CD1-CG 3.84Å; Y402-R425 HydrophobicContact CE1-CB 4.27Å; Y402-R425 VanDerWaalsContact CE1-CD 3.48Å; Y402-R425 HydrophobicContact CE1-CG 3.73Å; Y402-R425 HydrophobicContact CG-CG 4.5Å; Y402-R425 PolarHBondContact OH-NH1 2.86Å; R425-V427 HydrophobicContact CG-CG2 4.11Å
426	L	83.7	Confident	81.2	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	135.9	174.8	-59.1	103.6	0	0	0	109.3	I333 A367 L392 L397 S400 Y401 L403	I333-L426 CarbonylContact O-C 3.47Å; I333-L426 WeakPolarHBondContact O-CA 3.43Å; A367-L426 HydrophobicContact CB-CD2 3.73Å; L392-L426 HydrophobicContact CD1-CD1 4.23Å; L392-L426 HydrophobicContact CD1-CD2 4.14Å; L392-L426 HydrophobicContact CD2-CD1 4.11Å; L392-L426 HydrophobicContact CD2-CD2 4.26Å; L392-L426 HydrophobicContact CD2-CG 4.09Å; L392-L426 HydrophobicContact CG-CD1 4.48Å; L392-L426 HydrophobicContact CG-CD2 4Å; L392-L426 HydrophobicContact CG-CG 4.38Å; L397-L426 HydrophobicContact CD1-CB 4.01Å; L397-L426 HydrophobicContact CD1-CD2 4.18Å; L397-L426 HydrophobicContact CD2-CB 3.5Å; L397-L426 HydrophobicContact CD2-CD2 3.97Å; L397-L426 HydrophobicContact CD2-CG 4.33Å; L397-L426 HydrophobicContact CG-CB 4.32Å; L397-L426 HydrophobicContact CG-CD2 4.26Å; S400-L426 CarbonylContact C-O 3.52Å; S400-L426 WeakPolarHBondContact CA-O 3.49Å; Y401-L426 HydrophobicContact CD2-CD1 4.19Å; Y401-L426 HydrophobicContact CE2-CD1 3.7Å; Y401-L426 PolarHBondContact N-O 2.9Å; Y401-L426 PolarHBondContact O-N 2.94Å; Y401-L426 VanDerWaalsContact O-O 3.05Å; L403-L426 HydrophobicContact CB-CD1 3.69Å; L403-L426 HydrophobicContact CD2-CD1 4.46Å
427	V	80.9	Confident	80.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	114	-169.3	170.9	0	0	0	0	109.7	V332 I333 N334 S335 S400 R425 Y462 F464 I524	V332-V427 HydrophobicContact CG1-CG2 3.64Å; I333-V427 PolarHBondContact O-N 3.3Å; N334-V427 CarbonylContact C-O 3.52Å; N334-V427 VanDerWaalsContact CA-O 3.23Å; N334-V427 WeakPolarHBondContact CA-O 3.49Å; N334-V427 HydrophobicContact CB-CB 4.37Å; N334-V427 HydrophobicContact CB-CG1 4.38Å; S335-V427 PolarHBondContact N-O 2.71Å; S400-V427 WeakPolarHBondContact OG-CA 3.49Å; R425-V427 HydrophobicContact CG-CG2 4.11Å; V427-Y462 HydrophobicContact CG1-CD1 3.28Å; V427-Y462 HydrophobicContact CG1-CE1 3.43Å; V427-Y462 VanDerWaalsContact CG1-CE1 3.43Å; V427-Y462 HydrophobicContact CG1-CG 4.36Å; V427-F464 HydrophobicContact CG1-CE1 3.74Å; V427-F464 HydrophobicContact CG1-CZ 3.93Å; V427-F464 HydrophobicContact CG2-CE1 4.09Å; V427-F464 HydrophobicContact CG2-CZ 4.2Å; V427-I524 HydrophobicContact CG1-CD1 4.36Å
428	Y	82	Confident	79.6	Confident	105 Å²	105	35 Å²	35	41%	0.412	18%	0.181	S	C	.	.			trans	-78.9	140.3	175.4	-179.6	-99.4	0	0	0	110.9	L397 S400 Y462	L397-Y428 HydrophobicContact CB-CD2 4.32Å; L397-Y428 WeakPolarHBondContact O-CD2 3.39Å; L397-Y428 WeakPolarHBondContact O-CE2 3.3Å; S400-Y428 PolarHBondContact OG-N 2.84Å; Y428-Y462 VanDerWaalsContact O-CD1 3.29Å; Y428-Y462 WeakPolarHBondContact O-CD1 3.28Å
429	G	80.5	Confident	78.3	Confident	7 Å²	7	37.7 Å²	37.7	7%	0.072	20%	0.199	C	C	.	.	S	Bend	trans	96.2	-174.4	179	0	0	0	0	0	115.8	S335 R461 Y462	S335-G429 PolarHBondContact OG-N 3.08Å; S335-G429 PolarHBondContact OG-O 2.86Å; G429-R461 WeakPolarHBondContact CA-O 3.3Å; G429-Y462 WeakPolarHBondContact O-CE1 3.33Å
430	S	82	Confident	77.1	Confident	11 Å²	11	32.9 Å²	32.9	8%	0.077	18%	0.184	C	C	.	.			trans	-158.9	144.2	-174.9	65.5	0	0	0	0	113.4	R336 T432 R461 Y462	R336-S430 PolarHBondContact NE-OG 3.5Å; R336-S430 PolarHBondContact NH2-OG 3.16Å; S430-T432 PolarHBondContact O-N 2.9Å; S430-R461 WeakPolarHBondContact O-CB 3.35Å; S430-R461 PolarHBondContact O-N 3.28Å; S430-Y462 VanDerWaalsContact CA-CZ 3.46Å
431	L	82.1	Confident	75.1	Confident	19 Å²	19	40.4 Å²	40.4	10%	0.099	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	120.6	165.2	-169.3	69.8	0	0	0	109.6	L458 Y462 L466 L493 F527	L431-L458 HydrophobicContact CD1-CB 4.39Å; L431-L458 HydrophobicContact CD2-CD1 4.49Å; L431-Y462 HydrophobicContact CB-CE2 4.04Å; L431-L466 HydrophobicContact CD1-CD1 4.44Å; L431-L466 HydrophobicContact CD1-CD2 4.45Å; L431-L493 HydrophobicContact CD1-CD1 4.22Å; L431-F527 HydrophobicContact CB-CD1 4.35Å; L431-F527 HydrophobicContact CB-CD2 4.16Å; L431-F527 HydrophobicContact CB-CE1 4.08Å; L431-F527 HydrophobicContact CB-CE2 3.85Å; L431-F527 HydrophobicContact CB-CG 4.39Å; L431-F527 HydrophobicContact CB-CZ 3.83Å; L431-F527 HydrophobicContact CD2-CB 4.4Å; L431-F527 HydrophobicContact CD2-CD2 3.39Å; L431-F527 HydrophobicContact CD2-CE2 3.71Å; L431-F527 HydrophobicContact CD2-CG 3.93Å; L431-F527 HydrophobicContact CG-CD2 4.41Å; L431-F527 HydrophobicContact CG-CE2 4.41Å
432	T	82.4	Confident	73.1	Confident	29 Å²	29	44.8 Å²	44.8	18%	0.178	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.4	173.9	54.1	0	0	0	0	111	R336 S430 T459	R336-T432 VanDerWaalsContact NH2-CG2 3.3Å; S430-T432 PolarHBondContact O-N 2.9Å; T432-T459 PolarHBondContact N-O 3.16Å; T432-T459 PolarHBondContact O-N 2.87Å; T432-T459 WeakPolarHBondContact OG1-CB 3.34Å
433	S	82.4	Confident	70.9	Confident	59 Å²	59	50.2 Å²	50.2	41%	0.413	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	148	175	51.3	0	0	0	0	111.2	M457	S433-M457 WeakPolarHBondContact CA-O 3.46Å
434	S	79.5	Confident	68.8	Low	52 Å²	52	59.8 Å²	59.8	36%	0.364	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	141.4	166	58.7	0	0	0	0	109.8	M457	S434-M457 PolarHBondContact N-O 3.3Å; S434-M457 PolarHBondContact O-N 2.99Å
435	V	74.7	Confident	66.7	Low	67 Å²	67	69.1 Å²	69.1	41%	0.406	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.4	179.7	-173.1	0	0	0	0	107.9	F454 R455 F456	V435-F454 HydrophobicContact CG1-CD1 4.4Å; V435-R455 WeakPolarHBondContact CA-O 3.46Å; V435-F456 HydrophobicContact CG1-CD1 4.46Å; V435-F456 HydrophobicContact CG1-CE1 4.13Å; V435-F456 HydrophobicContact CG1-CZ 4.24Å; V435-F456 HydrophobicContact CG2-CD1 3.72Å; V435-F456 HydrophobicContact CG2-CE1 3.65Å
436	Q	69.9	Low	64.5	Low	99 Å²	99	72.4 Å²	72.4	46%	0.463	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.7	175.3	-66.8	179.6	-11.5	0	0	108.9	R455	Q436-R455 HydrophobicContact CB-CB 4.32Å; Q436-R455 PolarHBondContact N-O 3.08Å; Q436-R455 PolarHBondContact O-N 3.12Å
437	T	65.7	Low	62.4	Low	55 Å²	55	80.4 Å²	80.4	34%	0.337	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	118.6	172.8	-53.8	0	0	0	0	109	F452 F454	T437-F452 HydrophobicContact CG2-CD1 3.72Å; T437-F452 HydrophobicContact CG2-CE1 4.36Å; T437-F454 HydrophobicContact CG2-CD1 4.24Å; T437-F454 HydrophobicContact CG2-CE1 3.8Å; T437-F454 HydrophobicContact CG2-CE2 4.34Å; T437-F454 HydrophobicContact CG2-CZ 3.85Å; T437-F454 WeakPolarHBondContact OG1-CE1 3.02Å
438	V	59.9	Low	60.7	Low	38 Å²	38	88.7 Å²	88.7	23%	0.23	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	118.7	178.4	-176.6	0	0	0	0	109.1	N440 L453 R455	V438-N440 PolarHBondContact O-N 2.97Å; V438-L453 PolarHBondContact N-O 2.92Å; V438-L453 PolarHBondContact O-N 3.4Å; V438-R455 HydrophobicContact CG2-CG 4.41Å
439	P	56.5	Low	59.2	Low	63 Å²	63	87.1 Å²	87.1	41%	0.409	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	116.3	170.5	28.8	-32	0	0	0	108.9	Y441 F452	P439-Y441 HydrophobicContact CB-CE2 4.21Å; P439-Y441 HydrophobicContact CG-CE2 4.48Å; P439-F452 HydrophobicContact CB-CE1 4.41Å
440	N	53.4	Low	58	Low	42 Å²	42	88.2 Å²	88.2	23%	0.225	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	93.3	-174.8	-160.1	32.9	0	0	0	110.5	V438 L442 V451 L453	V438-N440 PolarHBondContact O-N 2.97Å; N440-L442 VanDerWaalsContact C-N 3.35Å; N440-L442 WeakPolarHBondContact ND2-CG 3.2Å; N440-L442 PolarHBondContact O-N 2.87Å; N440-V451 VanDerWaalsContact CB-O 3.23Å; N440-V451 WeakPolarHBondContact CB-O 3.21Å; N440-V451 PolarHBondContact N-O 2.95Å; N440-V451 VanDerWaalsContact N-O 3.1Å; N440-L453 HydrophobicContact CB-CB 4.14Å
441	Y	43.2	Very low	57	Low	161 Å²	161	90 Å²	90	63%	0.631	46%	0.462	S	S	*	.			trans	-72.8	86.3	174	-68.2	-81.8	0	0	0	110.3	P439 N443 P450	P439-Y441 HydrophobicContact CB-CE2 4.21Å; P439-Y441 HydrophobicContact CG-CE2 4.48Å; Y441-N443 VanDerWaalsContact C-N 3.33Å; Y441-N443 PolarHBondContact O-N 2.66Å; Y441-P450 HydrophobicContact CD1-CB 3.98Å; Y441-P450 HydrophobicContact CE1-CB 3.95Å; Y441-P450 HydrophobicContact CE1-CG 4.37Å
442	L	38.8	Very low	56.2	Low	96 Å²	96	90 Å²	90	50%	0.503	46%	0.461	S	S	.	.			trans	-75.9	80.8	-177.8	-79	167.7	0	0	0	112.3	N440	N440-L442 VanDerWaalsContact C-N 3.35Å; N440-L442 WeakPolarHBondContact ND2-CG 3.2Å; N440-L442 PolarHBondContact O-N 2.87Å
443	N	38.7	Very low	55.8	Low	113 Å²	113	89.2 Å²	89.2	60%	0.604	46%	0.456	S	S	*	.			trans	69	117.3	173.9	-55.4	-47.9	0	0	0	116	Y441 K445 N446	Y441-N443 VanDerWaalsContact C-N 3.33Å; Y441-N443 PolarHBondContact O-N 2.66Å; N443-K445 PolarHBondContact O-N 2.59Å; N443-N446 PolarHBondContact O-N 2.81Å; N443-N446 VanDerWaalsContact O-N 3.11Å
444	E	41.6	Very low	55.7	Low	208 Å²	208	86.6 Å²	86.6	97%	0.972	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-8.1	172	-56.8	176.9	134.6	0	0	115
445	K	40.4	Very low	55.9	Low	195 Å²	195	88.2 Å²	88.2	85%	0.848	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-12.2	-178	-63.5	-174.6	178.8	180	0	114.1	N443	N443-K445 PolarHBondContact O-N 2.59Å
446	N	36.3	Very low	56.4	Low	101 Å²	101	85.2 Å²	85.2	54%	0.54	42%	0.416	S	S	.	.	S	Bend	trans	-118.3	125.6	178.7	-76.2	-4.6	0	0	0	110.9	N443 Q448	N443-N446 PolarHBondContact O-N 2.81Å; N443-N446 VanDerWaalsContact O-N 3.11Å; N446-Q448 VanDerWaalsContact C-N 3.34Å; N446-Q448 PolarHBondContact O-N 2.88Å
447	Q	40.2	Very low	57.1	Low	168 Å²	168	82 Å²	82	79%	0.785	40%	0.402	S	S	*	.			trans	-80.9	76.4	178.6	-63.6	171.3	-76.7	0	0	110.9
448	Q	45.1	Very low	58.1	Low	174 Å²	174	79.4 Å²	79.4	81%	0.813	39%	0.386	S	S	*	.			trans	-134.3	149.4	168.7	-71.4	-174.1	-41	0	0	109.9	N446	N446-Q448 VanDerWaalsContact C-N 3.34Å; N446-Q448 PolarHBondContact O-N 2.88Å
449	D	50.9	Low	59.4	Low	73 Å²	73	78.5 Å²	78.5	39%	0.39	38%	0.38	S	S	.	.			trans	-57.6	146.7	-171.5	-64.3	-41.6	0	0	0	113.1	V451 K537	D449-V451 PolarHBondContact O-N 2.85Å; D449-V451 VanDerWaalsContact O-N 3.08Å; D449-K537 WeakPolarHBondContact OD2-CE 3.23Å; D449-K537 IonicContact OD2-NZ 3.79Å; D449-K537 PolarHBondContact OD2-NZ 3.46Å
450	P	53.9	Low	60.9	Low	30 Å²	30	75.5 Å²	75.5	20%	0.195	36%	0.361	C	S	.	.			trans	-65.1	112.2	174.8	28.2	-34.3	0	0	0	110.4	Y441 F452 Y651	Y441-P450 HydrophobicContact CD1-CB 3.98Å; Y441-P450 HydrophobicContact CE1-CB 3.95Å; Y441-P450 HydrophobicContact CE1-CG 4.37Å; P450-F452 PolarHBondContact O-N 2.81Å; P450-Y651 VanDerWaalsContact CD-O 3.27Å; P450-Y651 WeakPolarHBondContact CD-O 3.4Å; P450-Y651 WeakPolarHBondContact CG-O 3.31Å
451	V	60.4	Low	62.4	Low	49 Å²	49	80.5 Å²	80.5	30%	0.297	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	119.3	-178.6	-179.6	0	0	0	0	109.4	N440 D449 L453	N440-V451 VanDerWaalsContact CB-O 3.23Å; N440-V451 WeakPolarHBondContact CB-O 3.21Å; N440-V451 PolarHBondContact N-O 2.95Å; N440-V451 VanDerWaalsContact N-O 3.1Å; D449-V451 PolarHBondContact O-N 2.85Å; D449-V451 VanDerWaalsContact O-N 3.08Å; V451-L453 PolarHBondContact O-N 2.99Å
452	F	66.4	Low	64.2	Low	19 Å²	19	73 Å²	73	8%	0.083	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	119.2	172.3	-77.7	-86.4	0	0	0	110.9	T437 P439 P450 F454 S505 S535 Y651	T437-F452 HydrophobicContact CG2-CD1 3.72Å; T437-F452 HydrophobicContact CG2-CE1 4.36Å; P439-F452 HydrophobicContact CB-CE1 4.41Å; P450-F452 PolarHBondContact O-N 2.81Å; F452-F454 HydrophobicContact CB-CD2 4.32Å; F452-F454 HydrophobicContact CB-CE2 3.64Å; F452-F454 HydrophobicContact CB-CZ 4.38Å; F452-S505 VanDerWaalsContact O-CB 3.26Å; F452-S505 WeakPolarHBondContact O-CB 3.47Å; F452-S535 VanDerWaalsContact CD2-O 3.29Å; F452-S535 WeakPolarHBondContact CD2-O 3.34Å; F452-S535 WeakPolarHBondContact CE2-O 3.27Å; F452-Y651 HydrophobicContact CE2-CD1 4.24Å; F452-Y651 HydrophobicContact CE2-CG 4.23Å; F452-Y651 AromaticContact CZ-CD1 3.59Å; F452-Y651 HydrophobicContact CZ-CD1 3.59Å; F452-Y651 AromaticContact CZ-CE1 3.9Å; F452-Y651 HydrophobicContact CZ-CE1 3.9Å; F452-Y651 AromaticContact CZ-CG 3.94Å; F452-Y651 HydrophobicContact CZ-CG 3.94Å
453	L	74.7	Confident	66.2	Low	12 Å²	12	71.9 Å²	71.9	6%	0.063	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	106	179.6	-173.2	72.2	0	0	0	109.8	V438 N440 V451 R455 H485	V438-L453 PolarHBondContact N-O 2.92Å; V438-L453 PolarHBondContact O-N 3.4Å; N440-L453 HydrophobicContact CB-CB 4.14Å; V451-L453 PolarHBondContact O-N 2.99Å; L453-R455 HydrophobicContact CD2-CG 4.41Å; L453-R455 HydrophobicContact CG-CG 4.43Å; L453-R455 PolarHBondContact O-N 3.45Å; L453-H485 HydrophobicContact CD1-CB 3.76Å
454	F	80.1	Confident	68.1	Low	3 Å²	3	68.8 Å²	68.8	1%	0.013	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	110.7	178	-67.9	-101.7	0	0	0	109.2	V435 T437 F452 F456 S503 I504 I533 Y534	V435-F454 HydrophobicContact CG1-CD1 4.4Å; T437-F454 HydrophobicContact CG2-CD1 4.24Å; T437-F454 HydrophobicContact CG2-CE1 3.8Å; T437-F454 HydrophobicContact CG2-CE2 4.34Å; T437-F454 HydrophobicContact CG2-CZ 3.85Å; T437-F454 WeakPolarHBondContact OG1-CE1 3.02Å; F452-F454 HydrophobicContact CB-CD2 4.32Å; F452-F454 HydrophobicContact CB-CE2 3.64Å; F452-F454 HydrophobicContact CB-CZ 4.38Å; F454-F456 HydrophobicContact CB-CE2 4Å; F454-S503 CarbonylContact O-C 3.31Å; F454-S503 VanDerWaalsContact O-CA 3.26Å; F454-S503 WeakPolarHBondContact O-CA 3.31Å; F454-I504 PolarHBondContact N-O 2.85Å; F454-I504 PolarHBondContact O-N 2.94Å; F454-I533 HydrophobicContact CD1-CG1 4.33Å; F454-I533 HydrophobicContact CD2-CG2 3.66Å; F454-I533 HydrophobicContact CE2-CB 4.49Å; F454-I533 HydrophobicContact CE2-CG2 3.66Å; F454-I533 HydrophobicContact CG-CG1 4.23Å; F454-I533 HydrophobicContact CG-CG2 4.17Å; F454-I533 HydrophobicContact CZ-CG2 4.17Å; F454-Y534 HydrophobicContact CE1-CD1 4.03Å; F454-Y534 AromaticContact CE1-CE1 3.82Å; F454-Y534 HydrophobicContact CE1-CE1 3.82Å; F454-Y534 WeakPolarHBondContact CE2-O 3.21Å; F454-Y534 AromaticContact CZ-CD1 3.83Å; F454-Y534 HydrophobicContact CZ-CD1 3.83Å; F454-Y534 HydrophobicContact CZ-CD2 4.26Å; F454-Y534 AromaticContact CZ-CE1 3.88Å; F454-Y534 HydrophobicContact CZ-CE1 3.88Å; F454-Y534 HydrophobicContact CZ-CE2 4.29Å; F454-Y534 HydrophobicContact CZ-CG 4.03Å; F454-Y534 VanDerWaalsContact CZ-N 3.34Å; F454-Y534 VanDerWaalsContact CZ-O 3.32Å; F454-Y534 WeakPolarHBondContact CZ-O 3.38Å
455	R	82.4	Confident	69.9	Low	86 Å²	86	61.6 Å²	61.6	33%	0.325	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	120.2	-179.1	-69.1	-176.5	-178.1	174.5	1.4	110.3	V435 Q436 V438 L453 L500	V435-R455 WeakPolarHBondContact CA-O 3.46Å; Q436-R455 HydrophobicContact CB-CB 4.32Å; Q436-R455 PolarHBondContact N-O 3.08Å; Q436-R455 PolarHBondContact O-N 3.12Å; V438-R455 HydrophobicContact CG2-CG 4.41Å; L453-R455 HydrophobicContact CD2-CG 4.41Å; L453-R455 HydrophobicContact CG-CG 4.43Å; L453-R455 PolarHBondContact O-N 3.45Å; R455-L500 HydrophobicContact CB-CD1 3.71Å; R455-L500 HydrophobicContact CG-CD1 4.03Å
456	F	85.4	Confident	71.7	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.018	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	106.1	177.7	-66.6	-95.2	0	0	0	109.1	V435 F454 F501 M502 I504 M518 I533	V435-F456 HydrophobicContact CG1-CD1 4.46Å; V435-F456 HydrophobicContact CG1-CE1 4.13Å; V435-F456 HydrophobicContact CG1-CZ 4.24Å; V435-F456 HydrophobicContact CG2-CD1 3.72Å; V435-F456 HydrophobicContact CG2-CE1 3.65Å; F454-F456 HydrophobicContact CB-CE2 4Å; F456-F501 PolarHBondContact O-N 2.85Å; F456-M502 HydrophobicContact CB-CB 4.32Å; F456-M502 HydrophobicContact CD2-CB 4.49Å; F456-M502 PolarHBondContact N-O 3.11Å; F456-M502 PolarHBondContact O-N 3.44Å; F456-I504 HydrophobicContact CD2-CD1 3.98Å; F456-I504 HydrophobicContact CD2-CG1 4.09Å; F456-I504 HydrophobicContact CE2-CB 4.4Å; F456-I504 HydrophobicContact CE2-CD1 3.48Å; F456-I504 VanDerWaalsContact CE2-CD1 3.48Å; F456-I504 HydrophobicContact CE2-CG1 3.81Å; F456-I504 HydrophobicContact CZ-CD1 4.19Å; F456-M518 HydrophobicContact CD1-CE 4.15Å; F456-M518 HydrophobicContact CG-CE 4.47Å; F456-I533 HydrophobicContact CZ-CD1 4.3Å
457	M	85.7	Confident	73.6	Confident	32 Å²	32	49 Å²	49	16%	0.158	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	134	175.7	-51.6	-61.3	-67.6	0	0	109.1	S433 S434 T498 K499 L500	S433-M457 WeakPolarHBondContact CA-O 3.46Å; S434-M457 PolarHBondContact N-O 3.3Å; S434-M457 PolarHBondContact O-N 2.99Å; M457-T498 HydrophobicContact CB-CG2 4.09Å; M457-T498 HydrophobicContact CE-CG2 4.04Å; M457-K499 WeakPolarHBondContact CA-O 3.48Å; M457-L500 HydrophobicContact CE-CB 4.08Å; M457-L500 VanDerWaalsContact SD-CA 3.57Å; M457-L500 HydrophobicContact SD-CB 3.72Å; M457-L500 HydrophobicContact SD-CD1 3.63Å; M457-L500 HydrophobicContact SD-CG 4.29Å
458	L	87	Confident	75.4	Confident	1 Å²	1	41 Å²	41	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.4	171.4	-61.8	-177.2	0	0	0	109.2	L431 I468 L493 T498 K499 F501 V520 I529	L431-L458 HydrophobicContact CD1-CB 4.39Å; L431-L458 HydrophobicContact CD2-CD1 4.49Å; L458-I468 HydrophobicContact CD1-CD1 3.39Å; L458-L493 HydrophobicContact CB-CD1 4.21Å; L458-T498 CarbonylContact O-C 3.51Å; L458-T498 WeakPolarHBondContact O-CA 3.11Å; L458-K499 PolarHBondContact N-O 3.49Å; L458-K499 PolarHBondContact O-N 2.84Å; L458-F501 HydrophobicContact CD1-CB 3.89Å; L458-F501 HydrophobicContact CD1-CD2 3.61Å; L458-F501 HydrophobicContact CD1-CE2 4.3Å; L458-F501 HydrophobicContact CD1-CG 3.74Å; L458-F501 HydrophobicContact CG-CB 3.96Å; L458-F501 HydrophobicContact CG-CD2 4.48Å; L458-F501 HydrophobicContact CG-CG 4.37Å; L458-V520 HydrophobicContact CD1-CG1 4.45Å; L458-I529 HydrophobicContact CD2-CD1 3.56Å
459	T	86.2	Confident	76.6	Confident	18 Å²	18	34.9 Å²	34.9	11%	0.11	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	118.5	173.9	-46.9	0	0	0	0	108.5	T432 R461 Q497 T498	T432-T459 PolarHBondContact N-O 3.16Å; T432-T459 PolarHBondContact O-N 2.87Å; T432-T459 WeakPolarHBondContact OG1-CB 3.34Å; T459-R461 HydrophobicContact CG2-CG 4.18Å; T459-Q497 WeakPolarHBondContact CA-O 3.18Å; T459-T498 WeakPolarHBondContact CG2-OG1 3.49Å; T459-T498 PolarHBondContact OG1-OG1 3.01Å; T459-T498 VanDerWaalsContact OG1-OG1 3.09Å
460	N	88	Confident	77.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	122.8	170	-178.3	13.3	0	0	0	109.2	Y462 F464 L466 L493 N496 Q497	N460-Y462 VanDerWaalsContact OD1-CB 3.29Å; N460-Y462 WeakPolarHBondContact OD1-CB 3.41Å; N460-Y462 VanDerWaalsContact OD1-CD2 3.24Å; N460-Y462 WeakPolarHBondContact OD1-CD2 3.49Å; N460-Y462 PolarHBondContact OD1-N 3.34Å; N460-F464 PolarHBondContact ND2-O 2.82Å; N460-L466 PolarHBondContact ND2-N 3.17Å; N460-L493 HydrophobicContact CB-CB 3.97Å; N460-L493 PolarHBondContact ND2-O 3.2Å; N460-N496 WeakPolarHBondContact O-CA 3.46Å; N460-N496 PolarHBondContact O-N 2.93Å; N460-Q497 PolarHBondContact N-O 3.22Å
461	R	84.1	Confident	78.8	Confident	148 Å²	148	35.6 Å²	35.6	56%	0.558	17%	0.17	S	C	*	.			trans	-119.1	20.5	167.2	-58.1	-168.5	174.6	-143.4	0	113.1	G429 S430 T459	G429-R461 WeakPolarHBondContact CA-O 3.3Å; S430-R461 WeakPolarHBondContact O-CB 3.35Å; S430-R461 PolarHBondContact O-N 3.28Å; T459-R461 HydrophobicContact CG2-CG 4.18Å
462	Y	82.4	Confident	79.7	Confident	3 Å²	3	35.8 Å²	35.8	1%	0.012	17%	0.17	C	C	.	.	S	Bend	trans	-73.4	155.1	160	-61.5	-71.2	0	0	0	109.3	N334 V427 Y428 G429 S430 L431 N460 L466 P495 I524 F527	N334-Y462 HydrophobicContact CB-CE1 4Å; V427-Y462 HydrophobicContact CG1-CD1 3.28Å; V427-Y462 HydrophobicContact CG1-CE1 3.43Å; V427-Y462 VanDerWaalsContact CG1-CE1 3.43Å; V427-Y462 HydrophobicContact CG1-CG 4.36Å; Y428-Y462 VanDerWaalsContact O-CD1 3.29Å; Y428-Y462 WeakPolarHBondContact O-CD1 3.28Å; G429-Y462 WeakPolarHBondContact O-CE1 3.33Å; S430-Y462 VanDerWaalsContact CA-CZ 3.46Å; L431-Y462 HydrophobicContact CB-CE2 4.04Å; N460-Y462 VanDerWaalsContact OD1-CB 3.29Å; N460-Y462 WeakPolarHBondContact OD1-CB 3.41Å; N460-Y462 VanDerWaalsContact OD1-CD2 3.24Å; N460-Y462 WeakPolarHBondContact OD1-CD2 3.49Å; N460-Y462 PolarHBondContact OD1-N 3.34Å; Y462-L466 HydrophobicContact CD2-CD1 3.44Å; Y462-L466 VanDerWaalsContact CD2-CD1 3.44Å; Y462-L466 HydrophobicContact CE2-CD1 3.49Å; Y462-L466 VanDerWaalsContact CE2-CD1 3.49Å; Y462-P495 WeakPolarHBondContact O-CB 3.15Å; Y462-I524 HydrophobicContact CD1-CD1 3.94Å; Y462-I524 HydrophobicContact CD2-CD1 3.6Å; Y462-I524 HydrophobicContact CE1-CD1 3.93Å; Y462-I524 HydrophobicContact CE2-CD1 3.56Å; Y462-I524 HydrophobicContact CG-CD1 3.8Å; Y462-F527 AromaticContact CE2-CZ 3.93Å; Y462-F527 HydrophobicContact CE2-CZ 3.93Å; Y462-F527 AromaticContact CZ-CZ 3.99Å; Y462-F527 WeakPolarHBondContact OH-CE1 3.22Å; Y462-F527 VanDerWaalsContact OH-CZ 3.25Å; Y462-F527 WeakPolarHBondContact OH-CZ 3.34Å
463	D	80.2	Confident	80.4	Confident	73 Å²	73	36.2 Å²	36.2	39%	0.39	17%	0.171	S	C	.	.	S	Bend	trans	-75.9	-10.8	175.3	47	7.1	0	0	0	113.2	S400 P495	S400-D463 VanDerWaalsContact CB-OD1 3.3Å; S400-D463 WeakPolarHBondContact CB-OD1 3.48Å; S400-D463 VanDerWaalsContact CB-OD2 3.28Å; S400-D463 WeakPolarHBondContact CB-OD2 3.35Å; S400-D463 PolarHBondContact N-OD2 3.27Å; S400-D463 VanDerWaalsContact OG-CG 3.24Å; S400-D463 PolarHBondContact OG-OD1 2.95Å; S400-D463 PolarHBondContact OG-OD2 2.82Å; S400-D463 VanDerWaalsContact OG-OD2 3.11Å; D463-P495 WeakPolarHBondContact O-CG 3.4Å
464	F	78.9	Confident	80.6	Confident	47 Å²	47	40.6 Å²	40.6	21%	0.206	19%	0.194	C	C	.	.	S	Bend	trans	-119.2	161.5	172.4	60.5	-94.2	0	0	0	113.7	V427 N460 L466 I524	V427-F464 HydrophobicContact CG1-CE1 3.74Å; V427-F464 HydrophobicContact CG1-CZ 3.93Å; V427-F464 HydrophobicContact CG2-CE1 4.09Å; V427-F464 HydrophobicContact CG2-CZ 4.2Å; N460-F464 PolarHBondContact ND2-O 2.82Å; F464-L466 PolarHBondContact O-N 2.79Å; F464-I524 HydrophobicContact CE2-CD1 3.64Å; F464-I524 HydrophobicContact CE2-CG1 3.89Å; F464-I524 HydrophobicContact CZ-CD1 3.51Å; F464-I524 HydrophobicContact CZ-CG1 3.92Å
465	T	80	Confident	80.5	Confident	58 Å²	58	42.6 Å²	42.6	36%	0.356	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-65.7	126.3	178.5	-57.5	0	0	0	0	111.2	E492 L493	T465-E492 HydrophobicContact CG2-CG 3.3Å; T465-E492 WeakPolarHBondContact CG2-OE1 3.42Å; T465-L493 WeakPolarHBondContact CA-O 3.03Å
466	L	77.7	Confident	80	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.5	-176.7	-178.5	150.6	0	0	0	110.4	L431 N460 Y462 F464 I468 L493 I524 F527	L431-L466 HydrophobicContact CD1-CD1 4.44Å; L431-L466 HydrophobicContact CD1-CD2 4.45Å; N460-L466 PolarHBondContact ND2-N 3.17Å; Y462-L466 HydrophobicContact CD2-CD1 3.44Å; Y462-L466 VanDerWaalsContact CD2-CD1 3.44Å; Y462-L466 HydrophobicContact CE2-CD1 3.49Å; Y462-L466 VanDerWaalsContact CE2-CD1 3.49Å; F464-L466 PolarHBondContact O-N 2.79Å; L466-I468 HydrophobicContact CD2-CD1 4.03Å; L466-I468 HydrophobicContact CD2-CG1 3.46Å; L466-I468 VanDerWaalsContact CD2-CG1 3.46Å; L466-L493 HydrophobicContact CD2-CD1 4.18Å; L466-L493 PolarHBondContact N-O 3.16Å; L466-L493 WeakPolarHBondContact O-CB 3.23Å; L466-L493 PolarHBondContact O-N 2.79Å; L466-I524 HydrophobicContact CD1-CD1 3.71Å; L466-I524 HydrophobicContact CD1-CG1 4.29Å; L466-F527 HydrophobicContact CD1-CE2 4.22Å
467	F	76.7	Confident	79.5	Confident	31 Å²	31	46 Å²	46	14%	0.136	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137.1	174.1	-177.4	-106.1	0	0	0	110.6	Y279 N490 S522 S523	Y279-F467 AromaticContact CD2-CE2 3.89Å; Y279-F467 HydrophobicContact CD2-CE2 3.89Å; Y279-F467 HydrophobicContact CD2-CZ 4.08Å; Y279-F467 HydrophobicContact CE2-CE2 4.4Å; Y279-F467 HydrophobicContact CG-CE2 4.24Å; F467-N490 HydrophobicContact CE2-CB 3.89Å; F467-N490 HydrophobicContact CZ-CB 3.58Å; F467-S522 CarbonylContact O-C 3.58Å; F467-S522 WeakPolarHBondContact O-CA 3.37Å; F467-S522 WeakPolarHBondContact O-CB 3.49Å; F467-S523 PolarHBondContact N-OG 3.37Å; F467-S523 VanDerWaalsContact N-OG 3.09Å; F467-S523 PolarHBondContact O-N 2.78Å
468	I	78.2	Confident	79.1	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	108.5	175.7	-60.5	178.6	0	0	0	109	L458 L466 N490 A491 L493 F501 V520 Y521	L458-I468 HydrophobicContact CD1-CD1 3.39Å; L466-I468 HydrophobicContact CD2-CD1 4.03Å; L466-I468 HydrophobicContact CD2-CG1 3.46Å; L466-I468 VanDerWaalsContact CD2-CG1 3.46Å; I468-N490 CarbonylContact O-C 3.49Å; I468-N490 WeakPolarHBondContact O-CA 3.31Å; I468-N490 PolarHBondContact O-N 2.78Å; I468-A491 PolarHBondContact N-O 2.63Å; I468-A491 PolarHBondContact O-N 3.39Å; I468-L493 HydrophobicContact CD1-CD1 3.51Å; I468-L493 HydrophobicContact CG1-CD1 4.25Å; I468-F501 HydrophobicContact CB-CE2 3.69Å; I468-F501 HydrophobicContact CB-CZ 4Å; I468-F501 HydrophobicContact CD1-CD2 3.86Å; I468-F501 HydrophobicContact CD1-CE2 3.5Å; I468-F501 HydrophobicContact CD1-CZ 4.35Å; I468-F501 HydrophobicContact CG1-CE2 4.14Å; I468-F501 HydrophobicContact CG2-CE1 4.44Å; I468-F501 HydrophobicContact CG2-CE2 3.56Å; I468-F501 HydrophobicContact CG2-CZ 3.38Å; I468-V520 HydrophobicContact CB-CG1 4.49Å; I468-V520 HydrophobicContact CD1-CG1 3.91Å; I468-V520 HydrophobicContact CG1-CG1 4.19Å; I468-V520 HydrophobicContact CG2-CG1 3.52Å; I468-Y521 WeakPolarHBondContact CA-O 3.4Å; I468-Y521 WeakPolarHBondContact CG2-O 2.9Å
469	S	68.8	Low	78.3	Confident	45 Å²	45	51.5 Å²	51.5	32%	0.315	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-36.4	-176.3	54.1	0	0	0	0	113.1	N490 Y521	S469-N490 PolarHBondContact O-OD1 3.33Å; S469-Y521 PolarHBondContact N-O 2.77Å; S469-Y521 PolarHBondContact OG-O 3.19Å
470	K	75.5	Confident	77.7	Confident	103 Å²	103	58.4 Å²	58.4	45%	0.448	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	153.3	-175.8	-157.9	-173	177.2	-155.3	0	112.9	D472 Y521	K470-D472 WeakPolarHBondContact CD-OD2 3.44Å; K470-D472 VanDerWaalsContact CE-OD1 3.24Å; K470-D472 WeakPolarHBondContact CE-OD1 3.23Å; K470-D472 WeakPolarHBondContact CE-OD2 2.84Å; K470-D472 IonicContact NZ-OD1 3.78Å; K470-D472 PolarHBondContact NZ-OD1 2.94Å; K470-D472 IonicContact NZ-OD2 3.48Å; K470-D472 PolarHBondContact NZ-OD2 2.96Å; K470-Y521 HydrophobicContact CB-CD2 3.91Å; K470-Y521 HydrophobicContact CB-CG 4.21Å; K470-Y521 PolarHBondContact O-N 3.12Å
471	I	76.2	Confident	77.1	Confident	16 Å²	16	60.7 Å²	60.7	8%	0.082	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.9	157	-65.2	-166.2	0	0	0	110.4	F501 M502 M518 V519 V520	I471-F501 HydrophobicContact CD1-CD1 3.34Å; I471-F501 HydrophobicContact CD1-CE1 3.13Å; I471-F501 HydrophobicContact CD1-CG 4.33Å; I471-F501 HydrophobicContact CD1-CZ 3.94Å; I471-F501 HydrophobicContact CG1-CD1 4.31Å; I471-F501 HydrophobicContact CG1-CE1 3.6Å; I471-F501 HydrophobicContact CG1-CZ 4.12Å; I471-M502 HydrophobicContact CB-CE 4.06Å; I471-M502 HydrophobicContact CD1-CE 3.86Å; I471-M502 HydrophobicContact CG2-CE 3.59Å; I471-M518 HydrophobicContact CD1-CE 4.06Å; I471-M518 HydrophobicContact CD1-SD 4.16Å; I471-M518 HydrophobicContact CG2-CG 3.32Å; I471-M518 HydrophobicContact CG2-SD 3.72Å; I471-V519 VanDerWaalsContact CA-O 3.27Å; I471-V519 WeakPolarHBondContact CA-O 3.22Å; I471-V520 HydrophobicContact CD1-CB 4.49Å; I471-V520 HydrophobicContact CD1-CG1 4.28Å; I471-V520 HydrophobicContact CD1-CG2 3.79Å; I471-V520 HydrophobicContact CG1-CB 4.35Å; I471-V520 HydrophobicContact CG1-CG1 4.15Å; I471-V520 HydrophobicContact CG1-CG2 4.09Å
472	D	79.8	Confident	76.7	Confident	53 Å²	53	54 Å²	54	28%	0.283	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	165.7	166	-71.7	-61.7	0	0	0	111.2	K470 V519 Y521	K470-D472 WeakPolarHBondContact CD-OD2 3.44Å; K470-D472 VanDerWaalsContact CE-OD1 3.24Å; K470-D472 WeakPolarHBondContact CE-OD1 3.23Å; K470-D472 WeakPolarHBondContact CE-OD2 2.84Å; K470-D472 IonicContact NZ-OD1 3.78Å; K470-D472 PolarHBondContact NZ-OD1 2.94Å; K470-D472 IonicContact NZ-OD2 3.48Å; K470-D472 PolarHBondContact NZ-OD2 2.96Å; D472-V519 PolarHBondContact N-O 3.02Å; D472-V519 PolarHBondContact O-N 2.92Å; D472-Y521 HydrophobicContact CB-CE2 4.32Å; D472-Y521 WeakPolarHBondContact OD2-CE2 3.48Å
473	F	81.5	Confident	76.5	Confident	28 Å²	28	58.8 Å²	58.8	12%	0.123	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	131.6	166	-61.5	-72	0	0	0	110.2	T475 I484 M502 I504 M518 Y531	F473-T475 PolarHBondContact O-N 2.83Å; F473-T475 VanDerWaalsContact O-N 3.13Å; F473-I484 HydrophobicContact CE2-CD1 4.06Å; F473-I484 HydrophobicContact CZ-CD1 4.46Å; F473-M502 HydrophobicContact CZ-SD 3.98Å; F473-I504 HydrophobicContact CE1-CD1 4.18Å; F473-I504 HydrophobicContact CZ-CD1 4.03Å; F473-M518 HydrophobicContact CD1-CB 4.3Å; F473-M518 HydrophobicContact CD1-CG 4.3Å; F473-M518 HydrophobicContact CE1-CB 4.42Å; F473-M518 HydrophobicContact CE1-CG 4.17Å; F473-M518 HydrophobicContact CE1-SD 4.24Å; F473-Y531 AromaticContact CD1-CE1 3.75Å; F473-Y531 HydrophobicContact CD1-CE1 3.75Å; F473-Y531 HydrophobicContact CE1-CE1 4.13Å
474	L	78.4	Confident	76.3	Confident	103 Å²	103	58.6 Å²	58.6	54%	0.539	30%	0.298	S	S	.	.	S	Bend	trans	-66.3	-14.2	177.7	-164.5	70.5	0	0	0	112.7	I517 V519	L474-I517 HydrophobicContact CB-CB 4.12Å; L474-I517 HydrophobicContact CB-CG2 4.47Å; L474-I517 WeakPolarHBondContact CB-O 3.47Å; L474-I517 HydrophobicContact CD2-CB 4.01Å; L474-I517 HydrophobicContact CD2-CD1 4.13Å; L474-I517 HydrophobicContact CD2-CG2 4.26Å; L474-I517 PolarHBondContact N-O 3.45Å; L474-V519 HydrophobicContact CB-CG2 4.23Å; L474-V519 HydrophobicContact CD1-CG2 4.18Å
475	T	77.6	Confident	75.9	Confident	45 Å²	45	59.9 Å²	59.9	28%	0.276	31%	0.305	S	S	.	.	S	Bend	trans	-121.1	96	177.1	-52.3	0	0	0	0	108.4	F473 S477 H478	F473-T475 PolarHBondContact O-N 2.83Å; F473-T475 VanDerWaalsContact O-N 3.13Å; T475-S477 VanDerWaalsContact C-N 3.28Å; T475-S477 PolarHBondContact O-N 2.78Å; T475-H478 WeakPolarHBondContact O-CB 2.99Å; T475-H478 PolarHBondContact O-N 3.43Å; T475-H478 VanDerWaalsContact O-N 3.12Å
476	P	71.7	Confident	75.3	Confident	94 Å²	94	60.9 Å²	60.9	61%	0.61	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-64.7	-29.8	-167.8	23	-33.4	0	0	0	113.4	H478 K479	P476-H478 PolarHBondContact O-N 2.8Å; P476-K479 WeakPolarHBondContact O-CB 3.08Å; P476-K479 PolarHBondContact O-N 3.47Å
477	S	74.8	Confident	75.1	Confident	69 Å²	69	64 Å²	64	48%	0.483	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-60.7	-25.8	176.2	52.7	0	0	0	0	113.7	T475 K479 Y480	T475-S477 VanDerWaalsContact C-N 3.28Å; T475-S477 PolarHBondContact O-N 2.78Å; S477-K479 PolarHBondContact O-N 2.77Å; S477-Y480 PolarHBondContact O-N 2.9Å
478	H	77.2	Confident	74.7	Confident	10 Å²	10	64.6 Å²	64.6	5%	0.046	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-68.8	-20.9	175.7	-63.8	178.5	0	0	0	112.7	T475 P476 Y480 L481 L482 H515 Y531	T475-H478 WeakPolarHBondContact O-CB 2.99Å; T475-H478 PolarHBondContact O-N 3.43Å; T475-H478 VanDerWaalsContact O-N 3.12Å; P476-H478 PolarHBondContact O-N 2.8Å; H478-Y480 PolarHBondContact O-N 3.29Å; H478-L481 PolarHBondContact O-N 2.93Å; H478-L481 VanDerWaalsContact O-N 3.09Å; H478-L482 HydrophobicContact CB-CD1 4.08Å; H478-L482 WeakPolarHBondContact O-CB 3.45Å; H478-L482 WeakPolarHBondContact O-CG 3.18Å; H478-L482 PolarHBondContact O-N 3.48Å; H478-H515 PolarHBondContact CE1-O 2.99Å; H478-Y531 AromaticContact ND1-CZ 3.87Å; H478-Y531 PolarHBondContact ND1-OH 3.27Å
479	K	70.4	Confident	74	Confident	138 Å²	138	69 Å²	69	60%	0.6	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-61.5	-26.3	178.8	-170.1	-178.8	175.9	-175.1	0	113.1	P476 S477	P476-K479 WeakPolarHBondContact O-CB 3.08Å; P476-K479 PolarHBondContact O-N 3.47Å; S477-K479 PolarHBondContact O-N 2.77Å
480	Y	73.7	Confident	73.9	Confident	162 Å²	162	68.9 Å²	68.9	64%	0.635	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-92.6	-12.6	178.8	-50.5	-90	0	0	0	113.1	S477 H478	S477-Y480 PolarHBondContact O-N 2.9Å; H478-Y480 PolarHBondContact O-N 3.29Å
481	L	74.9	Confident	73.7	Confident	48 Å²	48	64 Å²	64	25%	0.251	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-8.7	-178	-55.4	175.9	0	0	0	112.6	H478 V507 I511 L514	H478-L481 PolarHBondContact O-N 2.93Å; H478-L481 VanDerWaalsContact O-N 3.09Å; L481-V507 PolarHBondContact O-N 2.84Å; L481-I511 HydrophobicContact CB-CD1 4.46Å; L481-I511 HydrophobicContact CD1-CD1 3.85Å; L481-I511 HydrophobicContact CD2-CD1 3.85Å; L481-I511 HydrophobicContact CG-CD1 4.26Å; L481-L514 HydrophobicContact CB-CD1 3.91Å; L481-L514 HydrophobicContact CD1-CD2 4.07Å
482	L	76.9	Confident	73.8	Confident	9 Å²	9	68.6 Å²	68.6	5%	0.047	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	124.9	-171.5	-69.4	175.3	0	0	0	111	H478 I504 S505 I506 L514 Y531 I533	H478-L482 HydrophobicContact CB-CD1 4.08Å; H478-L482 WeakPolarHBondContact O-CB 3.45Å; H478-L482 WeakPolarHBondContact O-CG 3.18Å; H478-L482 PolarHBondContact O-N 3.48Å; L482-I504 HydrophobicContact CB-CG2 3.68Å; L482-I504 HydrophobicContact CD1-CG2 4.26Å; L482-I504 HydrophobicContact CD2-CG2 3.89Å; L482-I504 HydrophobicContact CG-CG2 4.15Å; L482-S505 CarbonylContact C-O 3.59Å; L482-S505 VanDerWaalsContact CA-O 3.26Å; L482-S505 WeakPolarHBondContact CA-O 3.34Å; L482-I506 HydrophobicContact CD2-CG1 4.29Å; L482-L514 HydrophobicContact CD2-CD1 3.57Å; L482-L514 HydrophobicContact CG-CD1 3.97Å; L482-Y531 HydrophobicContact CD1-CE2 4.48Å; L482-I533 HydrophobicContact CD1-CD1 4.36Å; L482-I533 HydrophobicContact CD2-CD1 3.96Å; L482-I533 HydrophobicContact CD2-CG2 4.29Å
483	Q	76.9	Confident	73.8	Confident	102 Å²	102	66 Å²	66	48%	0.477	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	108.4	174.1	-175.6	176.6	6.6	0	0	110.1	H485 I504 S505 V507	Q483-H485 VanDerWaalsContact CD-CE1 3.47Å; Q483-H485 PolarHBondContact O-N 2.89Å; Q483-H485 PolarHBondContact O-ND1 3.47Å; Q483-I504 WeakPolarHBondContact O-CA 3.35Å; Q483-S505 PolarHBondContact N-O 2.87Å; Q483-S505 PolarHBondContact O-N 2.85Å; Q483-V507 HydrophobicContact CB-CG2 3.59Å
484	I	76.7	Confident	73.9	Confident	69 Å²	69	69.1 Å²	69.1	35%	0.354	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	107.3	174.1	-52.5	175.5	0	0	0	108.2	F473 H486 H487 M502 S503	F473-I484 HydrophobicContact CE2-CD1 4.06Å; F473-I484 HydrophobicContact CZ-CD1 4.46Å; I484-H486 WeakPolarHBondContact CG2-O 3.38Å; I484-H487 HydrophobicContact CG2-CB 3.85Å; I484-M502 HydrophobicContact CD1-SD 4.46Å; I484-M502 HydrophobicContact CG1-SD 4.49Å; I484-M502 HydrophobicContact CG2-CG 3.9Å; I484-M502 HydrophobicContact CG2-SD 4.14Å; I484-S503 CarbonylContact C-O 3.6Å
485	H	71	Confident	74.1	Confident	74 Å²	74	66.1 Å²	66.1	34%	0.343	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-28.7	-179.1	-79.7	64.2	0	0	0	112.7	L453 Q483 S503 S505	L453-H485 HydrophobicContact CD1-CB 3.76Å; Q483-H485 VanDerWaalsContact CD-CE1 3.47Å; Q483-H485 PolarHBondContact O-N 2.89Å; Q483-H485 PolarHBondContact O-ND1 3.47Å; H485-S503 WeakPolarHBondContact CB-OG 3.39Å; H485-S503 PolarHBondContact N-O 2.59Å; H485-S505 PolarHBondContact CE1-OG 3.48Å
486	H	67.9	Low	74.4	Confident	80 Å²	80	69.7 Å²	69.7	37%	0.37	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	141.1	175.4	-173.2	74	0	0	0	108.8	I484 I488 M502 S503	I484-H486 WeakPolarHBondContact CG2-O 3.38Å; H486-I488 WeakPolarHBondContact NE2-CG1 3.21Å; H486-M502 CarbonylContact O-C 3.54Å; H486-M502 VanDerWaalsContact O-CA 3.25Å; H486-M502 WeakPolarHBondContact O-CA 3.29Å; H486-M502 WeakPolarHBondContact O-CG 3.38Å; H486-S503 VanDerWaalsContact CB-OG 3.3Å; H486-S503 WeakPolarHBondContact CB-OG 3.32Å; H486-S503 PolarHBondContact N-O 2.88Å; H486-S503 PolarHBondContact N-OG 2.91Å; H486-S503 PolarHBondContact O-N 2.83Å
487	H	73.3	Confident	75	Confident	65 Å²	65	68.6 Å²	68.6	30%	0.301	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	131.6	175.7	-174.9	-63.8	0	0	0	108.7	I484 T489 F501 M502	I484-H487 HydrophobicContact CG2-CB 3.85Å; H487-T489 PolarHBondContact ND1-N 3.23Å; H487-F501 WeakPolarHBondContact CA-O 3.4Å; H487-M502 VanDerWaalsContact CD2-CE 3.43Å; H487-M502 WeakPolarHBondContact CD2-CE 3.47Å
488	I	67.2	Low	75.5	Confident	43 Å²	43	68.9 Å²	68.9	22%	0.221	34%	0.34	C	S	.	.			trans	-104.8	113.9	170.1	-48.1	-176	0	0	0	108.4	H486 A491 K499 L500 F501	H486-I488 WeakPolarHBondContact NE2-CG1 3.21Å; I488-A491 HydrophobicContact CB-CB 4.18Å; I488-A491 HydrophobicContact CG2-CB 3.56Å; I488-K499 HydrophobicContact CD1-CD 4.47Å; I488-L500 VanDerWaalsContact CD1-O 3.23Å; I488-L500 WeakPolarHBondContact CD1-O 3.13Å; I488-F501 PolarHBondContact N-O 2.93Å; I488-F501 WeakPolarHBondContact O-CE1 3.33Å; I488-F501 WeakPolarHBondContact O-CZ 3.13Å
489	T	64.6	Low	75.8	Confident	93 Å²	93	71.3 Å²	71.3	57%	0.571	35%	0.351	S	S	*	.	S	Bend	trans	-85.3	154.2	162.9	41.1	0	0	0	0	109.8	H487 A491	H487-T489 PolarHBondContact ND1-N 3.23Å; T489-A491 PolarHBondContact O-N 3.14Å
490	N	65.2	Low	76.4	Confident	43 Å²	43	67 Å²	67	23%	0.23	33%	0.334	C	S	.	.	S	Bend	trans	53.8	50.6	174.1	-60.3	35.6	0	0	0	111.8	D277 Y279 F467 I468 S469	D277-N490 PolarHBondContact OD1-ND2 2.86Å; Y279-N490 HydrophobicContact CD2-CB 4.35Å; Y279-N490 HydrophobicContact CE2-CB 3.94Å; F467-N490 HydrophobicContact CE2-CB 3.89Å; F467-N490 HydrophobicContact CZ-CB 3.58Å; I468-N490 CarbonylContact O-C 3.49Å; I468-N490 WeakPolarHBondContact O-CA 3.31Å; I468-N490 PolarHBondContact O-N 2.78Å; S469-N490 PolarHBondContact O-OD1 3.33Å
491	A	72.4	Confident	76.6	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.008	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	125.1	-174.2	0	0	0	0	0	111.8	I468 I488 T489 F501	I468-A491 PolarHBondContact N-O 2.63Å; I468-A491 PolarHBondContact O-N 3.39Å; I488-A491 HydrophobicContact CB-CB 4.18Å; I488-A491 HydrophobicContact CG2-CB 3.56Å; T489-A491 PolarHBondContact O-N 3.14Å; A491-F501 HydrophobicContact CB-CD2 4.21Å; A491-F501 HydrophobicContact CB-CE2 3.57Å; A491-F501 HydrophobicContact CB-CZ 4.34Å
492	E	77.9	Confident	77	Confident	111 Å²	111	57.2 Å²	57.2	52%	0.519	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	137.3	166.2	-165.7	173.4	-155.9	0	0	111.2	T465 K499	T465-E492 HydrophobicContact CG2-CG 3.3Å; T465-E492 WeakPolarHBondContact CG2-OE1 3.42Å; E492-K499 PolarHBondContact O-NZ 3.48Å
493	L	80.1	Confident	77.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	106.3	178.7	-76.7	166.9	0	0	0	110.7	L431 L458 N460 T465 L466 I468 K499	L431-L493 HydrophobicContact CD1-CD1 4.22Å; L458-L493 HydrophobicContact CB-CD1 4.21Å; N460-L493 HydrophobicContact CB-CB 3.97Å; N460-L493 PolarHBondContact ND2-O 3.2Å; T465-L493 WeakPolarHBondContact CA-O 3.03Å; L466-L493 HydrophobicContact CD2-CD1 4.18Å; L466-L493 PolarHBondContact N-O 3.16Å; L466-L493 WeakPolarHBondContact O-CB 3.23Å; L466-L493 PolarHBondContact O-N 2.79Å; I468-L493 HydrophobicContact CD1-CD1 3.51Å; I468-L493 HydrophobicContact CG1-CD1 4.25Å; L493-K499 HydrophobicContact CD2-CB 3.48Å; L493-K499 VanDerWaalsContact CD2-CB 3.48Å; L493-K499 HydrophobicContact CD2-CD 3.87Å; L493-K499 HydrophobicContact CD2-CG 4.35Å
494	I	83.9	Confident	77.8	Confident	92 Å²	92	52.2 Å²	52.2	47%	0.472	27%	0.27	S	S	.	.			trans	-66.5	151.2	177.8	-60.9	172.1	0	0	0	109.9	N496 Q497	I494-N496 PolarHBondContact O-N 3.1Å; I494-Q497 HydrophobicContact CB-CB 4.15Å; I494-Q497 WeakPolarHBondContact O-CB 3.34Å; I494-Q497 PolarHBondContact O-N 3.31Å
495	P	81.8	Confident	77.9	Confident	41 Å²	41	49 Å²	49	27%	0.266	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	136.7	173.9	-33.2	38.9	0	0	0	113.8	Y462 D463 Q497	Y462-P495 WeakPolarHBondContact O-CB 3.15Å; D463-P495 WeakPolarHBondContact O-CG 3.4Å; P495-Q497 PolarHBondContact O-N 3.3Å
496	N	83.7	Confident	78.2	Confident	120 Å²	120	46.6 Å²	46.6	64%	0.642	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	3.2	-173.5	-62.6	-57.1	0	0	0	116.3	N460 I494	N460-N496 WeakPolarHBondContact O-CA 3.46Å; N460-N496 PolarHBondContact O-N 2.93Å; I494-N496 PolarHBondContact O-N 3.1Å
497	Q	85.5	Confident	78.3	Confident	71 Å²	71	46.7 Å²	46.7	33%	0.332	25%	0.249	S	C	.	.			trans	-73.9	132.3	176.3	-166.5	-179.7	33.6	0	0	111.3	T459 N460 I494 P495	T459-Q497 WeakPolarHBondContact CA-O 3.18Å; N460-Q497 PolarHBondContact N-O 3.22Å; I494-Q497 HydrophobicContact CB-CB 4.15Å; I494-Q497 WeakPolarHBondContact O-CB 3.34Å; I494-Q497 PolarHBondContact O-N 3.31Å; P495-Q497 PolarHBondContact O-N 3.3Å
498	T	84.2	Confident	78	Confident	74 Å²	74	45.8 Å²	45.8	45%	0.454	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.5	168.6	-54.8	0	0	0	0	109.8	M457 L458 T459	M457-T498 HydrophobicContact CB-CG2 4.09Å; M457-T498 HydrophobicContact CE-CG2 4.04Å; L458-T498 CarbonylContact O-C 3.51Å; L458-T498 WeakPolarHBondContact O-CA 3.11Å; T459-T498 WeakPolarHBondContact CG2-OG1 3.49Å; T459-T498 PolarHBondContact OG1-OG1 3.01Å; T459-T498 VanDerWaalsContact OG1-OG1 3.09Å
499	K	83.6	Confident	77.8	Confident	62 Å²	62	49.3 Å²	49.3	27%	0.27	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	139.4	-177.3	-153.7	174.9	-169.3	174.1	0	110.1	M457 L458 I488 E492 L493 F501	M457-K499 WeakPolarHBondContact CA-O 3.48Å; L458-K499 PolarHBondContact N-O 3.49Å; L458-K499 PolarHBondContact O-N 2.84Å; I488-K499 HydrophobicContact CD1-CD 4.47Å; E492-K499 PolarHBondContact O-NZ 3.48Å; L493-K499 HydrophobicContact CD2-CB 3.48Å; L493-K499 VanDerWaalsContact CD2-CB 3.48Å; L493-K499 HydrophobicContact CD2-CD 3.87Å; L493-K499 HydrophobicContact CD2-CG 4.35Å; K499-F501 PolarHBondContact O-N 3.21Å
500	L	82.9	Confident	77.8	Confident	48 Å²	48	53 Å²	53	25%	0.251	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	122.2	164.6	176.8	65.1	0	0	0	107.4	R455 M457 I488 M502	R455-L500 HydrophobicContact CB-CD1 3.71Å; R455-L500 HydrophobicContact CG-CD1 4.03Å; M457-L500 HydrophobicContact CE-CB 4.08Å; M457-L500 VanDerWaalsContact SD-CA 3.57Å; M457-L500 HydrophobicContact SD-CB 3.72Å; M457-L500 HydrophobicContact SD-CD1 3.63Å; M457-L500 HydrophobicContact SD-CG 4.29Å; I488-L500 VanDerWaalsContact CD1-O 3.23Å; I488-L500 WeakPolarHBondContact CD1-O 3.13Å; L500-M502 WeakPolarHBondContact CD1-O 3.47Å
501	F	78.3	Confident	77.8	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.009	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-43.7	-177.9	-163.8	-74.8	0	0	0	112	F456 L458 I468 I471 H487 I488 A491 K499	F456-F501 PolarHBondContact O-N 2.85Å; L458-F501 HydrophobicContact CD1-CB 3.89Å; L458-F501 HydrophobicContact CD1-CD2 3.61Å; L458-F501 HydrophobicContact CD1-CE2 4.3Å; L458-F501 HydrophobicContact CD1-CG 3.74Å; L458-F501 HydrophobicContact CG-CB 3.96Å; L458-F501 HydrophobicContact CG-CD2 4.48Å; L458-F501 HydrophobicContact CG-CG 4.37Å; I468-F501 HydrophobicContact CB-CE2 3.69Å; I468-F501 HydrophobicContact CB-CZ 4Å; I468-F501 HydrophobicContact CD1-CD2 3.86Å; I468-F501 HydrophobicContact CD1-CE2 3.5Å; I468-F501 HydrophobicContact CD1-CZ 4.35Å; I468-F501 HydrophobicContact CG1-CE2 4.14Å; I468-F501 HydrophobicContact CG2-CE1 4.44Å; I468-F501 HydrophobicContact CG2-CE2 3.56Å; I468-F501 HydrophobicContact CG2-CZ 3.38Å; I471-F501 HydrophobicContact CD1-CD1 3.34Å; I471-F501 HydrophobicContact CD1-CE1 3.13Å; I471-F501 HydrophobicContact CD1-CG 4.33Å; I471-F501 HydrophobicContact CD1-CZ 3.94Å; I471-F501 HydrophobicContact CG1-CD1 4.31Å; I471-F501 HydrophobicContact CG1-CE1 3.6Å; I471-F501 HydrophobicContact CG1-CZ 4.12Å; H487-F501 WeakPolarHBondContact CA-O 3.4Å; I488-F501 PolarHBondContact N-O 2.93Å; I488-F501 WeakPolarHBondContact O-CE1 3.33Å; I488-F501 WeakPolarHBondContact O-CZ 3.13Å; A491-F501 HydrophobicContact CB-CD2 4.21Å; A491-F501 HydrophobicContact CB-CE2 3.57Å; A491-F501 HydrophobicContact CB-CZ 4.34Å; K499-F501 PolarHBondContact O-N 3.21Å
502	M	83.6	Confident	77.6	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	149.3	178.5	-155.7	-179.1	-54.2	0	0	110.9	F456 I471 F473 I484 H486 H487 L500 I504 M518	F456-M502 HydrophobicContact CB-CB 4.32Å; F456-M502 HydrophobicContact CD2-CB 4.49Å; F456-M502 PolarHBondContact N-O 3.11Å; F456-M502 PolarHBondContact O-N 3.44Å; I471-M502 HydrophobicContact CB-CE 4.06Å; I471-M502 HydrophobicContact CD1-CE 3.86Å; I471-M502 HydrophobicContact CG2-CE 3.59Å; F473-M502 HydrophobicContact CZ-SD 3.98Å; I484-M502 HydrophobicContact CD1-SD 4.46Å; I484-M502 HydrophobicContact CG1-SD 4.49Å; I484-M502 HydrophobicContact CG2-CG 3.9Å; I484-M502 HydrophobicContact CG2-SD 4.14Å; H486-M502 CarbonylContact O-C 3.54Å; H486-M502 VanDerWaalsContact O-CA 3.25Å; H486-M502 WeakPolarHBondContact O-CA 3.29Å; H486-M502 WeakPolarHBondContact O-CG 3.38Å; H487-M502 VanDerWaalsContact CD2-CE 3.43Å; H487-M502 WeakPolarHBondContact CD2-CE 3.47Å; L500-M502 WeakPolarHBondContact CD1-O 3.47Å; M502-I504 HydrophobicContact CG-CD1 4.31Å; M502-I504 HydrophobicContact CG-CG1 3.94Å; M502-I504 HydrophobicContact SD-CD1 3.56Å; M502-I504 VanDerWaalsContact SD-CD1 3.56Å; M502-I504 HydrophobicContact SD-CG1 3.77Å; M502-M518 HydrophobicContact CE-SD 3.64Å; M502-M518 HydrophobicContact SD-SD 4.3Å
503	S	84.1	Confident	77.6	Confident	7 Å²	7	52.7 Å²	52.7	5%	0.049	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.8	162.5	68.2	0	0	0	0	111.1	F454 I484 H485 H486	F454-S503 CarbonylContact O-C 3.31Å; F454-S503 VanDerWaalsContact O-CA 3.26Å; F454-S503 WeakPolarHBondContact O-CA 3.31Å; I484-S503 CarbonylContact C-O 3.6Å; H485-S503 WeakPolarHBondContact CB-OG 3.39Å; H485-S503 PolarHBondContact N-O 2.59Å; H486-S503 VanDerWaalsContact CB-OG 3.3Å; H486-S503 WeakPolarHBondContact CB-OG 3.32Å; H486-S503 PolarHBondContact N-O 2.88Å; H486-S503 PolarHBondContact N-OG 2.91Å; H486-S503 PolarHBondContact O-N 2.83Å
504	I	85.1	Confident	77.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	144.5	-166.8	-39.6	178.9	0	0	0	110.2	F454 F456 F473 L482 Q483 M502 I533	F454-I504 PolarHBondContact N-O 2.85Å; F454-I504 PolarHBondContact O-N 2.94Å; F456-I504 HydrophobicContact CD2-CD1 3.98Å; F456-I504 HydrophobicContact CD2-CG1 4.09Å; F456-I504 HydrophobicContact CE2-CB 4.4Å; F456-I504 HydrophobicContact CE2-CD1 3.48Å; F456-I504 VanDerWaalsContact CE2-CD1 3.48Å; F456-I504 HydrophobicContact CE2-CG1 3.81Å; F456-I504 HydrophobicContact CZ-CD1 4.19Å; F473-I504 HydrophobicContact CE1-CD1 4.18Å; F473-I504 HydrophobicContact CZ-CD1 4.03Å; L482-I504 HydrophobicContact CB-CG2 3.68Å; L482-I504 HydrophobicContact CD1-CG2 4.26Å; L482-I504 HydrophobicContact CD2-CG2 3.89Å; L482-I504 HydrophobicContact CG-CG2 4.15Å; Q483-I504 WeakPolarHBondContact O-CA 3.35Å; M502-I504 HydrophobicContact CG-CD1 4.31Å; M502-I504 HydrophobicContact CG-CG1 3.94Å; M502-I504 HydrophobicContact SD-CD1 3.56Å; M502-I504 VanDerWaalsContact SD-CD1 3.56Å; M502-I504 HydrophobicContact SD-CG1 3.77Å; I504-I533 HydrophobicContact CB-CD1 4.47Å; I504-I533 HydrophobicContact CD1-CD1 4.36Å; I504-I533 HydrophobicContact CG2-CD1 4.42Å
505	S	79.1	Confident	77.4	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	171.6	163.5	71.7	0	0	0	0	111.6	F452 L482 Q483 H485	F452-S505 VanDerWaalsContact O-CB 3.26Å; F452-S505 WeakPolarHBondContact O-CB 3.47Å; L482-S505 CarbonylContact C-O 3.59Å; L482-S505 VanDerWaalsContact CA-O 3.26Å; L482-S505 WeakPolarHBondContact CA-O 3.34Å; Q483-S505 PolarHBondContact N-O 2.87Å; Q483-S505 PolarHBondContact O-N 2.85Å; H485-S505 PolarHBondContact CE1-OG 3.48Å
506	I	77	Confident	77.5	Confident	24 Å²	24	52.5 Å²	52.5	12%	0.123	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	141.9	169.1	-54.9	-171.6	0	0	0	109.4	L482 I511 L514 I533	L482-I506 HydrophobicContact CD2-CG1 4.29Å; I506-I511 HydrophobicContact CD1-CG2 4.45Å; I506-I511 HydrophobicContact CG2-CB 4.12Å; I506-I511 HydrophobicContact CG2-CG2 4.33Å; I506-L514 HydrophobicContact CD1-CD1 4.23Å; I506-L514 HydrophobicContact CD1-CG 4.34Å; I506-L514 HydrophobicContact CG1-CD1 4.22Å; I506-L514 HydrophobicContact CG2-CD1 4.41Å; I506-I533 HydrophobicContact CD1-CG2 3.95Å; I506-I533 HydrophobicContact CG1-CG2 3.61Å
507	V	72	Confident	77.5	Confident	83 Å²	83	49.6 Å²	49.6	50%	0.503	24%	0.244	S	C	.	.			trans	-95.8	-44.6	176.4	-179.4	0	0	0	0	112.8	L481 Q483 N509	L481-V507 PolarHBondContact O-N 2.84Å; Q483-V507 HydrophobicContact CB-CG2 3.59Å; V507-N509 PolarHBondContact O-N 3.07Å
508	D	66.8	Low	77.4	Confident	46 Å²	46	46.3 Å²	46.3	25%	0.246	23%	0.229	C	C	.	.			trans	-78.6	116.4	-175.2	-170.4	-16.1	0	0	0	111	R510 I511	D508-R510 PolarHBondContact O-N 3.19Å; D508-R510 VanDerWaalsContact O-N 3.16Å; D508-R510 WeakPolarHBondContact OD1-CB 3.13Å; D508-R510 PolarHBondContact OD1-N 3.33Å; D508-R510 IonicContact OD1-NE 3.98Å; D508-R510 IonicContact OD2-NE 2.68Å; D508-R510 IonicContact OD2-NH2 3.71Å; D508-I511 HydrophobicContact CB-CB 4.42Å; D508-I511 HydrophobicContact CB-CD1 3.89Å; D508-I511 HydrophobicContact CB-CG1 3.91Å; D508-I511 PolarHBondContact O-N 3.02Å
509	N	62.8	Low	77.4	Confident	116 Å²	116	43.1 Å²	43.1	62%	0.62	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.5	176.6	-81.2	-27.6	0	0	0	114.1	V507 I511 K537	V507-N509 PolarHBondContact O-N 3.07Å; N509-I511 VanDerWaalsContact C-N 3.29Å; N509-K537 PolarHBondContact OD1-NZ 3.24Å
510	R	63.5	Low	77.3	Confident	171 Å²	171	40.2 Å²	40.2	65%	0.645	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-13.5	176	-66.9	176.4	-70.7	-161.3	-7.9	113	D508 D714	D508-R510 PolarHBondContact O-N 3.19Å; D508-R510 VanDerWaalsContact O-N 3.16Å; D508-R510 WeakPolarHBondContact OD1-CB 3.13Å; D508-R510 PolarHBondContact OD1-N 3.33Å; D508-R510 IonicContact OD1-NE 3.98Å; D508-R510 IonicContact OD2-NE 2.68Å; D508-R510 IonicContact OD2-NH2 3.71Å; R510-D714 IonicContact CZ-OD2 2.7Å; R510-D714 IonicContact NH1-OD2 2.71Å; R510-D714 PolarHBondContact NH1-OD2 3.27Å
511	I	66.6	Low	77.1	Confident	35 Å²	35	42.2 Å²	42.2	18%	0.179	20%	0.201	C	C	.	.			trans	-99.3	111.9	-173.9	-58.9	-175.9	0	0	0	110.8	L481 I506 D508 N509 L514 S535	L481-I511 HydrophobicContact CB-CD1 4.46Å; L481-I511 HydrophobicContact CD1-CD1 3.85Å; L481-I511 HydrophobicContact CD2-CD1 3.85Å; L481-I511 HydrophobicContact CG-CD1 4.26Å; I506-I511 HydrophobicContact CD1-CG2 4.45Å; I506-I511 HydrophobicContact CG2-CB 4.12Å; I506-I511 HydrophobicContact CG2-CG2 4.33Å; D508-I511 HydrophobicContact CB-CB 4.42Å; D508-I511 HydrophobicContact CB-CD1 3.89Å; D508-I511 HydrophobicContact CB-CG1 3.91Å; D508-I511 PolarHBondContact O-N 3.02Å; N509-I511 VanDerWaalsContact C-N 3.29Å; I511-L514 HydrophobicContact CG2-CD1 4.23Å; I511-L514 HydrophobicContact CG2-CD2 3.94Å; I511-L514 HydrophobicContact CG2-CG 3.72Å; I511-S535 PolarHBondContact O-OG 2.93Å
512	T	67.8	Low	77	Confident	24 Å²	24	42.7 Å²	42.7	15%	0.147	21%	0.205	C	C	.	.			trans	-82.9	-30.6	178.2	49.2	0	0	0	0	113.3	Y534 S535 L572 N573	T512-Y534 WeakPolarHBondContact O-CA 3.39Å; T512-Y534 WeakPolarHBondContact O-CB 3.29Å; T512-S535 WeakPolarHBondContact CA-OG 3.37Å; T512-S535 PolarHBondContact O-N 2.91Å; T512-L572 HydrophobicContact CG2-CB 4.04Å; T512-L572 HydrophobicContact CG2-CD1 4.28Å; T512-L572 VanDerWaalsContact OG1-CB 3.29Å; T512-L572 WeakPolarHBondContact OG1-CB 3.15Å; T512-N573 PolarHBondContact O-OD1 2.91Å
513	R	76.7	Confident	76.3	Confident	90 Å²	90	43.3 Å²	43.3	34%	0.34	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	137.4	-175	-170.9	-179.9	178.8	176.7	0.2	113.8	D532 I533	R513-D532 WeakPolarHBondContact CG-OD1 3.33Å; R513-D532 IonicContact CZ-OD1 3.46Å; R513-D532 IonicContact CZ-OD2 3.96Å; R513-D532 IonicContact NE-OD1 3.76Å; R513-D532 PolarHBondContact NE-OD1 3.03Å; R513-D532 IonicContact NE-OD2 2.79Å; R513-D532 PolarHBondContact NE-OD2 3.02Å; R513-D532 IonicContact NH2-OD1 3.51Å; R513-D532 IonicContact NH2-OD2 3.82Å; R513-D532 PolarHBondContact NH2-OD2 3.42Å; R513-I533 CarbonylContact C-O 3.57Å; R513-I533 WeakPolarHBondContact CA-O 3.23Å
514	L	79.3	Confident	75.6	Confident	13 Å²	13	43.7 Å²	43.7	7%	0.068	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	109.4	174.4	-72.7	173.2	0	0	0	110.9	L481 L482 I506 I511 I533	L481-L514 HydrophobicContact CB-CD1 3.91Å; L481-L514 HydrophobicContact CD1-CD2 4.07Å; L482-L514 HydrophobicContact CD2-CD1 3.57Å; L482-L514 HydrophobicContact CG-CD1 3.97Å; I506-L514 HydrophobicContact CD1-CD1 4.23Å; I506-L514 HydrophobicContact CD1-CG 4.34Å; I506-L514 HydrophobicContact CG1-CD1 4.22Å; I506-L514 HydrophobicContact CG2-CD1 4.41Å; I511-L514 HydrophobicContact CG2-CD1 4.23Å; I511-L514 HydrophobicContact CG2-CD2 3.94Å; I511-L514 HydrophobicContact CG2-CG 3.72Å; L514-I533 PolarHBondContact N-O 3.37Å; L514-I533 PolarHBondContact O-N 3.44Å
515	H	81.3	Confident	74.8	Confident	107 Å²	107	45.5 Å²	45.5	50%	0.495	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129.6	174.9	176.5	55.4	0	0	0	111.2	H478 Y531	H478-H515 PolarHBondContact CE1-O 2.99Å; H515-Y531 WeakPolarHBondContact CA-O 3.35Å; H515-Y531 PolarHBondContact ND1-O 3.45Å
516	G	83.9	Confident	74.5	Confident	8 Å²	8	48.9 Å²	48.9	8%	0.082	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	-168.6	-178.4	0	0	0	0	0	113.9	P530 Y531	G516-P530 WeakPolarHBondContact O-CA 3.3Å; G516-Y531 PolarHBondContact N-O 3.39Å; G516-Y531 PolarHBondContact O-N 3.06Å
517	I	83	Confident	74.5	Confident	60 Å²	60	49.4 Å²	49.4	31%	0.308	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.9	177.9	-61.6	175.6	0	0	0	109.5	L474 H528 Y531	L474-I517 HydrophobicContact CB-CB 4.12Å; L474-I517 HydrophobicContact CB-CG2 4.47Å; L474-I517 WeakPolarHBondContact CB-O 3.47Å; L474-I517 HydrophobicContact CD2-CB 4.01Å; L474-I517 HydrophobicContact CD2-CD1 4.13Å; L474-I517 HydrophobicContact CD2-CG2 4.26Å; L474-I517 PolarHBondContact N-O 3.45Å; I517-H528 HydrophobicContact CG2-CB 3.89Å; I517-Y531 VanDerWaalsContact C-CE1 3.5Å
518	M	84.3	Confident	75	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	141.1	170.2	-173.9	174.1	75.6	0	0	108.7	F456 I471 F473 M502 V520 I529 Y531	F456-M518 HydrophobicContact CD1-CE 4.15Å; F456-M518 HydrophobicContact CG-CE 4.47Å; I471-M518 HydrophobicContact CD1-CE 4.06Å; I471-M518 HydrophobicContact CD1-SD 4.16Å; I471-M518 HydrophobicContact CG2-CG 3.32Å; I471-M518 HydrophobicContact CG2-SD 3.72Å; F473-M518 HydrophobicContact CD1-CB 4.3Å; F473-M518 HydrophobicContact CD1-CG 4.3Å; F473-M518 HydrophobicContact CE1-CB 4.42Å; F473-M518 HydrophobicContact CE1-CG 4.17Å; F473-M518 HydrophobicContact CE1-SD 4.24Å; M502-M518 HydrophobicContact CE-SD 3.64Å; M502-M518 HydrophobicContact SD-SD 4.3Å; M518-V520 HydrophobicContact CE-CG2 4.24Å; M518-I529 HydrophobicContact CB-CB 4.45Å; M518-I529 HydrophobicContact CE-CB 4.14Å; M518-I529 HydrophobicContact CE-CD1 3.88Å; M518-I529 HydrophobicContact CE-CG2 4.22Å; M518-I529 PolarHBondContact N-O 2.92Å; M518-I529 PolarHBondContact O-N 3.21Å; M518-Y531 HydrophobicContact CB-CD1 4.04Å; M518-Y531 HydrophobicContact CB-CE1 4.16Å
519	V	83.1	Confident	75.8	Confident	7 Å²	7	48.8 Å²	48.8	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	120.2	-178.7	-170.2	0	0	0	0	108.6	I471 D472 L474 Y521	I471-V519 VanDerWaalsContact CA-O 3.27Å; I471-V519 WeakPolarHBondContact CA-O 3.22Å; D472-V519 PolarHBondContact N-O 3.02Å; D472-V519 PolarHBondContact O-N 2.92Å; L474-V519 HydrophobicContact CB-CG2 4.23Å; L474-V519 HydrophobicContact CD1-CG2 4.18Å; V519-Y521 HydrophobicContact CB-CE2 4.11Å; V519-Y521 HydrophobicContact CG1-CD2 4.29Å; V519-Y521 HydrophobicContact CG1-CE2 3.72Å
520	V	83	Confident	76.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	117.3	178.5	-171.6	0	0	0	0	109.1	L458 I468 I471 M518 T526 F527 I529	L458-V520 HydrophobicContact CD1-CG1 4.45Å; I468-V520 HydrophobicContact CB-CG1 4.49Å; I468-V520 HydrophobicContact CD1-CG1 3.91Å; I468-V520 HydrophobicContact CG1-CG1 4.19Å; I468-V520 HydrophobicContact CG2-CG1 3.52Å; I471-V520 HydrophobicContact CD1-CB 4.49Å; I471-V520 HydrophobicContact CD1-CG1 4.28Å; I471-V520 HydrophobicContact CD1-CG2 3.79Å; I471-V520 HydrophobicContact CG1-CB 4.35Å; I471-V520 HydrophobicContact CG1-CG1 4.15Å; I471-V520 HydrophobicContact CG1-CG2 4.09Å; M518-V520 HydrophobicContact CE-CG2 4.24Å; V520-T526 CarbonylContact O-C 3.42Å; V520-T526 WeakPolarHBondContact O-CA 3.49Å; V520-F527 HydrophobicContact CB-CB 4.32Å; V520-F527 PolarHBondContact N-O 2.86Å; V520-F527 PolarHBondContact O-N 2.84Å; V520-I529 HydrophobicContact CG2-CD1 3.57Å; V520-I529 HydrophobicContact CG2-CG1 4.18Å
521	Y	77.9	Confident	77.6	Confident	90 Å²	90	39.4 Å²	39.4	35%	0.353	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	124	176.3	-63.5	-98.5	0	0	0	108.9	I468 S469 K470 D472 V519 T526	I468-Y521 WeakPolarHBondContact CA-O 3.4Å; I468-Y521 WeakPolarHBondContact CG2-O 2.9Å; S469-Y521 PolarHBondContact N-O 2.77Å; S469-Y521 PolarHBondContact OG-O 3.19Å; K470-Y521 HydrophobicContact CB-CD2 3.91Å; K470-Y521 HydrophobicContact CB-CG 4.21Å; K470-Y521 PolarHBondContact O-N 3.12Å; D472-Y521 HydrophobicContact CB-CE2 4.32Å; D472-Y521 WeakPolarHBondContact OD2-CE2 3.48Å; V519-Y521 HydrophobicContact CB-CE2 4.11Å; V519-Y521 HydrophobicContact CG1-CD2 4.29Å; V519-Y521 HydrophobicContact CG1-CE2 3.72Å; Y521-T526 HydrophobicContact CD1-CG2 3.51Å; Y521-T526 HydrophobicContact CE1-CG2 3.64Å; Y521-T526 HydrophobicContact CG-CG2 4.23Å
522	S	76.7	Confident	78.2	Confident	12 Å²	12	40.4 Å²	40.4	8%	0.084	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	167.3	-176.4	73.2	0	0	0	0	112.7	F467 I524 S525 F527	F467-S522 CarbonylContact O-C 3.58Å; F467-S522 WeakPolarHBondContact O-CA 3.37Å; F467-S522 WeakPolarHBondContact O-CB 3.49Å; S522-I524 PolarHBondContact O-N 2.75Å; S522-I524 PolarHBondContact OG-N 2.9Å; S522-S525 PolarHBondContact N-O 2.82Å; S522-S525 PolarHBondContact OG-N 3.33Å; S522-S525 PolarHBondContact OG-O 2.91Å; S522-F527 WeakPolarHBondContact OG-CE2 3.44Å
523	S	68.8	Low	78.8	Confident	14 Å²	14	39.3 Å²	39.3	10%	0.098	20%	0.201	C	C	.	.	S	Bend	trans	-68.2	29.3	172.5	64	0	0	0	0	115	Y249 F467	Y249-S523 VanDerWaalsContact CE2-CA 3.45Å; Y249-S523 WeakPolarHBondContact CE2-O 3.46Å; F467-S523 PolarHBondContact N-OG 3.37Å; F467-S523 VanDerWaalsContact N-OG 3.09Å; F467-S523 PolarHBondContact O-N 2.78Å
524	I	68.2	Low	79	Confident	16 Å²	16	36.7 Å²	36.7	8%	0.082	19%	0.191	C	C	.	.	S	Bend	trans	-148.2	-54.4	175.5	-51.2	179	0	0	0	109.6	V332 V427 Y462 F464 L466 S522	V332-I524 HydrophobicContact CG1-CG2 3.96Å; V427-I524 HydrophobicContact CG1-CD1 4.36Å; Y462-I524 HydrophobicContact CD1-CD1 3.94Å; Y462-I524 HydrophobicContact CD2-CD1 3.6Å; Y462-I524 HydrophobicContact CE1-CD1 3.93Å; Y462-I524 HydrophobicContact CE2-CD1 3.56Å; Y462-I524 HydrophobicContact CG-CD1 3.8Å; F464-I524 HydrophobicContact CE2-CD1 3.64Å; F464-I524 HydrophobicContact CE2-CG1 3.89Å; F464-I524 HydrophobicContact CZ-CD1 3.51Å; F464-I524 HydrophobicContact CZ-CG1 3.92Å; L466-I524 HydrophobicContact CD1-CD1 3.71Å; L466-I524 HydrophobicContact CD1-CG1 4.29Å; S522-I524 PolarHBondContact O-N 2.75Å; S522-I524 PolarHBondContact OG-N 2.9Å
525	S	68.5	Low	78.8	Confident	37 Å²	37	37 Å²	37	26%	0.259	20%	0.195	S	C	.	.			trans	-164.3	162.7	-172	54.6	0	0	0	0	112.8	S522 F527	S522-S525 PolarHBondContact N-O 2.82Å; S522-S525 PolarHBondContact OG-N 3.33Å; S522-S525 PolarHBondContact OG-O 2.91Å; S525-F527 WeakPolarHBondContact OG-CE1 3.09Å; S525-F527 VanDerWaalsContact OG-CZ 3.24Å; S525-F527 WeakPolarHBondContact OG-CZ 3.28Å
526	T	73.3	Confident	78.4	Confident	72 Å²	72	32 Å²	32	44%	0.442	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	119.4	167.9	49.2	0	0	0	0	111.2	V520 Y521	V520-T526 CarbonylContact O-C 3.42Å; V520-T526 WeakPolarHBondContact O-CA 3.49Å; Y521-T526 HydrophobicContact CD1-CG2 3.51Å; Y521-T526 HydrophobicContact CE1-CG2 3.64Å; Y521-T526 HydrophobicContact CG-CG2 4.23Å
527	F	78	Confident	78	Confident	34 Å²	34	33.3 Å²	33.3	15%	0.149	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	131.8	175.4	-57.8	-75.5	0	0	0	111.2	L431 Y462 L466 V520 S522 S525	L431-F527 HydrophobicContact CB-CD1 4.35Å; L431-F527 HydrophobicContact CB-CD2 4.16Å; L431-F527 HydrophobicContact CB-CE1 4.08Å; L431-F527 HydrophobicContact CB-CE2 3.85Å; L431-F527 HydrophobicContact CB-CG 4.39Å; L431-F527 HydrophobicContact CB-CZ 3.83Å; L431-F527 HydrophobicContact CD2-CB 4.4Å; L431-F527 HydrophobicContact CD2-CD2 3.39Å; L431-F527 HydrophobicContact CD2-CE2 3.71Å; L431-F527 HydrophobicContact CD2-CG 3.93Å; L431-F527 HydrophobicContact CG-CD2 4.41Å; L431-F527 HydrophobicContact CG-CE2 4.41Å; Y462-F527 AromaticContact CE2-CZ 3.93Å; Y462-F527 HydrophobicContact CE2-CZ 3.93Å; Y462-F527 AromaticContact CZ-CZ 3.99Å; Y462-F527 WeakPolarHBondContact OH-CE1 3.22Å; Y462-F527 VanDerWaalsContact OH-CZ 3.25Å; Y462-F527 WeakPolarHBondContact OH-CZ 3.34Å; L466-F527 HydrophobicContact CD1-CE2 4.22Å; V520-F527 HydrophobicContact CB-CB 4.32Å; V520-F527 PolarHBondContact N-O 2.86Å; V520-F527 PolarHBondContact O-N 2.84Å; S522-F527 WeakPolarHBondContact OG-CE2 3.44Å; S525-F527 WeakPolarHBondContact OG-CE1 3.09Å; S525-F527 VanDerWaalsContact OG-CZ 3.24Å; S525-F527 WeakPolarHBondContact OG-CZ 3.28Å
528	H	81.3	Confident	77.9	Confident	109 Å²	109	31 Å²	31	51%	0.505	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	114.4	176.4	-66.4	-74.9	0	0	0	110.3	I517	I517-H528 HydrophobicContact CG2-CB 3.89Å
529	I	83.4	Confident	77.8	Confident	8 Å²	8	35.3 Å²	35.3	4%	0.041	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	109.4	179.5	-60.9	178.3	0	0	0	108.2	L458 M518 V520	L458-I529 HydrophobicContact CD2-CD1 3.56Å; M518-I529 HydrophobicContact CB-CB 4.45Å; M518-I529 HydrophobicContact CE-CB 4.14Å; M518-I529 HydrophobicContact CE-CD1 3.88Å; M518-I529 HydrophobicContact CE-CG2 4.22Å; M518-I529 PolarHBondContact N-O 2.92Å; M518-I529 PolarHBondContact O-N 3.21Å; V520-I529 HydrophobicContact CG2-CD1 3.57Å; V520-I529 HydrophobicContact CG2-CG1 4.18Å
530	P	81.6	Confident	78	Confident	83 Å²	83	36 Å²	36	54%	0.539	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	145.5	172	30.4	-33.7	0	0	0	110.3	G516	G516-P530 WeakPolarHBondContact O-CA 3.3Å
531	Y	83.1	Confident	78.1	Confident	7 Å²	7	39 Å²	39	3%	0.027	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	152.3	172.6	60	-98	0	0	0	111.1	F473 H478 L482 H515 G516 I517 M518 I533	F473-Y531 AromaticContact CD1-CE1 3.75Å; F473-Y531 HydrophobicContact CD1-CE1 3.75Å; F473-Y531 HydrophobicContact CE1-CE1 4.13Å; H478-Y531 AromaticContact ND1-CZ 3.87Å; H478-Y531 PolarHBondContact ND1-OH 3.27Å; L482-Y531 HydrophobicContact CD1-CE2 4.48Å; H515-Y531 WeakPolarHBondContact CA-O 3.35Å; H515-Y531 PolarHBondContact ND1-O 3.45Å; G516-Y531 PolarHBondContact N-O 3.39Å; G516-Y531 PolarHBondContact O-N 3.06Å; I517-Y531 VanDerWaalsContact C-CE1 3.5Å; M518-Y531 HydrophobicContact CB-CD1 4.04Å; M518-Y531 HydrophobicContact CB-CE1 4.16Å; Y531-I533 HydrophobicContact CD2-CD1 3.74Å; Y531-I533 HydrophobicContact CD2-CG1 3.93Å; Y531-I533 HydrophobicContact CE2-CD1 4.27Å; Y531-I533 HydrophobicContact CG-CD1 4.29Å
532	D	79.7	Confident	78.5	Confident	55 Å²	55	35 Å²	35	29%	0.294	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	92	175.1	-162.3	7	0	0	0	107.2	R513	R513-D532 WeakPolarHBondContact CG-OD1 3.33Å; R513-D532 IonicContact CZ-OD1 3.46Å; R513-D532 IonicContact CZ-OD2 3.96Å; R513-D532 IonicContact NE-OD1 3.76Å; R513-D532 PolarHBondContact NE-OD1 3.03Å; R513-D532 IonicContact NE-OD2 2.79Å; R513-D532 PolarHBondContact NE-OD2 3.02Å; R513-D532 IonicContact NH2-OD1 3.51Å; R513-D532 IonicContact NH2-OD2 3.82Å; R513-D532 PolarHBondContact NH2-OD2 3.42Å
533	I	79.9	Confident	78.5	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	140.2	-171.7	-63.1	173.6	0	0	0	107.4	F454 F456 L482 I504 I506 R513 L514 Y531	F454-I533 HydrophobicContact CD1-CG1 4.33Å; F454-I533 HydrophobicContact CD2-CG2 3.66Å; F454-I533 HydrophobicContact CE2-CB 4.49Å; F454-I533 HydrophobicContact CE2-CG2 3.66Å; F454-I533 HydrophobicContact CG-CG1 4.23Å; F454-I533 HydrophobicContact CG-CG2 4.17Å; F454-I533 HydrophobicContact CZ-CG2 4.17Å; F456-I533 HydrophobicContact CZ-CD1 4.3Å; L482-I533 HydrophobicContact CD1-CD1 4.36Å; L482-I533 HydrophobicContact CD2-CD1 3.96Å; L482-I533 HydrophobicContact CD2-CG2 4.29Å; I504-I533 HydrophobicContact CB-CD1 4.47Å; I504-I533 HydrophobicContact CD1-CD1 4.36Å; I504-I533 HydrophobicContact CG2-CD1 4.42Å; I506-I533 HydrophobicContact CD1-CG2 3.95Å; I506-I533 HydrophobicContact CG1-CG2 3.61Å; R513-I533 CarbonylContact C-O 3.57Å; R513-I533 WeakPolarHBondContact CA-O 3.23Å; L514-I533 PolarHBondContact N-O 3.37Å; L514-I533 PolarHBondContact O-N 3.44Å; Y531-I533 HydrophobicContact CD2-CD1 3.74Å; Y531-I533 HydrophobicContact CD2-CG1 3.93Å; Y531-I533 HydrophobicContact CE2-CD1 4.27Å; Y531-I533 HydrophobicContact CG-CD1 4.29Å
534	Y	80.3	Confident	78.7	Confident	35 Å²	35	40.5 Å²	40.5	14%	0.137	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	153.4	-179.3	56	-91.5	0	0	0	111.4	F454 T512 P574 V575	F454-Y534 HydrophobicContact CE1-CD1 4.03Å; F454-Y534 AromaticContact CE1-CE1 3.82Å; F454-Y534 HydrophobicContact CE1-CE1 3.82Å; F454-Y534 WeakPolarHBondContact CE2-O 3.21Å; F454-Y534 AromaticContact CZ-CD1 3.83Å; F454-Y534 HydrophobicContact CZ-CD1 3.83Å; F454-Y534 HydrophobicContact CZ-CD2 4.26Å; F454-Y534 AromaticContact CZ-CE1 3.88Å; F454-Y534 HydrophobicContact CZ-CE1 3.88Å; F454-Y534 HydrophobicContact CZ-CE2 4.29Å; F454-Y534 HydrophobicContact CZ-CG 4.03Å; F454-Y534 VanDerWaalsContact CZ-N 3.34Å; F454-Y534 VanDerWaalsContact CZ-O 3.32Å; F454-Y534 WeakPolarHBondContact CZ-O 3.38Å; T512-Y534 WeakPolarHBondContact O-CA 3.39Å; T512-Y534 WeakPolarHBondContact O-CB 3.29Å; Y534-P574 HydrophobicContact CD1-CG 3.43Å; Y534-P574 VanDerWaalsContact CD1-CG 3.43Å; Y534-P574 HydrophobicContact CE1-CG 4Å; Y534-P574 HydrophobicContact CG-CG 3.93Å; Y534-V575 HydrophobicContact CD2-CG2 4.08Å; Y534-V575 HydrophobicContact CE1-CG1 4.24Å; Y534-V575 HydrophobicContact CE2-CG1 4.45Å; Y534-V575 HydrophobicContact CE2-CG2 3.58Å
535	S	75.8	Confident	79.3	Confident	20 Å²	20	40.6 Å²	40.6	14%	0.14	23%	0.233	C	C	.	.			trans	-95.9	-8	-176.3	57.4	0	0	0	0	114.2	F452 I511 T512 K537	F452-S535 VanDerWaalsContact CD2-O 3.29Å; F452-S535 WeakPolarHBondContact CD2-O 3.34Å; F452-S535 WeakPolarHBondContact CE2-O 3.27Å; I511-S535 PolarHBondContact O-OG 2.93Å; T512-S535 WeakPolarHBondContact CA-OG 3.37Å; T512-S535 PolarHBondContact O-N 2.91Å; S535-K537 PolarHBondContact O-N 2.89Å; S535-K537 VanDerWaalsContact O-N 3.1Å
536	G	72	Confident	79.5	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.01	24%	0.24	C	C	.	.			trans	70.8	-2.4	-177.7	0	0	0	0	0	114.1	N573	G536-N573 VanDerWaalsContact CA-OD1 3.25Å; G536-N573 WeakPolarHBondContact CA-OD1 3.3Å; G536-N573 PolarHBondContact N-OD1 3.45Å
537	K	76.5	Confident	79.5	Confident	36 Å²	36	44.1 Å²	44.1	16%	0.157	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-73.8	139.7	178.9	-60.2	-163.1	166.5	-167.2	0	110.4	D449 N509 S535 N573 T652	D449-K537 WeakPolarHBondContact OD2-CE 3.23Å; D449-K537 IonicContact OD2-NZ 3.79Å; D449-K537 PolarHBondContact OD2-NZ 3.46Å; N509-K537 PolarHBondContact OD1-NZ 3.24Å; S535-K537 PolarHBondContact O-N 2.89Å; S535-K537 VanDerWaalsContact O-N 3.1Å; K537-N573 PolarHBondContact O-ND2 2.98Å; K537-T652 HydrophobicContact CG-CG2 4.05Å
538	L	80.6	Confident	79.2	Confident	13 Å²	13	45.6 Å²	45.6	7%	0.068	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-90.7	146.5	172.3	-63.5	178.3	0	0	0	109.7	I569 N571 V577 L579 I620 T649 I654	L538-I569 HydrophobicContact CB-CG2 4.08Å; L538-I569 HydrophobicContact CD1-CG2 3.81Å; L538-I569 HydrophobicContact CG-CG2 4.44Å; L538-N571 HydrophobicContact CD2-CB 3.61Å; L538-V577 HydrophobicContact CD1-CG1 4.06Å; L538-V577 HydrophobicContact CD2-CB 4.03Å; L538-V577 HydrophobicContact CD2-CG1 4.05Å; L538-V577 HydrophobicContact CD2-CG2 4.09Å; L538-V577 HydrophobicContact CG-CG1 4.16Å; L538-L579 HydrophobicContact CD1-CD2 3.68Å; L538-I620 HydrophobicContact CD1-CD1 4Å; L538-I620 HydrophobicContact CD2-CD1 4.5Å; L538-T649 HydrophobicContact CD1-CG2 3.7Å; L538-I654 HydrophobicContact CB-CD1 4.25Å
539	H	83.3	Confident	78.5	Confident	92 Å²	92	45.2 Å²	45.2	43%	0.426	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	140	171.9	-170.1	-80	0	0	0	109.5	F541 I569 V570 L572	H539-F541 AromaticContact CE1-CD1 3.79Å; H539-F541 AromaticContact ND1-CD1 3.58Å; H539-F541 AromaticContact ND1-CE1 3.91Å; H539-I569 WeakPolarHBondContact O-CA 3.44Å; H539-V570 HydrophobicContact CB-CB 4.36Å; H539-V570 PolarHBondContact N-O 3.44Å; H539-V570 PolarHBondContact O-N 3.12Å; H539-L572 HydrophobicContact CB-CD1 4.25Å
540	F	85.3	Confident	78	Confident	20 Å²	20	50.1 Å²	50.1	9%	0.088	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.5	-172.6	170.4	-81.8	0	0	0	110.5	I542 Y552 I567 I645 I647 Q656	F540-I542 HydrophobicContact CE1-CD1 4.17Å; F540-I542 HydrophobicContact CE1-CG1 3.73Å; F540-I542 HydrophobicContact CZ-CD1 3.93Å; F540-I542 HydrophobicContact CZ-CG1 3.63Å; F540-Y552 HydrophobicContact CD1-CE2 4.26Å; F540-Y552 HydrophobicContact CE1-CD2 4.36Å; F540-Y552 AromaticContact CE1-CE2 3.84Å; F540-Y552 HydrophobicContact CE1-CE2 3.84Å; F540-I567 HydrophobicContact CD2-CG2 3.99Å; F540-I567 HydrophobicContact CE2-CG1 4.45Å; F540-I567 HydrophobicContact CE2-CG2 3.39Å; F540-I567 HydrophobicContact CZ-CG1 4.49Å; F540-I567 HydrophobicContact CZ-CG2 4.14Å; F540-I645 HydrophobicContact CE2-CG2 3.89Å; F540-I645 HydrophobicContact CZ-CD1 3.98Å; F540-I645 HydrophobicContact CZ-CG2 4.25Å; F540-I647 HydrophobicContact CD2-CD1 3.38Å; F540-I647 HydrophobicContact CE2-CD1 3.63Å; F540-Q656 HydrophobicContact CD1-CG 4.24Å; F540-Q656 HydrophobicContact CE1-CB 4.28Å; F540-Q656 HydrophobicContact CE1-CG 3.59Å; F540-Q656 HydrophobicContact CZ-CB 4.38Å; F540-Q656 HydrophobicContact CZ-CG 4.03Å
541	F	86	Confident	78	Confident	65 Å²	65	47.4 Å²	47.4	29%	0.285	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	168.8	164.5	51.2	-85.4	0	0	0	111.9	H539 D543 T568 V570	H539-F541 AromaticContact CE1-CD1 3.79Å; H539-F541 AromaticContact ND1-CD1 3.58Å; H539-F541 AromaticContact ND1-CE1 3.91Å; F541-D543 VanDerWaalsContact CE2-OD1 3.31Å; F541-D543 WeakPolarHBondContact CE2-OD1 3Å; F541-T568 HydrophobicContact CD2-CG2 4.39Å; F541-T568 HydrophobicContact CE1-CG2 3.96Å; F541-T568 HydrophobicContact CE2-CG2 3.59Å; F541-T568 HydrophobicContact CZ-CG2 3.33Å; F541-T568 PolarHBondContact N-O 3.22Å; F541-T568 PolarHBondContact O-N 3.31Å; F541-V570 HydrophobicContact CE1-CG2 3.76Å; F541-V570 HydrophobicContact CZ-CG2 4.22Å
542	I	86.2	Confident	78.1	Confident	6 Å²	6	47.8 Å²	47.8	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	120.1	177.1	-55.1	-178.2	0	0	0	108.2	F540 G544 A545 Y552 L554 Q565 S566 I567 I645	F540-I542 HydrophobicContact CE1-CD1 4.17Å; F540-I542 HydrophobicContact CE1-CG1 3.73Å; F540-I542 HydrophobicContact CZ-CD1 3.93Å; F540-I542 HydrophobicContact CZ-CG1 3.63Å; I542-G544 PolarHBondContact O-N 3.04Å; I542-A545 HydrophobicContact CB-CB 3.92Å; I542-A545 HydrophobicContact CG2-CB 3.68Å; I542-A545 PolarHBondContact O-N 2.92Å; I542-Y552 HydrophobicContact CB-CD1 3.83Å; I542-Y552 HydrophobicContact CB-CE1 4.08Å; I542-Y552 HydrophobicContact CD1-CD1 4.01Å; I542-Y552 HydrophobicContact CD1-CD2 4.33Å; I542-Y552 HydrophobicContact CD1-CG 3.8Å; I542-Y552 HydrophobicContact CG1-CD1 3.97Å; I542-Y552 HydrophobicContact CG1-CE1 4.2Å; I542-Y552 HydrophobicContact CG1-CG 4.23Å; I542-L554 HydrophobicContact CD1-CD2 4.38Å; I542-L554 HydrophobicContact CG2-CD2 3.98Å; I542-Q565 HydrophobicContact CG2-CG 3.53Å; I542-S566 WeakPolarHBondContact CG2-O 3.31Å; I542-I567 HydrophobicContact CG1-CG1 4.17Å; I542-I645 HydrophobicContact CD1-CD1 3.51Å; I542-I645 HydrophobicContact CG1-CD1 4.44Å
543	D	76.9	Confident	78.3	Confident	62 Å²	62	47.3 Å²	47.3	33%	0.332	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	104.2	-165.3	-64.6	-61	0	0	0	113.6	F541 Q565 S566 T568	F541-D543 VanDerWaalsContact CE2-OD1 3.31Å; F541-D543 WeakPolarHBondContact CE2-OD1 3Å; D543-Q565 PolarHBondContact O-NE2 2.86Å; D543-S566 WeakPolarHBondContact CB-OG 3.47Å; D543-S566 PolarHBondContact N-O 3.38Å; D543-S566 WeakPolarHBondContact OD2-CB 3.45Å; D543-S566 PolarHBondContact OD2-OG 3.3Å; D543-T568 PolarHBondContact OD2-OG1 3.25Å
544	G	72.5	Confident	78.5	Confident	78 Å²	78	48 Å²	48	80%	0.804	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.9	-3.2	178.2	0	0	0	0	0	115.4	I542	I542-G544 PolarHBondContact O-N 3.04Å
545	A	80.3	Confident	78.5	Confident	18 Å²	18	47.5 Å²	47.5	15%	0.149	26%	0.26	C	S	.	.			trans	-72.4	158.6	165	0	0	0	0	0	110.9	I542 Y552 L553 L554	I542-A545 HydrophobicContact CB-CB 3.92Å; I542-A545 HydrophobicContact CG2-CB 3.68Å; I542-A545 PolarHBondContact O-N 2.92Å; A545-Y552 HydrophobicContact CB-CD1 3.94Å; A545-L553 WeakPolarHBondContact CA-O 3.07Å; A545-L554 HydrophobicContact CB-CD2 3.72Å
546	R	73.3	Confident	78.7	Confident	107 Å²	107	49 Å²	49	40%	0.404	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	113.5	-179	-63.4	-177.1	-172.7	176.8	5.2	111	L548 L553 N672	R546-L548 PolarHBondContact O-N 3.32Å; R546-L553 HydrophobicContact CB-CB 4.46Å; R546-L553 PolarHBondContact N-O 3.37Å; R546-L553 PolarHBondContact O-N 3.09Å; R546-N672 VanDerWaalsContact CZ-OD1 3.31Å; R546-N672 PolarHBondContact NH1-OD1 2.97Å; R546-N672 PolarHBondContact NH2-OD1 3.03Å
547	Q	74.4	Confident	79.3	Confident	77 Å²	77	49 Å²	49	36%	0.36	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	115.9	170.4	-171.6	177.3	-4.8	0	0	109.7	D550 V551 Y552 I710	Q547-D550 PolarHBondContact NE2-OD1 3.47Å; Q547-V551 CarbonylContact C-O 3.55Å; Q547-V551 WeakPolarHBondContact CA-O 3.48Å; Q547-Y552 HydrophobicContact CB-CD1 4.29Å; Q547-Y552 HydrophobicContact CB-CE1 4.05Å; Q547-Y552 HydrophobicContact CB-CE2 4.31Å; Q547-Y552 HydrophobicContact CG-CD2 4.44Å; Q547-Y552 HydrophobicContact CG-CE2 4.08Å; Q547-Y552 PolarHBondContact OE1-OH 3.39Å; Q547-I710 VanDerWaalsContact O-CD1 3.26Å; Q547-I710 WeakPolarHBondContact O-CD1 3.42Å
548	L	70.1	Confident	79.4	Confident	64 Å²	64	50.4 Å²	50.4	34%	0.335	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.1	168.2	-66.3	-175.4	0	0	0	107.9	R546 D550 V551 L553 I710	R546-L548 PolarHBondContact O-N 3.32Å; L548-D550 VanDerWaalsContact C-N 3.28Å; L548-D550 PolarHBondContact O-N 3.05Å; L548-V551 PolarHBondContact N-O 3.07Å; L548-V551 PolarHBondContact O-N 3.36Å; L548-L553 HydrophobicContact CD1-CD1 3.67Å; L548-L553 HydrophobicContact CG-CD1 4.18Å; L548-I710 HydrophobicContact CD2-CD1 4.45Å
549	Q	68.2	Low	79.4	Confident	101 Å²	101	52.7 Å²	52.7	47%	0.472	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.9	53.1	178.5	-63	-179.2	-103.7	0	0	112.7	V551 N2215	Q549-V551 VanDerWaalsContact C-N 3.25Å; Q549-V551 PolarHBondContact O-N 3.28Å; Q549-N2215 PolarHBondContact NE2-OD1 2.93Å
550	D	72.4	Confident	79.1	Confident	112 Å²	112	50 Å²	50	60%	0.599	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	26	179.5	-53.7	-37.5	0	0	0	116	Q547 L548 Q656	Q547-D550 PolarHBondContact NE2-OD1 3.47Å; L548-D550 VanDerWaalsContact C-N 3.28Å; L548-D550 PolarHBondContact O-N 3.05Å; D550-Q656 PolarHBondContact O-NE2 2.87Å
551	V	81	Confident	78.9	Confident	26 Å²	26	52.9 Å²	52.9	16%	0.158	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130	165.5	-178.9	0	0	0	0	110.4	Q547 L548 Q549 Q657 E659	Q547-V551 CarbonylContact C-O 3.55Å; Q547-V551 WeakPolarHBondContact CA-O 3.48Å; L548-V551 PolarHBondContact N-O 3.07Å; L548-V551 PolarHBondContact O-N 3.36Å; Q549-V551 VanDerWaalsContact C-N 3.25Å; Q549-V551 PolarHBondContact O-N 3.28Å; V551-Q657 HydrophobicContact CG1-CB 4.46Å; V551-Q657 HydrophobicContact CG1-CG 4.1Å; V551-Q657 HydrophobicContact CG2-CB 4.26Å; V551-Q657 HydrophobicContact CG2-CG 4.27Å; V551-E659 HydrophobicContact CG1-CB 4.2Å; V551-E659 HydrophobicContact CG1-CG 3.69Å
552	Y	85.5	Confident	78.8	Confident	14 Å²	14	53.4 Å²	53.4	6%	0.055	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	103.8	175.9	-81.2	-96.5	0	0	0	112.4	F540 I542 A545 Q547 L554 Q656 Q657 F658 E659	F540-Y552 HydrophobicContact CD1-CE2 4.26Å; F540-Y552 HydrophobicContact CE1-CD2 4.36Å; F540-Y552 AromaticContact CE1-CE2 3.84Å; F540-Y552 HydrophobicContact CE1-CE2 3.84Å; I542-Y552 HydrophobicContact CB-CD1 3.83Å; I542-Y552 HydrophobicContact CB-CE1 4.08Å; I542-Y552 HydrophobicContact CD1-CD1 4.01Å; I542-Y552 HydrophobicContact CD1-CD2 4.33Å; I542-Y552 HydrophobicContact CD1-CG 3.8Å; I542-Y552 HydrophobicContact CG1-CD1 3.97Å; I542-Y552 HydrophobicContact CG1-CE1 4.2Å; I542-Y552 HydrophobicContact CG1-CG 4.23Å; A545-Y552 HydrophobicContact CB-CD1 3.94Å; Q547-Y552 HydrophobicContact CB-CD1 4.29Å; Q547-Y552 HydrophobicContact CB-CE1 4.05Å; Q547-Y552 HydrophobicContact CB-CE2 4.31Å; Q547-Y552 HydrophobicContact CG-CD2 4.44Å; Q547-Y552 HydrophobicContact CG-CE2 4.08Å; Q547-Y552 PolarHBondContact OE1-OH 3.39Å; Y552-L554 PolarHBondContact O-N 3.16Å; Y552-Q656 VanDerWaalsContact CD2-CD 3.47Å; Y552-Q656 HydrophobicContact CD2-CG 3.65Å; Y552-Q656 HydrophobicContact CE2-CG 3.78Å; Y552-Q657 PolarHBondContact N-O 2.8Å; Y552-F658 CarbonylContact O-C 3.43Å; Y552-F658 WeakPolarHBondContact O-CA 3.25Å; Y552-F658 VanDerWaalsContact O-CB 3.26Å; Y552-F658 WeakPolarHBondContact O-CB 3.19Å; Y552-E659 PolarHBondContact O-N 3.4Å
553	L	83.8	Confident	78.6	Confident	45 Å²	45	57.5 Å²	57.5	24%	0.236	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	111.2	172	-76.4	155.2	0	0	0	110.6	A545 R546 L548 G555 E659 F661	A545-L553 WeakPolarHBondContact CA-O 3.07Å; R546-L553 HydrophobicContact CB-CB 4.46Å; R546-L553 PolarHBondContact N-O 3.37Å; R546-L553 PolarHBondContact O-N 3.09Å; L548-L553 HydrophobicContact CD1-CD1 3.67Å; L548-L553 HydrophobicContact CG-CD1 4.18Å; L553-G555 VanDerWaalsContact C-N 3.3Å; L553-E659 WeakPolarHBondContact CA-O 3.03Å; L553-E659 HydrophobicContact CD2-CB 3.88Å; L553-F661 HydrophobicContact CD2-CE2 4Å
554	L	84.5	Confident	79.1	Confident	15 Å²	15	60.3 Å²	60.3	8%	0.079	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	-20	173.6	-46.2	-175.8	0	0	0	111.7	I542 A545 Y552 Q565 F630 W632 F658 E659	I542-L554 HydrophobicContact CD1-CD2 4.38Å; I542-L554 HydrophobicContact CG2-CD2 3.98Å; A545-L554 HydrophobicContact CB-CD2 3.72Å; Y552-L554 PolarHBondContact O-N 3.16Å; L554-Q565 HydrophobicContact CD2-CG 4.47Å; L554-F630 HydrophobicContact CD1-CE2 3.91Å; L554-F630 HydrophobicContact CD1-CZ 3.82Å; L554-F630 HydrophobicContact CD2-CZ 4.45Å; L554-W632 HydrophobicContact CB-CH2 3.92Å; L554-W632 HydrophobicContact CB-CZ2 3.5Å; L554-W632 HydrophobicContact CD1-CD2 4.14Å; L554-W632 HydrophobicContact CD1-CG 4.13Å; L554-W632 HydrophobicContact CD1-CZ2 4.48Å; L554-W632 WeakPolarHBondContact O-CH2 3.29Å; L554-W632 WeakPolarHBondContact O-CZ2 3.35Å; L554-F658 HydrophobicContact CD1-CD2 3.51Å; L554-F658 HydrophobicContact CD1-CE2 3.94Å; L554-F658 HydrophobicContact CD1-CG 4.31Å; L554-F658 HydrophobicContact CD2-CB 4.31Å; L554-F658 HydrophobicContact CG-CB 4.34Å; L554-F658 HydrophobicContact CG-CD2 4Å; L554-E659 PolarHBondContact N-O 2.88Å
555	G	80.4	Confident	79.8	Confident	26 Å²	26	58 Å²	58	27%	0.268	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	102.8	-152.3	173.1	0	0	0	0	0	114.4	L553 Y660 F661	L553-G555 VanDerWaalsContact C-N 3.3Å; G555-Y660 WeakPolarHBondContact O-CA 3.36Å; G555-F661 PolarHBondContact O-N 3.05Å
556	T	80.3	Confident	80.1	Confident	52 Å²	52	58.8 Å²	58.8	32%	0.319	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139.5	-175.9	42.5	0	0	0	0	112.1	R563 F661 T663	T556-R563 PolarHBondContact O-NE 3.15Å; T556-R563 PolarHBondContact O-NH1 3.01Å; T556-R563 PolarHBondContact O-NH2 3.15Å; T556-F661 CarbonylContact C-O 3.6Å; T556-F661 WeakPolarHBondContact CA-O 2.98Å; T556-F661 HydrophobicContact CG2-CB 3.87Å; T556-T663 HydrophobicContact CG2-CG2 4.48Å
557	T	83.1	Confident	80.8	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	156.7	168.8	-163.8	0	0	0	0	110.4	Q561 W632 F661 V662 T663	T557-Q561 PolarHBondContact OG1-O 2.79Å; T557-Q561 VanDerWaalsContact OG1-O 3.11Å; T557-W632 HydrophobicContact CG2-CE3 4.2Å; T557-W632 HydrophobicContact CG2-CZ3 3.89Å; T557-F661 PolarHBondContact N-O 2.89Å; T557-V662 HydrophobicContact CG2-CG2 4.01Å; T557-V662 CarbonylContact O-C 3.2Å; T557-V662 WeakPolarHBondContact O-CA 3.1Å; T557-T663 PolarHBondContact O-N 2.97Å
558	L	80.2	Confident	81.5	Confident	65 Å²	65	50.2 Å²	50.2	34%	0.34	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	156.4	176.1	-62.8	174.8	0	0	0	111.1	G560 Q561 T663 L666	L558-G560 PolarHBondContact O-N 2.89Å; L558-Q561 HydrophobicContact CB-CB 4.05Å; L558-Q561 WeakPolarHBondContact O-CB 3.37Å; L558-Q561 PolarHBondContact O-N 3.4Å; L558-T663 WeakPolarHBondContact CA-O 3.49Å; L558-L666 HydrophobicContact CD2-CD1 3.91Å; L558-L666 HydrophobicContact CG-CD1 4.43Å
559	I	80.9	Confident	82.3	Confident	61 Å²	61	47.2 Å²	47.2	31%	0.313	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	130.1	169.3	-73.3	-179.6	0	0	0	110	Q561 E635 A638 V662 T663 R664	I559-Q561 PolarHBondContact O-N 3.47Å; I559-E635 WeakPolarHBondContact CA-O 3.19Å; I559-A638 HydrophobicContact CD1-CB 4.16Å; I559-V662 HydrophobicContact CG1-CG1 3.88Å; I559-T663 PolarHBondContact N-O 2.94Å; I559-T663 VanDerWaalsContact N-O 3.1Å; I559-R664 HydrophobicContact CD1-CG 3.59Å
560	G	75.8	Confident	83.2	Confident	37 Å²	37	43.4 Å²	43.4	38%	0.381	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	3	-176.9	0	0	0	0	0	116	L558 N634 E635	L558-G560 PolarHBondContact O-N 2.89Å; G560-N634 PolarHBondContact O-OD1 2.76Å; G560-E635 PolarHBondContact N-O 3.37Å
561	Q	81.3	Confident	83.9	Confident	80 Å²	80	38 Å²	38	37%	0.374	21%	0.211	S	C	.	.			trans	-94.9	129	177.7	-176.1	178.1	15.5	0	0	111.8	T557 L558 I559 G633 N634	T557-Q561 PolarHBondContact OG1-O 2.79Å; T557-Q561 VanDerWaalsContact OG1-O 3.11Å; L558-Q561 HydrophobicContact CB-CB 4.05Å; L558-Q561 WeakPolarHBondContact O-CB 3.37Å; L558-Q561 PolarHBondContact O-N 3.4Å; I559-Q561 PolarHBondContact O-N 3.47Å; Q561-G633 WeakPolarHBondContact O-CA 3.41Å; Q561-N634 PolarHBondContact O-N 3.06Å
562	I	82.9	Confident	84	Confident	75 Å²	75	39.9 Å²	39.9	39%	0.385	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	142.4	170	-58.8	161.5	0	0	0	109.6	N634	I562-N634 HydrophobicContact CG1-CB 3.77Å
563	R	83.7	Confident	83.7	Confident	92 Å²	92	39.2 Å²	39.2	35%	0.347	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	152.1	164.2	-71.7	-177.8	172.1	-147	0.4	110.1	T556 S631 W632	T556-R563 PolarHBondContact O-NE 3.15Å; T556-R563 PolarHBondContact O-NH1 3.01Å; T556-R563 PolarHBondContact O-NH2 3.15Å; R563-S631 CarbonylContact O-C 3.56Å; R563-S631 WeakPolarHBondContact O-CA 3.36Å; R563-W632 HydrophobicContact CB-CD2 4.08Å; R563-W632 HydrophobicContact CB-CH2 4.45Å; R563-W632 HydrophobicContact CB-CZ2 3.93Å; R563-W632 VanDerWaalsContact CD-CH2 3.48Å; R563-W632 HydrophobicContact CG-CZ2 4.37Å; R563-W632 PolarHBondContact N-O 2.94Å; R563-W632 PolarHBondContact O-N 2.92Å
564	N	87	Confident	83.3	Confident	122 Å²	122	38.7 Å²	38.7	65%	0.652	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	147.6	176.1	-65	-7.8	0	0	0	109.5	S631	N564-S631 WeakPolarHBondContact OD1-CB 3.35Å; N564-S631 PolarHBondContact OD1-OG 2.8Å
565	Q	86.3	Confident	82.9	Confident	29 Å²	29	39.9 Å²	39.9	14%	0.136	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	142.4	-172.7	-175.4	58.9	66.2	0	0	110.4	I542 D543 L554 P629 F630	I542-Q565 HydrophobicContact CG2-CG 3.53Å; D543-Q565 PolarHBondContact O-NE2 2.86Å; L554-Q565 HydrophobicContact CD2-CG 4.47Å; Q565-P629 WeakPolarHBondContact O-CA 3.3Å; Q565-F630 HydrophobicContact CB-CD1 4.07Å; Q565-F630 HydrophobicContact CB-CE1 3.61Å; Q565-F630 HydrophobicContact CB-CE2 4.27Å; Q565-F630 HydrophobicContact CB-CZ 3.74Å; Q565-F630 HydrophobicContact CG-CD1 4.28Å; Q565-F630 HydrophobicContact CG-CE1 3.41Å; Q565-F630 VanDerWaalsContact CG-CE1 3.41Å; Q565-F630 HydrophobicContact CG-CZ 3.57Å; Q565-F630 PolarHBondContact N-O 3.46Å; Q565-F630 WeakPolarHBondContact O-CD1 3.14Å; Q565-F630 PolarHBondContact O-N 3.29Å; Q565-F630 VanDerWaalsContact O-O 3.05Å
566	S	86.6	Confident	83	Confident	35 Å²	35	41.2 Å²	41.2	25%	0.245	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	141.1	169.2	44.1	0	0	0	0	111.9	I542 D543	I542-S566 WeakPolarHBondContact CG2-O 3.31Å; D543-S566 WeakPolarHBondContact CB-OG 3.47Å; D543-S566 PolarHBondContact N-O 3.38Å; D543-S566 WeakPolarHBondContact OD2-CB 3.45Å; D543-S566 PolarHBondContact OD2-OG 3.3Å
567	I	88.3	Confident	83.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.7	159.3	-72.2	153.8	0	0	0	107	F540 I542 I569 I584 N627 I628 F630 I645	F540-I567 HydrophobicContact CD2-CG2 3.99Å; F540-I567 HydrophobicContact CE2-CG1 4.45Å; F540-I567 HydrophobicContact CE2-CG2 3.39Å; F540-I567 HydrophobicContact CZ-CG1 4.49Å; F540-I567 HydrophobicContact CZ-CG2 4.14Å; I542-I567 HydrophobicContact CG1-CG1 4.17Å; I567-I569 HydrophobicContact CG2-CG1 4.06Å; I567-I584 HydrophobicContact CD1-CD1 3.47Å; I567-I584 VanDerWaalsContact CD1-CD1 3.47Å; I567-I584 HydrophobicContact CD1-CG1 4.23Å; I567-N627 CarbonylContact O-C 3.57Å; I567-N627 WeakPolarHBondContact O-CA 3.5Å; I567-I628 HydrophobicContact CB-CB 4.28Å; I567-I628 PolarHBondContact N-O 3.13Å; I567-I628 PolarHBondContact O-N 2.81Å; I567-F630 HydrophobicContact CD1-CD1 3.82Å; I567-F630 HydrophobicContact CD1-CE1 3.85Å; I567-F630 HydrophobicContact CG1-CD1 4.12Å; I567-F630 HydrophobicContact CG1-CE1 3.83Å; I567-I645 HydrophobicContact CD1-CD1 3.59Å; I567-I645 HydrophobicContact CD1-CG1 3.9Å; I567-I645 HydrophobicContact CD1-CG2 4.09Å; I567-I645 HydrophobicContact CG1-CD1 3.92Å
568	T	88.5	Confident	83	Confident	3 Å²	3	42 Å²	42	2%	0.018	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	119.6	-178.8	-66.1	0	0	0	0	109.9	F541 D543 V570 N627	F541-T568 HydrophobicContact CD2-CG2 4.39Å; F541-T568 HydrophobicContact CE1-CG2 3.96Å; F541-T568 HydrophobicContact CE2-CG2 3.59Å; F541-T568 HydrophobicContact CZ-CG2 3.33Å; F541-T568 PolarHBondContact N-O 3.22Å; F541-T568 PolarHBondContact O-N 3.31Å; D543-T568 PolarHBondContact OD2-OG1 3.25Å; T568-V570 HydrophobicContact CG2-CG2 4.12Å; T568-N627 WeakPolarHBondContact CG2-OD1 3.3Å; T568-N627 PolarHBondContact OG1-OD1 3.07Å
569	I	88.2	Confident	83.1	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	119.5	-178.4	-53.3	177.1	0	0	0	108.4	L538 H539 I567 I620 E625 V626 I628 I647	L538-I569 HydrophobicContact CB-CG2 4.08Å; L538-I569 HydrophobicContact CD1-CG2 3.81Å; L538-I569 HydrophobicContact CG-CG2 4.44Å; H539-I569 WeakPolarHBondContact O-CA 3.44Å; I567-I569 HydrophobicContact CG2-CG1 4.06Å; I569-I620 HydrophobicContact CB-CD1 4.33Å; I569-I620 HydrophobicContact CG2-CD1 3.68Å; I569-E625 CarbonylContact O-C 3.57Å; I569-E625 WeakPolarHBondContact O-CA 3.23Å; I569-V626 PolarHBondContact N-O 2.84Å; I569-V626 PolarHBondContact O-N 2.03Å; I569-I628 HydrophobicContact CD1-CD1 3.63Å; I569-I647 HydrophobicContact CD1-CD1 3.56Å; I569-I647 HydrophobicContact CD1-CG1 4.05Å; I569-I647 HydrophobicContact CD1-CG2 4.45Å; I569-I647 HydrophobicContact CG1-CD1 4.03Å
570	V	87.1	Confident	83	Confident	20 Å²	20	39.6 Å²	39.6	12%	0.121	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	120.9	-177	-169.6	0	0	0	0	110.5	H539 F541 T568 L572 E625	H539-V570 HydrophobicContact CB-CB 4.36Å; H539-V570 PolarHBondContact N-O 3.44Å; H539-V570 PolarHBondContact O-N 3.12Å; F541-V570 HydrophobicContact CE1-CG2 3.76Å; F541-V570 HydrophobicContact CZ-CG2 4.22Å; T568-V570 HydrophobicContact CG2-CG2 4.12Å; V570-L572 HydrophobicContact CG1-CD2 3.75Å; V570-L572 HydrophobicContact CG1-CG 4.02Å; V570-L572 PolarHBondContact O-N 2.79Å; V570-E625 HydrophobicContact CB-CB 4.5Å; V570-E625 HydrophobicContact CG1-CB 4.43Å; V570-E625 HydrophobicContact CG2-CB 3.94Å
571	N	87.6	Confident	83.3	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.208	C	C	.	.			trans	-88.8	91.1	173.7	-178.4	21	0	0	0	110.9	L538 N573 V575 I620 Q621 L623 S624	L538-N571 HydrophobicContact CD2-CB 3.61Å; N571-N573 PolarHBondContact O-N 2.92Å; N571-N573 VanDerWaalsContact OD1-CB 3.29Å; N571-N573 WeakPolarHBondContact OD1-CB 3.45Å; N571-N573 PolarHBondContact OD1-N 3.43Å; N571-N573 PolarHBondContact OD1-ND2 2.91Å; N571-V575 PolarHBondContact ND2-O 3.16Å; N571-I620 HydrophobicContact CB-CB 4.2Å; N571-I620 HydrophobicContact CB-CG2 3.55Å; N571-I620 PolarHBondContact ND2-O 3.45Å; N571-Q621 WeakPolarHBondContact CB-O 3.29Å; N571-Q621 PolarHBondContact ND2-O 2.91Å; N571-L623 WeakPolarHBondContact O-CA 3.16Å; N571-L623 PolarHBondContact O-N 3.45Å; N571-S624 PolarHBondContact N-O 3.19Å
572	L	82.5	Confident	83.4	Confident	64 Å²	64	35 Å²	35	34%	0.335	19%	0.19	S	C	.	.			trans	-78.6	-0.6	177.4	-64	176.3	0	0	0	114.2	T512 H539 V570	T512-L572 HydrophobicContact CG2-CB 4.04Å; T512-L572 HydrophobicContact CG2-CD1 4.28Å; T512-L572 VanDerWaalsContact OG1-CB 3.29Å; T512-L572 WeakPolarHBondContact OG1-CB 3.15Å; H539-L572 HydrophobicContact CB-CD1 4.25Å; V570-L572 HydrophobicContact CG1-CD2 3.75Å; V570-L572 HydrophobicContact CG1-CG 4.02Å; V570-L572 PolarHBondContact O-N 2.79Å
573	N	78.6	Confident	83.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-76.4	151.6	178.7	-55.5	-82.2	0	0	0	110.9	T512 G536 K537 N571 V575 S622	T512-N573 PolarHBondContact O-OD1 2.91Å; G536-N573 VanDerWaalsContact CA-OD1 3.25Å; G536-N573 WeakPolarHBondContact CA-OD1 3.3Å; G536-N573 PolarHBondContact N-OD1 3.45Å; K537-N573 PolarHBondContact O-ND2 2.98Å; N571-N573 PolarHBondContact O-N 2.92Å; N571-N573 VanDerWaalsContact OD1-CB 3.29Å; N571-N573 WeakPolarHBondContact OD1-CB 3.45Å; N571-N573 PolarHBondContact OD1-N 3.43Å; N571-N573 PolarHBondContact OD1-ND2 2.91Å; N573-V575 HydrophobicContact CB-CG2 4.17Å; N573-V575 PolarHBondContact O-N 3.14Å; N573-S622 PolarHBondContact O-OG 3.18Å
574	P	74.9	Confident	83.7	Confident	35 Å²	35	27.5 Å²	27.5	23%	0.227	16%	0.158	C	C	.	.	S	Bend	trans	-76.2	5.4	175.5	33	-35.1	0	0	0	113.8	Y534	Y534-P574 HydrophobicContact CD1-CG 3.43Å; Y534-P574 VanDerWaalsContact CD1-CG 3.43Å; Y534-P574 HydrophobicContact CE1-CG 4Å; Y534-P574 HydrophobicContact CG-CG 3.93Å
575	V	77.7	Confident	83.7	Confident	40 Å²	40	23.6 Å²	23.6	24%	0.242	13%	0.134	C	C	.	.	S	Bend	trans	-126.1	150.1	179.1	-66	0	0	0	0	109	Y534 N571 N573	Y534-V575 HydrophobicContact CD2-CG2 4.08Å; Y534-V575 HydrophobicContact CE1-CG1 4.24Å; Y534-V575 HydrophobicContact CE2-CG1 4.45Å; Y534-V575 HydrophobicContact CE2-CG2 3.58Å; N571-V575 PolarHBondContact ND2-O 3.16Å; N573-V575 HydrophobicContact CB-CG2 4.17Å; N573-V575 PolarHBondContact O-N 3.14Å
576	P	80.7	Confident	83.7	Confident	53 Å²	53	22.2 Å²	22.2	34%	0.344	13%	0.128	S	C	.	.			trans	-68	158.1	172.2	33.2	-37.1	0	0	0	111.2	E619 I620	P576-E619 HydrophobicContact CB-CG 4.06Å; P576-E619 WeakPolarHBondContact CB-OE1 3.35Å; P576-E619 WeakPolarHBondContact CG-OE1 3.34Å; P576-I620 CarbonylContact C-O 3.19Å; P576-I620 WeakPolarHBondContact CA-O 3.5Å; P576-I620 WeakPolarHBondContact CB-O 3.35Å
577	V	82.4	Confident	83.4	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-132.6	122.5	-176.6	176.1	0	0	0	0	110.1	L538 I620 T649 Y651	L538-V577 HydrophobicContact CD1-CG1 4.06Å; L538-V577 HydrophobicContact CD2-CB 4.03Å; L538-V577 HydrophobicContact CD2-CG1 4.05Å; L538-V577 HydrophobicContact CD2-CG2 4.09Å; L538-V577 HydrophobicContact CG-CG1 4.16Å; V577-I620 PolarHBondContact N-O 3.5Å; V577-I620 PolarHBondContact O-N 3.44Å; V577-T649 HydrophobicContact CG1-CG2 4.14Å; V577-Y651 HydrophobicContact CB-CE2 4.39Å; V577-Y651 HydrophobicContact CG1-CD2 3.9Å; V577-Y651 HydrophobicContact CG1-CE2 4.02Å; V577-Y651 HydrophobicContact CG2-CD2 4.31Å; V577-Y651 HydrophobicContact CG2-CE2 4.09Å
578	E	81.3	Confident	82.6	Confident	69 Å²	69	25.9 Å²	25.9	32%	0.322	15%	0.145	S	C	.	.			trans	-79.5	118.7	176.3	-177.4	173.1	138.4	0	0	111.2	T618 T649 K650	E578-T618 WeakPolarHBondContact CG-O 3.49Å; E578-T649 VanDerWaalsContact O-CA 3.28Å; E578-T649 WeakPolarHBondContact O-CA 3.44Å; E578-T649 WeakPolarHBondContact O-CB 3.34Å; E578-K650 HydrophobicContact CB-CD 4.24Å; E578-K650 HydrophobicContact CG-CD 4.45Å; E578-K650 PolarHBondContact O-N 3.27Å; E578-K650 WeakPolarHBondContact OE1-CE 3.42Å; E578-K650 IonicContact OE1-NZ 3.4Å; E578-K650 PolarHBondContact OE1-NZ 2.98Å; E578-K650 WeakPolarHBondContact OE2-CE 3.14Å; E578-K650 IonicContact OE2-NZ 3.43Å; E578-K650 PolarHBondContact OE2-NZ 3.15Å
579	L	82.2	Confident	81.5	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.021	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	128.7	165.9	-64	-173.7	0	0	0	108.7	L538 V582 F617 I620 I647 T649	L538-L579 HydrophobicContact CD1-CD2 3.68Å; L579-V582 HydrophobicContact CD1-CG2 4.03Å; L579-F617 HydrophobicContact CB-CB 3.98Å; L579-F617 HydrophobicContact CD1-CB 3.73Å; L579-F617 HydrophobicContact CD1-CD2 3.84Å; L579-F617 HydrophobicContact CD1-CG 3.92Å; L579-F617 HydrophobicContact CG-CB 4.37Å; L579-I620 HydrophobicContact CD1-CD1 3.98Å; L579-I620 HydrophobicContact CD1-CG1 4.16Å; L579-I620 HydrophobicContact CD2-CD1 3.94Å; L579-I620 HydrophobicContact CD2-CG1 4.47Å; L579-I620 HydrophobicContact CG-CD1 3.96Å; L579-I620 HydrophobicContact CG-CG1 4.02Å; L579-I647 HydrophobicContact CD2-CG2 3.92Å; L579-T649 HydrophobicContact CD2-CG2 3.78Å
580	T	79.6	Confident	80.1	Confident	72 Å²	72	35.7 Å²	35.7	44%	0.442	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-27.2	178.3	52.6	0	0	0	0	112.7	K648 T649 K650	T580-K648 PolarHBondContact N-O 3.34Å; T580-K648 WeakPolarHBondContact OG1-CB 3.33Å; T580-K648 PolarHBondContact OG1-O 2.95Å; T580-T649 PolarHBondContact OG1-N 2.8Å; T580-K650 HydrophobicContact CG2-CG 4.1Å
581	S	81	Confident	78.4	Confident	21 Å²	21	42.1 Å²	42.1	15%	0.147	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	145.5	165.5	67.6	0	0	0	0	111	N583 K648	S581-N583 PolarHBondContact OG-ND2 3.11Å; S581-N583 VanDerWaalsContact OG-ND2 3.13Å; S581-K648 PolarHBondContact N-O 2.85Å; S581-K648 PolarHBondContact O-N 2.82Å
582	V	83.7	Confident	76.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	122.5	161.4	-177	0	0	0	0	109.1	L579 F615 F617 I628 I647	L579-V582 HydrophobicContact CD1-CG2 4.03Å; V582-F615 HydrophobicContact CB-CB 4.3Å; V582-F615 HydrophobicContact CB-CD2 4.49Å; V582-F615 HydrophobicContact CG1-CD2 4.44Å; V582-F615 PolarHBondContact N-O 2.69Å; V582-F615 VanDerWaalsContact N-O 3.14Å; V582-F615 PolarHBondContact O-N 3.18Å; V582-F617 HydrophobicContact CB-CD2 4.5Å; V582-F617 HydrophobicContact CB-CE2 4.34Å; V582-F617 HydrophobicContact CG2-CD2 3.96Å; V582-F617 HydrophobicContact CG2-CE2 4.11Å; V582-I628 HydrophobicContact CB-CD1 4.31Å; V582-I628 HydrophobicContact CG1-CD1 3.97Å; V582-I628 HydrophobicContact CG2-CD1 4.02Å; V582-I647 HydrophobicContact CB-CG1 4.46Å; V582-I647 HydrophobicContact CG1-CG1 3.84Å; V582-I647 HydrophobicContact CG2-CG1 4.03Å; V582-I647 HydrophobicContact CG2-CG2 4.29Å
583	N	85.3	Confident	75.7	Confident	9 Å²	9	50.4 Å²	50.4	5%	0.048	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	141.3	177.4	-55.9	-102.5	0	0	0	108.8	S581 Y585 K612 C613 I645 Q646	S581-N583 PolarHBondContact OG-ND2 3.11Å; S581-N583 VanDerWaalsContact OG-ND2 3.13Å; N583-Y585 HydrophobicContact CB-CD1 4.25Å; N583-Y585 HydrophobicContact CB-CE1 4.38Å; N583-K612 WeakPolarHBondContact OD1-CE 3.49Å; N583-K612 PolarHBondContact OD1-NZ 2.91Å; N583-C613 WeakPolarHBondContact CA-O 3.21Å; N583-I645 CarbonylContact O-C 3.59Å; N583-I645 WeakPolarHBondContact O-CA 3.3Å; N583-Q646 HydrophobicContact CB-CB 4.3Å; N583-Q646 PolarHBondContact N-O 2.71Å; N583-Q646 PolarHBondContact ND2-O 2.99Å; N583-Q646 PolarHBondContact O-N 2.88Å
584	I	87.4	Confident	74.9	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	126.7	166.3	-47	179.9	0	0	0	106.8	I567 L606 K612 C613 F615 F630 F644 I645 F658	I567-I584 HydrophobicContact CD1-CD1 3.47Å; I567-I584 VanDerWaalsContact CD1-CD1 3.47Å; I567-I584 HydrophobicContact CD1-CG1 4.23Å; I584-L606 HydrophobicContact CG2-CD1 3.89Å; I584-K612 CarbonylContact O-C 3.49Å; I584-K612 WeakPolarHBondContact O-CA 3.46Å; I584-C613 HydrophobicContact CB-CB 4.27Å; I584-C613 PolarHBondContact N-O 3.06Å; I584-C613 VanDerWaalsContact N-O 3.07Å; I584-C613 PolarHBondContact O-N 3.38Å; I584-F615 HydrophobicContact CD1-CE2 3.71Å; I584-F615 HydrophobicContact CD1-CZ 4.36Å; I584-F615 HydrophobicContact CG1-CE2 4.06Å; I584-F630 HydrophobicContact CD1-CB 4.01Å; I584-F630 HydrophobicContact CD1-CD1 4.25Å; I584-F630 HydrophobicContact CD1-CG 4.12Å; I584-F644 WeakPolarHBondContact CA-O 3.32Å; I584-I645 HydrophobicContact CG1-CG1 4.21Å; I584-I645 HydrophobicContact CG2-CG1 3.94Å; I584-F658 HydrophobicContact CG2-CE1 3.73Å; I584-F658 HydrophobicContact CG2-CZ 3.97Å
585	Y	87.4	Confident	74	Confident	39 Å²	39	59.7 Å²	59.7	15%	0.153	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	158.3	-179.3	50.6	-82.7	0	0	0	112.9	N583 E611 G643 F644 Q646 E655	N583-Y585 HydrophobicContact CB-CD1 4.25Å; N583-Y585 HydrophobicContact CB-CE1 4.38Å; Y585-E611 CarbonylContact C-O 3.59Å; Y585-E611 WeakPolarHBondContact CA-O 3.47Å; Y585-G643 CarbonylContact O-C 3.35Å; Y585-G643 WeakPolarHBondContact O-CA 3.2Å; Y585-F644 HydrophobicContact CD2-CB 4.15Å; Y585-F644 HydrophobicContact CD2-CD2 4.09Å; Y585-F644 HydrophobicContact CE1-CB 4.1Å; Y585-F644 HydrophobicContact CE2-CB 3.59Å; Y585-F644 AromaticContact CE2-CD2 3.65Å; Y585-F644 HydrophobicContact CE2-CD2 3.65Å; Y585-F644 AromaticContact CE2-CG 3.93Å; Y585-F644 HydrophobicContact CE2-CG 3.93Å; Y585-F644 PolarHBondContact N-O 3.06Å; Y585-F644 PolarHBondContact O-N 2.63Å; Y585-Q646 HydrophobicContact CE1-CB 4.08Å; Y585-E655 PolarHBondContact OH-OE1 2.82Å
586	T	86.5	Confident	73	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.006	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	145	175.6	51.4	0	0	0	0	111.8	L606 G608 P609 C610 E611 I641 K642 F658 Y660	T586-L606 HydrophobicContact CG2-CB 4.37Å; T586-L606 HydrophobicContact CG2-CD1 4.05Å; T586-L606 HydrophobicContact CG2-CD2 4.33Å; T586-L606 HydrophobicContact CG2-CG 4.49Å; T586-G608 PolarHBondContact OG1-O 3.2Å; T586-P609 WeakPolarHBondContact OG1-CA 3.2Å; T586-C610 VanDerWaalsContact O-CA 3.3Å; T586-C610 WeakPolarHBondContact O-CA 3.39Å; T586-C610 PolarHBondContact O-N 3.06Å; T586-C610 PolarHBondContact OG1-N 3.03Å; T586-E611 PolarHBondContact N-O 3.49Å; T586-E611 PolarHBondContact OG1-N 2.86Å; T586-E611 VanDerWaalsContact OG1-N 3.08Å; T586-I641 HydrophobicContact CG2-CG2 3.99Å; T586-K642 CarbonylContact C-O 3.54Å; T586-K642 WeakPolarHBondContact CA-O 3.25Å; T586-F658 HydrophobicContact CG2-CZ 4.45Å; T586-Y660 HydrophobicContact CG2-CE1 4.47Å
587	E	81.6	Confident	72.1	Confident	77 Å²	77	65.6 Å²	65.6	36%	0.36	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	163.1	178.1	-170.4	161.6	-140	0	0	111	K642 F644	E587-K642 PolarHBondContact N-O 3.09Å; E587-F644 HydrophobicContact CB-CE2 4.44Å
588	S	69.9	Low	71.1	Confident	34 Å²	34	72.1 Å²	72.1	24%	0.238	37%	0.371	C	S	.	.			trans	-98.2	132.5	176.7	-174.1	0	0	0	0	111.1	N590	S588-N590 PolarHBondContact O-N 3.28Å
589	D	65.4	Low	70.2	Confident	73 Å²	73	73.1 Å²	73.1	39%	0.39	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-11.5	-179.8	-91.6	-20.6	0	0	0	115.1	N591 H640 K642	D589-N591 PolarHBondContact O-N 2.87Å; D589-H640 IonicContact OD1-CE1 2.87Å; D589-H640 IonicContact OD1-ND1 2.75Å; D589-H640 PolarHBondContact OD1-ND1 3.14Å; D589-H640 IonicContact OD2-CE1 3.12Å; D589-H640 IonicContact OD2-CG 2.89Å; D589-H640 IonicContact OD2-ND1 3.87Å; D589-H640 PolarHBondContact OD2-ND1 3.37Å; D589-K642 WeakPolarHBondContact OD1-CD 3.4Å; D589-K642 WeakPolarHBondContact OD1-CE 3.34Å; D589-K642 IonicContact OD1-NZ 2.72Å
590	N	59	Low	69.2	Low	138 Å²	138	76.1 Å²	76.1	74%	0.738	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	12.7	-174.2	-76.7	-23.5	0	0	0	115.3	S588 A592	S588-N590 PolarHBondContact O-N 3.28Å; N590-A592 PolarHBondContact O-N 2.97Å
591	N	52.8	Low	67.9	Low	155 Å²	155	81 Å²	81	83%	0.829	41%	0.406	S	S	*	.			trans	55.8	10.2	-170.7	-70	-19.6	0	0	0	115	D589 K593	D589-N591 PolarHBondContact O-N 2.87Å; N591-K593 PolarHBondContact O-N 3.33Å; N591-K593 VanDerWaalsContact O-N 3.13Å
592	A	55	Low	66.5	Low	57 Å²	57	88.9 Å²	88.9	47%	0.471	44%	0.44	S	S	.	.			trans	-76.7	99.1	175	0	0	0	0	0	108.8	N590 C594	N590-A592 PolarHBondContact O-N 2.97Å; A592-C594 PolarHBondContact O-N 2.84Å
593	K	56.6	Low	65.5	Low	181 Å²	181	91.8 Å²	91.8	79%	0.787	47%	0.47	S	S	*	.			trans	-48.9	126.1	173.9	-75	-176.6	174.8	180	0	109.8	N591 E595	N591-K593 PolarHBondContact O-N 3.33Å; N591-K593 VanDerWaalsContact O-N 3.13Å; K593-E595 PolarHBondContact O-N 2.91Å
594	C	62.5	Low	65	Low	34 Å²	34	92.1 Å²	92.1	23%	0.23	47%	0.473	C	S	.	.			trans	-62.1	95.3	176.7	-62.1	0	0	0	0	110.8	A592 I596 M597 C610	A592-C594 PolarHBondContact O-N 2.84Å; C594-I596 PolarHBondContact O-N 2.93Å; C594-M597 HydrophobicContact CB-CG 4.16Å; C594-C610 HydrophobicContact CB-CB 3.62Å; C594-C610 WeakPolarHBondContact CB-SG 3.37Å; C594-C610 WeakPolarHBondContact SG-CA 3.18Å; C594-C610 WeakPolarHBondContact SG-CB 3.34Å; C594-C610 CovalentContact SG-SG 2.03Å; C594-C610 PolarHBondContact SG-SG 2.79Å
595	E	56.9	Low	64.5	Low	197 Å²	197	95 Å²	95	92%	0.921	49%	0.487	S	S	*	.	S	Bend	trans	-57.6	-32.1	180	-65.4	-171.6	133.5	0	0	112.4	K593	K593-E595 PolarHBondContact O-N 2.91Å
596	I	56.4	Low	64.2	Low	143 Å²	143	93.2 Å²	93.2	73%	0.733	48%	0.48	S	S	*	.	S	Bend	trans	-136.9	110.7	174.7	-53	178.1	0	0	0	108.8	C594	C594-I596 PolarHBondContact O-N 2.93Å
597	M	62	Low	63.5	Low	73 Å²	73	94.7 Å²	94.7	36%	0.36	49%	0.49	S	S	.	.			trans	-77.5	129.9	166.1	-75.7	-175	-71.9	0	0	110.3	C594 H599 C610 K612	C594-M597 HydrophobicContact CB-CG 4.16Å; M597-H599 PolarHBondContact O-N 2.84Å; M597-C610 WeakPolarHBondContact CA-O 3.37Å; M597-K612 HydrophobicContact CB-CB 4.13Å; M597-K612 HydrophobicContact CE-CD 3.89Å; M597-K612 HydrophobicContact SD-CB 4.05Å; M597-K612 HydrophobicContact SD-CD 3.86Å; M597-K612 HydrophobicContact SD-CG 4.49Å
598	K	61.7	Low	63.1	Low	137 Å²	137	91.2 Å²	91.2	60%	0.596	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	109.3	175.3	-66.3	173.7	-174.1	164.6	0	110.2	C610 E611 K612	K598-C610 PolarHBondContact N-O 2.84Å; K598-E611 HydrophobicContact CB-CG 4.37Å; K598-K612 PolarHBondContact O-N 3.19Å
599	H	62.2	Low	63.3	Low	91 Å²	91	91.3 Å²	91.3	42%	0.421	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	130.7	170.4	-84.6	-83.8	0	0	0	111.3	M597 K612	M597-H599 PolarHBondContact O-N 2.84Å; H599-K612 WeakPolarHBondContact CA-O 3.43Å
600	K	61.2	Low	64	Low	66 Å²	66	89.1 Å²	89.1	29%	0.287	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.4	167.6	-80.7	170.9	172.4	161.4	0	109.8	Q605 S607 E611 K612	K600-Q605 WeakPolarHBondContact CD-O 3.38Å; K600-Q605 WeakPolarHBondContact CE-O 3.37Å; K600-Q605 PolarHBondContact NZ-O 2.81Å; K600-S607 PolarHBondContact NZ-OG 2.99Å; K600-E611 IonicContact NZ-OE1 3.24Å; K600-E611 PolarHBondContact NZ-OE1 2.77Å; K600-E611 IonicContact NZ-OE2 2.76Å; K600-E611 PolarHBondContact NZ-OE2 2.87Å; K600-K612 PolarHBondContact N-O 3.11Å
601	H	52.1	Low	65	Low	174 Å²	174	83.1 Å²	83.1	81%	0.806	43%	0.433	S	S	*	.	S	Bend	trans	-101.8	-19.8	-173.4	-71.9	-76	0	0	0	114.1
602	E	51.5	Low	66.5	Low	187 Å²	187	77.5 Å²	77.5	87%	0.874	40%	0.401	S	S	*	.	S	Bend	trans	-130.6	121.3	174.5	-65.9	-173.7	144.9	0	0	109.3
603	G	61.2	Low	67.8	Low	61 Å²	61	75 Å²	75	63%	0.629	38%	0.379	S	S	*	.	S	Bend	trans	69.9	113.9	-177.3	0	0	0	0	0	113.9	Q605	G603-Q605 VanDerWaalsContact C-N 3.33Å; G603-Q605 PolarHBondContact O-N 2.96Å
604	C	75	Confident	68.8	Low	17 Å²	17	70.3 Å²	70.3	12%	0.115	36%	0.363	C	S	.	.			trans	-76.5	85	173.3	-177.8	0	0	0	0	110.9	C613 F615 F630 S631	C604-C613 WeakPolarHBondContact CA-SG 3.48Å; C604-C613 HydrophobicContact CB-CB 3.8Å; C604-C613 WeakPolarHBondContact CB-SG 3.3Å; C604-C613 WeakPolarHBondContact SG-CB 3.4Å; C604-C613 CovalentContact SG-SG 2.03Å; C604-C613 PolarHBondContact SG-SG 3.26Å; C604-F615 HydrophobicContact CB-CE1 4.24Å; C604-F615 HydrophobicContact CB-CE2 4.12Å; C604-F615 HydrophobicContact CB-CZ 3.45Å; C604-F615 VanDerWaalsContact CB-CZ 3.45Å; C604-F630 HydrophobicContact CB-CB 4.2Å; C604-F630 CarbonylContact O-C 3.55Å; C604-F630 WeakPolarHBondContact O-CA 3.5Å; C604-S631 PolarHBondContact O-N 2.85Å
605	Q	78.3	Confident	69.5	Low	60 Å²	60	70.7 Å²	70.7	28%	0.28	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	117.2	168.9	-179.8	-172.9	-8.6	0	0	109.8	K600 G603 S631	K600-Q605 WeakPolarHBondContact CD-O 3.38Å; K600-Q605 WeakPolarHBondContact CE-O 3.37Å; K600-Q605 PolarHBondContact NZ-O 2.81Å; G603-Q605 VanDerWaalsContact C-N 3.33Å; G603-Q605 PolarHBondContact O-N 2.96Å; Q605-S631 CarbonylContact C-O 3.09Å; Q605-S631 WeakPolarHBondContact CA-O 3.39Å
606	L	80.9	Confident	70	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.005	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	110.2	174	-59.3	168.8	0	0	0	109.3	I584 T586 E611 F630 S631 W632 G633 F658	I584-L606 HydrophobicContact CG2-CD1 3.89Å; T586-L606 HydrophobicContact CG2-CB 4.37Å; T586-L606 HydrophobicContact CG2-CD1 4.05Å; T586-L606 HydrophobicContact CG2-CD2 4.33Å; T586-L606 HydrophobicContact CG2-CG 4.49Å; L606-E611 WeakPolarHBondContact CA-OE2 3.44Å; L606-E611 HydrophobicContact CD2-CB 4.05Å; L606-F630 HydrophobicContact CD1-CD2 4.17Å; L606-F630 HydrophobicContact CD1-CE2 4.45Å; L606-S631 PolarHBondContact N-O 3.25Å; L606-W632 WeakPolarHBondContact O-CA 3.24Å; L606-G633 PolarHBondContact O-N 2.73Å; L606-G633 VanDerWaalsContact O-N 3.14Å; L606-F658 HydrophobicContact CD1-CE2 4.45Å; L606-F658 HydrophobicContact CD1-CZ 3.88Å
607	S	71.9	Confident	70.5	Confident	33 Å²	33	66 Å²	66	23%	0.231	34%	0.335	C	S	.	.			trans	-102.6	4.4	-177.5	44.8	0	0	0	0	115.5	K600 E611 G633	K600-S607 PolarHBondContact NZ-OG 2.99Å; S607-E611 PolarHBondContact N-OE2 2.81Å; S607-E611 PolarHBondContact OG-OE1 2.91Å; S607-E611 PolarHBondContact OG-OE2 3.09Å; S607-G633 WeakPolarHBondContact CA-O 3.26Å
608	G	72.6	Confident	70.7	Confident	3 Å²	3	68.4 Å²	68.4	3%	0.031	35%	0.353	C	S	.	.	S	Bend	trans	169.7	-169.1	176	0	0	0	0	0	112.6	T586 E635	T586-G608 PolarHBondContact OG1-O 3.2Å; G608-E635 WeakPolarHBondContact CA-OE2 3.27Å
609	P	74.9	Confident	71.5	Confident	36 Å²	36	67.3 Å²	67.3	23%	0.234	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	157.6	174.6	29.9	-35	0	0	0	112.3	T586 E611 E635	T586-P609 WeakPolarHBondContact OG1-CA 3.2Å; P609-E611 VanDerWaalsContact C-N 3.33Å; P609-E611 PolarHBondContact O-N 2.9Å; P609-E635 WeakPolarHBondContact CD-OE1 3.33Å
610	C	78.7	Confident	72.5	Confident	28 Å²	28	63 Å²	63	19%	0.189	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	33.6	-179.1	-55.9	0	0	0	0	114.9	T586 C594 M597 K598	T586-C610 VanDerWaalsContact O-CA 3.3Å; T586-C610 WeakPolarHBondContact O-CA 3.39Å; T586-C610 PolarHBondContact O-N 3.06Å; T586-C610 PolarHBondContact OG1-N 3.03Å; C594-C610 HydrophobicContact CB-CB 3.62Å; C594-C610 WeakPolarHBondContact CB-SG 3.37Å; C594-C610 WeakPolarHBondContact SG-CA 3.18Å; C594-C610 WeakPolarHBondContact SG-CB 3.34Å; C594-C610 CovalentContact SG-SG 2.03Å; C594-C610 PolarHBondContact SG-SG 2.79Å; M597-C610 WeakPolarHBondContact CA-O 3.37Å; K598-C610 PolarHBondContact N-O 2.84Å
611	E	80.7	Confident	73.6	Confident	12 Å²	12	66.6 Å²	66.6	6%	0.056	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	150.9	170.3	-61.5	-165	176.8	0	0	111.1	Y585 T586 K598 K600 L606 S607 P609	Y585-E611 CarbonylContact C-O 3.59Å; Y585-E611 WeakPolarHBondContact CA-O 3.47Å; T586-E611 PolarHBondContact N-O 3.49Å; T586-E611 PolarHBondContact OG1-N 2.86Å; T586-E611 VanDerWaalsContact OG1-N 3.08Å; K598-E611 HydrophobicContact CB-CG 4.37Å; K600-E611 IonicContact NZ-OE1 3.24Å; K600-E611 PolarHBondContact NZ-OE1 2.77Å; K600-E611 IonicContact NZ-OE2 2.76Å; K600-E611 PolarHBondContact NZ-OE2 2.87Å; L606-E611 WeakPolarHBondContact CA-OE2 3.44Å; L606-E611 HydrophobicContact CD2-CB 4.05Å; S607-E611 PolarHBondContact N-OE2 2.81Å; S607-E611 PolarHBondContact OG-OE1 2.91Å; S607-E611 PolarHBondContact OG-OE2 3.09Å; P609-E611 VanDerWaalsContact C-N 3.33Å; P609-E611 PolarHBondContact O-N 2.9Å
612	K	83.2	Confident	74.9	Confident	36 Å²	36	60.7 Å²	60.7	16%	0.157	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	127.1	-179.3	-179.8	169.7	176	173.5	0	113.3	N583 I584 M597 K598 H599 K600	N583-K612 WeakPolarHBondContact OD1-CE 3.49Å; N583-K612 PolarHBondContact OD1-NZ 2.91Å; I584-K612 CarbonylContact O-C 3.49Å; I584-K612 WeakPolarHBondContact O-CA 3.46Å; M597-K612 HydrophobicContact CB-CB 4.13Å; M597-K612 HydrophobicContact CE-CD 3.89Å; M597-K612 HydrophobicContact SD-CB 4.05Å; M597-K612 HydrophobicContact SD-CD 3.86Å; M597-K612 HydrophobicContact SD-CG 4.49Å; K598-K612 PolarHBondContact O-N 3.19Å; H599-K612 WeakPolarHBondContact CA-O 3.43Å; K600-K612 PolarHBondContact N-O 3.11Å
613	C	82.7	Confident	76.2	Confident	4 Å²	4	56.9 Å²	56.9	3%	0.027	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	144	162.8	-52.7	0	0	0	0	110.5	N583 I584 C604 F615	N583-C613 WeakPolarHBondContact CA-O 3.21Å; I584-C613 HydrophobicContact CB-CB 4.27Å; I584-C613 PolarHBondContact N-O 3.06Å; I584-C613 VanDerWaalsContact N-O 3.07Å; I584-C613 PolarHBondContact O-N 3.38Å; C604-C613 WeakPolarHBondContact CA-SG 3.48Å; C604-C613 HydrophobicContact CB-CB 3.8Å; C604-C613 WeakPolarHBondContact CB-SG 3.3Å; C604-C613 WeakPolarHBondContact SG-CB 3.4Å; C604-C613 CovalentContact SG-SG 2.03Å; C604-C613 PolarHBondContact SG-SG 3.26Å; C613-F615 HydrophobicContact CB-CE2 3.93Å
614	L	78.9	Confident	77.4	Confident	83 Å²	83	55.8 Å²	55.8	44%	0.435	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	126.9	168.4	171.9	64.6	0	0	0	108
615	F	76.6	Confident	78	Confident	43 Å²	43	61 Å²	61	19%	0.189	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	136.7	172.2	-55.1	-101.3	0	0	0	109.6	V582 I584 C604 C613 F617 I628	V582-F615 HydrophobicContact CB-CB 4.3Å; V582-F615 HydrophobicContact CB-CD2 4.49Å; V582-F615 HydrophobicContact CG1-CD2 4.44Å; V582-F615 PolarHBondContact N-O 2.69Å; V582-F615 VanDerWaalsContact N-O 3.14Å; V582-F615 PolarHBondContact O-N 3.18Å; I584-F615 HydrophobicContact CD1-CE2 3.71Å; I584-F615 HydrophobicContact CD1-CZ 4.36Å; I584-F615 HydrophobicContact CG1-CE2 4.06Å; C604-F615 HydrophobicContact CB-CE1 4.24Å; C604-F615 HydrophobicContact CB-CE2 4.12Å; C604-F615 HydrophobicContact CB-CZ 3.45Å; C604-F615 VanDerWaalsContact CB-CZ 3.45Å; C613-F615 HydrophobicContact CB-CE2 3.93Å; F615-F617 HydrophobicContact CB-CD2 3.99Å; F615-F617 HydrophobicContact CB-CE2 3.38Å; F615-F617 HydrophobicContact CB-CZ 4.08Å; F615-F617 HydrophobicContact CD1-CE2 4.42Å; F615-F617 HydrophobicContact CD1-CZ 4.37Å; F615-F617 HydrophobicContact CG-CE2 4.08Å; F615-F617 HydrophobicContact CG-CZ 4.48Å; F615-I628 HydrophobicContact CD1-CG2 4.03Å; F615-I628 HydrophobicContact CD2-CG2 4.16Å; F615-I628 HydrophobicContact CE1-CG2 3.69Å; F615-I628 HydrophobicContact CE2-CG2 3.85Å; F615-I628 HydrophobicContact CG-CG2 4.25Å; F615-I628 HydrophobicContact CZ-CG2 3.57Å
616	Q	67.7	Low	78.3	Confident	174 Å²	174	59.8 Å²	59.8	81%	0.813	31%	0.314	S	S	*	.			trans	-101	131.8	168	-70.2	177.3	-26.9	0	0	108.7
617	F	67.4	Low	78.6	Confident	67 Å²	67	64 Å²	64	29%	0.294	34%	0.336	S	S	.	.			trans	-137	160.1	173.7	-65.5	-80.1	0	0	0	106.9	L579 V582 F615 V626 I628	L579-F617 HydrophobicContact CB-CB 3.98Å; L579-F617 HydrophobicContact CD1-CB 3.73Å; L579-F617 HydrophobicContact CD1-CD2 3.84Å; L579-F617 HydrophobicContact CD1-CG 3.92Å; L579-F617 HydrophobicContact CG-CB 4.37Å; V582-F617 HydrophobicContact CB-CD2 4.5Å; V582-F617 HydrophobicContact CB-CE2 4.34Å; V582-F617 HydrophobicContact CG2-CD2 3.96Å; V582-F617 HydrophobicContact CG2-CE2 4.11Å; F615-F617 HydrophobicContact CB-CD2 3.99Å; F615-F617 HydrophobicContact CB-CE2 3.38Å; F615-F617 HydrophobicContact CB-CZ 4.08Å; F615-F617 HydrophobicContact CD1-CE2 4.42Å; F615-F617 HydrophobicContact CD1-CZ 4.37Å; F615-F617 HydrophobicContact CG-CE2 4.08Å; F615-F617 HydrophobicContact CG-CZ 4.48Å; F617-V626 HydrophobicContact CE1-CG1 4.39Å; F617-I628 HydrophobicContact CD2-CD1 4.49Å; F617-I628 HydrophobicContact CE2-CD1 3.57Å; F617-I628 HydrophobicContact CE2-CG1 4.04Å; F617-I628 HydrophobicContact CZ-CD1 3.85Å; F617-I628 HydrophobicContact CZ-CG1 3.76Å; F617-I628 HydrophobicContact CZ-CG2 4.38Å
618	T	64.3	Low	79.2	Confident	123 Å²	123	62.4 Å²	62.4	76%	0.755	33%	0.325	S	S	*	.			trans	-124.2	-25	-173.8	42.4	0	0	0	0	115.1	E578	E578-T618 WeakPolarHBondContact CG-O 3.49Å
619	E	78.8	Confident	79.8	Confident	114 Å²	114	66.8 Å²	66.8	53%	0.533	35%	0.353	S	S	.	.			trans	-162	146.9	169.6	-135.7	179.7	-176.7	0	0	112.4	P576	P576-E619 HydrophobicContact CB-CG 4.06Å; P576-E619 WeakPolarHBondContact CB-OE1 3.35Å; P576-E619 WeakPolarHBondContact CG-OE1 3.34Å
620	I	83.3	Confident	80.4	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.01	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-110	125.3	161.3	-50.8	-178.7	0	0	0	108	L538 I569 N571 P576 V577 L579 S624 V626	L538-I620 HydrophobicContact CD1-CD1 4Å; L538-I620 HydrophobicContact CD2-CD1 4.5Å; I569-I620 HydrophobicContact CB-CD1 4.33Å; I569-I620 HydrophobicContact CG2-CD1 3.68Å; N571-I620 HydrophobicContact CB-CB 4.2Å; N571-I620 HydrophobicContact CB-CG2 3.55Å; N571-I620 PolarHBondContact ND2-O 3.45Å; P576-I620 CarbonylContact C-O 3.19Å; P576-I620 WeakPolarHBondContact CA-O 3.5Å; P576-I620 WeakPolarHBondContact CB-O 3.35Å; V577-I620 PolarHBondContact N-O 3.5Å; V577-I620 PolarHBondContact O-N 3.44Å; L579-I620 HydrophobicContact CD1-CD1 3.98Å; L579-I620 HydrophobicContact CD1-CG1 4.16Å; L579-I620 HydrophobicContact CD2-CD1 3.94Å; L579-I620 HydrophobicContact CD2-CG1 4.47Å; L579-I620 HydrophobicContact CG-CD1 3.96Å; L579-I620 HydrophobicContact CG-CG1 4.02Å; I620-S624 WeakPolarHBondContact CG2-OG 3.12Å; I620-V626 HydrophobicContact CD1-CG2 4.39Å; I620-V626 HydrophobicContact CG1-CG2 4.09Å; I620-V626 HydrophobicContact CG2-CG2 4.06Å
621	Q	84.3	Confident	80.8	Confident	141 Å²	141	65.1 Å²	65.1	66%	0.659	34%	0.342	S	S	*	.			trans	-68.2	162.9	-179.8	-63.6	-173	-1	0	0	112.6	N571 L623 S624	N571-Q621 WeakPolarHBondContact CB-O 3.29Å; N571-Q621 PolarHBondContact ND2-O 2.91Å; Q621-L623 PolarHBondContact O-N 2.9Å; Q621-S624 PolarHBondContact N-OG 3.37Å; Q621-S624 PolarHBondContact O-N 2.83Å; Q621-S624 PolarHBondContact O-OG 2.82Å
622	S	80.8	Confident	81.1	Confident	49 Å²	49	64.7 Å²	64.7	34%	0.343	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	126.6	174	152	0	0	0	0	110.6	N573 S624	N573-S622 PolarHBondContact O-OG 3.18Å; S622-S624 VanDerWaalsContact C-N 3.29Å; S622-S624 PolarHBondContact O-N 3.42Å
623	L	79.1	Confident	80.9	Confident	108 Å²	108	63 Å²	63	57%	0.565	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	24.9	179.6	-54.5	173	0	0	0	115	N571 Q621	N571-L623 WeakPolarHBondContact O-CA 3.16Å; N571-L623 PolarHBondContact O-N 3.45Å; Q621-L623 PolarHBondContact O-N 2.9Å
624	S	85.5	Confident	80.8	Confident	37 Å²	37	65.9 Å²	65.9	26%	0.259	35%	0.348	S	S	.	.			trans	-106	159.9	171.5	67.1	0	0	0	0	113.1	N571 I620 Q621 S622	N571-S624 PolarHBondContact N-O 3.19Å; I620-S624 WeakPolarHBondContact CG2-OG 3.12Å; Q621-S624 PolarHBondContact N-OG 3.37Å; Q621-S624 PolarHBondContact O-N 2.83Å; Q621-S624 PolarHBondContact O-OG 2.82Å; S622-S624 VanDerWaalsContact C-N 3.29Å; S622-S624 PolarHBondContact O-N 3.42Å
625	E	86.5	Confident	80.9	Confident	126 Å²	126	63.4 Å²	63.4	59%	0.589	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	151.1	171.9	63.9	-167.6	-169.4	0	0	111.5	I569 V570	I569-E625 CarbonylContact O-C 3.57Å; I569-E625 WeakPolarHBondContact O-CA 3.23Å; V570-E625 HydrophobicContact CB-CB 4.5Å; V570-E625 HydrophobicContact CG1-CB 4.43Å; V570-E625 HydrophobicContact CG2-CB 3.94Å
626	V	86.3	Confident	80.9	Confident	36 Å²	36	68 Å²	68	22%	0.218	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	124.9	177.2	174.4	0	0	0	0	109	I569 F617 I620 I628	I569-V626 PolarHBondContact N-O 2.84Å; I569-V626 PolarHBondContact O-N 2.03Å; F617-V626 HydrophobicContact CE1-CG1 4.39Å; I620-V626 HydrophobicContact CD1-CG2 4.39Å; I620-V626 HydrophobicContact CG1-CG2 4.09Å; I620-V626 HydrophobicContact CG2-CG2 4.06Å; V626-I628 HydrophobicContact CG1-CG1 4.39Å
627	N	85.5	Confident	81.4	Confident	88 Å²	88	63.5 Å²	63.5	47%	0.471	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.5	-176.1	-60	8.7	0	0	0	109.4	I567 T568 P629	I567-N627 CarbonylContact O-C 3.57Å; I567-N627 WeakPolarHBondContact O-CA 3.5Å; T568-N627 WeakPolarHBondContact CG2-OD1 3.3Å; T568-N627 PolarHBondContact OG1-OD1 3.07Å; N627-P629 WeakPolarHBondContact O-CD 3.46Å
628	I	85.8	Confident	81.8	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	107.6	-177.8	-51.5	176.6	0	0	0	108.2	I567 I569 V582 F615 F617 V626	I567-I628 HydrophobicContact CB-CB 4.28Å; I567-I628 PolarHBondContact N-O 3.13Å; I567-I628 PolarHBondContact O-N 2.81Å; I569-I628 HydrophobicContact CD1-CD1 3.63Å; V582-I628 HydrophobicContact CB-CD1 4.31Å; V582-I628 HydrophobicContact CG1-CD1 3.97Å; V582-I628 HydrophobicContact CG2-CD1 4.02Å; F615-I628 HydrophobicContact CD1-CG2 4.03Å; F615-I628 HydrophobicContact CD2-CG2 4.16Å; F615-I628 HydrophobicContact CE1-CG2 3.69Å; F615-I628 HydrophobicContact CE2-CG2 3.85Å; F615-I628 HydrophobicContact CG-CG2 4.25Å; F615-I628 HydrophobicContact CZ-CG2 3.57Å; F617-I628 HydrophobicContact CD2-CD1 4.49Å; F617-I628 HydrophobicContact CE2-CD1 3.57Å; F617-I628 HydrophobicContact CE2-CG1 4.04Å; F617-I628 HydrophobicContact CZ-CD1 3.85Å; F617-I628 HydrophobicContact CZ-CG1 3.76Å; F617-I628 HydrophobicContact CZ-CG2 4.38Å; V626-I628 HydrophobicContact CG1-CG1 4.39Å
629	P	84.9	Confident	82.6	Confident	94 Å²	94	59.9 Å²	59.9	61%	0.61	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	138.8	178.3	31.2	-33.8	0	0	0	111.8	Q565 N627	Q565-P629 WeakPolarHBondContact O-CA 3.3Å; N627-P629 WeakPolarHBondContact O-CD 3.46Å
630	F	87.5	Confident	82.9	Confident	3 Å²	3	56.4 Å²	56.4	1%	0.013	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	156.9	167.9	75.7	-79.4	0	0	0	111.2	L554 Q565 I567 I584 C604 L606 W632	L554-F630 HydrophobicContact CD1-CE2 3.91Å; L554-F630 HydrophobicContact CD1-CZ 3.82Å; L554-F630 HydrophobicContact CD2-CZ 4.45Å; Q565-F630 HydrophobicContact CB-CD1 4.07Å; Q565-F630 HydrophobicContact CB-CE1 3.61Å; Q565-F630 HydrophobicContact CB-CE2 4.27Å; Q565-F630 HydrophobicContact CB-CZ 3.74Å; Q565-F630 HydrophobicContact CG-CD1 4.28Å; Q565-F630 HydrophobicContact CG-CE1 3.41Å; Q565-F630 VanDerWaalsContact CG-CE1 3.41Å; Q565-F630 HydrophobicContact CG-CZ 3.57Å; Q565-F630 PolarHBondContact N-O 3.46Å; Q565-F630 WeakPolarHBondContact O-CD1 3.14Å; Q565-F630 PolarHBondContact O-N 3.29Å; Q565-F630 VanDerWaalsContact O-O 3.05Å; I567-F630 HydrophobicContact CD1-CD1 3.82Å; I567-F630 HydrophobicContact CD1-CE1 3.85Å; I567-F630 HydrophobicContact CG1-CD1 4.12Å; I567-F630 HydrophobicContact CG1-CE1 3.83Å; I584-F630 HydrophobicContact CD1-CB 4.01Å; I584-F630 HydrophobicContact CD1-CD1 4.25Å; I584-F630 HydrophobicContact CD1-CG 4.12Å; C604-F630 HydrophobicContact CB-CB 4.2Å; C604-F630 CarbonylContact O-C 3.55Å; C604-F630 WeakPolarHBondContact O-CA 3.5Å; L606-F630 HydrophobicContact CD1-CD2 4.17Å; L606-F630 HydrophobicContact CD1-CE2 4.45Å; F630-W632 HydrophobicContact CE2-CB 4.41Å; F630-W632 AromaticContact CE2-CD1 3.67Å; F630-W632 HydrophobicContact CE2-CG 4.32Å
631	S	86.4	Confident	82.9	Confident	26 Å²	26	56.4 Å²	56.4	18%	0.182	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	150.1	175.6	-59	0	0	0	0	110.4	R563 N564 C604 Q605 L606	R563-S631 CarbonylContact O-C 3.56Å; R563-S631 WeakPolarHBondContact O-CA 3.36Å; N564-S631 WeakPolarHBondContact OD1-CB 3.35Å; N564-S631 PolarHBondContact OD1-OG 2.8Å; C604-S631 PolarHBondContact O-N 2.85Å; Q605-S631 CarbonylContact C-O 3.09Å; Q605-S631 WeakPolarHBondContact CA-O 3.39Å; L606-S631 PolarHBondContact N-O 3.25Å
632	W	86.8	Confident	83.1	Confident	3 Å²	3	53 Å²	53	1%	0.011	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	155.2	-178.9	56.7	-87.8	0	0	0	111.8	L554 T557 R563 L606 F630 Y660	L554-W632 HydrophobicContact CB-CH2 3.92Å; L554-W632 HydrophobicContact CB-CZ2 3.5Å; L554-W632 HydrophobicContact CD1-CD2 4.14Å; L554-W632 HydrophobicContact CD1-CG 4.13Å; L554-W632 HydrophobicContact CD1-CZ2 4.48Å; L554-W632 WeakPolarHBondContact O-CH2 3.29Å; L554-W632 WeakPolarHBondContact O-CZ2 3.35Å; T557-W632 HydrophobicContact CG2-CE3 4.2Å; T557-W632 HydrophobicContact CG2-CZ3 3.89Å; R563-W632 HydrophobicContact CB-CD2 4.08Å; R563-W632 HydrophobicContact CB-CH2 4.45Å; R563-W632 HydrophobicContact CB-CZ2 3.93Å; R563-W632 VanDerWaalsContact CD-CH2 3.48Å; R563-W632 HydrophobicContact CG-CZ2 4.37Å; R563-W632 PolarHBondContact N-O 2.94Å; R563-W632 PolarHBondContact O-N 2.92Å; L606-W632 WeakPolarHBondContact O-CA 3.24Å; F630-W632 HydrophobicContact CE2-CB 4.41Å; F630-W632 AromaticContact CE2-CD1 3.67Å; F630-W632 HydrophobicContact CE2-CG 4.32Å; W632-Y660 HydrophobicContact CB-CE1 4.48Å; W632-Y660 HydrophobicContact CD2-CD2 4.42Å; W632-Y660 HydrophobicContact CD2-CG 4.46Å; W632-Y660 HydrophobicContact CE3-CD1 4.4Å; W632-Y660 AromaticContact CE3-CD2 3.35Å; W632-Y660 HydrophobicContact CE3-CD2 3.35Å; W632-Y660 AromaticContact CE3-CE2 3.83Å; W632-Y660 HydrophobicContact CE3-CE2 3.83Å; W632-Y660 AromaticContact CE3-CG 3.67Å; W632-Y660 HydrophobicContact CE3-CG 3.67Å; W632-Y660 AromaticContact CZ3-CD2 3.63Å; W632-Y660 HydrophobicContact CZ3-CD2 3.63Å; W632-Y660 HydrophobicContact CZ3-CE2 4.49Å; W632-Y660 AromaticContact CZ3-CG 3.89Å; W632-Y660 HydrophobicContact CZ3-CG 3.89Å
633	G	80.8	Confident	83.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	111.5	-137.9	180	0	0	0	0	0	112.9	Q561 L606 S607 E635	Q561-G633 WeakPolarHBondContact O-CA 3.41Å; L606-G633 PolarHBondContact O-N 2.73Å; L606-G633 VanDerWaalsContact O-N 3.14Å; S607-G633 WeakPolarHBondContact CA-O 3.26Å; G633-E635 PolarHBondContact O-N 3.12Å; G633-E635 VanDerWaalsContact O-N 3.12Å
634	N	80.6	Confident	83.9	Confident	66 Å²	66	47.1 Å²	47.1	35%	0.353	26%	0.259	S	S	.	.			trans	59.6	12.9	-177.6	-159.4	42.6	0	0	0	116.6	G560 Q561 I562	G560-N634 PolarHBondContact O-OD1 2.76Å; Q561-N634 PolarHBondContact O-N 3.06Å; I562-N634 HydrophobicContact CG1-CB 3.77Å
635	E	79.9	Confident	84	Confident	31 Å²	31	45.4 Å²	45.4	15%	0.145	25%	0.246	C	C	.	.			trans	-81.4	144.3	-179.6	-166	138.7	-149.1	0	0	111.9	I559 G560 G608 P609 G633 V637 Q639 I641 V662	I559-E635 WeakPolarHBondContact CA-O 3.19Å; G560-E635 PolarHBondContact N-O 3.37Å; G608-E635 WeakPolarHBondContact CA-OE2 3.27Å; P609-E635 WeakPolarHBondContact CD-OE1 3.33Å; G633-E635 PolarHBondContact O-N 3.12Å; G633-E635 VanDerWaalsContact O-N 3.12Å; E635-V637 VanDerWaalsContact C-N 3.33Å; E635-Q639 PolarHBondContact OE1-NE2 2.76Å; E635-Q639 PolarHBondContact OE2-NE2 3.08Å; E635-I641 WeakPolarHBondContact OE2-CD1 3.4Å; E635-V662 HydrophobicContact CB-CG1 4.45Å; E635-V662 HydrophobicContact CB-CG2 4.24Å
636	N	76.1	Confident	84.1	Confident	138 Å²	138	40.9 Å²	40.9	74%	0.738	23%	0.225	S	C	*	.	S	Bend	trans	-84.3	-5.7	-176.9	-70.3	-44.7	0	0	0	113.8
637	V	78.2	Confident	84.1	Confident	81 Å²	81	39.2 Å²	39.2	49%	0.491	22%	0.215	S	C	.	.	S	Bend	trans	-122.2	142.8	-176.5	-177.1	0	0	0	0	108.9	E635 Q639 V662	E635-V637 VanDerWaalsContact C-N 3.33Å; V637-Q639 PolarHBondContact O-N 3.01Å; V637-V662 WeakPolarHBondContact O-CG1 3Å
638	A	77.1	Confident	84	Confident	46 Å²	46	38.4 Å²	38.4	38%	0.38	21%	0.207	S	C	.	.			trans	-80.3	110	171.3	0	0	0	0	0	109.2	I559 V662 R664	I559-A638 HydrophobicContact CD1-CB 4.16Å; A638-V662 CarbonylContact C-O 3.6Å; A638-V662 WeakPolarHBondContact CA-O 3.48Å; A638-V662 WeakPolarHBondContact CB-O 3.19Å; A638-R664 HydrophobicContact CB-CG 4.24Å
639	Q	81.4	Confident	83.9	Confident	67 Å²	67	38.9 Å²	38.9	31%	0.313	21%	0.211	S	C	.	.			trans	-150.8	165.5	-178	65.4	-173.5	25	0	0	111.5	E635 V637 I641 V662	E635-Q639 PolarHBondContact OE1-NE2 2.76Å; E635-Q639 PolarHBondContact OE2-NE2 3.08Å; V637-Q639 PolarHBondContact O-N 3.01Å; Q639-I641 HydrophobicContact CG-CD1 4.2Å; Q639-I641 HydrophobicContact CG-CG1 4.01Å; Q639-V662 PolarHBondContact N-O 3.21Å; Q639-V662 VanDerWaalsContact N-O 3.16Å; Q639-V662 PolarHBondContact O-N 2.67Å
640	H	83.6	Confident	83.3	Confident	42 Å²	42	39.4 Å²	39.4	19%	0.194	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	144.6	169.6	174.1	-111.9	0	0	0	109.6	D589 E659 Y660 F661	D589-H640 IonicContact OD1-CE1 2.87Å; D589-H640 IonicContact OD1-ND1 2.75Å; D589-H640 PolarHBondContact OD1-ND1 3.14Å; D589-H640 IonicContact OD2-CE1 3.12Å; D589-H640 IonicContact OD2-CG 2.89Å; D589-H640 IonicContact OD2-ND1 3.87Å; D589-H640 PolarHBondContact OD2-ND1 3.37Å; H640-E659 IonicContact CE1-OE1 2.66Å; H640-E659 IonicContact NE2-OE2 2.64Å; H640-Y660 PolarHBondContact CD2-O 3.21Å; H640-F661 HydrophobicContact CB-CD1 3.95Å; H640-F661 HydrophobicContact CB-CE1 3.93Å; H640-F661 AromaticContact CD2-CD1 3.61Å; H640-F661 AromaticContact CD2-CE1 3.25Å; H640-F661 WeakPolarHBondContact CD2-CE1 2.96Å; H640-F661 AromaticContact CD2-CE2 3.77Å; H640-F661 AromaticContact CD2-CZ 3.33Å; H640-F661 WeakPolarHBondContact CD2-CZ 3.35Å; H640-F661 AromaticContact CG-CE1 3.75Å; H640-F661 AromaticContact NE2-CZ 3.79Å
641	I	83.9	Confident	82.4	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	120.3	-174.2	-55.8	165.1	0	0	0	108.8	T586 E635 Q639 Y660 V662	T586-I641 HydrophobicContact CG2-CG2 3.99Å; E635-I641 WeakPolarHBondContact OE2-CD1 3.4Å; Q639-I641 HydrophobicContact CG-CD1 4.2Å; Q639-I641 HydrophobicContact CG-CG1 4.01Å; I641-Y660 HydrophobicContact CB-CD1 4.15Å; I641-Y660 HydrophobicContact CB-CE1 3.78Å; I641-Y660 HydrophobicContact CB-CE2 4.2Å; I641-Y660 HydrophobicContact CD1-CD2 4.33Å; I641-Y660 HydrophobicContact CD1-CE1 4.43Å; I641-Y660 HydrophobicContact CD1-CE2 3.52Å; I641-Y660 HydrophobicContact CG1-CE2 4.4Å; I641-Y660 HydrophobicContact CG2-CD1 4.34Å; I641-Y660 HydrophobicContact CG2-CE1 3.59Å; I641-Y660 PolarHBondContact N-O 2.78Å; I641-Y660 PolarHBondContact O-N 3.33Å; I641-V662 HydrophobicContact CD1-CG2 3.86Å
642	K	87.5	Confident	81.8	Confident	70 Å²	70	41.8 Å²	41.8	30%	0.304	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	149.4	172	-60	-174.1	176.1	175.9	0	110.1	T586 E587 D589 E659	T586-K642 CarbonylContact C-O 3.54Å; T586-K642 WeakPolarHBondContact CA-O 3.25Å; E587-K642 PolarHBondContact N-O 3.09Å; D589-K642 WeakPolarHBondContact OD1-CD 3.4Å; D589-K642 WeakPolarHBondContact OD1-CE 3.34Å; D589-K642 IonicContact OD1-NZ 2.72Å; K642-E659 VanDerWaalsContact CE-OE1 3.23Å; K642-E659 WeakPolarHBondContact CE-OE1 3.4Å; K642-E659 HydrophobicContact CG-CG 4.15Å
643	G	87.6	Confident	81.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	170.3	170.6	0	0	0	0	0	112.5	Y585 Q657 F658	Y585-G643 CarbonylContact O-C 3.35Å; Y585-G643 WeakPolarHBondContact O-CA 3.2Å; G643-Q657 CarbonylContact O-C 3.55Å; G643-Q657 WeakPolarHBondContact O-CA 3.34Å; G643-F658 VanDerWaalsContact C-CD1 3.43Å; G643-F658 PolarHBondContact N-O 3.43Å; G643-F658 WeakPolarHBondContact O-CD1 3.2Å; G643-F658 PolarHBondContact O-N 2.81Å; G643-F658 VanDerWaalsContact O-O 3.09Å
644	F	89.3	Confident	81.5	Confident	33 Å²	33	47.3 Å²	47.3	15%	0.145	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	143.9	-176.1	-58.4	-90.1	0	0	0	110.4	I584 Y585 E587 Q656 Q657 F658	I584-F644 WeakPolarHBondContact CA-O 3.32Å; Y585-F644 HydrophobicContact CD2-CB 4.15Å; Y585-F644 HydrophobicContact CD2-CD2 4.09Å; Y585-F644 HydrophobicContact CE1-CB 4.1Å; Y585-F644 HydrophobicContact CE2-CB 3.59Å; Y585-F644 AromaticContact CE2-CD2 3.65Å; Y585-F644 HydrophobicContact CE2-CD2 3.65Å; Y585-F644 AromaticContact CE2-CG 3.93Å; Y585-F644 HydrophobicContact CE2-CG 3.93Å; Y585-F644 PolarHBondContact N-O 3.06Å; Y585-F644 PolarHBondContact O-N 2.63Å; E587-F644 HydrophobicContact CB-CE2 4.44Å; F644-Q656 CarbonylContact C-O 3.53Å; F644-Q656 WeakPolarHBondContact CA-O 3.43Å; F644-Q657 HydrophobicContact CD1-CB 3.81Å; F644-Q657 HydrophobicContact CD1-CG 4.08Å; F644-Q657 HydrophobicContact CE1-CB 3.7Å; F644-Q657 HydrophobicContact CE1-CG 3.66Å; F644-Q657 HydrophobicContact CZ-CG 4.16Å; F644-F658 VanDerWaalsContact N-CE1 3.31Å
645	I	88.6	Confident	81.7	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	116	173.1	-64.5	152.1	0	0	0	106.9	F540 I542 I567 N583 I584 I647 E655 Q656 F658	F540-I645 HydrophobicContact CE2-CG2 3.89Å; F540-I645 HydrophobicContact CZ-CD1 3.98Å; F540-I645 HydrophobicContact CZ-CG2 4.25Å; I542-I645 HydrophobicContact CD1-CD1 3.51Å; I542-I645 HydrophobicContact CG1-CD1 4.44Å; I567-I645 HydrophobicContact CD1-CD1 3.59Å; I567-I645 HydrophobicContact CD1-CG1 3.9Å; I567-I645 HydrophobicContact CD1-CG2 4.09Å; I567-I645 HydrophobicContact CG1-CD1 3.92Å; N583-I645 CarbonylContact O-C 3.59Å; N583-I645 WeakPolarHBondContact O-CA 3.3Å; I584-I645 HydrophobicContact CG1-CG1 4.21Å; I584-I645 HydrophobicContact CG2-CG1 3.94Å; I645-I647 HydrophobicContact CG2-CD1 4.2Å; I645-I647 HydrophobicContact CG2-CG1 4.18Å; I645-E655 CarbonylContact O-C 3.59Å; I645-E655 WeakPolarHBondContact O-CA 3.35Å; I645-Q656 PolarHBondContact N-O 2.95Å; I645-Q656 PolarHBondContact O-N 2.85Å; I645-F658 HydrophobicContact CD1-CD1 3.74Å; I645-F658 HydrophobicContact CD1-CE1 4.2Å; I645-F658 HydrophobicContact CG1-CD1 3.82Å; I645-F658 HydrophobicContact CG1-CE1 3.88Å
646	Q	88.9	Confident	82.1	Confident	31 Å²	31	48.7 Å²	48.7	15%	0.145	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	100.9	-179.2	-170.6	-173.5	78.1	0	0	109.8	N583 Y585 K648 V653 I654 E655	N583-Q646 HydrophobicContact CB-CB 4.3Å; N583-Q646 PolarHBondContact N-O 2.71Å; N583-Q646 PolarHBondContact ND2-O 2.99Å; N583-Q646 PolarHBondContact O-N 2.88Å; Y585-Q646 HydrophobicContact CE1-CB 4.08Å; Q646-K648 VanDerWaalsContact OE1-NZ 3.07Å; Q646-V653 HydrophobicContact CG-CG1 3.97Å; Q646-I654 CarbonylContact C-O 3.5Å; Q646-I654 WeakPolarHBondContact CA-O 3.04Å; Q646-E655 HydrophobicContact CB-CG 4.31Å; Q646-E655 HydrophobicContact CG-CB 4.35Å; Q646-E655 HydrophobicContact CG-CG 4.35Å; Q646-E655 PolarHBondContact NE2-OE2 2.65Å
647	I	86.2	Confident	82.7	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.6	175.5	-64.1	155.6	0	0	0	108.1	F540 I569 L579 V582 I645 T649 V653 I654	F540-I647 HydrophobicContact CD2-CD1 3.38Å; F540-I647 HydrophobicContact CE2-CD1 3.63Å; I569-I647 HydrophobicContact CD1-CD1 3.56Å; I569-I647 HydrophobicContact CD1-CG1 4.05Å; I569-I647 HydrophobicContact CD1-CG2 4.45Å; I569-I647 HydrophobicContact CG1-CD1 4.03Å; L579-I647 HydrophobicContact CD2-CG2 3.92Å; V582-I647 HydrophobicContact CB-CG1 4.46Å; V582-I647 HydrophobicContact CG1-CG1 3.84Å; V582-I647 HydrophobicContact CG2-CG1 4.03Å; V582-I647 HydrophobicContact CG2-CG2 4.29Å; I645-I647 HydrophobicContact CG2-CD1 4.2Å; I645-I647 HydrophobicContact CG2-CG1 4.18Å; I647-T649 HydrophobicContact CG2-CG2 4.37Å; I647-V653 WeakPolarHBondContact O-CA 3.42Å; I647-I654 HydrophobicContact CB-CB 4.37Å; I647-I654 PolarHBondContact N-O 2.81Å; I647-I654 PolarHBondContact O-N 2.8Å
648	K	83.8	Confident	83.2	Confident	71 Å²	71	40.5 Å²	40.5	31%	0.309	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	140	173.5	-55.3	-166.9	-179.4	175.9	0	109.7	T580 S581 Q646 V653	T580-K648 PolarHBondContact N-O 3.34Å; T580-K648 WeakPolarHBondContact OG1-CB 3.33Å; T580-K648 PolarHBondContact OG1-O 2.95Å; S581-K648 PolarHBondContact N-O 2.85Å; S581-K648 PolarHBondContact O-N 2.82Å; Q646-K648 VanDerWaalsContact OE1-NZ 3.07Å; K648-V653 HydrophobicContact CB-CG2 4.47Å; K648-V653 HydrophobicContact CD-CG2 4.28Å; K648-V653 HydrophobicContact CG-CG1 4.15Å; K648-V653 HydrophobicContact CG-CG2 4.03Å
649	T	82.3	Confident	83.8	Confident	12 Å²	12	39.8 Å²	39.8	7%	0.074	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	-178.2	172.2	75	0	0	0	0	109.2	L538 V577 E578 L579 T580 I647 Y651 T652	L538-T649 HydrophobicContact CD1-CG2 3.7Å; V577-T649 HydrophobicContact CG1-CG2 4.14Å; E578-T649 VanDerWaalsContact O-CA 3.28Å; E578-T649 WeakPolarHBondContact O-CA 3.44Å; E578-T649 WeakPolarHBondContact O-CB 3.34Å; L579-T649 HydrophobicContact CD2-CG2 3.78Å; T580-T649 PolarHBondContact OG1-N 2.8Å; I647-T649 HydrophobicContact CG2-CG2 4.37Å; T649-Y651 PolarHBondContact O-N 3.02Å; T649-Y651 PolarHBondContact OG1-N 2.98Å; T649-T652 PolarHBondContact N-O 2.98Å; T649-T652 PolarHBondContact OG1-N 3.04Å; T649-T652 PolarHBondContact OG1-O 3.03Å; T649-T652 PolarHBondContact OG1-OG1 2.73Å; T649-T652 VanDerWaalsContact OG1-OG1 3.1Å
650	K	72.6	Confident	84.1	Confident	104 Å²	104	36.6 Å²	36.6	45%	0.452	17%	0.172	S	C	.	.	S	Bend	trans	-70.5	-7.5	166.9	-75.7	-179	169.5	163.1	0	114.2	E578 T580	E578-K650 HydrophobicContact CB-CD 4.24Å; E578-K650 HydrophobicContact CG-CD 4.45Å; E578-K650 PolarHBondContact O-N 3.27Å; E578-K650 WeakPolarHBondContact OE1-CE 3.42Å; E578-K650 IonicContact OE1-NZ 3.4Å; E578-K650 PolarHBondContact OE1-NZ 2.98Å; E578-K650 WeakPolarHBondContact OE2-CE 3.14Å; E578-K650 IonicContact OE2-NZ 3.43Å; E578-K650 PolarHBondContact OE2-NZ 3.15Å; T580-K650 HydrophobicContact CG2-CG 4.1Å
651	Y	69.2	Low	84.1	Confident	66 Å²	66	38.5 Å²	38.5	26%	0.259	18%	0.18	S	C	.	.	S	Bend	trans	-125.2	-22.6	-170.9	-46.7	-51.9	0	0	0	114.3	P450 F452 V577 T649	P450-Y651 VanDerWaalsContact CD-O 3.27Å; P450-Y651 WeakPolarHBondContact CD-O 3.4Å; P450-Y651 WeakPolarHBondContact CG-O 3.31Å; F452-Y651 HydrophobicContact CE2-CD1 4.24Å; F452-Y651 HydrophobicContact CE2-CG 4.23Å; F452-Y651 AromaticContact CZ-CD1 3.59Å; F452-Y651 HydrophobicContact CZ-CD1 3.59Å; F452-Y651 AromaticContact CZ-CE1 3.9Å; F452-Y651 HydrophobicContact CZ-CE1 3.9Å; F452-Y651 AromaticContact CZ-CG 3.94Å; F452-Y651 HydrophobicContact CZ-CG 3.94Å; V577-Y651 HydrophobicContact CB-CE2 4.39Å; V577-Y651 HydrophobicContact CG1-CD2 3.9Å; V577-Y651 HydrophobicContact CG1-CE2 4.02Å; V577-Y651 HydrophobicContact CG2-CD2 4.31Å; V577-Y651 HydrophobicContact CG2-CE2 4.09Å; T649-Y651 PolarHBondContact O-N 3.02Å; T649-Y651 PolarHBondContact OG1-N 2.98Å
652	T	73.1	Confident	84	Confident	13 Å²	13	38.5 Å²	38.5	8%	0.08	18%	0.18	C	C	.	.			trans	-151.6	154.8	-174	54	0	0	0	0	111.8	K537 T649	K537-T652 HydrophobicContact CG-CG2 4.05Å; T649-T652 PolarHBondContact N-O 2.98Å; T649-T652 PolarHBondContact OG1-N 3.04Å; T649-T652 PolarHBondContact OG1-O 3.03Å; T649-T652 PolarHBondContact OG1-OG1 2.73Å; T649-T652 VanDerWaalsContact OG1-OG1 3.1Å
653	V	80.4	Confident	83.6	Confident	81 Å²	81	36.5 Å²	36.5	49%	0.491	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	113	158.2	178.4	0	0	0	0	107	Q646 I647 K648	Q646-V653 HydrophobicContact CG-CG1 3.97Å; I647-V653 WeakPolarHBondContact O-CA 3.42Å; K648-V653 HydrophobicContact CB-CG2 4.47Å; K648-V653 HydrophobicContact CD-CG2 4.28Å; K648-V653 HydrophobicContact CG-CG1 4.15Å; K648-V653 HydrophobicContact CG-CG2 4.03Å
654	I	81	Confident	82.9	Confident	39 Å²	39	46.3 Å²	46.3	20%	0.2	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	118.6	173.1	-57.5	172.6	0	0	0	106.3	L538 Q646 I647	L538-I654 HydrophobicContact CB-CD1 4.25Å; Q646-I654 CarbonylContact C-O 3.5Å; Q646-I654 WeakPolarHBondContact CA-O 3.04Å; I647-I654 HydrophobicContact CB-CB 4.37Å; I647-I654 PolarHBondContact N-O 2.81Å; I647-I654 PolarHBondContact O-N 2.8Å
655	E	85.4	Confident	81.9	Confident	101 Å²	101	45 Å²	45	47%	0.472	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125.9	174.5	-170.6	163.6	164.8	0	0	109.1	Y585 I645 Q646	Y585-E655 PolarHBondContact OH-OE1 2.82Å; I645-E655 CarbonylContact O-C 3.59Å; I645-E655 WeakPolarHBondContact O-CA 3.35Å; Q646-E655 HydrophobicContact CB-CG 4.31Å; Q646-E655 HydrophobicContact CG-CB 4.35Å; Q646-E655 HydrophobicContact CG-CG 4.35Å; Q646-E655 PolarHBondContact NE2-OE2 2.65Å
656	Q	87.5	Confident	81	Confident	24 Å²	24	46.7 Å²	46.7	11%	0.112	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	115.8	-165.4	179.9	53.9	81.4	0	0	110.8	F540 D550 Y552 F644 I645	F540-Q656 HydrophobicContact CD1-CG 4.24Å; F540-Q656 HydrophobicContact CE1-CB 4.28Å; F540-Q656 HydrophobicContact CE1-CG 3.59Å; F540-Q656 HydrophobicContact CZ-CB 4.38Å; F540-Q656 HydrophobicContact CZ-CG 4.03Å; D550-Q656 PolarHBondContact O-NE2 2.87Å; Y552-Q656 VanDerWaalsContact CD2-CD 3.47Å; Y552-Q656 HydrophobicContact CD2-CG 3.65Å; Y552-Q656 HydrophobicContact CE2-CG 3.78Å; F644-Q656 CarbonylContact C-O 3.53Å; F644-Q656 WeakPolarHBondContact CA-O 3.43Å; I645-Q656 PolarHBondContact N-O 2.95Å; I645-Q656 PolarHBondContact O-N 2.85Å
657	Q	88.8	Confident	80.2	Confident	47 Å²	47	48.2 Å²	48.2	22%	0.22	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	145	176.9	-170.1	172.6	-36.5	0	0	111.5	V551 Y552 G643 F644 E659	V551-Q657 HydrophobicContact CG1-CB 4.46Å; V551-Q657 HydrophobicContact CG1-CG 4.1Å; V551-Q657 HydrophobicContact CG2-CB 4.26Å; V551-Q657 HydrophobicContact CG2-CG 4.27Å; Y552-Q657 PolarHBondContact N-O 2.8Å; G643-Q657 CarbonylContact O-C 3.55Å; G643-Q657 WeakPolarHBondContact O-CA 3.34Å; F644-Q657 HydrophobicContact CD1-CB 3.81Å; F644-Q657 HydrophobicContact CD1-CG 4.08Å; F644-Q657 HydrophobicContact CE1-CB 3.7Å; F644-Q657 HydrophobicContact CE1-CG 3.66Å; F644-Q657 HydrophobicContact CZ-CG 4.16Å; Q657-E659 PolarHBondContact NE2-OE1 2.86Å
658	F	89.8	Confident	79.5	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	153.6	168.6	70.6	-94	0	0	0	110.6	Y552 L554 I584 T586 L606 G643 F644 I645 Y660	Y552-F658 CarbonylContact O-C 3.43Å; Y552-F658 WeakPolarHBondContact O-CA 3.25Å; Y552-F658 VanDerWaalsContact O-CB 3.26Å; Y552-F658 WeakPolarHBondContact O-CB 3.19Å; L554-F658 HydrophobicContact CD1-CD2 3.51Å; L554-F658 HydrophobicContact CD1-CE2 3.94Å; L554-F658 HydrophobicContact CD1-CG 4.31Å; L554-F658 HydrophobicContact CD2-CB 4.31Å; L554-F658 HydrophobicContact CG-CB 4.34Å; L554-F658 HydrophobicContact CG-CD2 4Å; I584-F658 HydrophobicContact CG2-CE1 3.73Å; I584-F658 HydrophobicContact CG2-CZ 3.97Å; T586-F658 HydrophobicContact CG2-CZ 4.45Å; L606-F658 HydrophobicContact CD1-CE2 4.45Å; L606-F658 HydrophobicContact CD1-CZ 3.88Å; G643-F658 VanDerWaalsContact C-CD1 3.43Å; G643-F658 PolarHBondContact N-O 3.43Å; G643-F658 WeakPolarHBondContact O-CD1 3.2Å; G643-F658 PolarHBondContact O-N 2.81Å; G643-F658 VanDerWaalsContact O-O 3.09Å; F644-F658 VanDerWaalsContact N-CE1 3.31Å; I645-F658 HydrophobicContact CD1-CD1 3.74Å; I645-F658 HydrophobicContact CD1-CE1 4.2Å; I645-F658 HydrophobicContact CG1-CD1 3.82Å; I645-F658 HydrophobicContact CG1-CE1 3.88Å; F658-Y660 HydrophobicContact CD2-CD1 4.39Å; F658-Y660 HydrophobicContact CE2-CD1 4.11Å; F658-Y660 HydrophobicContact CE2-CE1 4.16Å
659	E	88.8	Confident	79	Confident	32 Å²	32	50.5 Å²	50.5	15%	0.15	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	141.7	-175.9	-70.9	-172	161.7	0	0	111.8	V551 Y552 L553 L554 H640 K642 Q657	V551-E659 HydrophobicContact CG1-CB 4.2Å; V551-E659 HydrophobicContact CG1-CG 3.69Å; Y552-E659 PolarHBondContact O-N 3.4Å; L553-E659 WeakPolarHBondContact CA-O 3.03Å; L553-E659 HydrophobicContact CD2-CB 3.88Å; L554-E659 PolarHBondContact N-O 2.88Å; H640-E659 IonicContact CE1-OE1 2.66Å; H640-E659 IonicContact NE2-OE2 2.64Å; K642-E659 VanDerWaalsContact CE-OE1 3.23Å; K642-E659 WeakPolarHBondContact CE-OE1 3.4Å; K642-E659 HydrophobicContact CG-CG 4.15Å; Q657-E659 PolarHBondContact NE2-OE1 2.86Å
660	Y	87.8	Confident	78.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	158.6	174.8	73.2	-84.9	0	0	0	113.2	G555 T586 W632 H640 I641 F658 V662	G555-Y660 WeakPolarHBondContact O-CA 3.36Å; T586-Y660 HydrophobicContact CG2-CE1 4.47Å; W632-Y660 HydrophobicContact CB-CE1 4.48Å; W632-Y660 HydrophobicContact CD2-CD2 4.42Å; W632-Y660 HydrophobicContact CD2-CG 4.46Å; W632-Y660 HydrophobicContact CE3-CD1 4.4Å; W632-Y660 AromaticContact CE3-CD2 3.35Å; W632-Y660 HydrophobicContact CE3-CD2 3.35Å; W632-Y660 AromaticContact CE3-CE2 3.83Å; W632-Y660 HydrophobicContact CE3-CE2 3.83Å; W632-Y660 AromaticContact CE3-CG 3.67Å; W632-Y660 HydrophobicContact CE3-CG 3.67Å; W632-Y660 AromaticContact CZ3-CD2 3.63Å; W632-Y660 HydrophobicContact CZ3-CD2 3.63Å; W632-Y660 HydrophobicContact CZ3-CE2 4.49Å; W632-Y660 AromaticContact CZ3-CG 3.89Å; W632-Y660 HydrophobicContact CZ3-CG 3.89Å; H640-Y660 PolarHBondContact CD2-O 3.21Å; I641-Y660 HydrophobicContact CB-CD1 4.15Å; I641-Y660 HydrophobicContact CB-CE1 3.78Å; I641-Y660 HydrophobicContact CB-CE2 4.2Å; I641-Y660 HydrophobicContact CD1-CD2 4.33Å; I641-Y660 HydrophobicContact CD1-CE1 4.43Å; I641-Y660 HydrophobicContact CD1-CE2 3.52Å; I641-Y660 HydrophobicContact CG1-CE2 4.4Å; I641-Y660 HydrophobicContact CG2-CD1 4.34Å; I641-Y660 HydrophobicContact CG2-CE1 3.59Å; I641-Y660 PolarHBondContact N-O 2.78Å; I641-Y660 PolarHBondContact O-N 3.33Å; F658-Y660 HydrophobicContact CD2-CD1 4.39Å; F658-Y660 HydrophobicContact CE2-CD1 4.11Å; F658-Y660 HydrophobicContact CE2-CE1 4.16Å; Y660-V662 HydrophobicContact CD2-CG2 4.34Å; Y660-V662 HydrophobicContact CE2-CG2 4.09Å
661	F	83.8	Confident	78	Confident	81 Å²	81	51 Å²	51	36%	0.355	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.6	-174.9	-64.4	-95.6	0	0	0	110.7	L553 G555 T556 T557 H640	L553-F661 HydrophobicContact CD2-CE2 4Å; G555-F661 PolarHBondContact O-N 3.05Å; T556-F661 CarbonylContact C-O 3.6Å; T556-F661 WeakPolarHBondContact CA-O 2.98Å; T556-F661 HydrophobicContact CG2-CB 3.87Å; T557-F661 PolarHBondContact N-O 2.89Å; H640-F661 HydrophobicContact CB-CD1 3.95Å; H640-F661 HydrophobicContact CB-CE1 3.93Å; H640-F661 AromaticContact CD2-CD1 3.61Å; H640-F661 AromaticContact CD2-CE1 3.25Å; H640-F661 WeakPolarHBondContact CD2-CE1 2.96Å; H640-F661 AromaticContact CD2-CE2 3.77Å; H640-F661 AromaticContact CD2-CZ 3.33Å; H640-F661 WeakPolarHBondContact CD2-CZ 3.35Å; H640-F661 AromaticContact CG-CE1 3.75Å; H640-F661 AromaticContact NE2-CZ 3.79Å
662	V	82.7	Confident	77.7	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.3	171.5	-173.2	0	0	0	0	108.5	T557 I559 E635 V637 A638 Q639 I641 Y660	T557-V662 HydrophobicContact CG2-CG2 4.01Å; T557-V662 CarbonylContact O-C 3.2Å; T557-V662 WeakPolarHBondContact O-CA 3.1Å; I559-V662 HydrophobicContact CG1-CG1 3.88Å; E635-V662 HydrophobicContact CB-CG1 4.45Å; E635-V662 HydrophobicContact CB-CG2 4.24Å; V637-V662 WeakPolarHBondContact O-CG1 3Å; A638-V662 CarbonylContact C-O 3.6Å; A638-V662 WeakPolarHBondContact CA-O 3.48Å; A638-V662 WeakPolarHBondContact CB-O 3.19Å; Q639-V662 PolarHBondContact N-O 3.21Å; Q639-V662 VanDerWaalsContact N-O 3.16Å; Q639-V662 PolarHBondContact O-N 2.67Å; I641-V662 HydrophobicContact CD1-CG2 3.86Å; Y660-V662 HydrophobicContact CD2-CG2 4.34Å; Y660-V662 HydrophobicContact CE2-CG2 4.09Å
663	T	79	Confident	77	Confident	28 Å²	28	55.3 Å²	55.3	17%	0.172	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	156.1	-173.9	61	0	0	0	0	113.9	T556 T557 L558 I559 G665	T556-T663 HydrophobicContact CG2-CG2 4.48Å; T557-T663 PolarHBondContact O-N 2.97Å; L558-T663 WeakPolarHBondContact CA-O 3.49Å; I559-T663 PolarHBondContact N-O 2.94Å; I559-T663 VanDerWaalsContact N-O 3.1Å; T663-G665 VanDerWaalsContact CB-O 3.31Å; T663-G665 WeakPolarHBondContact CB-O 3.46Å; T663-G665 PolarHBondContact O-N 2.86Å; T663-G665 PolarHBondContact OG1-O 3.28Å
664	R	71.4	Confident	76.2	Confident	205 Å²	205	53.5 Å²	53.5	77%	0.774	27%	0.269	S	S	*	.	S	Bend	trans	-75.5	-9.8	177.1	-77.5	-178	176.4	-175.6	0.2	114.3	I559 A638 Y695	I559-R664 HydrophobicContact CD1-CG 3.59Å; A638-R664 HydrophobicContact CB-CG 4.24Å; R664-Y695 HydrophobicContact CB-CE1 4.28Å
665	G	69	Low	75.5	Confident	6 Å²	6	56.9 Å²	56.9	6%	0.062	29%	0.287	C	S	.	.	S	Bend	trans	-171.7	178.8	-179.9	0	0	0	0	0	109.2	T663 Y695	T663-G665 VanDerWaalsContact CB-O 3.31Å; T663-G665 WeakPolarHBondContact CB-O 3.46Å; T663-G665 PolarHBondContact O-N 2.86Å; T663-G665 PolarHBondContact OG1-O 3.28Å; G665-Y695 VanDerWaalsContact C-CZ 3.44Å; G665-Y695 WeakPolarHBondContact O-CE2 3.39Å; G665-Y695 VanDerWaalsContact O-CZ 3.26Å; G665-Y695 PolarHBondContact O-OH 3Å; G665-Y695 VanDerWaalsContact O-OH 3.07Å
666	L	70.4	Confident	74.5	Confident	36 Å²	36	53.6 Å²	53.6	19%	0.188	27%	0.274	C	S	.	.			trans	-123	154.4	175.4	-122	93.5	0	0	0	112	L558 N668 A694	L558-L666 HydrophobicContact CD2-CD1 3.91Å; L558-L666 HydrophobicContact CG-CD1 4.43Å; L666-N668 VanDerWaalsContact CD2-OD1 3.32Å; L666-N668 WeakPolarHBondContact CD2-OD1 3.33Å; L666-A694 WeakPolarHBondContact O-CB 3.24Å; L666-A694 PolarHBondContact O-N 3.06Å
667	I	71.7	Confident	73.2	Confident	63 Å²	63	58.5 Å²	58.5	32%	0.323	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	108.8	162.2	-63.6	177.3	0	0	0	105.6	V669 V691 Y695 I699 I701	I667-V669 HydrophobicContact CG2-CG2 4.49Å; I667-V669 PolarHBondContact O-N 2.88Å; I667-V691 HydrophobicContact CG2-CG1 3.31Å; I667-Y695 HydrophobicContact CG1-CD2 4.31Å; I667-Y695 HydrophobicContact CG1-CE2 4.08Å; I667-I699 HydrophobicContact CD1-CD1 4.26Å; I667-I699 HydrophobicContact CD1-CG2 4.14Å; I667-I699 HydrophobicContact CG1-CD1 4.45Å; I667-I701 HydrophobicContact CG2-CD1 4.48Å
668	N	72	Confident	71.6	Confident	62 Å²	62	58.3 Å²	58.3	33%	0.332	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	118.3	179.3	-75.6	-11	0	0	0	108.8	L666 V691 Q692	L666-N668 VanDerWaalsContact CD2-OD1 3.32Å; L666-N668 WeakPolarHBondContact CD2-OD1 3.33Å; N668-V691 CarbonylContact O-C 3.46Å; N668-V691 WeakPolarHBondContact O-CA 3.43Å; N668-Q692 HydrophobicContact CB-CB 4.25Å; N668-Q692 PolarHBondContact N-O 2.83Å; N668-Q692 PolarHBondContact O-N 2.96Å
669	V	71.9	Confident	70	Confident	57 Å²	57	61 Å²	61	35%	0.345	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.6	172.7	-175.8	0	0	0	0	108.2	I667 N672 I689 V691	I667-V669 HydrophobicContact CG2-CG2 4.49Å; I667-V669 PolarHBondContact O-N 2.88Å; V669-N672 WeakPolarHBondContact O-CB 3.24Å; V669-I689 HydrophobicContact CG1-CG2 3.75Å; V669-V691 HydrophobicContact CG1-CG2 4.32Å; V669-V691 HydrophobicContact CG2-CG1 4.49Å; V669-V691 HydrophobicContact CG2-CG2 4.17Å
670	I	73.2	Confident	68.4	Low	79 Å²	79	60.7 Å²	60.7	41%	0.405	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	128.6	-176.4	-57	177	0	0	0	108.6	T690	I670-T690 PolarHBondContact N-O 2.94Å; I670-T690 PolarHBondContact O-N 3.22Å
671	P	61	Low	66.5	Low	48 Å²	48	63 Å²	63	31%	0.312	33%	0.332	S	S	.	.	S	Bend	cis	-78.2	151.4	-7.2	34.2	-36.5	0	0	0	112.7	L674 K688	P671-L674 HydrophobicContact CG-CB 4.5Å; P671-L674 HydrophobicContact CG-CG 4.01Å; P671-K688 VanDerWaalsContact CD-O 3.27Å; P671-K688 WeakPolarHBondContact CD-O 3.28Å
672	N	62.6	Low	64.9	Low	96 Å²	96	60.8 Å²	60.8	51%	0.513	33%	0.331	S	S	.	.	S	Bend	trans	-152.3	113.2	177.1	-179.4	26.6	0	0	0	110.3	R546 V669	R546-N672 VanDerWaalsContact CZ-OD1 3.31Å; R546-N672 PolarHBondContact NH1-OD1 2.97Å; R546-N672 PolarHBondContact NH2-OD1 3.03Å; V669-N672 WeakPolarHBondContact O-CB 3.24Å
673	P	58.3	Low	63.6	Low	74 Å²	74	63.6 Å²	63.6	48%	0.481	34%	0.343	S	S	.	.	S	Bend	cis	-67.7	158.1	-0.7	29.9	-34.7	0	0	0	112.8	I675	P673-I675 HydrophobicContact CB-CG1 4.34Å; P673-I675 HydrophobicContact CG-CD1 4.12Å; P673-I675 HydrophobicContact CG-CG1 3.96Å; P673-I675 PolarHBondContact O-N 3.05Å
674	L	65.4	Low	62.9	Low	42 Å²	42	66.9 Å²	66.9	22%	0.22	36%	0.359	C	S	.	.			trans	-91.9	82.5	178.8	-161	164.6	0	0	0	108.8	P671 V676 H687 I689 V760 F762	P671-L674 HydrophobicContact CG-CB 4.5Å; P671-L674 HydrophobicContact CG-CG 4.01Å; L674-V676 HydrophobicContact CD2-CG2 3.64Å; L674-H687 HydrophobicContact CD1-CB 4.08Å; L674-H687 HydrophobicContact CD2-CB 3.94Å; L674-H687 HydrophobicContact CG-CB 4.17Å; L674-I689 HydrophobicContact CD1-CD1 4.47Å; L674-I689 HydrophobicContact CD1-CG1 4.34Å; L674-V760 HydrophobicContact CD1-CG2 4.29Å; L674-F762 HydrophobicContact CD2-CE2 3.62Å; L674-F762 HydrophobicContact CD2-CZ 3.6Å
675	I	65.6	Low	62.6	Low	111 Å²	111	58.4 Å²	58.4	57%	0.569	33%	0.329	S	S	*	.			trans	-79.9	128.3	-174.9	-56.5	175.8	0	0	0	110.1	P673 N677	P673-I675 HydrophobicContact CB-CG1 4.34Å; P673-I675 HydrophobicContact CG-CD1 4.12Å; P673-I675 HydrophobicContact CG-CG1 3.96Å; P673-I675 PolarHBondContact O-N 3.05Å; I675-N677 WeakPolarHBondContact CG2-OD1 3.25Å
676	V	64.4	Low	62.7	Low	32 Å²	32	63.9 Å²	63.9	19%	0.194	35%	0.354	C	S	.	.			trans	-123.1	97.9	-178.7	-167.1	0	0	0	0	111.1	L674 L679 I685 F762	L674-V676 HydrophobicContact CD2-CG2 3.64Å; V676-L679 HydrophobicContact CB-CD1 4.24Å; V676-L679 HydrophobicContact CG1-CD1 3.79Å; V676-L679 HydrophobicContact CG1-CD2 3.95Å; V676-L679 HydrophobicContact CG1-CG 3.74Å; V676-I685 HydrophobicContact CG1-CB 4.22Å; V676-I685 HydrophobicContact CG1-CD1 3.6Å; V676-I685 HydrophobicContact CG1-CG1 4.48Å; V676-I685 HydrophobicContact CG1-CG2 4.12Å; V676-F762 HydrophobicContact CG1-CG 4.31Å; V676-F762 HydrophobicContact CG2-CD1 4.08Å; V676-F762 HydrophobicContact CG2-CD2 4.03Å; V676-F762 HydrophobicContact CG2-CE1 3.78Å; V676-F762 HydrophobicContact CG2-CE2 3.73Å; V676-F762 HydrophobicContact CG2-CG 4.22Å; V676-F762 HydrophobicContact CG2-CZ 3.61Å
677	N	60.3	Low	62.7	Low	126 Å²	126	64.5 Å²	64.5	67%	0.674	36%	0.356	S	S	*	.			trans	-84.4	134	-176.9	-69.2	-21.3	0	0	0	112.5	I675	I675-N677 WeakPolarHBondContact CG2-OD1 3.25Å
678	S	55.7	Low	62.9	Low	43 Å²	43	65.3 Å²	65.3	30%	0.301	36%	0.357	S	S	.	.			trans	58.3	66.2	174.3	-52.3	0	0	0	0	114.3	K683 Y917	S678-K683 WeakPolarHBondContact O-CD 3Å; S678-K683 PolarHBondContact O-NZ 3.45Å; S678-Y917 VanDerWaalsContact OG-CB 3.23Å; S678-Y917 WeakPolarHBondContact OG-CB 3.24Å
679	L	55.5	Low	63.2	Low	56 Å²	56	62.8 Å²	62.8	29%	0.293	34%	0.343	S	S	.	.			trans	-80.9	143.7	163.7	-74.8	165.1	0	0	0	110.5	V676 I685 F762 P764	V676-L679 HydrophobicContact CB-CD1 4.24Å; V676-L679 HydrophobicContact CG1-CD1 3.79Å; V676-L679 HydrophobicContact CG1-CD2 3.95Å; V676-L679 HydrophobicContact CG1-CG 3.74Å; L679-I685 HydrophobicContact CD2-CB 4.42Å; L679-I685 HydrophobicContact CD2-CD1 3.64Å; L679-I685 HydrophobicContact CD2-CG1 4Å; L679-I685 HydrophobicContact CG-CD1 4.21Å; L679-F762 HydrophobicContact CD1-CB 4.33Å; L679-F762 HydrophobicContact CD1-CD1 4.21Å; L679-F762 HydrophobicContact CD2-CB 3.73Å; L679-P764 HydrophobicContact CB-CG 4.47Å; L679-P764 HydrophobicContact CD2-CG 4.46Å
680	F	54.7	Low	63.6	Low	27 Å²	27	60.8 Å²	60.8	12%	0.118	33%	0.331	C	S	.	.			trans	-156.3	153.8	171.4	58	-96.9	0	0	0	110	G682 K683 P764 M918 T1123	F680-G682 PolarHBondContact O-N 3.36Å; F680-G682 VanDerWaalsContact O-N 3.16Å; F680-K683 HydrophobicContact CD1-CB 4Å; F680-K683 HydrophobicContact CD1-CD 3.88Å; F680-K683 HydrophobicContact CD2-CB 3.92Å; F680-K683 HydrophobicContact CE1-CB 3.79Å; F680-K683 HydrophobicContact CE1-CD 3.34Å; F680-K683 HydrophobicContact CE1-CG 4.15Å; F680-K683 HydrophobicContact CE2-CB 3.69Å; F680-K683 HydrophobicContact CG-CB 4.08Å; F680-K683 HydrophobicContact CZ-CB 3.64Å; F680-K683 HydrophobicContact CZ-CD 3.82Å; F680-K683 HydrophobicContact CZ-CG 4.22Å; F680-K683 PolarHBondContact O-N 2.87Å; F680-P764 VanDerWaalsContact C-CG 3.49Å; F680-P764 VanDerWaalsContact O-CG 3.22Å; F680-P764 WeakPolarHBondContact O-CG 3.18Å; F680-M918 HydrophobicContact CB-CE 3.93Å; F680-M918 HydrophobicContact CB-SD 3.65Å; F680-M918 HydrophobicContact CD1-CE 3.79Å; F680-M918 HydrophobicContact CD1-CG 3.56Å; F680-M918 HydrophobicContact CD1-SD 3.45Å; F680-M918 WeakPolarHBondContact CD1-SD 3.17Å; F680-M918 HydrophobicContact CD2-CE 3.51Å; F680-M918 HydrophobicContact CD2-SD 4.21Å; F680-M918 HydrophobicContact CE1-CE 4.06Å; F680-M918 HydrophobicContact CE1-CG 3.59Å; F680-M918 HydrophobicContact CE1-SD 4.03Å; F680-M918 HydrophobicContact CE2-CE 3.81Å; F680-M918 HydrophobicContact CG-CE 3.49Å; F680-M918 VanDerWaalsContact CG-CE 3.49Å; F680-M918 HydrophobicContact CG-CG 4.23Å; F680-M918 HydrophobicContact CG-SD 3.53Å; F680-M918 VanDerWaalsContact CG-SD 3.53Å; F680-M918 HydrophobicContact CZ-CE 4.06Å; F680-M918 HydrophobicContact CZ-CG 4.31Å; F680-T1123 HydrophobicContact CE2-CG2 4.12Å
681	P	47.5	Very low	63.9	Low	49 Å²	49	57.1 Å²	57.1	32%	0.318	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	120.6	-179.3	-28.6	36.7	0	0	0	112.3	C822	P681-C822 VanDerWaalsContact CB-SG 3.56Å
682	G	51.6	Low	64.7	Low	33 Å²	33	57.7 Å²	57.7	34%	0.34	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.1	-13.6	-176	0	0	0	0	0	115.9	F680	F680-G682 PolarHBondContact O-N 3.36Å; F680-G682 VanDerWaalsContact O-N 3.16Å
683	K	55.3	Low	65.4	Low	62 Å²	62	53.2 Å²	53.2	27%	0.27	29%	0.287	S	S	.	.			trans	-96.5	97.7	173	-177.9	-178.1	167.1	-157.7	0	111.2	S678 F680 I685	S678-K683 WeakPolarHBondContact O-CD 3Å; S678-K683 PolarHBondContact O-NZ 3.45Å; F680-K683 HydrophobicContact CD1-CB 4Å; F680-K683 HydrophobicContact CD1-CD 3.88Å; F680-K683 HydrophobicContact CD2-CB 3.92Å; F680-K683 HydrophobicContact CE1-CB 3.79Å; F680-K683 HydrophobicContact CE1-CD 3.34Å; F680-K683 HydrophobicContact CE1-CG 4.15Å; F680-K683 HydrophobicContact CE2-CB 3.69Å; F680-K683 HydrophobicContact CG-CB 4.08Å; F680-K683 HydrophobicContact CZ-CB 3.64Å; F680-K683 HydrophobicContact CZ-CD 3.82Å; F680-K683 HydrophobicContact CZ-CG 4.22Å; F680-K683 PolarHBondContact O-N 2.87Å; K683-I685 HydrophobicContact CD-CD1 4.37Å; K683-I685 HydrophobicContact CD-CG1 4.5Å; K683-I685 HydrophobicContact CG-CG1 4.19Å
684	I	64.3	Low	66	Low	97 Å²	97	51.8 Å²	51.8	50%	0.497	28%	0.281	S	S	.	.			trans	-76.9	130.9	172.4	-54.1	178.3	0	0	0	109.8	F762 D763	I684-F762 WeakPolarHBondContact CA-O 3.24Å; I684-D763 HydrophobicContact CG1-CB 4.1Å
685	I	64.8	Low	66.2	Low	28 Å²	28	52.3 Å²	52.3	14%	0.144	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	134	174.8	-56.7	177.9	0	0	0	109.6	V676 L679 K683 F762	V676-I685 HydrophobicContact CG1-CB 4.22Å; V676-I685 HydrophobicContact CG1-CD1 3.6Å; V676-I685 HydrophobicContact CG1-CG1 4.48Å; V676-I685 HydrophobicContact CG1-CG2 4.12Å; L679-I685 HydrophobicContact CD2-CB 4.42Å; L679-I685 HydrophobicContact CD2-CD1 3.64Å; L679-I685 HydrophobicContact CD2-CG1 4Å; L679-I685 HydrophobicContact CG-CD1 4.21Å; K683-I685 HydrophobicContact CD-CD1 4.37Å; K683-I685 HydrophobicContact CD-CG1 4.5Å; K683-I685 HydrophobicContact CG-CG1 4.19Å; I685-F762 HydrophobicContact CB-CB 4.38Å; I685-F762 PolarHBondContact N-O 2.91Å; I685-F762 VanDerWaalsContact N-O 3.1Å; I685-F762 PolarHBondContact O-N 3.13Å
686	M	69.9	Low	66.2	Low	121 Å²	121	52.4 Å²	52.4	60%	0.596	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.6	178.5	-67.8	-173.6	-68.1	0	0	111.4	V759 V760 Y761	M686-V759 HydrophobicContact CB-CG1 3.96Å; M686-V759 HydrophobicContact CG-CG1 4.27Å; M686-V759 HydrophobicContact SD-CG1 4.48Å; M686-V760 WeakPolarHBondContact CA-O 3.33Å; M686-Y761 HydrophobicContact CG-CD1 3.65Å; M686-Y761 HydrophobicContact CG-CE1 3.67Å; M686-Y761 HydrophobicContact CG-CG 4.35Å; M686-Y761 HydrophobicContact SD-CD1 3.97Å; M686-Y761 HydrophobicContact SD-CE1 3.34Å; M686-Y761 WeakPolarHBondContact SD-CE1 3.4Å
687	H	71.3	Confident	66.4	Low	49 Å²	49	55 Å²	55	23%	0.227	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128.8	169.2	-76.3	98.9	0	0	0	110.9	L674 V759 V760	L674-H687 HydrophobicContact CD1-CB 4.08Å; L674-H687 HydrophobicContact CD2-CB 3.94Å; L674-H687 HydrophobicContact CG-CB 4.17Å; H687-V759 CarbonylContact O-C 3.5Å; H687-V759 VanDerWaalsContact O-CA 3.31Å; H687-V759 WeakPolarHBondContact O-CA 3.42Å; H687-V760 PolarHBondContact N-O 2.92Å; H687-V760 PolarHBondContact O-N 3.35Å
688	K	76.6	Confident	66.9	Low	79 Å²	79	54.6 Å²	54.6	34%	0.343	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	139.1	167.7	-66.3	-177.8	-177.6	178.2	0	109.4	P671 V756 V759 M1848	P671-K688 VanDerWaalsContact CD-O 3.27Å; P671-K688 WeakPolarHBondContact CD-O 3.28Å; K688-V756 HydrophobicContact CB-CG1 4.26Å; K688-V756 HydrophobicContact CD-CG2 4.45Å; K688-V756 HydrophobicContact CG-CG1 4.5Å; K688-V759 HydrophobicContact CG-CG2 4.13Å; K688-M1848 PolarHBondContact NZ-SD 3.46Å
689	I	78.1	Confident	67.8	Low	10 Å²	10	54.1 Å²	54.1	5%	0.051	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	107.5	167.3	-60.9	-178.7	0	0	0	108.1	V669 L674 V691 L706 V756 I757 G758 V760	V669-I689 HydrophobicContact CG1-CG2 3.75Å; L674-I689 HydrophobicContact CD1-CD1 4.47Å; L674-I689 HydrophobicContact CD1-CG1 4.34Å; I689-V691 HydrophobicContact CG2-CG2 4.02Å; I689-L706 HydrophobicContact CD1-CD1 4.45Å; I689-V756 WeakPolarHBondContact O-CA 2.87Å; I689-I757 PolarHBondContact O-N 3.03Å; I689-G758 PolarHBondContact N-O 3.4Å; I689-V760 HydrophobicContact CD1-CG2 3.61Å; I689-V760 HydrophobicContact CG1-CG2 4.18Å
690	T	79.1	Confident	68.5	Low	14 Å²	14	55.7 Å²	55.7	9%	0.086	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	134.1	169.8	-59.9	0	0	0	0	108.8	I670 E1850	I670-T690 PolarHBondContact N-O 2.94Å; I670-T690 PolarHBondContact O-N 3.22Å; T690-E1850 PolarHBondContact OG1-OE1 2.93Å
691	V	79.1	Confident	69.2	Low	3 Å²	3	55.6 Å²	55.6	2%	0.018	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	134.2	176	-177.3	0	0	0	0	109.8	I667 N668 V669 I689 I701 F749 S754 R755 I757	I667-V691 HydrophobicContact CG2-CG1 3.31Å; N668-V691 CarbonylContact O-C 3.46Å; N668-V691 WeakPolarHBondContact O-CA 3.43Å; V669-V691 HydrophobicContact CG1-CG2 4.32Å; V669-V691 HydrophobicContact CG2-CG1 4.49Å; V669-V691 HydrophobicContact CG2-CG2 4.17Å; I689-V691 HydrophobicContact CG2-CG2 4.02Å; V691-I701 HydrophobicContact CG1-CD1 3.82Å; V691-F749 HydrophobicContact CB-CE1 4.49Å; V691-F749 HydrophobicContact CB-CZ 4.31Å; V691-F749 WeakPolarHBondContact O-CE1 3.48Å; V691-S754 CarbonylContact O-C 3.56Å; V691-S754 VanDerWaalsContact O-CA 3.31Å; V691-S754 WeakPolarHBondContact O-CA 3.41Å; V691-R755 PolarHBondContact N-O 2.87Å; V691-R755 PolarHBondContact O-N 3.32Å; V691-I757 HydrophobicContact CB-CD1 3.71Å; V691-I757 HydrophobicContact CB-CG1 4.24Å; V691-I757 HydrophobicContact CG1-CD1 4.35Å; V691-I757 HydrophobicContact CG2-CD1 3.48Å; V691-I757 VanDerWaalsContact CG2-CD1 3.48Å; V691-I757 HydrophobicContact CG2-CG1 4.04Å
692	Q	77.7	Confident	70	Confident	59 Å²	59	58.4 Å²	58.4	28%	0.276	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.2	179.5	179.5	-176.5	20.5	0	0	110	N668 S754	N668-Q692 HydrophobicContact CB-CB 4.25Å; N668-Q692 PolarHBondContact N-O 2.83Å; N668-Q692 PolarHBondContact O-N 2.96Å; Q692-S754 WeakPolarHBondContact CB-OG 3.32Å; Q692-S754 WeakPolarHBondContact CG-OG 3.25Å
693	N	77.1	Confident	70.3	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.016	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	111.8	173.2	178.6	16.8	0	0	0	110.2	Y695 T697 F749 N752 Q753	N693-Y695 WeakPolarHBondContact OD1-CB 3.49Å; N693-Y695 PolarHBondContact OD1-N 3.19Å; N693-T697 PolarHBondContact ND2-O 3.14Å; N693-F749 HydrophobicContact CB-CB 3.79Å; N693-F749 HydrophobicContact CB-CG 4.46Å; N693-F749 PolarHBondContact ND2-O 3.03Å; N693-N752 WeakPolarHBondContact O-CA 3.4Å; N693-N752 PolarHBondContact O-N 2.65Å; N693-Q753 PolarHBondContact N-O 2.79Å
694	A	71.5	Confident	70.6	Confident	43 Å²	43	60.3 Å²	60.3	36%	0.355	32%	0.323	S	S	.	.			trans	-101.6	12.7	174.4	0	0	0	0	0	113.4	L666	L666-A694 WeakPolarHBondContact O-CB 3.24Å; L666-A694 PolarHBondContact O-N 3.06Å
695	Y	69.8	Low	70.3	Confident	53 Å²	53	62.9 Å²	62.9	21%	0.208	33%	0.331	C	S	.	.	S	Bend	trans	-80.8	149.8	167.4	-73.7	-108.9	0	0	0	110.6	R664 G665 I667 N693 T697 I699 A751	R664-Y695 HydrophobicContact CB-CE1 4.28Å; G665-Y695 VanDerWaalsContact C-CZ 3.44Å; G665-Y695 WeakPolarHBondContact O-CE2 3.39Å; G665-Y695 VanDerWaalsContact O-CZ 3.26Å; G665-Y695 PolarHBondContact O-OH 3Å; G665-Y695 VanDerWaalsContact O-OH 3.07Å; I667-Y695 HydrophobicContact CG1-CD2 4.31Å; I667-Y695 HydrophobicContact CG1-CE2 4.08Å; N693-Y695 WeakPolarHBondContact OD1-CB 3.49Å; N693-Y695 PolarHBondContact OD1-N 3.19Å; Y695-T697 PolarHBondContact O-N 3.18Å; Y695-I699 HydrophobicContact CD1-CD1 4.15Å; Y695-I699 HydrophobicContact CD2-CD1 3.39Å; Y695-I699 HydrophobicContact CE2-CD1 3.93Å; Y695-I699 HydrophobicContact CG-CD1 3.51Å; Y695-A751 WeakPolarHBondContact O-CB 3.48Å
696	P	65.8	Low	69.7	Low	114 Å²	114	65.7 Å²	65.7	74%	0.74	35%	0.345	S	S	*	.	S	Bend	trans	-74.3	1.2	178	31.7	-36.8	0	0	0	114.1
697	T	67.7	Low	68.8	Low	86 Å²	86	67 Å²	67	53%	0.528	35%	0.349	S	S	.	.	S	Bend	trans	-122.6	160.1	-178.1	54.2	0	0	0	0	110.8	N693 Y695	N693-T697 PolarHBondContact ND2-O 3.14Å; Y695-T697 PolarHBondContact O-N 3.18Å
698	E	72.5	Confident	67.6	Low	118 Å²	118	71.4 Å²	71.4	55%	0.551	36%	0.364	S	S	*	.			trans	-61.8	143.8	169.8	-56.1	-153.8	149.7	0	0	111.1	Q748 F749	E698-Q748 PolarHBondContact OE2-NE2 2.86Å; E698-F749 VanDerWaalsContact CA-O 3.27Å; E698-F749 WeakPolarHBondContact CA-O 3.16Å
699	I	72.7	Confident	66.1	Low	32 Å²	32	70.4 Å²	70.4	16%	0.164	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.1	175.5	-70.5	-171.2	0	0	0	110.2	I667 Y695 I701 F749	I667-I699 HydrophobicContact CD1-CD1 4.26Å; I667-I699 HydrophobicContact CD1-CG2 4.14Å; I667-I699 HydrophobicContact CG1-CD1 4.45Å; Y695-I699 HydrophobicContact CD1-CD1 4.15Å; Y695-I699 HydrophobicContact CD2-CD1 3.39Å; Y695-I699 HydrophobicContact CE2-CD1 3.93Å; Y695-I699 HydrophobicContact CG-CD1 3.51Å; I699-I701 HydrophobicContact CG2-CG1 4.27Å; I699-F749 PolarHBondContact N-O 3Å; I699-F749 PolarHBondContact O-N 2.93Å
700	N	72.1	Confident	64.5	Low	89 Å²	89	76 Å²	76	48%	0.476	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	110.2	167.9	-73.4	-11	0	0	0	108.9	T702 P746 Q748	N700-T702 PolarHBondContact O-N 3.37Å; N700-P746 HydrophobicContact CB-CB 4.1Å; N700-Q748 WeakPolarHBondContact OD1-CG 3.29Å
701	I	69.2	Low	62.6	Low	26 Å²	26	79.1 Å²	79.1	13%	0.133	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	118.6	168	-56.8	-176.1	0	0	0	107.7	I667 V691 I699 I704 P746 I747 F749 I757	I667-I701 HydrophobicContact CG2-CD1 4.48Å; V691-I701 HydrophobicContact CG1-CD1 3.82Å; I699-I701 HydrophobicContact CG2-CG1 4.27Å; I701-I704 HydrophobicContact CG2-CD1 3.99Å; I701-I704 HydrophobicContact CG2-CG1 3.65Å; I701-P746 WeakPolarHBondContact O-CA 3.26Å; I701-I747 PolarHBondContact N-O 2.9Å; I701-I747 PolarHBondContact O-N 2.94Å; I701-F749 HydrophobicContact CD1-CD2 3.92Å; I701-F749 HydrophobicContact CD1-CE2 3.62Å; I701-F749 HydrophobicContact CD1-CZ 4.36Å; I701-F749 HydrophobicContact CG1-CD2 4.08Å; I701-F749 HydrophobicContact CG1-CE2 4.11Å; I701-I757 HydrophobicContact CD1-CD1 4Å
702	T	63.7	Low	60.8	Low	108 Å²	108	85.2 Å²	85.2	66%	0.663	46%	0.457	S	S	*	.			trans	-93.8	-33.8	-175.8	47.3	0	0	0	0	113.5	N700	N700-T702 PolarHBondContact O-N 3.37Å
703	D	57.9	Low	58.9	Low	82 Å²	82	84.3 Å²	84.3	44%	0.439	46%	0.457	S	S	.	.			trans	-151.2	154.3	-178.8	-171.3	9.4	0	0	0	110	K705	D703-K705 WeakPolarHBondContact OD2-CE 3.39Å; D703-K705 IonicContact OD2-NZ 3Å
704	I	62.5	Low	56.9	Low	53 Å²	53	89.4 Å²	89.4	27%	0.272	48%	0.484	S	S	.	.			trans	-140.7	100.2	175	-56.5	-178.9	0	0	0	108.7	I701 I757	I701-I704 HydrophobicContact CG2-CD1 3.99Å; I701-I704 HydrophobicContact CG2-CG1 3.65Å; I704-I757 HydrophobicContact CD1-CB 4.32Å; I704-I757 HydrophobicContact CD1-CD1 3.53Å; I704-I757 HydrophobicContact CD1-CG2 3.74Å
705	K	56.7	Low	55.3	Low	151 Å²	151	92.4 Å²	92.4	66%	0.657	49%	0.494	S	S	*	.			trans	-91.4	132	177.5	-57.8	-171.2	-174.8	-174.8	0	111.2	D703	D703-K705 WeakPolarHBondContact OD2-CE 3.39Å; D703-K705 IonicContact OD2-NZ 3Å
706	L	53.5	Low	53.7	Low	87 Å²	87	95.5 Å²	95.5	46%	0.455	51%	0.509	S	S	.	.			trans	-96.1	114.8	165.7	-79.6	158.9	0	0	0	108	I689 I724 V760	I689-L706 HydrophobicContact CD1-CD1 4.45Å; L706-I724 HydrophobicContact CD1-CD1 3.73Å; L706-I724 HydrophobicContact CD1-CG1 4.21Å; L706-V760 HydrophobicContact CD1-CG2 3.78Å
707	H	49.7	Very low	52.4	Low	147 Å²	147	97.3 Å²	97.3	68%	0.681	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-77.1	151.9	173.4	-73.2	-72.3	0	0	0	111.2
708	R	45.7	Very low	51.1	Low	142 Å²	142	95.9 Å²	95.9	54%	0.536	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-56	138.8	-172.2	-171.4	-175.5	-92.5	-172.3	-4.1	111.3	E719	R708-E719 IonicContact CZ-OE1 3.03Å; R708-E719 IonicContact NE-OE1 3.38Å; R708-E719 IonicContact NH2-OE1 2.65Å; R708-E719 PolarHBondContact NH2-OE1 3.25Å
709	A	45.9	Very low	49.5	Very low	58 Å²	58	95.6 Å²	95.6	48%	0.479	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-67.8	131.1	-176.9	0	0	0	0	0	112.3	M711	A709-M711 PolarHBondContact O-N 2.83Å
710	I	43.8	Very low	48.2	Very low	127 Å²	127	95.7 Å²	95.7	65%	0.651	50%	0.501	S	S	*	.			trans	-75.9	101.2	165.2	-53.7	171	0	0	0	107.1	Q547 L548	Q547-I710 VanDerWaalsContact O-CD1 3.26Å; Q547-I710 WeakPolarHBondContact O-CD1 3.42Å; L548-I710 HydrophobicContact CD2-CD1 4.45Å
711	M	39.3	Very low	46.9	Very low	81 Å²	81	94 Å²	94	40%	0.399	50%	0.496	S	S	.	.			trans	-84	137	169.6	-65.7	-174.2	68.1	0	0	109	A709 S713 F716 I720	A709-M711 PolarHBondContact O-N 2.83Å; M711-S713 PolarHBondContact O-N 2.99Å; M711-F716 HydrophobicContact CE-CD2 3.95Å; M711-F716 HydrophobicContact CE-CE2 4.34Å; M711-F716 HydrophobicContact CE-CG 4.48Å; M711-F716 HydrophobicContact SD-CB 4.5Å; M711-I720 HydrophobicContact CE-CD1 4.05Å; M711-I720 HydrophobicContact SD-CD1 3.64Å
712	S	41.2	Very low	45.9	Very low	131 Å²	131	96.7 Å²	96.7	92%	0.916	51%	0.507	S	S	*	.	S	Bend	trans	-77	36.4	-177.5	68.3	0	0	0	0	113.8
713	S	38.3	Very low	45.1	Very low	39 Å²	39	95.6 Å²	95.6	27%	0.273	50%	0.497	S	S	.	.	S	Bend	trans	-165.6	112.7	178.5	58.6	0	0	0	0	109.8	M711 N715	M711-S713 PolarHBondContact O-N 2.99Å; S713-N715 PolarHBondContact O-N 2.97Å
714	D	35.3	Very low	44.7	Very low	111 Å²	111	94.2 Å²	94.2	59%	0.594	49%	0.489	S	S	*	.	S	Bend	trans	-70.7	20.1	-172.8	-53.9	-20.7	0	0	0	114.9	R510	R510-D714 IonicContact CZ-OD2 2.7Å; R510-D714 IonicContact NH1-OD2 2.71Å; R510-D714 PolarHBondContact NH1-OD2 3.27Å
715	N	38.2	Very low	43.9	Very low	106 Å²	106	96.1 Å²	96.1	57%	0.567	50%	0.496	S	S	*	.			trans	-110.4	20.5	-168.8	-73.4	18.2	0	0	0	114	S713 F910	S713-N715 PolarHBondContact O-N 2.97Å; N715-F910 HydrophobicContact CB-CE1 4.12Å; N715-F910 HydrophobicContact CB-CZ 4.14Å
716	F	36.8	Very low	43.6	Very low	117 Å²	117	90.7 Å²	90.7	51%	0.513	47%	0.473	S	S	.	.			trans	-123.7	79.9	174.9	-78.6	-79.3	0	0	0	110.7	M711 N718	M711-F716 HydrophobicContact CE-CD2 3.95Å; M711-F716 HydrophobicContact CE-CE2 4.34Å; M711-F716 HydrophobicContact CE-CG 4.48Å; M711-F716 HydrophobicContact SD-CB 4.5Å; F716-N718 PolarHBondContact O-N 2.77Å
717	D	37.7	Very low	43.1	Very low	152 Å²	152	94.3 Å²	94.3	81%	0.813	48%	0.482	S	S	*	.			trans	-67.9	-14.7	176.6	-68.7	-47.4	0	0	0	113.8
718	N	39.8	Very low	42.6	Very low	57 Å²	57	96.3 Å²	96.3	31%	0.305	49%	0.488	S	S	.	.	S	Bend	trans	-92.1	133.5	-176.1	-73.4	64.5	0	0	0	112	F716 I720 N816	F716-N718 PolarHBondContact O-N 2.77Å; N718-I720 PolarHBondContact O-N 3.46Å; N718-I720 VanDerWaalsContact O-N 3.15Å; N718-N816 PolarHBondContact ND2-O 3.26Å; N718-N816 PolarHBondContact OD1-O 2.71Å
719	E	40.5	Very low	42.1	Very low	112 Å²	112	94.7 Å²	94.7	52%	0.523	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-64.1	116.1	177.7	-60.8	-165.5	124.3	0	0	111.7	R708 S721 S767	R708-E719 IonicContact CZ-OE1 3.03Å; R708-E719 IonicContact NE-OE1 3.38Å; R708-E719 IonicContact NH2-OE1 2.65Å; R708-E719 PolarHBondContact NH2-OE1 3.25Å; E719-S721 PolarHBondContact O-N 3.32Å; E719-S767 PolarHBondContact O-OG 3.49Å
720	I	44.6	Very low	41.3	Very low	33 Å²	33	101 Å²	101	17%	0.169	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-64.6	122.4	163.7	-61.3	177.4	0	0	0	107.2	M711 N718 F722 S767	M711-I720 HydrophobicContact CE-CD1 4.05Å; M711-I720 HydrophobicContact SD-CD1 3.64Å; N718-I720 PolarHBondContact O-N 3.46Å; N718-I720 VanDerWaalsContact O-N 3.15Å; I720-F722 HydrophobicContact CB-CE1 4.48Å; I720-F722 HydrophobicContact CB-CE2 4.43Å; I720-F722 HydrophobicContact CB-CZ 4.07Å; I720-F722 HydrophobicContact CG2-CE1 4.15Å; I720-F722 HydrophobicContact CG2-CZ 4.25Å; I720-F722 WeakPolarHBondContact O-CD2 3.41Å; I720-F722 WeakPolarHBondContact O-CE2 3.47Å; I720-F722 PolarHBondContact O-N 3.27Å; I720-S767 WeakPolarHBondContact CA-OG 3.31Å
721	S	44.7	Very low	40.6	Very low	53 Å²	53	105.3 Å²	105.3	37%	0.371	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-73.3	121.1	178.7	64.8	0	0	0	0	110.8	E719 A766 S767	E719-S721 PolarHBondContact O-N 3.32Å; S721-A766 WeakPolarHBondContact OG-CB 3.46Å; S721-S767 PolarHBondContact N-OG 2.79Å
722	F	48.4	Very low	40.1	Very low	84 Å²	84	108.1 Å²	108.1	37%	0.368	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	109.6	172.7	-52.1	-79.5	0	0	0	109	I720 I724 F762	I720-F722 HydrophobicContact CB-CE1 4.48Å; I720-F722 HydrophobicContact CB-CE2 4.43Å; I720-F722 HydrophobicContact CB-CZ 4.07Å; I720-F722 HydrophobicContact CG2-CE1 4.15Å; I720-F722 HydrophobicContact CG2-CZ 4.25Å; I720-F722 WeakPolarHBondContact O-CD2 3.41Å; I720-F722 WeakPolarHBondContact O-CE2 3.47Å; I720-F722 PolarHBondContact O-N 3.27Å; F722-I724 HydrophobicContact CB-CG1 4.48Å; F722-F762 AromaticContact CD1-CD1 3.77Å; F722-F762 HydrophobicContact CD1-CD1 3.77Å; F722-F762 AromaticContact CD1-CE1 3.73Å; F722-F762 HydrophobicContact CD1-CE1 3.73Å; F722-F762 AromaticContact CE1-CD1 3.68Å; F722-F762 HydrophobicContact CE1-CD1 3.68Å; F722-F762 AromaticContact CE1-CE1 3.58Å; F722-F762 HydrophobicContact CE1-CE1 3.58Å
723	D	47.4	Very low	39.6	Very low	84 Å²	84	111.5 Å²	111.5	45%	0.449	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	124	168.7	-169.9	29.9	0	0	0	108.9	Q725 Y761	D723-Q725 PolarHBondContact OD2-NE2 2.93Å; D723-Y761 PolarHBondContact N-O 3.14Å; D723-Y761 WeakPolarHBondContact O-CB 3.42Å; D723-Y761 WeakPolarHBondContact O-CD2 3.48Å; D723-Y761 PolarHBondContact O-N 3.39Å
724	I	48.3	Very low	39.1	Very low	54 Å²	54	115.3 Å²	115.3	28%	0.277	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.9	101.7	-173.4	-57.3	155.9	0	0	0	107.9	L706 F722 F726 V760	L706-I724 HydrophobicContact CD1-CD1 3.73Å; L706-I724 HydrophobicContact CD1-CG1 4.21Å; F722-I724 HydrophobicContact CB-CG1 4.48Å; I724-F726 HydrophobicContact CB-CE2 4.39Å; I724-F726 HydrophobicContact CG2-CD2 4.02Å; I724-F726 HydrophobicContact CG2-CE1 4.18Å; I724-F726 HydrophobicContact CG2-CE2 3.51Å; I724-F726 HydrophobicContact CG2-CZ 3.62Å; I724-F726 PolarHBondContact O-N 3.17Å; I724-V760 HydrophobicContact CG1-CG1 4.29Å; I724-V760 HydrophobicContact CG2-CG2 4.4Å
725	Q	46.6	Very low	38.8	Very low	92 Å²	92	115.7 Å²	115.7	43%	0.43	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.1	98.8	-178.4	-53	-167.4	7.9	0	0	109.9	D723 V759 Y761	D723-Q725 PolarHBondContact OD2-NE2 2.93Å; Q725-V759 PolarHBondContact N-O 2.8Å; Q725-V759 PolarHBondContact O-N 2.83Å; Q725-Y761 HydrophobicContact CB-CD2 4.46Å; Q725-Y761 HydrophobicContact CB-CE2 3.82Å; Q725-Y761 HydrophobicContact CG-CD2 4.18Å; Q725-Y761 HydrophobicContact CG-CE2 3.86Å
726	F	49.6	Very low	38.4	Very low	37 Å²	37	118.1 Å²	118.1	16%	0.162	58%	0.575	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.9	132.4	171.5	-66.9	-74	0	0	0	110.9	I724 K728 F744 I757	I724-F726 HydrophobicContact CB-CE2 4.39Å; I724-F726 HydrophobicContact CG2-CD2 4.02Å; I724-F726 HydrophobicContact CG2-CE1 4.18Å; I724-F726 HydrophobicContact CG2-CE2 3.51Å; I724-F726 HydrophobicContact CG2-CZ 3.62Å; I724-F726 PolarHBondContact O-N 3.17Å; F726-K728 PolarHBondContact O-N 2.83Å; F726-F744 HydrophobicContact CB-CE1 4.34Å; F726-F744 AromaticContact CD2-CE1 3.85Å; F726-F744 HydrophobicContact CD2-CE1 3.85Å; F726-F744 AromaticContact CD2-CZ 3.74Å; F726-F744 HydrophobicContact CD2-CZ 3.74Å; F726-F744 HydrophobicContact CE2-CE1 4.23Å; F726-F744 AromaticContact CE2-CZ 3.82Å; F726-F744 HydrophobicContact CE2-CZ 3.82Å; F726-F744 AromaticContact CG-CE1 3.99Å; F726-F744 HydrophobicContact CG-CE1 3.99Å; F726-F744 HydrophobicContact CG-CZ 4.36Å; F726-F744 HydrophobicContact CZ-CZ 4.49Å; F726-I757 HydrophobicContact CD1-CG2 3.96Å; F726-I757 HydrophobicContact CE1-CG2 4.3Å
727	Y	43.6	Very low	38.1	Very low	164 Å²	164	120.1 Å²	120.1	64%	0.643	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	47.9	-166.5	-101.3	-54.4	0	0	0	114.3	I757 V759	Y727-I757 PolarHBondContact N-O 3.23Å; Y727-I757 VanDerWaalsContact N-O 3.13Å; Y727-V759 HydrophobicContact CD2-CG2 4.05Å; Y727-V759 HydrophobicContact CE2-CG2 3.56Å
728	K	38.1	Very low	37.7	Very low	188 Å²	188	119.2 Å²	119.2	82%	0.817	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.9	4.7	166	-123.5	174.8	-176.8	-174.8	0	118	F726 K730	F726-K728 PolarHBondContact O-N 2.83Å; K728-K730 PolarHBondContact O-N 2.99Å
729	I	36.2	Very low	37.2	Very low	108 Å²	108	124.5 Å²	124.5	55%	0.554	62%	0.62	S	S	*	*			trans	-79	109.5	-177.5	-57.2	179.3	0	0	0	111	R731	I729-R731 PolarHBondContact O-N 2.84Å; I729-R731 VanDerWaalsContact O-N 3.1Å
730	K	29.4	Very low	36.7	Very low	191 Å²	191	123.8 Å²	123.8	83%	0.83	63%	0.627	S	S	*	*			trans	-76.5	92.8	173.3	-132.1	-171.8	-174	-173.4	0	109.4	K728 N732	K728-K730 PolarHBondContact O-N 2.99Å; K730-N732 VanDerWaalsContact C-N 3.26Å; K730-N732 PolarHBondContact O-N 2.78Å
731	R	29.7	Very low	36.4	Very low	217 Å²	217	128 Å²	128	82%	0.819	66%	0.657	S	S	*	*			trans	-73.5	71.4	-177	-157.7	174.7	-166.1	162.7	4.5	112	I729 K733	I729-R731 PolarHBondContact O-N 2.84Å; I729-R731 VanDerWaalsContact O-N 3.1Å; R731-K733 PolarHBondContact O-N 2.83Å
732	N	28.4	Very low	36.1	Very low	141 Å²	141	134.8 Å²	134.8	75%	0.754	68%	0.675	S	S	*	*			trans	-59	132.1	167.6	-89.5	11.2	0	0	0	109	K730	K730-N732 VanDerWaalsContact C-N 3.26Å; K730-N732 PolarHBondContact O-N 2.78Å
733	K	30.2	Very low	35.3	Very low	202 Å²	202	139 Å²	139	88%	0.878	70%	0.701	S	S	*	*			trans	-117.4	72.8	-161.7	-166.5	-177.4	-178.2	-177.7	0	111.9	R731	R731-K733 PolarHBondContact O-N 2.83Å
734	T	27.5	Very low	35.3	Very low	118 Å²	118	138.9 Å²	138.9	72%	0.724	70%	0.696	S	S	*	*			trans	-148.1	139.4	178.1	44.5	0	0	0	0	111.7
735	S	28.4	Very low	35.3	Very low	119 Å²	119	143.9 Å²	143.9	83%	0.832	72%	0.719	S	S	*	*			trans	61.7	147.6	173.6	38.7	0	0	0	0	117.7
736	N	30.3	Very low	35.7	Very low	158 Å²	158	142.9 Å²	142.9	85%	0.845	72%	0.72	S	S	*	*			trans	-91.6	130	178.7	-56.4	-21.3	0	0	0	109.3
737	D	31.7	Very low	36.4	Very low	159 Å²	159	143.5 Å²	143.5	85%	0.85	72%	0.724	S	S	*	*			trans	-157.2	113.5	151.4	-105.3	-38.5	0	0	0	109.3	N739	D737-N739 PolarHBondContact O-N 3.24Å
738	T	29	Very low	37.6	Very low	133 Å²	133	140.8 Å²	140.8	82%	0.816	72%	0.718	S	S	*	*			trans	-96.9	64.4	-177.3	48.8	0	0	0	0	111.1
739	N	29.2	Very low	39.1	Very low	168 Å²	168	131.9 Å²	131.9	90%	0.898	68%	0.679	S	S	*	*			trans	-168.8	78.4	161.3	-96.8	-30.7	0	0	0	112.1	D737	D737-N739 PolarHBondContact O-N 3.24Å
740	S	29.8	Very low	40.9	Very low	97 Å²	97	128.9 Å²	128.9	68%	0.678	67%	0.668	S	S	*	*			trans	-149.4	137.2	159	56.7	0	0	0	0	110.9
741	P	37.1	Very low	42.8	Very low	122 Å²	122	121.9 Å²	121.9	79%	0.792	65%	0.645	S	S	*	*			trans	-73	140.1	176.7	30.1	-33.8	0	0	0	110.4	L743	P741-L743 PolarHBondContact O-N 3.48Å
742	Y	38.9	Very low	44.6	Very low	194 Å²	194	117.4 Å²	117.4	76%	0.761	64%	0.638	S	S	*	*			trans	-63.1	107	-179.1	-64.2	-74.3	0	0	0	111.5	F744	Y742-F744 WeakPolarHBondContact O-CD2 3.43Å; Y742-F744 PolarHBondContact O-N 3.14Å
743	L	32.6	Very low	46.9	Very low	173 Å²	173	113.5 Å²	113.5	91%	0.906	62%	0.615	S	S	*	*			trans	-72.9	87.6	178.3	-160.8	82	0	0	0	110.7	P741 Q745	P741-L743 PolarHBondContact O-N 3.48Å; L743-Q745 PolarHBondContact O-N 2.92Å
744	F	47.4	Very low	49.1	Very low	81 Å²	81	107 Å²	107	36%	0.355	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-60.6	126.8	169.2	-78.2	-91.1	0	0	0	109.9	F726 Y742	F726-F744 HydrophobicContact CB-CE1 4.34Å; F726-F744 AromaticContact CD2-CE1 3.85Å; F726-F744 HydrophobicContact CD2-CE1 3.85Å; F726-F744 AromaticContact CD2-CZ 3.74Å; F726-F744 HydrophobicContact CD2-CZ 3.74Å; F726-F744 HydrophobicContact CE2-CE1 4.23Å; F726-F744 AromaticContact CE2-CZ 3.82Å; F726-F744 HydrophobicContact CE2-CZ 3.82Å; F726-F744 AromaticContact CG-CE1 3.99Å; F726-F744 HydrophobicContact CG-CE1 3.99Å; F726-F744 HydrophobicContact CG-CZ 4.36Å; F726-F744 HydrophobicContact CZ-CZ 4.49Å; Y742-F744 WeakPolarHBondContact O-CD2 3.43Å; Y742-F744 PolarHBondContact O-N 3.14Å
745	Q	48.7	Very low	51.4	Low	159 Å²	159	105.8 Å²	105.8	74%	0.743	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-67	125.2	160	-77.9	-169.1	-34	0	0	107.9	L743 I747	L743-Q745 PolarHBondContact O-N 2.92Å; Q745-I747 PolarHBondContact O-N 2.91Å
746	P	55.2	Low	53.6	Low	71 Å²	71	102.9 Å²	102.9	46%	0.461	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-60.3	128	-178.4	23.6	-33.1	0	0	0	109.9	N700 I701 Q748	N700-P746 HydrophobicContact CB-CB 4.1Å; I701-P746 WeakPolarHBondContact O-CA 3.26Å; P746-Q748 PolarHBondContact O-N 3.48Å
747	I	64.2	Low	55.6	Low	50 Å²	50	95.8 Å²	95.8	26%	0.256	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	101.7	-178.1	-54.4	178	0	0	0	107.3	I701 Q745 F749 I757	I701-I747 PolarHBondContact N-O 2.9Å; I701-I747 PolarHBondContact O-N 2.94Å; Q745-I747 PolarHBondContact O-N 2.91Å; I747-F749 HydrophobicContact CB-CD2 4.44Å; I747-F749 HydrophobicContact CB-CE2 3.88Å; I747-F749 HydrophobicContact CG2-CD2 3.99Å; I747-F749 HydrophobicContact CG2-CE2 3.39Å; I747-F749 HydrophobicContact CG2-CZ 3.95Å; I747-F749 WeakPolarHBondContact O-CD2 3.18Å; I747-F749 PolarHBondContact O-N 2.87Å; I747-I757 HydrophobicContact CD1-CB 4.49Å; I747-I757 HydrophobicContact CD1-CG1 4.35Å; I747-I757 HydrophobicContact CD1-CG2 3.61Å
748	Q	67.1	Low	57.5	Low	107 Å²	107	88.3 Å²	88.3	50%	0.5	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	122.4	169.6	-92.7	179.8	-72.5	0	0	110.4	E698 N700 P746 R755	E698-Q748 PolarHBondContact OE2-NE2 2.86Å; N700-Q748 WeakPolarHBondContact OD1-CG 3.29Å; P746-Q748 PolarHBondContact O-N 3.48Å; Q748-R755 PolarHBondContact O-NH1 3.17Å; Q748-R755 PolarHBondContact O-NH2 3.47Å
749	F	70.4	Confident	59.6	Low	1 Å²	1	82.3 Å²	82.3	0%	0.004	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	120.6	167.5	-75.6	-97.5	0	0	0	109.8	V691 N693 E698 I699 I701 I747 Q753 R755 I757	V691-F749 HydrophobicContact CB-CE1 4.49Å; V691-F749 HydrophobicContact CB-CZ 4.31Å; V691-F749 WeakPolarHBondContact O-CE1 3.48Å; N693-F749 HydrophobicContact CB-CB 3.79Å; N693-F749 HydrophobicContact CB-CG 4.46Å; N693-F749 PolarHBondContact ND2-O 3.03Å; E698-F749 VanDerWaalsContact CA-O 3.27Å; E698-F749 WeakPolarHBondContact CA-O 3.16Å; I699-F749 PolarHBondContact N-O 3Å; I699-F749 PolarHBondContact O-N 2.93Å; I701-F749 HydrophobicContact CD1-CD2 3.92Å; I701-F749 HydrophobicContact CD1-CE2 3.62Å; I701-F749 HydrophobicContact CD1-CZ 4.36Å; I701-F749 HydrophobicContact CG1-CD2 4.08Å; I701-F749 HydrophobicContact CG1-CE2 4.11Å; I747-F749 HydrophobicContact CB-CD2 4.44Å; I747-F749 HydrophobicContact CB-CE2 3.88Å; I747-F749 HydrophobicContact CG2-CD2 3.99Å; I747-F749 HydrophobicContact CG2-CE2 3.39Å; I747-F749 HydrophobicContact CG2-CZ 3.95Å; I747-F749 WeakPolarHBondContact O-CD2 3.18Å; I747-F749 PolarHBondContact O-N 2.87Å; F749-Q753 WeakPolarHBondContact CD1-O 3.16Å; F749-R755 HydrophobicContact CD1-CG 4.17Å; F749-R755 HydrophobicContact CE1-CB 3.54Å; F749-R755 HydrophobicContact CE1-CG 3.64Å; F749-R755 HydrophobicContact CZ-CB 3.93Å; F749-R755 HydrophobicContact CZ-CG 4.29Å; F749-I757 HydrophobicContact CE2-CD1 3.83Å; F749-I757 HydrophobicContact CE2-CG1 4.4Å; F749-I757 HydrophobicContact CZ-CD1 3.57Å; F749-I757 HydrophobicContact CZ-CG1 3.78Å
750	S	73.4	Confident	61.5	Low	45 Å²	45	74.4 Å²	74.4	32%	0.315	40%	0.397	S	S	.	.			trans	-69.6	161.7	166.1	56.3	0	0	0	0	110.9	Q753	S750-Q753 WeakPolarHBondContact O-CB 3.49Å; S750-Q753 PolarHBondContact O-N 3.43Å; S750-Q753 VanDerWaalsContact O-N 3.09Å; S750-Q753 PolarHBondContact OG-OE1 3.2Å
751	A	68.9	Low	63.4	Low	44 Å²	44	72.1 Å²	72.1	36%	0.364	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	139.3	179.5	0	0	0	0	0	111.5	Y695 Q753	Y695-A751 WeakPolarHBondContact O-CB 3.48Å; A751-Q753 PolarHBondContact O-N 2.88Å; A751-Q753 VanDerWaalsContact O-N 3.12Å
752	N	68.9	Low	64.7	Low	123 Å²	123	67.3 Å²	67.3	66%	0.658	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	9.6	-173.4	-63.2	-25.2	0	0	0	115.8	N693	N693-N752 WeakPolarHBondContact O-CA 3.4Å; N693-N752 PolarHBondContact O-N 2.65Å
753	Q	76.1	Confident	66	Low	60 Å²	60	60 Å²	60	28%	0.28	32%	0.315	S	S	.	.			trans	-80.4	126	178.3	-167.3	172.7	40.9	0	0	111.8	N693 F749 S750 A751 R755	N693-Q753 PolarHBondContact N-O 2.79Å; F749-Q753 WeakPolarHBondContact CD1-O 3.16Å; S750-Q753 WeakPolarHBondContact O-CB 3.49Å; S750-Q753 PolarHBondContact O-N 3.43Å; S750-Q753 VanDerWaalsContact O-N 3.09Å; S750-Q753 PolarHBondContact OG-OE1 3.2Å; A751-Q753 PolarHBondContact O-N 2.88Å; A751-Q753 VanDerWaalsContact O-N 3.12Å; Q753-R755 HydrophobicContact CG-CG 4.19Å; Q753-R755 VanDerWaalsContact OE1-CZ 3.26Å; Q753-R755 VanDerWaalsContact OE1-NE 3.14Å
754	S	76	Confident	67.3	Low	64 Å²	64	52.5 Å²	52.5	45%	0.448	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	137.5	165.3	-56.5	0	0	0	0	110.9	V691 Q692	V691-S754 CarbonylContact O-C 3.56Å; V691-S754 VanDerWaalsContact O-CA 3.31Å; V691-S754 WeakPolarHBondContact O-CA 3.41Å; Q692-S754 WeakPolarHBondContact CB-OG 3.32Å; Q692-S754 WeakPolarHBondContact CG-OG 3.25Å
755	R	76.1	Confident	67.7	Low	93 Å²	93	51 Å²	51	35%	0.351	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	146.9	167.7	-55.1	-176.7	-178.8	160.7	9.3	111.1	V691 Q748 F749 Q753	V691-R755 PolarHBondContact N-O 2.87Å; V691-R755 PolarHBondContact O-N 3.32Å; Q748-R755 PolarHBondContact O-NH1 3.17Å; Q748-R755 PolarHBondContact O-NH2 3.47Å; F749-R755 HydrophobicContact CD1-CG 4.17Å; F749-R755 HydrophobicContact CE1-CB 3.54Å; F749-R755 HydrophobicContact CE1-CG 3.64Å; F749-R755 HydrophobicContact CZ-CB 3.93Å; F749-R755 HydrophobicContact CZ-CG 4.29Å; Q753-R755 HydrophobicContact CG-CG 4.19Å; Q753-R755 VanDerWaalsContact OE1-CZ 3.26Å; Q753-R755 VanDerWaalsContact OE1-NE 3.14Å
756	V	75.2	Confident	67.9	Low	58 Å²	58	46.3 Å²	46.3	35%	0.352	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	125.9	163.7	-177.3	0	0	0	0	108.3	K688 I689	K688-V756 HydrophobicContact CB-CG1 4.26Å; K688-V756 HydrophobicContact CD-CG2 4.45Å; K688-V756 HydrophobicContact CG-CG1 4.5Å; I689-V756 WeakPolarHBondContact O-CA 2.87Å
757	I	72.8	Confident	67.7	Low	10 Å²	10	44 Å²	44	5%	0.051	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-37.8	179.5	-59.3	-175.2	0	0	0	111.7	I689 V691 I701 I704 F726 Y727 I747 F749	I689-I757 PolarHBondContact O-N 3.03Å; V691-I757 HydrophobicContact CB-CD1 3.71Å; V691-I757 HydrophobicContact CB-CG1 4.24Å; V691-I757 HydrophobicContact CG1-CD1 4.35Å; V691-I757 HydrophobicContact CG2-CD1 3.48Å; V691-I757 VanDerWaalsContact CG2-CD1 3.48Å; V691-I757 HydrophobicContact CG2-CG1 4.04Å; I701-I757 HydrophobicContact CD1-CD1 4Å; I704-I757 HydrophobicContact CD1-CB 4.32Å; I704-I757 HydrophobicContact CD1-CD1 3.53Å; I704-I757 HydrophobicContact CD1-CG2 3.74Å; F726-I757 HydrophobicContact CD1-CG2 3.96Å; F726-I757 HydrophobicContact CE1-CG2 4.3Å; Y727-I757 PolarHBondContact N-O 3.23Å; Y727-I757 VanDerWaalsContact N-O 3.13Å; I747-I757 HydrophobicContact CD1-CB 4.49Å; I747-I757 HydrophobicContact CD1-CG1 4.35Å; I747-I757 HydrophobicContact CD1-CG2 3.61Å; F749-I757 HydrophobicContact CE2-CD1 3.83Å; F749-I757 HydrophobicContact CE2-CG1 4.4Å; F749-I757 HydrophobicContact CZ-CD1 3.57Å; F749-I757 HydrophobicContact CZ-CG1 3.78Å
758	G	71.2	Confident	66.8	Low	1 Å²	1	42.8 Å²	42.8	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	178.6	-179.5	0	0	0	0	0	113.8	I689	I689-G758 PolarHBondContact N-O 3.4Å
759	V	71.7	Confident	65.9	Low	8 Å²	8	39.2 Å²	39.2	5%	0.048	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.3	172.2	178.6	0	0	0	0	108.8	M686 H687 K688 Q725 Y727 Y761	M686-V759 HydrophobicContact CB-CG1 3.96Å; M686-V759 HydrophobicContact CG-CG1 4.27Å; M686-V759 HydrophobicContact SD-CG1 4.48Å; H687-V759 CarbonylContact O-C 3.5Å; H687-V759 VanDerWaalsContact O-CA 3.31Å; H687-V759 WeakPolarHBondContact O-CA 3.42Å; K688-V759 HydrophobicContact CG-CG2 4.13Å; Q725-V759 PolarHBondContact N-O 2.8Å; Q725-V759 PolarHBondContact O-N 2.83Å; Y727-V759 HydrophobicContact CD2-CG2 4.05Å; Y727-V759 HydrophobicContact CE2-CG2 3.56Å; V759-Y761 HydrophobicContact CB-CD2 4.45Å; V759-Y761 HydrophobicContact CB-CE2 3.71Å; V759-Y761 HydrophobicContact CG1-CD2 4.02Å; V759-Y761 HydrophobicContact CG1-CE2 3.5Å; V759-Y761 VanDerWaalsContact CG1-CE2 3.5Å; V759-Y761 WeakPolarHBondContact O-CD2 3.49Å
760	V	70	Confident	64.7	Low	2 Å²	2	41.5 Å²	41.5	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	128.3	172	-174.5	0	0	0	0	108.5	L674 M686 H687 I689 L706 I724 F762	L674-V760 HydrophobicContact CD1-CG2 4.29Å; M686-V760 WeakPolarHBondContact CA-O 3.33Å; H687-V760 PolarHBondContact N-O 2.92Å; H687-V760 PolarHBondContact O-N 3.35Å; I689-V760 HydrophobicContact CD1-CG2 3.61Å; I689-V760 HydrophobicContact CG1-CG2 4.18Å; L706-V760 HydrophobicContact CD1-CG2 3.78Å; I724-V760 HydrophobicContact CG1-CG1 4.29Å; I724-V760 HydrophobicContact CG2-CG2 4.4Å; V760-F762 HydrophobicContact CB-CE2 3.92Å; V760-F762 HydrophobicContact CB-CZ 4.49Å; V760-F762 HydrophobicContact CG1-CD2 4.04Å; V760-F762 HydrophobicContact CG1-CE1 4.48Å; V760-F762 HydrophobicContact CG1-CE2 3.38Å; V760-F762 HydrophobicContact CG1-CZ 3.64Å
761	Y	69.1	Low	63.1	Low	49 Å²	49	46.2 Å²	46.2	19%	0.192	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122	176.2	-61.3	-110.6	0	0	0	108.4	M686 D723 Q725 V759	M686-Y761 HydrophobicContact CG-CD1 3.65Å; M686-Y761 HydrophobicContact CG-CE1 3.67Å; M686-Y761 HydrophobicContact CG-CG 4.35Å; M686-Y761 HydrophobicContact SD-CD1 3.97Å; M686-Y761 HydrophobicContact SD-CE1 3.34Å; M686-Y761 WeakPolarHBondContact SD-CE1 3.4Å; D723-Y761 PolarHBondContact N-O 3.14Å; D723-Y761 WeakPolarHBondContact O-CB 3.42Å; D723-Y761 WeakPolarHBondContact O-CD2 3.48Å; D723-Y761 PolarHBondContact O-N 3.39Å; Q725-Y761 HydrophobicContact CB-CD2 4.46Å; Q725-Y761 HydrophobicContact CB-CE2 3.82Å; Q725-Y761 HydrophobicContact CG-CD2 4.18Å; Q725-Y761 HydrophobicContact CG-CE2 3.86Å; V759-Y761 HydrophobicContact CB-CD2 4.45Å; V759-Y761 HydrophobicContact CB-CE2 3.71Å; V759-Y761 HydrophobicContact CG1-CD2 4.02Å; V759-Y761 HydrophobicContact CG1-CE2 3.5Å; V759-Y761 VanDerWaalsContact CG1-CE2 3.5Å; V759-Y761 WeakPolarHBondContact O-CD2 3.49Å
762	F	64.8	Low	61.7	Low	21 Å²	21	46.7 Å²	46.7	9%	0.092	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	102.1	173.4	-65.4	-96.9	0	0	0	107.8	L674 V676 L679 I684 I685 F722 V760	L674-F762 HydrophobicContact CD2-CE2 3.62Å; L674-F762 HydrophobicContact CD2-CZ 3.6Å; V676-F762 HydrophobicContact CG1-CG 4.31Å; V676-F762 HydrophobicContact CG2-CD1 4.08Å; V676-F762 HydrophobicContact CG2-CD2 4.03Å; V676-F762 HydrophobicContact CG2-CE1 3.78Å; V676-F762 HydrophobicContact CG2-CE2 3.73Å; V676-F762 HydrophobicContact CG2-CG 4.22Å; V676-F762 HydrophobicContact CG2-CZ 3.61Å; L679-F762 HydrophobicContact CD1-CB 4.33Å; L679-F762 HydrophobicContact CD1-CD1 4.21Å; L679-F762 HydrophobicContact CD2-CB 3.73Å; I684-F762 WeakPolarHBondContact CA-O 3.24Å; I685-F762 HydrophobicContact CB-CB 4.38Å; I685-F762 PolarHBondContact N-O 2.91Å; I685-F762 VanDerWaalsContact N-O 3.1Å; I685-F762 PolarHBondContact O-N 3.13Å; F722-F762 AromaticContact CD1-CD1 3.77Å; F722-F762 HydrophobicContact CD1-CD1 3.77Å; F722-F762 AromaticContact CD1-CE1 3.73Å; F722-F762 HydrophobicContact CD1-CE1 3.73Å; F722-F762 AromaticContact CE1-CD1 3.68Å; F722-F762 HydrophobicContact CE1-CD1 3.68Å; F722-F762 AromaticContact CE1-CE1 3.58Å; F722-F762 HydrophobicContact CE1-CE1 3.58Å; V760-F762 HydrophobicContact CB-CE2 3.92Å; V760-F762 HydrophobicContact CB-CZ 4.49Å; V760-F762 HydrophobicContact CG1-CD2 4.04Å; V760-F762 HydrophobicContact CG1-CE1 4.48Å; V760-F762 HydrophobicContact CG1-CE2 3.38Å; V760-F762 HydrophobicContact CG1-CZ 3.64Å
763	D	65.9	Low	60.5	Low	41 Å²	41	46.3 Å²	46.3	22%	0.219	24%	0.243	C	C	.	.			trans	-119.9	96.6	174.3	-171.2	-6.7	0	0	0	110.6	I684 S765	I684-D763 HydrophobicContact CG1-CB 4.1Å; D763-S765 VanDerWaalsContact CG-OG 3.24Å; D763-S765 PolarHBondContact O-N 3.08Å; D763-S765 VanDerWaalsContact OD1-CB 3.22Å; D763-S765 WeakPolarHBondContact OD1-CB 3.36Å; D763-S765 PolarHBondContact OD1-N 3.32Å; D763-S765 PolarHBondContact OD1-OG 2.9Å; D763-S765 PolarHBondContact OD2-OG 3.37Å
764	P	60.1	Low	58.8	Low	15 Å²	15	47 Å²	47	10%	0.097	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-75.5	-2.1	178	32.3	-36.4	0	0	0	113.6	L679 F680	L679-P764 HydrophobicContact CB-CG 4.47Å; L679-P764 HydrophobicContact CD2-CG 4.46Å; F680-P764 VanDerWaalsContact C-CG 3.49Å; F680-P764 VanDerWaalsContact O-CG 3.22Å; F680-P764 WeakPolarHBondContact O-CG 3.18Å
765	S	55.3	Low	57	Low	48 Å²	48	48.6 Å²	48.6	34%	0.336	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-69.7	-39.3	-179.8	69.6	0	0	0	0	112.7	D763 S767 C768	D763-S765 VanDerWaalsContact CG-OG 3.24Å; D763-S765 PolarHBondContact O-N 3.08Å; D763-S765 VanDerWaalsContact OD1-CB 3.22Å; D763-S765 WeakPolarHBondContact OD1-CB 3.36Å; D763-S765 PolarHBondContact OD1-N 3.32Å; D763-S765 PolarHBondContact OD1-OG 2.9Å; D763-S765 PolarHBondContact OD2-OG 3.37Å; S765-S767 PolarHBondContact O-N 3.17Å; S765-S767 VanDerWaalsContact O-N 3.11Å; S765-C768 PolarHBondContact O-N 2.92Å
766	A	53.8	Low	55.1	Low	62 Å²	62	47.1 Å²	47.1	51%	0.512	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-67	-12.3	-177.6	0	0	0	0	0	114.7	S721	S721-A766 WeakPolarHBondContact OG-CB 3.46Å
767	S	51.4	Low	53.4	Low	21 Å²	21	50.2 Å²	50.2	15%	0.147	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-91.1	-7.8	175.1	-57.6	0	0	0	0	113.5	E719 I720 S721 S765	E719-S767 PolarHBondContact O-OG 3.49Å; I720-S767 WeakPolarHBondContact CA-OG 3.31Å; S721-S767 PolarHBondContact N-OG 2.79Å; S765-S767 PolarHBondContact O-N 3.17Å; S765-S767 VanDerWaalsContact O-N 3.11Å
768	C	44.8	Very low	51.6	Low	25 Å²	25	54.3 Å²	54.3	17%	0.169	30%	0.297	C	S	.	.	S	Bend	trans	-107.3	146.1	-179.7	-74.2	0	0	0	0	111.1	S765 C820	S765-C768 PolarHBondContact O-N 2.92Å; C768-C820 VanDerWaalsContact CA-SG 3.56Å; C768-C820 HydrophobicContact CB-CB 3.47Å; C768-C820 VanDerWaalsContact CB-CB 3.47Å; C768-C820 WeakPolarHBondContact CB-SG 3.1Å; C768-C820 WeakPolarHBondContact SG-CB 3.05Å; C768-C820 CovalentContact SG-SG 2.03Å; C768-C820 PolarHBondContact SG-SG 3.42Å
769	V	47.2	Very low	49.8	Very low	33 Å²	33	59.7 Å²	59.7	20%	0.2	33%	0.326	C	S	.	.			trans	-103.5	122	166.7	-178.1	0	0	0	0	108	K817	V769-K817 HydrophobicContact CG2-CB 4.42Å; V769-K817 HydrophobicContact CG2-CD 3.78Å
770	D	46.1	Very low	48	Very low	48 Å²	48	63.3 Å²	63.3	26%	0.257	35%	0.348	S	S	.	.			trans	-78.1	129.4	171.7	-166.7	-34.2	0	0	0	109.3	F772 E773	D770-F772 PolarHBondContact O-N 2.96Å; D770-F772 VanDerWaalsContact O-N 3.09Å; D770-F772 WeakPolarHBondContact OD1-CD2 3.23Å; D770-F772 PolarHBondContact OD1-N 2.84Å; D770-F772 VanDerWaalsContact OD1-N 3.08Å; D770-E773 WeakPolarHBondContact O-CB 3.45Å; D770-E773 PolarHBondContact O-N 3.3Å
771	R	39.8	Very low	46.2	Very low	145 Å²	145	71.7 Å²	71.7	55%	0.547	39%	0.389	S	S	.	.	H	α-helix	trans	-62.9	-18.3	-176.6	-145.4	-173.6	-157.5	-174.7	10	113.2	I775	R771-I775 WeakPolarHBondContact O-CD1 3.43Å; R771-I775 WeakPolarHBondContact O-CG1 3.41Å
772	F	39.5	Very low	44.3	Very low	54 Å²	54	73.2 Å²	73.2	24%	0.237	41%	0.407	C	S	.	.	H	α-helix	trans	-81.2	-17	173.5	-70.5	-78.3	0	0	0	113.8	D770 A776 L830 I859	D770-F772 PolarHBondContact O-N 2.96Å; D770-F772 VanDerWaalsContact O-N 3.09Å; D770-F772 WeakPolarHBondContact OD1-CD2 3.23Å; D770-F772 PolarHBondContact OD1-N 2.84Å; D770-F772 VanDerWaalsContact OD1-N 3.08Å; F772-A776 PolarHBondContact O-N 3.42Å; F772-L830 HydrophobicContact CB-CD2 3.75Å; F772-L830 HydrophobicContact CD1-CD2 4.35Å; F772-L830 HydrophobicContact CG-CD2 4.01Å; F772-I859 HydrophobicContact CD1-CG1 4.45Å; F772-I859 HydrophobicContact CE1-CG1 3.96Å
773	E	42.7	Very low	42.5	Very low	115 Å²	115	77 Å²	77	54%	0.537	43%	0.432	S	S	.	.	H	α-helix	trans	-82.1	-38	-176.1	-144.1	166.2	-151.1	0	0	112	D770 I775 A776 Q777	D770-E773 WeakPolarHBondContact O-CB 3.45Å; D770-E773 PolarHBondContact O-N 3.3Å; E773-I775 VanDerWaalsContact C-N 3.29Å; E773-I775 PolarHBondContact O-N 3.21Å; E773-A776 WeakPolarHBondContact O-CB 3.19Å; E773-A776 PolarHBondContact O-N 2.95Å; E773-A776 VanDerWaalsContact O-N 3.11Å; E773-Q777 PolarHBondContact O-N 2.98Å
774	D	40.9	Very low	40.7	Very low	74 Å²	74	81.3 Å²	81.3	40%	0.396	46%	0.46	S	S	.	.	H	α-helix	trans	-57.6	-41.5	169.3	-77.1	-29.2	0	0	0	111.8	A776 Q777 C778	D774-A776 PolarHBondContact O-N 3.33Å; D774-Q777 PolarHBondContact O-N 3.02Å; D774-C778 PolarHBondContact O-N 3.35Å; D774-C778 VanDerWaalsContact O-N 3.13Å; D774-C778 PolarHBondContact O-SG 2.82Å
775	I	39.5	Very low	39.1	Very low	98 Å²	98	85.3 Å²	85.3	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-62.6	-33.4	178.4	-62.3	173.2	0	0	0	110.8	R771 E773	R771-I775 WeakPolarHBondContact O-CD1 3.43Å; R771-I775 WeakPolarHBondContact O-CG1 3.41Å; E773-I775 VanDerWaalsContact C-N 3.29Å; E773-I775 PolarHBondContact O-N 3.21Å
776	A	36.2	Very low	37.9	Very low	62 Å²	62	89.3 Å²	89.3	51%	0.512	52%	0.517	S	S	.	.	H	α-helix	trans	-77.9	-33.2	175.6	0	0	0	0	0	113.2	F772 E773 D774	F772-A776 PolarHBondContact O-N 3.42Å; E773-A776 WeakPolarHBondContact O-CB 3.19Å; E773-A776 PolarHBondContact O-N 2.95Å; E773-A776 VanDerWaalsContact O-N 3.11Å; D774-A776 PolarHBondContact O-N 3.33Å
777	Q	39	Very low	36.7	Very low	122 Å²	122	91.8 Å²	91.8	57%	0.57	53%	0.525	S	S	*	.	H	α-helix	trans	-72.8	-33.1	179.3	-71.2	-166.4	10.5	0	0	113.1	E773 D774 D779 T780 M781	E773-Q777 PolarHBondContact O-N 2.98Å; D774-Q777 PolarHBondContact O-N 3.02Å; Q777-D779 PolarHBondContact O-N 2.95Å; Q777-D779 VanDerWaalsContact O-N 3.17Å; Q777-T780 PolarHBondContact O-N 2.84Å; Q777-T780 PolarHBondContact O-OG1 2.66Å; Q777-M781 PolarHBondContact O-N 3.47Å
778	C	34.1	Very low	35.7	Very low	96 Å²	96	97.7 Å²	97.7	65%	0.649	56%	0.561	S	S	*	*	H	α-helix	trans	-53.8	-34.8	177	-77.9	0	0	0	0	114.1	D774	D774-C778 PolarHBondContact O-N 3.35Å; D774-C778 VanDerWaalsContact O-N 3.13Å; D774-C778 PolarHBondContact O-SG 2.82Å
779	D	34.6	Very low	34.9	Very low	114 Å²	114	102.5 Å²	102.5	61%	0.61	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-10.3	177	-91.5	-15.5	0	0	0	114.2	Q777 S782 T783	Q777-D779 PolarHBondContact O-N 2.95Å; Q777-D779 VanDerWaalsContact O-N 3.17Å; D779-S782 PolarHBondContact O-OG 3.45Å; D779-T783 PolarHBondContact O-OG1 2.87Å
780	T	34.2	Very low	34.2	Very low	84 Å²	84	107.9 Å²	107.9	52%	0.515	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.6	-31.7	175.9	64.9	0	0	0	0	112.6	Q777 S782	Q777-T780 PolarHBondContact O-N 2.84Å; Q777-T780 PolarHBondContact O-OG1 2.66Å; T780-S782 VanDerWaalsContact C-N 3.27Å; T780-S782 PolarHBondContact O-N 2.85Å
781	M	30.7	Very low	33.4	Very low	179 Å²	179	111.4 Å²	111.4	88%	0.882	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-12.2	174.4	-73.4	-177	65.8	0	0	113.7	Q777	Q777-M781 PolarHBondContact O-N 3.47Å
782	S	29.9	Very low	32.9	Very low	80 Å²	80	109.9 Å²	109.9	56%	0.559	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-6.3	177	63.7	0	0	0	0	114.1	D779 T780	D779-S782 PolarHBondContact O-OG 3.45Å; T780-S782 VanDerWaalsContact C-N 3.27Å; T780-S782 PolarHBondContact O-N 2.85Å
783	T	27	Very low	32.4	Very low	102 Å²	102	112 Å²	112	63%	0.626	67%	0.674	S	S	*	*	S	Bend	trans	-128.5	30.4	-165.5	51.6	0	0	0	0	115.8	D779	D779-T783 PolarHBondContact O-OG1 2.87Å
784	T	28.9	Very low	31.8	Very low	130 Å²	130	112.4 Å²	112.4	80%	0.798	69%	0.685	S	S	*	*			trans	-144.8	41	169.9	-10.8	0	0	0	0	115.7
785	A	26.5	Very low	31.1	Very low	99 Å²	99	114.3 Å²	114.3	82%	0.818	70%	0.699	S	S	*	*			trans	-126.8	69.9	175.2	0	0	0	0	0	112.8
786	T	29.1	Very low	30.5	Very low	133 Å²	133	116.1 Å²	116.1	82%	0.816	71%	0.71	S	S	*	*			trans	-137.5	149.5	170.6	64.4	0	0	0	0	107.6
787	V	27.9	Very low	30	Very low	113 Å²	113	118.9 Å²	118.9	69%	0.685	72%	0.721	S	S	*	*			cis	-146.3	140.9	23.2	169.1	0	0	0	0	110
788	T	31.9	Very low	29.4	Very low	146 Å²	146	118.5 Å²	118.5	90%	0.896	73%	0.727	S	S	*	*				-168	128.9	127.4	12.2	0	0	0	0	111.8
789	T	26.9	Very low	29	Very low	125 Å²	125	120.5 Å²	120.5	77%	0.767	73%	0.731	S	S	*	*			trans	-116	137.5	-176.7	51	0	0	0	0	111.3
790	T	32.5	Very low	28.4	Very low	146 Å²	146	119.9 Å²	119.9	90%	0.896	74%	0.736	S	S	*	*			trans	-130	132.5	156.6	42.4	0	0	0	0	110.4
791	T	28.8	Very low	28	Very low	123 Å²	123	122 Å²	122	76%	0.755	75%	0.749	S	S	*	*			trans	-91	173.1	-178.3	58.1	0	0	0	0	109.9
792	T	30.5	Very low	27.7	Very low	112 Å²	112	117.9 Å²	117.9	69%	0.687	74%	0.743	S	S	*	*			cis	-162.7	148.9	23.7	-27.7	0	0	0	0	110.6
793	S	28	Very low	27.4	Very low	98 Å²	98	120.3 Å²	120.3	69%	0.685	75%	0.754	S	S	*	*			trans	39	133.5	147.3	63.3	0	0	0	0	120.8
794	T	29.9	Very low	27.4	Very low	125 Å²	125	125.5 Å²	125.5	77%	0.767	76%	0.764	S	S	*	*				-166.4	173.4	59.5	47.6	0	0	0	0	111.1
795	T	27.7	Very low	27.2	Very low	113 Å²	113	124.6 Å²	124.6	69%	0.693	76%	0.76	S	S	*	*			cis	-166.2	160.6	-26.1	33	0	0	0	0	110.3
796	N	26.2	Very low	27.1	Very low	136 Å²	136	125.7 Å²	125.7	73%	0.727	76%	0.757	S	S	*	*			trans	73.6	107.9	147.6	-71	9.2	0	0	0	123.6
797	T	25.7	Very low	26.9	Very low	120 Å²	120	124.6 Å²	124.6	74%	0.736	75%	0.751	S	S	*	*				89	131	124.4	51.9	0	0	0	0	124.3
798	T	25.7	Very low	26.7	Very low	115 Å²	115	129.8 Å²	129.8	71%	0.706	76%	0.76	S	S	*	*			trans	79.1	103.4	148.2	43.6	0	0	0	0	122.8
799	N	25.6	Very low	26.5	Very low	138 Å²	138	130.5 Å²	130.5	74%	0.738	76%	0.757	S	S	*	*				84.7	120	127	-64.2	1.3	0	0	0	122.8
800	S	23.6	Very low	26.5	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	76%	0.756	S	S	*	*			trans	108.4	153.8	136.2	78.5	0	0	0	0	119.6
801	T	25.5	Very low	26.2	Very low	130 Å²	130	131.9 Å²	131.9	80%	0.798	75%	0.75	S	S	*	*			trans	57	88	179.4	54.1	0	0	0	0	117.4	V803	T801-V803 PolarHBondContact O-N 2.78Å
802	A	23.8	Very low	26.2	Very low	91 Å²	91	131.8 Å²	131.8	75%	0.752	75%	0.751	S	S	*	*			trans	-84.6	99.8	161.2	0	0	0	0	0	110.3
803	V	24.1	Very low	26	Very low	131 Å²	131	134.5 Å²	134.5	79%	0.794	76%	0.761	S	S	*	*			trans	-107	100.7	161.7	178.2	0	0	0	0	106.8	T801	T801-V803 PolarHBondContact O-N 2.78Å
804	Y	25.7	Very low	26	Very low	212 Å²	212	133 Å²	133	83%	0.831	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-74.2	127.2	171.8	-86.6	-82	0	0	0	109.3
805	P	25.8	Very low	26	Very low	110 Å²	110	131.5 Å²	131.5	71%	0.714	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-68.8	135.1	172.8	29.3	-33.2	0	0	0	109.4
806	V	23.6	Very low	26.5	Very low	123 Å²	123	133.5 Å²	133.5	75%	0.745	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-63.2	126.4	166	177.4	0	0	0	0	107.5	Y808	V806-Y808 PolarHBondContact O-N 2.82Å; V806-Y808 VanDerWaalsContact O-N 3.11Å
807	P	25.7	Very low	27	Very low	109 Å²	109	132.8 Å²	132.8	71%	0.708	76%	0.757	S	S	*	*			trans	-66.7	113.9	177.6	26.5	-32.9	0	0	0	109.4	I809	P807-I809 PolarHBondContact O-N 3.47Å
808	Y	23.3	Very low	27.7	Very low	223 Å²	223	129.7 Å²	129.7	88%	0.875	74%	0.74	S	S	*	*			trans	-63.2	105.9	167.7	-86.7	-102.1	0	0	0	108.6	V806 V810	V806-Y808 PolarHBondContact O-N 2.82Å; V806-Y808 VanDerWaalsContact O-N 3.11Å; Y808-V810 PolarHBondContact O-N 2.85Å
809	I	28.9	Very low	28.3	Very low	160 Å²	160	131.3 Å²	131.3	82%	0.821	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-69	117	170.1	-64.3	-179.7	0	0	0	107.7	P807	P807-I809 PolarHBondContact O-N 3.47Å
810	V	26.8	Very low	29	Very low	122 Å²	122	126.3 Å²	126.3	74%	0.739	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-63.7	136.8	-178.4	175.9	0	0	0	0	110	Y808 P812	Y808-V810 PolarHBondContact O-N 2.85Å; V810-P812 VanDerWaalsContact O-CD 3.29Å; V810-P812 WeakPolarHBondContact O-CD 3.42Å
811	K	24.6	Very low	29.6	Very low	178 Å²	178	128 Å²	128	77%	0.774	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-62.6	120	171	-71	-177.3	175.2	-176	0	110	L813	K811-L813 HydrophobicContact CB-CD1 4.37Å; K811-L813 PolarHBondContact O-N 2.83Å
812	P	29.9	Very low	30.1	Very low	121 Å²	121	123.5 Å²	123.5	79%	0.786	68%	0.678	S	S	*	*			trans	-74.4	110.4	166.5	30	-31.2	0	0	0	109.3	V810 G814	V810-P812 VanDerWaalsContact O-CD 3.29Å; V810-P812 WeakPolarHBondContact O-CD 3.42Å; P812-G814 PolarHBondContact O-N 2.89Å
813	L	26.2	Very low	30.7	Very low	170 Å²	170	120.3 Å²	120.3	89%	0.89	65%	0.654	S	S	*	*			trans	-78.5	102.8	164.8	-89.4	73.2	0	0	0	108.5	K811	K811-L813 HydrophobicContact CB-CD1 4.37Å; K811-L813 PolarHBondContact O-N 2.83Å
814	G	26.9	Very low	31.3	Very low	65 Å²	65	117.5 Å²	117.5	67%	0.67	63%	0.631	S	S	*	*	S	Bend	trans	161.9	107.1	170.1	0	0	0	0	0	114.9	P812	P812-G814 PolarHBondContact O-N 2.89Å
815	A	31.1	Very low	32	Very low	94 Å²	94	109.3 Å²	109.3	78%	0.777	60%	0.601	S	S	*	*			trans	53.9	115.9	167.2	0	0	0	0	0	117.8	K817	A815-K817 PolarHBondContact O-N 3.48Å; A815-K817 VanDerWaalsContact O-N 3.09Å
816	N	37.2	Very low	32.4	Very low	155 Å²	155	105.4 Å²	105.4	83%	0.829	58%	0.575	S	S	*	*			trans	-61.5	112.6	171.5	-66.3	-12.8	0	0	0	110.5	N718	N718-N816 PolarHBondContact ND2-O 3.26Å; N718-N816 PolarHBondContact OD1-O 2.71Å
817	K	37.6	Very low	33.1	Very low	121 Å²	121	105.8 Å²	105.8	53%	0.526	57%	0.572	S	S	.	*			trans	-104.6	132.2	159.2	-73.9	-167.9	176.9	-171	0	109	V769 A815	V769-K817 HydrophobicContact CG2-CB 4.42Å; V769-K817 HydrophobicContact CG2-CD 3.78Å; A815-K817 PolarHBondContact O-N 3.48Å; A815-K817 VanDerWaalsContact O-N 3.09Å
818	P	39.7	Very low	34	Very low	56 Å²	56	102.9 Å²	102.9	36%	0.364	55%	0.553	S	S	.	*			trans	-70	134.5	175	28.7	-33.6	0	0	0	110.6	C820	P818-C820 PolarHBondContact O-N 3.11Å
819	F	38.8	Very low	34.9	Very low	148 Å²	148	96.7 Å²	96.7	65%	0.649	54%	0.542	S	S	*	.			trans	-72.1	91.3	169.2	-72	-76.5	0	0	0	109.7	Y821	F819-Y821 PolarHBondContact O-N 3Å
820	C	40.4	Very low	35.5	Very low	33 Å²	33	92 Å²	92	22%	0.223	52%	0.518	C	S	.	.			trans	-69.5	117.6	172.3	-53.1	0	0	0	0	109.6	C768 P818 C822	C768-C820 VanDerWaalsContact CA-SG 3.56Å; C768-C820 HydrophobicContact CB-CB 3.47Å; C768-C820 VanDerWaalsContact CB-CB 3.47Å; C768-C820 WeakPolarHBondContact CB-SG 3.1Å; C768-C820 WeakPolarHBondContact SG-CB 3.05Å; C768-C820 CovalentContact SG-SG 2.03Å; C768-C820 PolarHBondContact SG-SG 3.42Å; P818-C820 PolarHBondContact O-N 3.11Å; C820-C822 PolarHBondContact O-N 2.99Å
821	Y	36.2	Very low	36.3	Very low	137 Å²	137	86.2 Å²	86.2	54%	0.537	48%	0.483	S	S	.	.			trans	-78	75.1	169.6	-147.4	-86	0	0	0	109.6	F819 G823 L866	F819-Y821 PolarHBondContact O-N 3Å; Y821-G823 PolarHBondContact O-N 2.83Å; Y821-L866 HydrophobicContact CE1-CD1 4.47Å; Y821-L866 HydrophobicContact CE1-CD2 4Å
822	C	36.4	Very low	37.2	Very low	35 Å²	35	81.1 Å²	81.1	24%	0.236	46%	0.463	C	S	.	.			trans	-62	92	177.3	-65.5	0	0	0	0	109.7	P681 C820 F824	P681-C822 VanDerWaalsContact CB-SG 3.56Å; C820-C822 PolarHBondContact O-N 2.99Å; C822-F824 PolarHBondContact O-N 2.92Å
823	G	35.4	Very low	37.8	Very low	23 Å²	23	80.4 Å²	80.4	24%	0.237	45%	0.452	C	S	.	.			trans	-55.4	106.5	-173.7	0	0	0	0	0	112.5	Y821 N825	Y821-G823 PolarHBondContact O-N 2.83Å; G823-N825 PolarHBondContact O-N 3.3Å; G823-N825 VanDerWaalsContact O-N 3.07Å
824	F	37.7	Very low	38.5	Very low	73 Å²	73	78.2 Å²	78.2	32%	0.32	43%	0.432	S	S	.	.			trans	1.1	82.1	-176	-161.8	-93.7	0	0	0	115.4	C822 L826 W834	C822-F824 PolarHBondContact O-N 2.92Å; F824-L826 HydrophobicContact CD1-CD2 4.18Å; F824-L826 HydrophobicContact CE1-CD2 3.98Å; F824-L826 PolarHBondContact O-N 3.39Å; F824-W834 HydrophobicContact CE1-CB 4.26Å; F824-W834 AromaticContact CE1-CD2 3.76Å; F824-W834 HydrophobicContact CE1-CD2 3.76Å; F824-W834 AromaticContact CE1-CE3 3.66Å; F824-W834 HydrophobicContact CE1-CE3 3.66Å; F824-W834 HydrophobicContact CE1-CG 4.06Å; F824-W834 HydrophobicContact CE1-CZ3 4.19Å; F824-W834 HydrophobicContact CZ-CB 3.69Å; F824-W834 AromaticContact CZ-CD2 3.84Å; F824-W834 HydrophobicContact CZ-CD2 3.84Å; F824-W834 HydrophobicContact CZ-CE3 4.2Å; F824-W834 AromaticContact CZ-CG 3.64Å; F824-W834 HydrophobicContact CZ-CG 3.64Å
825	N	39.4	Very low	38.9	Very low	39 Å²	39	78.7 Å²	78.7	21%	0.209	42%	0.419	C	S	.	.			trans	-79.7	118.4	-179	179.3	1.6	0	0	0	110.6	G823 D827 T828	G823-N825 PolarHBondContact O-N 3.3Å; G823-N825 VanDerWaalsContact O-N 3.07Å; N825-D827 PolarHBondContact O-N 3.38Å; N825-D827 PolarHBondContact OD1-N 2.9Å; N825-T828 HydrophobicContact CB-CG2 3.9Å; N825-T828 WeakPolarHBondContact O-CB 3.46Å; N825-T828 PolarHBondContact O-N 2.83Å; N825-T828 PolarHBondContact O-OG1 3.45Å
826	L	35.4	Very low	39.2	Very low	29 Å²	29	81 Å²	81	15%	0.152	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-26	-178.3	-66.9	174.9	0	0	0	113.7	F824 T828 G831 M832 W834 L835	F824-L826 HydrophobicContact CD1-CD2 4.18Å; F824-L826 HydrophobicContact CE1-CD2 3.98Å; F824-L826 PolarHBondContact O-N 3.39Å; L826-T828 VanDerWaalsContact C-N 3.31Å; L826-T828 PolarHBondContact O-N 2.92Å; L826-G831 CarbonylContact O-C 3.51Å; L826-M832 WeakPolarHBondContact O-CG 3.46Å; L826-M832 PolarHBondContact O-N 3.42Å; L826-W834 HydrophobicContact CD2-CE3 3.95Å; L826-W834 HydrophobicContact CD2-CZ3 3.78Å; L826-L835 HydrophobicContact CB-CD1 4.08Å; L826-L835 HydrophobicContact CD2-CD1 4.13Å; L826-L835 HydrophobicContact CD2-CD2 4.33Å; L826-L835 HydrophobicContact CD2-CG 4.12Å
827	D	37.3	Very low	39.1	Very low	130 Å²	130	76.6 Å²	76.6	70%	0.695	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-9.9	-179.7	-67	-32.1	0	0	0	113.4	N825	N825-D827 PolarHBondContact O-N 3.38Å; N825-D827 PolarHBondContact OD1-N 2.9Å
828	T	45.3	Very low	38.9	Very low	48 Å²	48	74.1 Å²	74.1	29%	0.294	40%	0.398	S	S	.	.	S	Bend	trans	-69.4	161.6	174.7	62.6	0	0	0	0	111.8	N825 L826 L830 G831 M832	N825-T828 HydrophobicContact CB-CG2 3.9Å; N825-T828 WeakPolarHBondContact O-CB 3.46Å; N825-T828 PolarHBondContact O-N 2.83Å; N825-T828 PolarHBondContact O-OG1 3.45Å; L826-T828 VanDerWaalsContact C-N 3.31Å; L826-T828 PolarHBondContact O-N 2.92Å; T828-L830 PolarHBondContact O-N 3Å; T828-G831 PolarHBondContact O-N 3.37Å; T828-G831 PolarHBondContact OG1-N 2.94Å; T828-M832 VanDerWaalsContact O-CB 3.27Å; T828-M832 WeakPolarHBondContact O-CB 3.48Å; T828-M832 WeakPolarHBondContact O-CG 3.5Å; T828-M832 PolarHBondContact O-N 2.94Å
829	S	42.6	Very low	38.3	Very low	93 Å²	93	83 Å²	83	65%	0.65	42%	0.424	S	S	*	.	H	α-helix	trans	-58	-35.7	173.8	56.1	0	0	0	0	112.7	L833	S829-L833 WeakPolarHBondContact O-CB 3.43Å; S829-L833 WeakPolarHBondContact O-CG 3.28Å; S829-L833 PolarHBondContact O-N 3.07Å
830	L	40.6	Very low	37.8	Very low	62 Å²	62	79.3 Å²	79.3	33%	0.325	43%	0.428	S	S	.	.	H	α-helix	trans	-73.9	-44.7	176.8	-133.4	75.4	0	0	0	112	F772 T828 M832 L833 W834	F772-L830 HydrophobicContact CB-CD2 3.75Å; F772-L830 HydrophobicContact CD1-CD2 4.35Å; F772-L830 HydrophobicContact CG-CD2 4.01Å; T828-L830 PolarHBondContact O-N 3Å; L830-M832 VanDerWaalsContact C-N 3.34Å; L830-M832 PolarHBondContact O-N 2.8Å; L830-L833 WeakPolarHBondContact O-CB 2.85Å; L830-L833 PolarHBondContact O-N 2.84Å; L830-L833 VanDerWaalsContact O-N 3.16Å; L830-W834 PolarHBondContact O-N 3.17Å
831	G	43.7	Very low	37.1	Very low	0 Å²	0	84.6 Å²	84.6	0%	0	46%	0.46	C	S	.	.	H	α-helix	trans	-61	-41.2	173.4	0	0	0	0	0	112.6	L826 T828 W834 L835	L826-G831 CarbonylContact O-C 3.51Å; T828-G831 PolarHBondContact O-N 3.37Å; T828-G831 PolarHBondContact OG1-N 2.94Å; G831-W834 WeakPolarHBondContact O-CB 3.37Å; G831-W834 PolarHBondContact O-N 3.07Å; G831-L835 WeakPolarHBondContact O-CG 3.3Å; G831-L835 PolarHBondContact O-N 2.72Å
832	M	43.6	Very low	36.6	Very low	72 Å²	72	84.4 Å²	84.4	36%	0.355	47%	0.473	S	S	.	.	H	α-helix	trans	-71	-27.4	173.4	-77.4	-62.7	-71.7	0	0	113.4	L826 T828 L830 L835 K836	L826-M832 WeakPolarHBondContact O-CG 3.46Å; L826-M832 PolarHBondContact O-N 3.42Å; T828-M832 VanDerWaalsContact O-CB 3.27Å; T828-M832 WeakPolarHBondContact O-CB 3.48Å; T828-M832 WeakPolarHBondContact O-CG 3.5Å; T828-M832 PolarHBondContact O-N 2.94Å; L830-M832 VanDerWaalsContact C-N 3.34Å; L830-M832 PolarHBondContact O-N 2.8Å; M832-L835 HydrophobicContact SD-CD1 3.86Å; M832-K836 WeakPolarHBondContact O-CB 3.01Å; M832-K836 WeakPolarHBondContact O-CD 3.19Å; M832-K836 WeakPolarHBondContact O-CG 3.15Å; M832-K836 PolarHBondContact O-N 3.49Å
833	L	42.2	Very low	36.1	Very low	105 Å²	105	89.9 Å²	89.9	55%	0.55	50%	0.499	S	S	.	.	H	α-helix	trans	-69.4	-42.4	170.1	-94.1	163.4	0	0	0	111.2	S829 L830 K836 G837	S829-L833 WeakPolarHBondContact O-CB 3.43Å; S829-L833 WeakPolarHBondContact O-CG 3.28Å; S829-L833 PolarHBondContact O-N 3.07Å; L830-L833 WeakPolarHBondContact O-CB 2.85Å; L830-L833 PolarHBondContact O-N 2.84Å; L830-L833 VanDerWaalsContact O-N 3.16Å; L833-K836 PolarHBondContact O-N 3.08Å; L833-G837 PolarHBondContact O-N 3.04Å
834	W	41.2	Very low	35.7	Very low	124 Å²	124	97.4 Å²	97.4	47%	0.47	53%	0.528	S	S	.	.	H	α-helix	trans	-63.2	-42.6	174.6	-174.6	87.7	0	0	0	111.7	F824 L826 L830 G831 G837	F824-W834 HydrophobicContact CE1-CB 4.26Å; F824-W834 AromaticContact CE1-CD2 3.76Å; F824-W834 HydrophobicContact CE1-CD2 3.76Å; F824-W834 AromaticContact CE1-CE3 3.66Å; F824-W834 HydrophobicContact CE1-CE3 3.66Å; F824-W834 HydrophobicContact CE1-CG 4.06Å; F824-W834 HydrophobicContact CE1-CZ3 4.19Å; F824-W834 HydrophobicContact CZ-CB 3.69Å; F824-W834 AromaticContact CZ-CD2 3.84Å; F824-W834 HydrophobicContact CZ-CD2 3.84Å; F824-W834 HydrophobicContact CZ-CE3 4.2Å; F824-W834 AromaticContact CZ-CG 3.64Å; F824-W834 HydrophobicContact CZ-CG 3.64Å; L826-W834 HydrophobicContact CD2-CE3 3.95Å; L826-W834 HydrophobicContact CD2-CZ3 3.78Å; L830-W834 PolarHBondContact O-N 3.17Å; G831-W834 WeakPolarHBondContact O-CB 3.37Å; G831-W834 PolarHBondContact O-N 3.07Å; W834-G837 PolarHBondContact O-N 3.15Å
835	L	35.6	Very low	35.2	Very low	76 Å²	76	99.7 Å²	99.7	40%	0.398	55%	0.553	S	S	.	*	H	α-helix	trans	-64.6	-40.2	171	-74.9	172.3	0	0	0	113.3	L826 G831 M832 G837	L826-L835 HydrophobicContact CB-CD1 4.08Å; L826-L835 HydrophobicContact CD2-CD1 4.13Å; L826-L835 HydrophobicContact CD2-CD2 4.33Å; L826-L835 HydrophobicContact CD2-CG 4.12Å; G831-L835 WeakPolarHBondContact O-CG 3.3Å; G831-L835 PolarHBondContact O-N 2.72Å; M832-L835 HydrophobicContact SD-CD1 3.86Å; L835-G837 VanDerWaalsContact C-N 3.26Å; L835-G837 PolarHBondContact O-N 2.76Å
836	K	36.4	Very low	34.7	Very low	141 Å²	141	104 Å²	104	61%	0.613	58%	0.581	S	S	*	*	H	α-helix	trans	-73.3	-14.4	177.8	-77.2	171.4	177.6	172.1	0	113.7	M832 L833 V838 R839	M832-K836 WeakPolarHBondContact O-CB 3.01Å; M832-K836 WeakPolarHBondContact O-CD 3.19Å; M832-K836 WeakPolarHBondContact O-CG 3.15Å; M832-K836 PolarHBondContact O-N 3.49Å; L833-K836 PolarHBondContact O-N 3.08Å; K836-V838 PolarHBondContact O-N 2.62Å; K836-R839 PolarHBondContact O-N 2.76Å
837	G	35.4	Very low	34.3	Very low	64 Å²	64	111.3 Å²	111.3	66%	0.66	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-6.7	-178.3	0	0	0	0	0	116.1	L833 W834 L835	L833-G837 PolarHBondContact O-N 3.04Å; W834-G837 PolarHBondContact O-N 3.15Å; L835-G837 VanDerWaalsContact C-N 3.26Å; L835-G837 PolarHBondContact O-N 2.76Å
838	V	34.2	Very low	33.9	Very low	69 Å²	69	114.4 Å²	114.4	42%	0.418	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109	-19.1	-174.3	-163.4	0	0	0	0	113.8	K836 I1030 T1031	K836-V838 PolarHBondContact O-N 2.62Å; V838-I1030 HydrophobicContact CG2-CG2 3.72Å; V838-T1031 HydrophobicContact CG1-CG2 4.41Å
839	R	26	Very low	33.2	Very low	241 Å²	241	119.1 Å²	119.1	91%	0.909	64%	0.644	S	S	*	*			trans	-142.2	92.9	179.1	-77.9	-167.8	174.4	179.6	-0.2	114	K836	K836-R839 PolarHBondContact O-N 2.76Å
840	G	28.8	Very low	32.8	Very low	72 Å²	72	119.9 Å²	119.9	74%	0.742	64%	0.644	S	S	*	*			trans	-148.8	108.6	161.4	0	0	0	0	0	110.1	V842	G840-V842 PolarHBondContact O-N 2.64Å
841	T	24.9	Very low	32.5	Very low	144 Å²	144	123.8 Å²	123.8	88%	0.883	66%	0.661	S	S	*	*			trans	-69.4	120.7	175.8	43.1	0	0	0	0	110.2	N843	T841-N843 PolarHBondContact O-N 2.83Å
842	V	26.5	Very low	32.2	Very low	133 Å²	133	130.7 Å²	130.7	81%	0.806	69%	0.693	S	S	*	*			trans	-65.2	128.1	178.8	175.2	0	0	0	0	110.6	G840	G840-V842 PolarHBondContact O-N 2.64Å
843	N	26.7	Very low	32	Very low	150 Å²	150	130.8 Å²	130.8	80%	0.802	70%	0.701	S	S	*	*			trans	-129.5	98	159.6	-98.9	-19.3	0	0	0	109.9	T841	T841-N843 PolarHBondContact O-N 2.83Å
844	Q	26.5	Very low	31.7	Very low	180 Å²	180	132.1 Å²	132.1	84%	0.841	70%	0.702	S	S	*	*			trans	45.6	92	149.9	-60.4	-179.6	-13	0	0	119.2
845	S	26.9	Very low	31.6	Very low	121 Å²	121	130.9 Å²	130.9	85%	0.846	70%	0.704	S	S	*	*				-152.6	148.5	114	63.8	0	0	0	0	110.5
846	T	27.9	Very low	31.9	Very low	129 Å²	129	131.9 Å²	131.9	79%	0.791	71%	0.71	S	S	*	*			trans	-109.1	86.7	-170.6	47.7	0	0	0	0	111.6
847	E	28.2	Very low	32.3	Very low	183 Å²	183	130 Å²	130	86%	0.855	70%	0.699	S	S	*	*	S	Bend	trans	-178.4	84.1	158.4	-107.3	163.9	-145.9	0	0	111.5
848	K	29.3	Very low	32.6	Very low	195 Å²	195	130.1 Å²	130.1	85%	0.848	68%	0.684	S	S	*	*			trans	157.9	85.1	159.6	-91.7	161.4	-177.5	-179.4	0	110.3
849	I	30.9	Very low	33.1	Very low	148 Å²	148	128.1 Å²	128.1	76%	0.759	67%	0.671	S	S	*	*			trans	-123.3	-13.8	-178.9	-66.9	179.2	0	0	0	112.8
850	T	33.8	Very low	34.1	Very low	108 Å²	108	118.9 Å²	118.9	66%	0.663	64%	0.639	S	S	*	*	S	Bend	trans	-75.7	-29.2	-174	42.9	0	0	0	0	115.7	S853	T850-S853 PolarHBondContact O-OG 2.95Å
851	H	34.6	Very low	35.1	Very low	145 Å²	145	119.3 Å²	119.3	67%	0.671	62%	0.622	S	S	*	*	S	Bend	trans	-87.9	-24.3	-170.9	-68.9	-93	0	0	0	114.4	S853 F854	H851-S853 VanDerWaalsContact C-N 3.29Å; H851-S853 PolarHBondContact O-N 2.7Å; H851-F854 PolarHBondContact O-N 2.74Å
852	Q	35.7	Very low	36	Very low	144 Å²	144	115.3 Å²	115.3	67%	0.673	59%	0.593	S	S	*	*	H	α-helix	trans	-79.7	-9.5	-172	-149.9	169.6	17	0	0	113.8
853	S	40	Very low	37	Very low	74 Å²	74	111.8 Å²	111.8	52%	0.517	57%	0.572	S	S	.	*	H	α-helix	trans	-78.9	-34.1	170.1	51.5	0	0	0	0	112.7	T850 H851 N856 R857	T850-S853 PolarHBondContact O-OG 2.95Å; H851-S853 VanDerWaalsContact C-N 3.29Å; H851-S853 PolarHBondContact O-N 2.7Å; S853-N856 PolarHBondContact O-N 3.28Å; S853-R857 PolarHBondContact O-N 2.91Å
854	F	35.9	Very low	37.9	Very low	133 Å²	133	106.4 Å²	106.4	58%	0.583	54%	0.541	S	S	*	.	H	α-helix	trans	-71.2	-38.7	-172.8	-143.2	-89.9	0	0	0	112.2	H851 R857 L858	H851-F854 PolarHBondContact O-N 2.74Å; F854-R857 PolarHBondContact O-N 3.02Å; F854-L858 HydrophobicContact CD1-CD1 3.78Å; F854-L858 HydrophobicContact CD1-CG 4.16Å; F854-L858 HydrophobicContact CE1-CD1 4.08Å; F854-L858 HydrophobicContact CE1-CG 4.3Å; F854-L858 PolarHBondContact O-N 2.78Å
855	I	39	Very low	38.9	Very low	98 Å²	98	102 Å²	102	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-61.2	-45.3	173.9	-62.7	172.6	0	0	0	110.7	R857 L858 I859	I855-R857 VanDerWaalsContact C-N 3.32Å; I855-R857 PolarHBondContact O-N 3.16Å; I855-L858 PolarHBondContact O-N 3.39Å; I855-I859 HydrophobicContact CG2-CD1 3.78Å; I855-I859 WeakPolarHBondContact O-CG1 3.5Å; I855-I859 PolarHBondContact O-N 2.85Å
856	N	42.7	Very low	39.8	Very low	97 Å²	97	99 Å²	99	52%	0.519	49%	0.493	S	S	.	.	H	α-helix	trans	-64.9	-36	176.4	-74.3	-14.2	0	0	0	112.2	S853 I860	S853-N856 PolarHBondContact O-N 3.28Å; N856-I860 WeakPolarHBondContact O-CB 3.34Å; N856-I860 WeakPolarHBondContact O-CD1 3.33Å; N856-I860 VanDerWaalsContact O-CG1 3.24Å; N856-I860 WeakPolarHBondContact O-CG1 3.11Å; N856-I860 PolarHBondContact O-N 2.97Å
857	R	44.2	Very low	40.6	Very low	101 Å²	101	94.7 Å²	94.7	38%	0.381	46%	0.463	S	S	.	.	H	α-helix	trans	-63.8	-50.1	174.3	-175.9	175	177.7	138.1	17.1	111.2	S853 F854 I855 I859 I860 E861 E1020	S853-R857 PolarHBondContact O-N 2.91Å; F854-R857 PolarHBondContact O-N 3.02Å; I855-R857 VanDerWaalsContact C-N 3.32Å; I855-R857 PolarHBondContact O-N 3.16Å; R857-I859 PolarHBondContact O-N 3.3Å; R857-I860 PolarHBondContact O-N 3.1Å; R857-E861 HydrophobicContact CG-CG 4.32Å; R857-E861 IonicContact CZ-OE1 2.74Å; R857-E861 VanDerWaalsContact CZ-OE1 3.24Å; R857-E861 IonicContact NE-OE1 3.46Å; R857-E861 PolarHBondContact NE-OE1 3.28Å; R857-E861 IonicContact NE-OE2 3.34Å; R857-E861 IonicContact NH2-OE1 2.69Å; R857-E861 PolarHBondContact NH2-OE1 2.89Å; R857-E861 WeakPolarHBondContact O-CB 3.33Å; R857-E861 WeakPolarHBondContact O-CG 3.39Å; R857-E861 PolarHBondContact O-N 3.28Å; R857-E1020 IonicContact NH2-OE1 3.84Å
858	L	41.9	Very low	41.6	Very low	68 Å²	68	89.4 Å²	89.4	36%	0.356	44%	0.44	S	S	.	.	H	α-helix	trans	-61.8	-42.7	179.9	-77.9	167.4	0	0	0	113.3	F854 I855 I860 E861 E862	F854-L858 HydrophobicContact CD1-CD1 3.78Å; F854-L858 HydrophobicContact CD1-CG 4.16Å; F854-L858 HydrophobicContact CE1-CD1 4.08Å; F854-L858 HydrophobicContact CE1-CG 4.3Å; F854-L858 PolarHBondContact O-N 2.78Å; I855-L858 PolarHBondContact O-N 3.39Å; L858-I860 VanDerWaalsContact C-N 3.28Å; L858-I860 PolarHBondContact O-N 3.3Å; L858-E861 PolarHBondContact O-N 2.83Å; L858-E862 WeakPolarHBondContact O-CB 3.21Å; L858-E862 PolarHBondContact O-N 2.83Å
859	I	44.3	Very low	42.4	Very low	26 Å²	26	85 Å²	85	13%	0.133	42%	0.423	C	S	.	.	H	α-helix	trans	-64.1	-36	177.4	-67.5	168.9	0	0	0	110.9	F772 I855 R857 T863	F772-I859 HydrophobicContact CD1-CG1 4.45Å; F772-I859 HydrophobicContact CE1-CG1 3.96Å; I855-I859 HydrophobicContact CG2-CD1 3.78Å; I855-I859 WeakPolarHBondContact O-CG1 3.5Å; I855-I859 PolarHBondContact O-N 2.85Å; R857-I859 PolarHBondContact O-N 3.3Å; I859-T863 WeakPolarHBondContact O-CB 3.02Å; I859-T863 WeakPolarHBondContact O-CG2 3.36Å; I859-T863 PolarHBondContact O-N 2.96Å; I859-T863 VanDerWaalsContact O-N 3.16Å; I859-T863 PolarHBondContact O-OG1 3.02Å
860	I	47.3	Very low	43	Very low	47 Å²	47	83 Å²	83	24%	0.241	41%	0.413	C	S	.	.	H	α-helix	trans	-73.6	-42.8	176.4	-69.7	171.2	0	0	0	111.2	N856 R857 L858 T863 F864 L1026	N856-I860 WeakPolarHBondContact O-CB 3.34Å; N856-I860 WeakPolarHBondContact O-CD1 3.33Å; N856-I860 VanDerWaalsContact O-CG1 3.24Å; N856-I860 WeakPolarHBondContact O-CG1 3.11Å; N856-I860 PolarHBondContact O-N 2.97Å; R857-I860 PolarHBondContact O-N 3.1Å; L858-I860 VanDerWaalsContact C-N 3.28Å; L858-I860 PolarHBondContact O-N 3.3Å; I860-T863 WeakPolarHBondContact CA-OG1 3.4Å; I860-T863 PolarHBondContact O-N 2.81Å; I860-T863 PolarHBondContact O-OG1 2.59Å; I860-T863 VanDerWaalsContact O-OG1 3.12Å; I860-F864 HydrophobicContact CG2-CD2 3.61Å; I860-F864 HydrophobicContact CG2-CE2 3.57Å; I860-F864 VanDerWaalsContact O-CD2 3.29Å; I860-F864 WeakPolarHBondContact O-CD2 3.38Å; I860-F864 PolarHBondContact O-N 2.57Å; I860-L1026 HydrophobicContact CD1-CD1 3.82Å
861	E	49.8	Very low	43.6	Very low	82 Å²	82	82.3 Å²	82.3	38%	0.383	40%	0.399	S	S	.	.	H	α-helix	trans	-64.8	-44.3	177.9	-75.2	174.3	166	0	0	112	R857 L858 F864 K865	R857-E861 HydrophobicContact CG-CG 4.32Å; R857-E861 IonicContact CZ-OE1 2.74Å; R857-E861 VanDerWaalsContact CZ-OE1 3.24Å; R857-E861 IonicContact NE-OE1 3.46Å; R857-E861 PolarHBondContact NE-OE1 3.28Å; R857-E861 IonicContact NE-OE2 3.34Å; R857-E861 IonicContact NH2-OE1 2.69Å; R857-E861 PolarHBondContact NH2-OE1 2.89Å; R857-E861 WeakPolarHBondContact O-CB 3.33Å; R857-E861 WeakPolarHBondContact O-CG 3.39Å; R857-E861 PolarHBondContact O-N 3.28Å; L858-E861 PolarHBondContact O-N 2.83Å; E861-F864 PolarHBondContact O-N 2.71Å; E861-K865 WeakPolarHBondContact O-CB 3.25Å; E861-K865 PolarHBondContact O-N 2.84Å
862	E	44.6	Very low	44.2	Very low	60 Å²	60	78.8 Å²	78.8	28%	0.28	39%	0.385	S	S	.	.	H	α-helix	trans	-69.9	-30.4	176.3	-71.6	-66	129.3	0	0	113.1	L858 K865 L866	L858-E862 WeakPolarHBondContact O-CB 3.21Å; L858-E862 PolarHBondContact O-N 2.83Å; E862-K865 PolarHBondContact O-N 3.04Å; E862-K865 WeakPolarHBondContact OE1-CD 3.17Å; E862-K865 IonicContact OE1-NZ 3.99Å; E862-K865 PolarHBondContact OE1-NZ 2.91Å; E862-K865 IonicContact OE2-NZ 3.77Å; E862-K865 PolarHBondContact OE2-NZ 3.02Å; E862-L866 WeakPolarHBondContact O-CB 3.21Å; E862-L866 PolarHBondContact O-N 3.01Å
863	T	46	Very low	44.5	Very low	59 Å²	59	77.5 Å²	77.5	36%	0.362	38%	0.379	S	S	.	.	H	α-helix	trans	-74.7	-36.9	173.9	47.8	0	0	0	0	112.8	I859 I860 K865 L866 Y867	I859-T863 WeakPolarHBondContact O-CB 3.02Å; I859-T863 WeakPolarHBondContact O-CG2 3.36Å; I859-T863 PolarHBondContact O-N 2.96Å; I859-T863 VanDerWaalsContact O-N 3.16Å; I859-T863 PolarHBondContact O-OG1 3.02Å; I860-T863 WeakPolarHBondContact CA-OG1 3.4Å; I860-T863 PolarHBondContact O-N 2.81Å; I860-T863 PolarHBondContact O-OG1 2.59Å; I860-T863 VanDerWaalsContact O-OG1 3.12Å; T863-K865 VanDerWaalsContact C-N 3.33Å; T863-L866 PolarHBondContact O-N 3.11Å; T863-Y867 PolarHBondContact O-N 3.05Å
864	F	46.8	Very low	44.5	Very low	37 Å²	37	77.1 Å²	77.1	16%	0.162	37%	0.367	C	S	.	.	H	α-helix	trans	-65.1	-36.8	169	-85.1	-59.4	0	0	0	112.3	I860 E861 Y867 N868 W1009 Y1013 Y1016	I860-F864 HydrophobicContact CG2-CD2 3.61Å; I860-F864 HydrophobicContact CG2-CE2 3.57Å; I860-F864 VanDerWaalsContact O-CD2 3.29Å; I860-F864 WeakPolarHBondContact O-CD2 3.38Å; I860-F864 PolarHBondContact O-N 2.57Å; E861-F864 PolarHBondContact O-N 2.71Å; F864-Y867 WeakPolarHBondContact O-CB 3.48Å; F864-Y867 PolarHBondContact O-N 3.18Å; F864-N868 WeakPolarHBondContact O-CB 3.44Å; F864-N868 PolarHBondContact O-N 2.97Å; F864-W1009 HydrophobicContact CD1-CZ3 4.4Å; F864-W1009 AromaticContact CE1-CZ3 3.93Å; F864-W1009 HydrophobicContact CE1-CZ3 3.93Å; F864-W1009 HydrophobicContact CZ-CZ3 4.47Å; F864-Y1013 HydrophobicContact CD1-CD2 4.04Å; F864-Y1013 HydrophobicContact CD1-CE2 4.43Å; F864-Y1013 AromaticContact CE1-CD2 3.9Å; F864-Y1013 HydrophobicContact CE1-CD2 3.9Å; F864-Y1016 HydrophobicContact CE2-CD1 4.08Å; F864-Y1016 HydrophobicContact CE2-CD2 4.02Å; F864-Y1016 AromaticContact CE2-CE1 3.95Å; F864-Y1016 HydrophobicContact CE2-CE1 3.95Å; F864-Y1016 AromaticContact CE2-CE2 3.9Å; F864-Y1016 HydrophobicContact CE2-CE2 3.9Å; F864-Y1016 HydrophobicContact CE2-CG 4.09Å; F864-Y1016 AromaticContact CE2-CZ 3.84Å; F864-Y1016 HydrophobicContact CZ-CD1 4.3Å; F864-Y1016 AromaticContact CZ-CD2 3.8Å; F864-Y1016 HydrophobicContact CZ-CD2 3.8Å; F864-Y1016 HydrophobicContact CZ-CE2 4.09Å; F864-Y1016 AromaticContact CZ-CG 3.89Å; F864-Y1016 HydrophobicContact CZ-CG 3.89Å
865	K	47.3	Very low	44.8	Very low	88 Å²	88	73.2 Å²	73.2	38%	0.383	35%	0.351	S	S	.	.	H	α-helix	trans	-64.3	-43.9	174.7	179.7	-178.6	165.8	-154.3	0	111.8	E861 E862 T863 N868 E869	E861-K865 WeakPolarHBondContact O-CB 3.25Å; E861-K865 PolarHBondContact O-N 2.84Å; E862-K865 PolarHBondContact O-N 3.04Å; E862-K865 WeakPolarHBondContact OE1-CD 3.17Å; E862-K865 IonicContact OE1-NZ 3.99Å; E862-K865 PolarHBondContact OE1-NZ 2.91Å; E862-K865 IonicContact OE2-NZ 3.77Å; E862-K865 PolarHBondContact OE2-NZ 3.02Å; T863-K865 VanDerWaalsContact C-N 3.33Å; K865-N868 CarbonylContact O-C 3.55Å; K865-N868 PolarHBondContact O-N 2.82Å; K865-E869 WeakPolarHBondContact O-CG 3.21Å; K865-E869 PolarHBondContact O-N 3.23Å
866	L	45.5	Very low	44.9	Very low	56 Å²	56	75.8 Å²	75.8	29%	0.293	36%	0.359	S	S	.	.	H	α-helix	trans	-60.8	-44.1	173.2	-174.4	73	0	0	0	112.1	Y821 E862 T863 N868 E869 L870	Y821-L866 HydrophobicContact CE1-CD1 4.47Å; Y821-L866 HydrophobicContact CE1-CD2 4Å; E862-L866 WeakPolarHBondContact O-CB 3.21Å; E862-L866 PolarHBondContact O-N 3.01Å; T863-L866 PolarHBondContact O-N 3.11Å; L866-N868 VanDerWaalsContact C-N 3.32Å; L866-N868 PolarHBondContact O-N 2.84Å; L866-E869 PolarHBondContact O-N 2.65Å; L866-L870 HydrophobicContact CG-CD1 4.31Å; L866-L870 WeakPolarHBondContact O-CG 3.35Å; L866-L870 PolarHBondContact O-N 2.87Å
867	Y	45.5	Very low	44.8	Very low	40 Å²	40	75.4 Å²	75.4	16%	0.157	35%	0.354	C	S	.	.	H	α-helix	trans	-57.7	-45.3	172.9	167.4	-93.7	0	0	0	111.4	T863 F864 L870 Y871 Y1013 L1115	T863-Y867 PolarHBondContact O-N 3.05Å; F864-Y867 WeakPolarHBondContact O-CB 3.48Å; F864-Y867 PolarHBondContact O-N 3.18Å; Y867-L870 PolarHBondContact O-N 2.79Å; Y867-Y871 VanDerWaalsContact O-CB 3.3Å; Y867-Y871 WeakPolarHBondContact O-CB 3.43Å; Y867-Y871 PolarHBondContact O-N 2.92Å; Y867-Y1013 HydrophobicContact CD1-CD2 4.22Å; Y867-Y1013 HydrophobicContact CD1-CE2 4.26Å; Y867-Y1013 AromaticContact CE1-CD2 3.73Å; Y867-Y1013 HydrophobicContact CE1-CD2 3.73Å; Y867-Y1013 AromaticContact CE1-CE2 3.88Å; Y867-Y1013 HydrophobicContact CE1-CE2 3.88Å; Y867-Y1013 HydrophobicContact CE1-CG 4.3Å; Y867-L1115 HydrophobicContact CD2-CD2 4.36Å; Y867-L1115 HydrophobicContact CE2-CD2 3.86Å
868	N	48.1	Very low	44.2	Very low	71 Å²	71	73.9 Å²	73.9	38%	0.38	35%	0.353	S	S	.	.	H	α-helix	trans	-67.9	-39	179.6	-157.6	8.5	0	0	0	111.8	F864 K865 L866 Y871 N872	F864-N868 WeakPolarHBondContact O-CB 3.44Å; F864-N868 PolarHBondContact O-N 2.97Å; K865-N868 CarbonylContact O-C 3.55Å; K865-N868 PolarHBondContact O-N 2.82Å; L866-N868 VanDerWaalsContact C-N 3.32Å; L866-N868 PolarHBondContact O-N 2.84Å; N868-Y871 PolarHBondContact O-N 2.93Å; N868-N872 VanDerWaalsContact O-CB 3.3Å; N868-N872 WeakPolarHBondContact O-CB 3.3Å; N868-N872 PolarHBondContact O-N 2.9Å; N868-N872 PolarHBondContact O-ND2 2.81Å; N868-N872 PolarHBondContact OD1-ND2 2.88Å
869	E	47	Very low	43.7	Very low	103 Å²	103	75.9 Å²	75.9	48%	0.481	36%	0.362	S	S	.	.	H	α-helix	trans	-62.7	-46.4	174.4	-77.4	178.6	-176.9	0	0	111.8	K865 L866 N872 Q873	K865-E869 WeakPolarHBondContact O-CG 3.21Å; K865-E869 PolarHBondContact O-N 3.23Å; L866-E869 PolarHBondContact O-N 2.65Å; E869-N872 PolarHBondContact O-N 2.82Å; E869-Q873 WeakPolarHBondContact O-CG 3.45Å; E869-Q873 PolarHBondContact O-N 3.45Å
870	L	43.6	Very low	43.2	Very low	107 Å²	107	81.5 Å²	81.5	56%	0.56	39%	0.392	S	S	*	.	H	α-helix	trans	-62.7	-44.4	176.3	-71.9	168.9	0	0	0	112	L866 Y867 Q873 W874	L866-L870 HydrophobicContact CG-CD1 4.31Å; L866-L870 WeakPolarHBondContact O-CG 3.35Å; L866-L870 PolarHBondContact O-N 2.87Å; Y867-L870 PolarHBondContact O-N 2.79Å; L870-Q873 PolarHBondContact O-N 2.72Å; L870-W874 WeakPolarHBondContact O-CB 3.43Å; L870-W874 PolarHBondContact O-N 2.61Å
871	Y	45.5	Very low	42.3	Very low	92 Å²	92	87.6 Å²	87.6	36%	0.361	42%	0.417	S	S	.	.	H	α-helix	trans	-61.8	-43.6	176.3	-174.6	-113.2	0	0	0	111.9	Y867 N868 W874 L875 W1129	Y867-Y871 VanDerWaalsContact O-CB 3.3Å; Y867-Y871 WeakPolarHBondContact O-CB 3.43Å; Y867-Y871 PolarHBondContact O-N 2.92Å; N868-Y871 PolarHBondContact O-N 2.93Å; Y871-W874 HydrophobicContact CD2-CE3 4.36Å; Y871-W874 HydrophobicContact CD2-CZ3 4.5Å; Y871-W874 HydrophobicContact CE2-CE3 4.41Å; Y871-W874 HydrophobicContact CE2-CZ3 4.12Å; Y871-W874 PolarHBondContact O-N 3.37Å; Y871-L875 HydrophobicContact CD1-CD1 3.81Å; Y871-L875 HydrophobicContact CE1-CD1 3.47Å; Y871-L875 VanDerWaalsContact CE1-CD1 3.47Å; Y871-L875 HydrophobicContact CE1-CG 4.43Å; Y871-L875 HydrophobicContact CG-CD1 4.49Å; Y871-L875 WeakPolarHBondContact O-CB 3.39Å; Y871-L875 PolarHBondContact O-N 3.37Å; Y871-W1129 HydrophobicContact CD2-CH2 4.22Å
872	N	47.4	Very low	41.2	Very low	72 Å²	72	89.6 Å²	89.6	39%	0.385	43%	0.43	S	S	.	.	H	α-helix	trans	-70.3	-36.8	177.8	-80.1	-66.9	0	0	0	113.6	N868 E869 K876	N868-N872 VanDerWaalsContact O-CB 3.3Å; N868-N872 WeakPolarHBondContact O-CB 3.3Å; N868-N872 PolarHBondContact O-N 2.9Å; N868-N872 PolarHBondContact O-ND2 2.81Å; N868-N872 PolarHBondContact OD1-ND2 2.88Å; E869-N872 PolarHBondContact O-N 2.82Å; N872-K876 WeakPolarHBondContact O-CB 3.17Å; N872-K876 WeakPolarHBondContact O-CG 3.42Å; N872-K876 PolarHBondContact O-N 3.42Å
873	Q	41.2	Very low	40.3	Very low	117 Å²	117	91.1 Å²	91.1	55%	0.547	44%	0.44	S	S	.	.	H	α-helix	trans	-64.6	-42.7	173.5	-76.2	-167.2	13.9	0	0	111.3	E869 L870 K876 H877	E869-Q873 WeakPolarHBondContact O-CG 3.45Å; E869-Q873 PolarHBondContact O-N 3.45Å; L870-Q873 PolarHBondContact O-N 2.72Å; Q873-K876 PolarHBondContact O-N 2.85Å; Q873-H877 WeakPolarHBondContact O-CB 3.23Å; Q873-H877 PolarHBondContact O-N 2.84Å
874	W	41.3	Very low	39.1	Very low	65 Å²	65	94.7 Å²	94.7	25%	0.246	46%	0.461	C	S	.	.	H	α-helix	trans	-66.5	-40.4	177	174.1	90.2	0	0	0	112.3	L870 Y871 H877 L878 R1113	L870-W874 WeakPolarHBondContact O-CB 3.43Å; L870-W874 PolarHBondContact O-N 2.61Å; Y871-W874 HydrophobicContact CD2-CE3 4.36Å; Y871-W874 HydrophobicContact CD2-CZ3 4.5Å; Y871-W874 HydrophobicContact CE2-CE3 4.41Å; Y871-W874 HydrophobicContact CE2-CZ3 4.12Å; Y871-W874 PolarHBondContact O-N 3.37Å; W874-H877 PolarHBondContact O-N 2.67Å; W874-H877 VanDerWaalsContact O-N 3.16Å; W874-L878 HydrophobicContact CD2-CD1 3.95Å; W874-L878 VanDerWaalsContact CE2-CD1 3.48Å; W874-L878 HydrophobicContact CE3-CD1 4.4Å; W874-L878 HydrophobicContact CH2-CD1 4.03Å; W874-L878 HydrophobicContact CZ2-CD1 3.53Å; W874-L878 HydrophobicContact CZ3-CD1 4.43Å; W874-L878 PolarHBondContact O-N 2.96Å; W874-R1113 VanDerWaalsContact CH2-CD 3.41Å
875	L	41.6	Very low	38.1	Very low	51 Å²	51	96.5 Å²	96.5	27%	0.267	48%	0.479	S	S	.	.	H	α-helix	trans	-58.7	-48.8	170.8	-88.7	168.8	0	0	0	112.2	Y871 H877 L878 M879	Y871-L875 HydrophobicContact CD1-CD1 3.81Å; Y871-L875 HydrophobicContact CE1-CD1 3.47Å; Y871-L875 VanDerWaalsContact CE1-CD1 3.47Å; Y871-L875 HydrophobicContact CE1-CG 4.43Å; Y871-L875 HydrophobicContact CG-CD1 4.49Å; Y871-L875 WeakPolarHBondContact O-CB 3.39Å; Y871-L875 PolarHBondContact O-N 3.37Å; L875-H877 PolarHBondContact O-N 3.37Å; L875-L878 PolarHBondContact O-N 3.1Å; L875-L878 VanDerWaalsContact O-N 3.13Å; L875-M879 PolarHBondContact O-N 2.77Å
876	K	42.2	Very low	37	Very low	152 Å²	152	95.7 Å²	95.7	66%	0.661	48%	0.475	S	S	*	.	H	α-helix	trans	-57.9	-36.2	174.4	-76.2	176.9	178	-178.4	0	112.2	N872 Q873 N880	N872-K876 WeakPolarHBondContact O-CB 3.17Å; N872-K876 WeakPolarHBondContact O-CG 3.42Å; N872-K876 PolarHBondContact O-N 3.42Å; Q873-K876 PolarHBondContact O-N 2.85Å; K876-N880 WeakPolarHBondContact O-CB 3.41Å; K876-N880 PolarHBondContact O-N 2.9Å
877	H	39.7	Very low	36	Very low	90 Å²	90	100.8 Å²	100.8	42%	0.417	50%	0.497	S	S	.	.	H	α-helix	trans	-75	-24.6	179.5	-151.4	-33.9	0	0	0	113.3	Q873 W874 L875	Q873-H877 WeakPolarHBondContact O-CB 3.23Å; Q873-H877 PolarHBondContact O-N 2.84Å; W874-H877 PolarHBondContact O-N 2.67Å; W874-H877 VanDerWaalsContact O-N 3.16Å; L875-H877 PolarHBondContact O-N 3.37Å
878	L	31.7	Very low	35.2	Very low	68 Å²	68	103.9 Å²	103.9	36%	0.356	52%	0.522	S	S	.	.	H	α-helix	trans	-78.1	-46.8	169.7	-106.1	112.7	0	0	0	112.4	W874 L875 N880 K881 D882	W874-L878 HydrophobicContact CD2-CD1 3.95Å; W874-L878 VanDerWaalsContact CE2-CD1 3.48Å; W874-L878 HydrophobicContact CE3-CD1 4.4Å; W874-L878 HydrophobicContact CH2-CD1 4.03Å; W874-L878 HydrophobicContact CZ2-CD1 3.53Å; W874-L878 HydrophobicContact CZ3-CD1 4.43Å; W874-L878 PolarHBondContact O-N 2.96Å; L875-L878 PolarHBondContact O-N 3.1Å; L875-L878 VanDerWaalsContact O-N 3.13Å; L878-N880 PolarHBondContact O-N 3.06Å; L878-N880 VanDerWaalsContact O-N 3.15Å; L878-K881 PolarHBondContact O-N 2.9Å; L878-D882 PolarHBondContact O-N 3.43Å
879	M	30.9	Very low	34	Very low	111 Å²	111	110.5 Å²	110.5	55%	0.547	55%	0.548	S	S	.	.	H	α-helix	trans	-68.5	-10	179.8	-64.6	-165.2	162.2	0	0	113.9	L875 K881 D882 I883	L875-M879 PolarHBondContact O-N 2.77Å; M879-K881 VanDerWaalsContact C-N 3.32Å; M879-D882 CarbonylContact C-O 3.59Å; M879-D882 WeakPolarHBondContact CA-O 3.38Å; M879-D882 VanDerWaalsContact O-O 3.07Å; M879-I883 HydrophobicContact CB-CD1 4.37Å; M879-I883 HydrophobicContact CE-CD1 3.83Å; M879-I883 HydrophobicContact CG-CD1 3.86Å; M879-I883 HydrophobicContact SD-CD1 4.02Å
880	N	34.1	Very low	32.7	Very low	144 Å²	144	114.2 Å²	114.2	77%	0.77	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	9.9	167.7	-83.9	-9.3	0	0	0	113.7	K876 L878	K876-N880 WeakPolarHBondContact O-CB 3.41Å; K876-N880 PolarHBondContact O-N 2.9Å; L878-N880 PolarHBondContact O-N 3.06Å; L878-N880 VanDerWaalsContact O-N 3.15Å
881	K	29.1	Very low	31.7	Very low	174 Å²	174	115.9 Å²	115.9	76%	0.757	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122	-34.6	173.1	-101.2	-175.2	173.6	-180	0	114.1	L878 M879	L878-K881 PolarHBondContact O-N 2.9Å; M879-K881 VanDerWaalsContact C-N 3.32Å
882	D	25.1	Very low	30.5	Very low	125 Å²	125	119.7 Å²	119.7	67%	0.668	60%	0.595	S	S	*	*	S	Bend	trans	-130.3	149	169.3	-69	-73.5	0	0	0	109	L878 M879	L878-D882 PolarHBondContact O-N 3.43Å; M879-D882 CarbonylContact C-O 3.59Å; M879-D882 WeakPolarHBondContact CA-O 3.38Å; M879-D882 VanDerWaalsContact O-O 3.07Å
883	I	27.1	Very low	29.3	Very low	92 Å²	92	122.9 Å²	122.9	47%	0.472	61%	0.612	S	S	.	*			trans	109.3	92.5	-174.9	-60.4	161.9	0	0	0	113.9	M879	M879-I883 HydrophobicContact CB-CD1 4.37Å; M879-I883 HydrophobicContact CE-CD1 3.83Å; M879-I883 HydrophobicContact CG-CD1 3.86Å; M879-I883 HydrophobicContact SD-CD1 4.02Å
884	T	21.5	Very low	28.5	Very low	134 Å²	134	125.6 Å²	125.6	82%	0.822	63%	0.629	S	S	*	*			trans	-95.7	129.5	140.5	49.3	0	0	0	0	109.1
885	S	23.8	Very low	27.5	Very low	75 Å²	75	128.8 Å²	128.8	52%	0.524	65%	0.65	S	S	.	*	S	Bend	trans	75.1	112.1	168.4	67.3	0	0	0	0	121
886	K	24.4	Very low	26.5	Very low	71 Å²	71	131.9 Å²	131.9	31%	0.309	67%	0.671	S	S	.	*				49.1	140.7	125.5	-57.1	-177.8	179.9	170.2	0	119.5	S253 L254	S253-K886 PolarHBondContact O-NZ 3.08Å; S253-K886 PolarHBondContact OG-NZ 2.91Å; L254-K886 VanDerWaalsContact C-NZ 3.33Å; L254-K886 PolarHBondContact O-NZ 2.92Å
887	H	25.6	Very low	25.5	Very low	163 Å²	163	130.1 Å²	130.1	76%	0.755	68%	0.678	S	S	*	*			cis	179.7	-168.1	-2.3	-103.7	-39	0	0	0	105.7
888	P	27.4	Very low	24.7	Very low	104 Å²	104	132.4 Å²	132.4	68%	0.675	69%	0.692	S	S	*	*				-125.9	169.9	-56.3	38.4	-24.5	0	0	0	111.9
889	F	23.8	Very low	24.1	Very low	210 Å²	210	134.5 Å²	134.5	92%	0.921	71%	0.712	S	S	*	*			trans	-149.8	119.9	152.1	-114.8	-78.4	0	0	0	111.3
890	M	20.4	Very low	23.7	Very low	181 Å²	181	138.3 Å²	138.3	89%	0.892	72%	0.722	S	S	*	*			trans	-153.7	113.7	171.6	-106.3	-68.1	178.4	0	0	108.3
891	N	21.8	Very low	23.1	Very low	143 Å²	143	141.5 Å²	141.5	77%	0.765	73%	0.729	S	S	*	*			trans	-144.8	75.8	166.6	-154	6.3	0	0	0	112.5
892	K	21.2	Very low	22.8	Very low	171 Å²	171	139.6 Å²	139.6	74%	0.743	73%	0.727	S	S	*	*			trans	53	144.3	145	-67	-179.9	176.4	176.1	0	121
893	N	21.8	Very low	22.7	Very low	139 Å²	139	138.4 Å²	138.4	74%	0.743	73%	0.725	S	S	*	*			trans	71	107.9	173.9	-46.3	-26	0	0	0	111.5
894	I	23.6	Very low	22.6	Very low	174 Å²	174	140.8 Å²	140.8	89%	0.892	74%	0.739	S	S	*	*				-120.4	142.7	51.3	-71.8	162.4	0	0	0	113.9
895	L	20.4	Very low	22.7	Very low	132 Å²	132	142.7 Å²	142.7	69%	0.691	74%	0.739	S	S	*	*			trans	-86.2	158.6	168.1	-94.1	67.3	0	0	0	109.8
896	T	20.9	Very low	22.8	Very low	117 Å²	117	146.5 Å²	146.5	72%	0.718	75%	0.753	S	S	*	*			cis	-162.2	161.2	15.1	-7.2	0	0	0	0	110.2
897	S	21.3	Very low	22.9	Very low	115 Å²	115	148.8 Å²	148.8	80%	0.804	77%	0.773	S	S	*	*			trans	66	151.6	171.9	77.7	0	0	0	0	115.3
898	I	21.9	Very low	22.8	Very low	137 Å²	137	146 Å²	146	70%	0.703	77%	0.767	S	S	*	*			cis	-118	139.7	12.7	-64.7	167	0	0	0	111.1	Y900	I898-Y900 HydrophobicContact CG2-CD2 3.68Å; I898-Y900 HydrophobicContact CG2-CE2 3.78Å
899	S	19.8	Very low	22.7	Very low	113 Å²	113	149.7 Å²	149.7	79%	0.79	77%	0.773	S	S	*	*			trans	-87.1	117.8	166.4	54.4	0	0	0	0	111
900	Y	22.3	Very low	22.9	Very low	191 Å²	191	145.7 Å²	145.7	75%	0.749	76%	0.756	S	S	*	*			trans	-113.4	104.3	163.2	-94.6	-68.6	0	0	0	110.8	I898 L902	I898-Y900 HydrophobicContact CG2-CD2 3.68Å; I898-Y900 HydrophobicContact CG2-CE2 3.78Å; Y900-L902 HydrophobicContact CD1-CD1 3.69Å; Y900-L902 HydrophobicContact CD1-CG 3.98Å; Y900-L902 HydrophobicContact CE1-CD1 4.09Å
901	K	21.5	Very low	23.2	Very low	210 Å²	210	140.9 Å²	140.9	91%	0.913	74%	0.74	S	S	*	*			trans	-103.2	101.3	161.4	-175.2	180	-175.9	179.8	0	106
902	L	23.3	Very low	23.3	Very low	135 Å²	135	139.2 Å²	139.2	71%	0.707	73%	0.731	S	S	*	*			trans	-115.3	139.2	175.1	-86	165	0	0	0	109.4	Y900	Y900-L902 HydrophobicContact CD1-CD1 3.69Å; Y900-L902 HydrophobicContact CD1-CG 3.98Å; Y900-L902 HydrophobicContact CE1-CD1 4.09Å
903	P	23.8	Very low	23.4	Very low	99 Å²	99	137.7 Å²	137.7	64%	0.643	73%	0.73	S	S	*	*			trans	-79.5	-169.2	169.6	37.2	-35.8	0	0	0	110.9
904	D	23.4	Very low	23.7	Very low	143 Å²	143	133.8 Å²	133.8	77%	0.765	71%	0.714	S	S	*	*			trans	72.8	88.4	170.7	-51.5	-26.7	0	0	0	115.7	N906	D904-N906 VanDerWaalsContact C-N 3.3Å; D904-N906 PolarHBondContact O-N 2.61Å
905	E	24.6	Very low	23.8	Very low	174 Å²	174	128.7 Å²	128.7	81%	0.813	69%	0.691	S	S	*	*			trans	-68.4	76	169.9	-63.1	-177.2	129	0	0	111.7
906	N	26.3	Very low	24	Very low	154 Å²	154	131.9 Å²	131.9	82%	0.824	69%	0.694	S	S	*	*			trans	-152.7	49	176.9	-106.7	-27.7	0	0	0	114.5	D904	D904-N906 VanDerWaalsContact C-N 3.3Å; D904-N906 PolarHBondContact O-N 2.61Å
907	V	24.8	Very low	24.4	Very low	119 Å²	119	134 Å²	134	72%	0.721	69%	0.689	S	S	*	*			trans	-127.2	101.1	171.9	-176.3	0	0	0	0	110.9	F909	V907-F909 HydrophobicContact CG1-CE2 4.26Å
908	T	24.5	Very low	24.7	Very low	104 Å²	104	129.7 Å²	129.7	64%	0.638	66%	0.657	S	S	*	*			trans	-87.4	116.2	175.9	42.5	0	0	0	0	111.4	F910	T908-F910 WeakPolarHBondContact O-CD2 3.44Å; T908-F910 PolarHBondContact O-N 3.01Å; T908-F910 VanDerWaalsContact OG1-CE2 3.31Å; T908-F910 WeakPolarHBondContact OG1-CE2 3.3Å
909	F	25.4	Very low	24.9	Very low	183 Å²	183	124.8 Å²	124.8	80%	0.803	63%	0.629	S	S	*	*			trans	-77.8	104.9	172.9	-76.7	-95	0	0	0	110.7	V907 S911	V907-F909 HydrophobicContact CG1-CE2 4.26Å; F909-S911 PolarHBondContact O-N 2.88Å; F909-S911 VanDerWaalsContact O-N 3.13Å
910	F	27.3	Very low	25.5	Very low	126 Å²	126	120.1 Å²	120.1	55%	0.553	60%	0.597	S	S	*	*			trans	-80.8	86.8	178.4	-74.1	-85.3	0	0	0	112.6	N715 T908	N715-F910 HydrophobicContact CB-CE1 4.12Å; N715-F910 HydrophobicContact CB-CZ 4.14Å; T908-F910 WeakPolarHBondContact O-CD2 3.44Å; T908-F910 PolarHBondContact O-N 3.01Å; T908-F910 VanDerWaalsContact OG1-CE2 3.31Å; T908-F910 WeakPolarHBondContact OG1-CE2 3.3Å
911	S	26.6	Very low	26.1	Very low	80 Å²	80	116.3 Å²	116.3	56%	0.559	59%	0.586	S	S	*	*			trans	-114.5	-9.5	170	55.1	0	0	0	0	114.4	F909 V915	F909-S911 PolarHBondContact O-N 2.88Å; F909-S911 VanDerWaalsContact O-N 3.13Å; S911-V915 WeakPolarHBondContact O-CG2 3.26Å
912	D	25.3	Very low	26.8	Very low	108 Å²	108	108.7 Å²	108.7	58%	0.578	55%	0.554	S	S	*	*	S	Bend	trans	-109.2	24.1	-153.4	-146.1	16.3	0	0	0	115.9
913	L	23.7	Very low	27.3	Very low	138 Å²	138	104.5 Å²	104.5	72%	0.723	54%	0.535	S	S	*	.	S	Bend	trans	-127.2	-32.7	176.4	-97.1	125.7	0	0	0	115.2
914	S	26.1	Very low	27.5	Very low	58 Å²	58	109.6 Å²	109.6	41%	0.406	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-77.8	-23	-179.8	53.6	0	0	0	0	113.6	R916 Y917	S914-R916 PolarHBondContact O-N 3.26Å; S914-R916 VanDerWaalsContact O-N 3.07Å; S914-Y917 PolarHBondContact O-N 3.43Å
915	V	26.6	Very low	27.7	Very low	67 Å²	67	106.8 Å²	106.8	41%	0.406	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-65.1	-15.1	-173.4	-179.9	0	0	0	0	113.8	S911 Y917 W919	S911-V915 WeakPolarHBondContact O-CG2 3.26Å; V915-Y917 PolarHBondContact O-N 2.85Å; V915-W919 HydrophobicContact CG1-CG 4.35Å
916	R	25.6	Very low	27.9	Very low	199 Å²	199	109.7 Å²	109.7	75%	0.751	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-80.1	-14.2	-176.4	-146.1	172.7	-173.7	176.1	-0.7	115.4	S914	S914-R916 PolarHBondContact O-N 3.26Å; S914-R916 VanDerWaalsContact O-N 3.07Å
917	Y	28.6	Very low	27.9	Very low	161 Å²	161	111.8 Å²	111.8	63%	0.631	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.2	-10	-172.9	-68.6	-77.6	0	0	0	115.6	S678 S914 V915	S678-Y917 VanDerWaalsContact OG-CB 3.23Å; S678-Y917 WeakPolarHBondContact OG-CB 3.24Å; S914-Y917 PolarHBondContact O-N 3.43Å; V915-Y917 PolarHBondContact O-N 2.85Å
918	M	26.3	Very low	28	Very low	25 Å²	25	111.8 Å²	111.8	12%	0.123	54%	0.543	C	S	.	.	S	Bend	trans	-95.6	-12.3	-178.3	-66.4	162.6	61.4	0	0	113.9	F680 T1123	F680-M918 HydrophobicContact CB-CE 3.93Å; F680-M918 HydrophobicContact CB-SD 3.65Å; F680-M918 HydrophobicContact CD1-CE 3.79Å; F680-M918 HydrophobicContact CD1-CG 3.56Å; F680-M918 HydrophobicContact CD1-SD 3.45Å; F680-M918 WeakPolarHBondContact CD1-SD 3.17Å; F680-M918 HydrophobicContact CD2-CE 3.51Å; F680-M918 HydrophobicContact CD2-SD 4.21Å; F680-M918 HydrophobicContact CE1-CE 4.06Å; F680-M918 HydrophobicContact CE1-CG 3.59Å; F680-M918 HydrophobicContact CE1-SD 4.03Å; F680-M918 HydrophobicContact CE2-CE 3.81Å; F680-M918 HydrophobicContact CG-CE 3.49Å; F680-M918 VanDerWaalsContact CG-CE 3.49Å; F680-M918 HydrophobicContact CG-CG 4.23Å; F680-M918 HydrophobicContact CG-SD 3.53Å; F680-M918 VanDerWaalsContact CG-SD 3.53Å; F680-M918 HydrophobicContact CZ-CE 4.06Å; F680-M918 HydrophobicContact CZ-CG 4.31Å; M918-T1123 HydrophobicContact CE-CG2 3.28Å
919	W	27.2	Very low	28	Very low	33 Å²	33	113.1 Å²	113.1	13%	0.125	55%	0.553	C	S	.	*	S	Bend	trans	-115	145.5	-164	-60	81	0	0	0	111.3	V915 Q921 S1124 E1126	V915-W919 HydrophobicContact CG1-CG 4.35Å; W919-Q921 PolarHBondContact O-N 2.87Å; W919-S1124 WeakPolarHBondContact CH2-O 3.34Å; W919-S1124 WeakPolarHBondContact CH2-OG 3.4Å; W919-S1124 WeakPolarHBondContact CZ3-O 3.44Å; W919-E1126 HydrophobicContact CE3-CB 3.82Å; W919-E1126 HydrophobicContact CE3-CG 3.81Å; W919-E1126 HydrophobicContact CZ3-CB 3.61Å; W919-E1126 HydrophobicContact CZ3-CG 3.95Å
920	P	33.2	Very low	28	Very low	15 Å²	15	111.2 Å²	111.2	10%	0.097	55%	0.55	C	S	.	*			trans	-66	105.9	-179.9	27.1	-33.1	0	0	0	110.3	I922 I992 T993 L1002	P920-I922 PolarHBondContact O-N 3.18Å; P920-I992 HydrophobicContact CB-CG2 3.44Å; P920-I992 VanDerWaalsContact CB-CG2 3.44Å; P920-I992 HydrophobicContact CG-CG2 3.98Å; P920-T993 VanDerWaalsContact CA-O 3.26Å; P920-T993 WeakPolarHBondContact CA-O 3.32Å; P920-T993 VanDerWaalsContact CB-O 3.26Å; P920-T993 WeakPolarHBondContact CB-O 3.05Å; P920-L1002 HydrophobicContact CB-CD2 3.98Å; P920-L1002 HydrophobicContact CG-CD2 4.38Å
921	Q	34.1	Very low	27.9	Very low	112 Å²	112	113.2 Å²	113.2	52%	0.523	57%	0.566	S	S	.	*			trans	-66.9	105	-170.5	-162.7	176	103.5	0	0	110.8	W919 T923 T993	W919-Q921 PolarHBondContact O-N 2.87Å; Q921-T923 HydrophobicContact CB-CG2 4.14Å; Q921-T923 HydrophobicContact CG-CG2 3.79Å; Q921-T923 PolarHBondContact O-N 3.33Å; Q921-T923 VanDerWaalsContact OE1-CG2 3.29Å; Q921-T993 PolarHBondContact N-OG1 3.38Å; Q921-T993 PolarHBondContact O-OG1 2.72Å; Q921-T993 VanDerWaalsContact O-OG1 3.08Å
922	I	36.1	Very low	27.8	Very low	50 Å²	50	115.5 Å²	115.5	26%	0.256	58%	0.577	S	S	.	*			trans	-69	82.9	173.1	-54.7	-176.7	0	0	0	108.3	P920 R924 L1128 L1141	P920-I922 PolarHBondContact O-N 3.18Å; I922-R924 PolarHBondContact O-N 3.36Å; I922-L1128 HydrophobicContact CD1-CD1 4.3Å; I922-L1128 HydrophobicContact CD1-CD2 4.09Å; I922-L1141 HydrophobicContact CB-CD1 4.34Å; I922-L1141 HydrophobicContact CD1-CD1 4.28Å
923	T	33	Very low	28	Very low	47 Å²	47	116 Å²	116	29%	0.288	59%	0.588	S	S	.	*			trans	-78.2	118.3	-170.2	39.9	0	0	0	0	111.2	Q921 A925	Q921-T923 HydrophobicContact CB-CG2 4.14Å; Q921-T923 HydrophobicContact CG-CG2 3.79Å; Q921-T923 PolarHBondContact O-N 3.33Å; Q921-T923 VanDerWaalsContact OE1-CG2 3.29Å; T923-A925 VanDerWaalsContact C-N 3.29Å; T923-A925 PolarHBondContact O-N 3.13Å
924	R	28.9	Very low	28.2	Very low	205 Å²	205	115 Å²	115	77%	0.774	59%	0.593	S	S	*	*			trans	-68	94.5	153	-74.6	-176.3	177.8	169.7	2.4	107.5	I922 R926 T938	I922-R924 PolarHBondContact O-N 3.36Å; R924-R926 PolarHBondContact O-N 3.43Å; R924-R926 VanDerWaalsContact O-N 3.14Å; R924-T938 HydrophobicContact CG-CG2 4.12Å
925	A	27.7	Very low	28.3	Very low	84 Å²	84	119.7 Å²	119.7	69%	0.694	61%	0.606	S	S	*	*			trans	-49.9	117.4	-173.9	0	0	0	0	0	112.5	T923	T923-A925 VanDerWaalsContact C-N 3.29Å; T923-A925 PolarHBondContact O-N 3.13Å
926	R	28.4	Very low	28.6	Very low	236 Å²	236	123.7 Å²	123.7	89%	0.891	62%	0.62	S	S	*	*			trans	-98.7	110.8	172.3	-89.1	-174.5	166.2	-170.7	-3.7	109.4	R924	R924-R926 PolarHBondContact O-N 3.43Å; R924-R926 VanDerWaalsContact O-N 3.14Å
927	K	26.6	Very low	28.7	Very low	197 Å²	197	120.9 Å²	120.9	86%	0.857	62%	0.619	S	S	*	*			trans	30.1	95.4	161.4	-68.6	-171.5	173.6	-171.9	0	116.9
928	V	27.2	Very low	29	Very low	120 Å²	120	117.1 Å²	117.1	73%	0.727	61%	0.613	S	S	*	*			trans	-96.8	138.1	145.5	178.1	0	0	0	0	107	I930	V928-I930 HydrophobicContact CG1-CG1 4.42Å; V928-I930 PolarHBondContact O-N 3.48Å
929	P	24.4	Very low	29.7	Very low	131 Å²	131	121.3 Å²	121.3	85%	0.851	63%	0.631	S	S	*	*			trans	-79.1	89.6	-175.7	31.4	-35	0	0	0	112
930	I	25.9	Very low	30.3	Very low	144 Å²	144	122 Å²	122	74%	0.738	64%	0.64	S	S	*	*			trans	-125.4	135.7	168	-60.3	-179.8	0	0	0	108.8	V928 V932	V928-I930 HydrophobicContact CG1-CG1 4.42Å; V928-I930 PolarHBondContact O-N 3.48Å; I930-V932 PolarHBondContact O-N 3.2Å
931	N	24.1	Very low	30.8	Very low	167 Å²	167	123.9 Å²	123.9	89%	0.893	65%	0.651	S	S	*	*			trans	-89	67.6	-157.8	-164.9	18.6	0	0	0	113.9
932	V	25.5	Very low	31.2	Very low	129 Å²	129	122.1 Å²	122.1	78%	0.782	65%	0.645	S	S	*	*			trans	-138.5	136.8	171.4	-173.3	0	0	0	0	110.6	I930	I930-V932 PolarHBondContact O-N 3.2Å
933	S	28.3	Very low	31.5	Very low	117 Å²	117	123.7 Å²	123.7	82%	0.818	65%	0.65	S	S	*	*			trans	-94	110.2	-170.6	57.4	0	0	0	0	114.7
934	S	28.4	Very low	31.7	Very low	117 Å²	117	126.1 Å²	126.1	82%	0.818	66%	0.661	S	S	*	*			trans	-164.4	166.8	154	57.5	0	0	0	0	111.6
935	K	27.9	Very low	31.8	Very low	158 Å²	158	120.5 Å²	120.5	69%	0.687	65%	0.649	S	S	*	*			trans	-116.2	147.8	-179	-65.6	179.5	179.4	174.9	0	111.4
936	H	32.5	Very low	31.8	Very low	150 Å²	150	121.9 Å²	121.9	69%	0.694	65%	0.651	S	S	*	*			trans	70.6	123.5	172.5	-51.1	-80.4	0	0	0	116.4	F939	H936-F939 HydrophobicContact CB-CE2 3.88Å; H936-F939 HydrophobicContact CB-CZ 4.4Å; H936-F939 WeakPolarHBondContact O-CD2 3.24Å; H936-F939 VanDerWaalsContact O-CE2 3.27Å; H936-F939 WeakPolarHBondContact O-CE2 3.26Å
937	L	28.1	Very low	31.6	Very low	141 Å²	141	116.2 Å²	116.2	74%	0.738	65%	0.648	S	S	*	*			trans	-138.9	65	173.1	-101.6	168.9	0	0	0	111.3
938	T	35.4	Very low	31.7	Very low	81 Å²	81	111.7 Å²	111.7	50%	0.497	64%	0.641	S	S	.	*			trans	-143.8	68.5	151.8	53.6	0	0	0	0	106.1	R924	R924-T938 HydrophobicContact CG-CG2 4.12Å
939	F	41.4	Very low	31.5	Very low	113 Å²	113	114.3 Å²	114.3	50%	0.496	65%	0.65	S	S	.	*			trans	-94.2	122.5	-176.2	-93.1	-75.6	0	0	0	110.5	H936 T941 I989	H936-F939 HydrophobicContact CB-CE2 3.88Å; H936-F939 HydrophobicContact CB-CZ 4.4Å; H936-F939 WeakPolarHBondContact O-CD2 3.24Å; H936-F939 VanDerWaalsContact O-CE2 3.27Å; H936-F939 WeakPolarHBondContact O-CE2 3.26Å; F939-T941 HydrophobicContact CB-CG2 4.11Å; F939-T941 HydrophobicContact CD1-CG2 4.31Å; F939-T941 HydrophobicContact CG-CG2 4.45Å; F939-I989 PolarHBondContact O-N 2.82Å
940	C	39.9	Very low	31.6	Very low	48 Å²	48	113.5 Å²	113.5	32%	0.324	65%	0.647	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.8	105.6	148	-66.1	0	0	0	0	107.3	E987 C988 I1137	C940-E987 CarbonylContact C-O 3.53Å; C940-E987 VanDerWaalsContact CA-O 3.31Å; C940-E987 WeakPolarHBondContact CA-O 3.25Å; C940-C988 HydrophobicContact CB-CB 4.11Å; C940-C988 WeakPolarHBondContact CB-SG 3.21Å; C940-C988 WeakPolarHBondContact SG-CB 3.43Å; C940-C988 CovalentContact SG-SG 2.04Å; C940-C988 PolarHBondContact SG-SG 3.2Å; C940-I1137 PolarHBondContact SG-O 2.68Å
941	T	43.7	Very low	31.5	Very low	54 Å²	54	113.6 Å²	113.6	33%	0.331	65%	0.654	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.6	137.4	173.8	51.5	0	0	0	0	110.2	F939 K943 E987	F939-T941 HydrophobicContact CB-CG2 4.11Å; F939-T941 HydrophobicContact CD1-CG2 4.31Å; F939-T941 HydrophobicContact CG-CG2 4.45Å; T941-K943 PolarHBondContact O-N 2.85Å; T941-E987 PolarHBondContact N-O 2.89Å; T941-E987 PolarHBondContact O-N 2.88Å; T941-E987 PolarHBondContact OG1-O 3.18Å
942	I	41.9	Very low	31.7	Very low	75 Å²	75	111.4 Å²	111.4	39%	0.385	65%	0.652	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.2	113	162.5	-54	179.9	0	0	0	106.6	N984 F986	I942-N984 HydrophobicContact CG2-CB 4.01Å; I942-F986 HydrophobicContact CD1-CD1 4.41Å; I942-F986 HydrophobicContact CD1-CE1 3.75Å; I942-F986 HydrophobicContact CD1-CZ 4.28Å; I942-F986 HydrophobicContact CG1-CD1 3.81Å; I942-F986 HydrophobicContact CG1-CE1 3.67Å; I942-F986 HydrophobicContact CG1-CZ 4.44Å
943	K	42.9	Very low	31.7	Very low	84 Å²	84	110.5 Å²	110.5	37%	0.365	65%	0.652	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.5	101.7	165.8	-79.5	-144.2	-178.4	98.9	0	108.6	T941 V945 S985 E987	T941-K943 PolarHBondContact O-N 2.85Å; K943-V945 HydrophobicContact CB-CG2 4.36Å; K943-V945 PolarHBondContact O-N 3.27Å; K943-S985 CarbonylContact C-O 3.34Å; K943-S985 PolarHBondContact N-O 3.22Å; K943-S985 PolarHBondContact O-N 3.35Å; K943-S985 VanDerWaalsContact O-N 3.17Å; K943-S985 PolarHBondContact O-OG 2.87Å; K943-E987 WeakPolarHBondContact CD-OE2 3.3Å; K943-E987 IonicContact NZ-OE1 3.55Å; K943-E987 PolarHBondContact NZ-OE1 3.35Å; K943-E987 IonicContact NZ-OE2 3.68Å; K943-E987 PolarHBondContact NZ-OE2 3.09Å
944	N	36.7	Very low	31.6	Very low	98 Å²	98	114.4 Å²	114.4	52%	0.524	66%	0.657	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-57.3	118	144.2	-60	48.4	0	0	0	105.7	P946 N984	N944-P946 VanDerWaalsContact O-CD 3.31Å; N944-P946 WeakPolarHBondContact O-CD 3.36Å; N944-N984 PolarHBondContact ND2-OD1 2.82Å; N944-N984 VanDerWaalsContact ND2-OD1 3.11Å; N944-N984 PolarHBondContact OD1-OD1 2.91Å
945	V	31.6	Very low	31.5	Very low	87 Å²	87	113.3 Å²	113.3	53%	0.527	65%	0.649	S	S	.	*			trans	-91.2	112	-178.7	178.5	0	0	0	0	108.8	K943	K943-V945 HydrophobicContact CB-CG2 4.36Å; K943-V945 PolarHBondContact O-N 3.27Å
946	P	26.4	Very low	31.4	Very low	112 Å²	112	113 Å²	113	73%	0.727	65%	0.65	S	S	*	*			trans	-81.8	127.4	171.4	-2.1	22.5	0	0	0	108.7	N944 S948	N944-P946 VanDerWaalsContact O-CD 3.31Å; N944-P946 WeakPolarHBondContact O-CD 3.36Å; P946-S948 VanDerWaalsContact C-N 3.35Å; P946-S948 PolarHBondContact O-N 3.1Å
947	S	25.1	Very low	31	Very low	117 Å²	117	112.1 Å²	112.1	82%	0.818	65%	0.651	S	S	*	*	S	Bend	trans	-79.2	72.4	-177.4	41.5	0	0	0	0	113
948	S	27.6	Very low	30.9	Very low	102 Å²	102	116.8 Å²	116.8	71%	0.713	66%	0.659	S	S	*	*			trans	-177.2	145.9	150.6	38.5	0	0	0	0	113.9	P946	P946-S948 VanDerWaalsContact C-N 3.35Å; P946-S948 PolarHBondContact O-N 3.1Å
949	L	24.3	Very low	30.3	Very low	176 Å²	176	117.9 Å²	117.9	92%	0.921	67%	0.669	S	S	*	*			trans	-88.6	125.9	155	-89.7	74.6	0	0	0	108.9
950	S	26.1	Very low	29.5	Very low	114 Å²	114	121.1 Å²	121.1	80%	0.797	69%	0.691	S	S	*	*			trans	-151.1	155.5	147.6	62.9	0	0	0	0	110
951	V	24.7	Very low	28.8	Very low	146 Å²	146	125.2 Å²	125.2	89%	0.885	71%	0.709	S	S	*	*			trans	-105.7	129.3	-167.1	174.7	0	0	0	0	111
952	S	27.9	Very low	27.8	Very low	121 Å²	121	125.7 Å²	125.7	85%	0.846	71%	0.712	S	S	*	*			trans	-168.3	152.5	139.6	22.5	0	0	0	0	110.7
953	S	24	Very low	27	Very low	110 Å²	110	127.4 Å²	127.4	77%	0.769	72%	0.718	S	S	*	*			trans	-115.8	135.1	-179	53.5	0	0	0	0	110.1
954	E	28.2	Very low	26.1	Very low	198 Å²	198	133 Å²	133	93%	0.925	74%	0.737	S	S	*	*			trans	-156.5	154.3	147.9	-121.3	162.3	-145.4	0	0	111.3
955	S	25.9	Very low	25.5	Very low	95 Å²	95	134.5 Å²	134.5	66%	0.664	74%	0.744	S	S	*	*			trans	-91.7	175.1	179.3	59	0	0	0	0	110.2
956	E	25.6	Very low	25.1	Very low	151 Å²	151	138.7 Å²	138.7	71%	0.706	76%	0.76	S	S	*	*			cis	-162.2	176.3	18.6	-150.4	167.1	-98.3	0	0	112.2
957	N	24.4	Very low	25	Very low	132 Å²	132	140.6 Å²	140.6	71%	0.706	76%	0.759	S	S	*	*			trans	59.5	96.4	154.7	-65.4	-40.4	0	0	0	120.9
958	R	24.9	Very low	24.9	Very low	239 Å²	239	140 Å²	140	90%	0.902	75%	0.746	S	S	*	*			trans	-152.2	109.4	133.9	-124.4	174.8	-173.1	172.4	4.3	114.7
959	S	22.9	Very low	24.7	Very low	103 Å²	103	140 Å²	140	72%	0.72	74%	0.744	S	S	*	*			trans	12.5	108.1	154.3	58.8	0	0	0	0	118.7
960	L	25.2	Very low	24.6	Very low	181 Å²	181	138.6 Å²	138.6	95%	0.948	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-81.4	130.7	165.1	-99.9	160.8	0	0	0	111.2
961	L	25.2	Very low	24.6	Very low	135 Å²	135	139.2 Å²	139.2	71%	0.707	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-87.6	157.4	174.2	-101.1	92.6	0	0	0	112.7	L1791	L961-L1791 HydrophobicContact CD2-CD2 4.1Å
962	T	23.2	Very low	24.5	Very low	63 Å²	63	136.6 Å²	136.6	39%	0.387	73%	0.725	S	S	.	*	P	Polyproline II helix	trans	-70.5	142	170	39.8	0	0	0	0	112.9	V1792	T962-V1792 HydrophobicContact CG2-CG1 4.09Å; T962-V1792 WeakPolarHBondContact OG1-CG1 3.34Å
963	H	24.9	Very low	24.3	Very low	111 Å²	111	136.1 Å²	136.1	51%	0.514	72%	0.722	S	S	.	*			trans	29.4	103.6	158.5	-76.3	-119.9	0	0	0	118.6	I2394	H963-I2394 HydrophobicContact CB-CG2 3.88Å
964	R	24.5	Very low	24.3	Very low	202 Å²	202	136.2 Å²	136.2	76%	0.762	72%	0.723	S	S	*	*			trans	-138.5	153.7	150	-80.9	-162.9	172.7	-165.2	-2.1	111.8	I2394	R964-I2394 HydrophobicContact CG-CD1 4.48Å
965	L	22.6	Very low	24.1	Very low	129 Å²	129	131.7 Å²	131.7	68%	0.675	71%	0.713	S	S	*	*			trans	-67.2	141.2	171.6	-63.8	80.9	0	0	0	110	Q967	L965-Q967 PolarHBondContact O-N 2.87Å
966	M	23.7	Very low	24.3	Very low	176 Å²	176	131.9 Å²	131.9	87%	0.867	71%	0.706	S	S	*	*			trans	-71.3	81.2	158	-80.9	-78.1	-77.3	0	0	109.2	I968	M966-I968 PolarHBondContact O-N 2.92Å
967	Q	23.5	Very low	24.2	Very low	151 Å²	151	131.8 Å²	131.8	71%	0.706	71%	0.709	S	S	*	*			trans	-73.8	111	152.2	-73.4	-174.7	-103	0	0	107	L965	L965-Q967 PolarHBondContact O-N 2.87Å
968	I	24.3	Very low	24.3	Very low	105 Å²	105	127 Å²	127	54%	0.538	69%	0.686	S	S	.	*			trans	-68.4	131.4	159.2	-60.7	175.3	0	0	0	105.9	M966 T970	M966-I968 PolarHBondContact O-N 2.92Å; I968-T970 PolarHBondContact O-N 3.39Å
969	P	23	Very low	24.4	Very low	103 Å²	103	122.2 Å²	122.2	67%	0.669	68%	0.678	S	S	*	*			trans	-69.3	123.8	-175.8	27.4	-34.1	0	0	0	110.8	V971	P969-V971 HydrophobicContact CB-CG2 4.21Å; P969-V971 PolarHBondContact O-N 3.06Å
970	T	22.9	Very low	24.6	Very low	146 Å²	146	122 Å²	122	90%	0.896	68%	0.677	S	S	*	*			trans	-69.2	107.7	160.1	47	0	0	0	0	108.1	I968	I968-T970 PolarHBondContact O-N 3.39Å
971	V	25.8	Very low	24.9	Very low	126 Å²	126	122.3 Å²	122.3	76%	0.764	67%	0.673	S	S	*	*			trans	-105.7	134.5	172.6	-175.9	0	0	0	0	108.5	P969	P969-V971 HydrophobicContact CB-CG2 4.21Å; P969-V971 PolarHBondContact O-N 3.06Å
972	T	22.7	Very low	25.2	Very low	92 Å²	92	119.5 Å²	119.5	56%	0.564	67%	0.669	S	S	*	*			trans	-69.7	164.3	178.5	36.8	0	0	0	0	111.9	E2487	T972-E2487 PolarHBondContact OG1-OE1 3.45Å
973	S	23.6	Very low	26.1	Very low	111 Å²	111	120.1 Å²	120.1	78%	0.776	67%	0.673	S	S	*	*	S	Bend	trans	-75.8	161.6	-163.5	53	0	0	0	0	115.4
974	S	23.8	Very low	27.1	Very low	112 Å²	112	117.9 Å²	117.9	78%	0.783	67%	0.665	S	S	*	*			trans	84.4	74.7	163	73.6	0	0	0	0	119.7
975	S	24.1	Very low	28.6	Very low	103 Å²	103	108.6 Å²	108.6	72%	0.72	63%	0.631	S	S	*	*			trans	179.3	171.8	130.2	45.4	0	0	0	0	110.4
976	L	29.6	Very low	30.2	Very low	98 Å²	98	103.4 Å²	103.4	51%	0.513	60%	0.603	S	S	.	*			trans	76	117.6	-172.3	-70.3	78.2	0	0	0	114.9	E1607 I1608	L976-E1607 VanDerWaalsContact C-OE1 3.28Å; L976-E1607 WeakPolarHBondContact CA-OE1 3.18Å; L976-E1607 HydrophobicContact CB-CG 4.27Å; L976-E1607 WeakPolarHBondContact CB-OE1 3.4Å; L976-E1607 HydrophobicContact CG-CG 4.04Å; L976-E1607 WeakPolarHBondContact CG-OE1 3.45Å; L976-I1608 HydrophobicContact CD1-CG1 4.36Å; L976-I1608 HydrophobicContact CD2-CD1 4.05Å; L976-I1608 HydrophobicContact CD2-CG1 3.78Å; L976-I1608 HydrophobicContact CG-CG1 3.98Å
977	L	24.1	Very low	32.1	Very low	149 Å²	149	95 Å²	95	78%	0.78	56%	0.562	S	S	*	*			trans	-161.3	54.9	166.6	-147.5	-176.4	0	0	0	111.1	E1607	L977-E1607 PolarHBondContact N-OE1 3.41Å
978	S	25.8	Very low	33.7	Very low	32 Å²	32	88 Å²	88	22%	0.224	53%	0.529	C	S	.	.			trans	-173.5	118.7	135.7	142	0	0	0	0	111.3	N1605 D1606 E1607	S978-N1605 WeakPolarHBondContact CB-OD1 3.46Å; S978-N1605 PolarHBondContact OG-OD1 3.24Å; S978-D1606 VanDerWaalsContact C-OD1 3.26Å; S978-D1606 WeakPolarHBondContact CA-OD1 3.33Å; S978-D1606 VanDerWaalsContact CB-CG 3.44Å; S978-D1606 WeakPolarHBondContact CB-OD1 3.44Å; S978-D1606 WeakPolarHBondContact CB-OD2 3.5Å; S978-D1606 PolarHBondContact N-OD1 3.45Å; S978-D1606 VanDerWaalsContact OG-CG 3.3Å; S978-D1606 PolarHBondContact OG-OD1 3Å; S978-D1606 PolarHBondContact OG-OD2 3.46Å; S978-E1607 PolarHBondContact N-OE1 2.91Å; S978-E1607 VanDerWaalsContact O-CD 3.26Å
979	L	27	Very low	35.4	Very low	139 Å²	139	85.4 Å²	85.4	73%	0.728	52%	0.516	S	S	*	.	S	Bend	trans	-151.5	141.8	143.1	-109.8	158.2	0	0	0	106.2	E981 I1608	L979-E981 PolarHBondContact O-N 3.38Å; L979-I1608 HydrophobicContact CD1-CD1 3.99Å
980	S	28.1	Very low	36.9	Very low	99 Å²	99	81.4 Å²	81.4	69%	0.692	49%	0.488	S	S	*	.			trans	-61.1	133.6	-159.1	54.9	0	0	0	0	114.7
981	E	29.8	Very low	38.6	Very low	187 Å²	187	76.2 Å²	76.2	87%	0.874	45%	0.453	S	S	*	.			trans	51.3	77.9	146.5	-59.9	-174.8	166.6	0	0	117.5	L979	L979-E981 PolarHBondContact O-N 3.38Å
982	A	32.7	Very low	40.3	Very low	75 Å²	75	70.4 Å²	70.4	62%	0.62	42%	0.418	S	S	*	.			trans	-136.8	74.2	162.1	0	0	0	0	0	111.4	N984	A982-N984 PolarHBondContact O-N 2.64Å
983	T	40.7	Very low	41.9	Very low	76 Å²	76	67.1 Å²	67.1	47%	0.466	40%	0.398	S	S	.	.			trans	-73.6	118.8	169.7	42	0	0	0	0	110	S985 Q1095	T983-S985 PolarHBondContact O-N 2.76Å; T983-Q1095 HydrophobicContact CG2-CG 4.4Å
984	N	47.2	Very low	43.7	Very low	64 Å²	64	62 Å²	62	34%	0.342	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	92.9	-179.9	-70.2	-18.5	0	0	0	110.3	I942 N944 A982 F986 P1093	I942-N984 HydrophobicContact CG2-CB 4.01Å; N944-N984 PolarHBondContact ND2-OD1 2.82Å; N944-N984 VanDerWaalsContact ND2-OD1 3.11Å; N944-N984 PolarHBondContact OD1-OD1 2.91Å; A982-N984 PolarHBondContact O-N 2.64Å; N984-F986 WeakPolarHBondContact O-CD2 3.44Å; N984-P1093 WeakPolarHBondContact O-CD 3.39Å
985	S	54.7	Low	44.9	Very low	7 Å²	7	59.1 Å²	59.1	5%	0.049	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	136.2	175.6	70.7	0	0	0	0	111.3	K943 T983	K943-S985 CarbonylContact C-O 3.34Å; K943-S985 PolarHBondContact N-O 3.22Å; K943-S985 PolarHBondContact O-N 3.35Å; K943-S985 VanDerWaalsContact O-N 3.17Å; K943-S985 PolarHBondContact O-OG 2.87Å; T983-S985 PolarHBondContact O-N 2.76Å
986	F	58.1	Low	46.1	Very low	20 Å²	20	56 Å²	56	9%	0.088	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	117.7	174.3	-68.1	-100.7	0	0	0	108.9	I942 N984 I1090 F1091 P1093 F1098 I1137	I942-F986 HydrophobicContact CD1-CD1 4.41Å; I942-F986 HydrophobicContact CD1-CE1 3.75Å; I942-F986 HydrophobicContact CD1-CZ 4.28Å; I942-F986 HydrophobicContact CG1-CD1 3.81Å; I942-F986 HydrophobicContact CG1-CE1 3.67Å; I942-F986 HydrophobicContact CG1-CZ 4.44Å; N984-F986 WeakPolarHBondContact O-CD2 3.44Å; F986-I1090 CarbonylContact O-C 3.07Å; F986-I1090 WeakPolarHBondContact O-CA 3.49Å; F986-F1091 HydrophobicContact CB-CB 4.32Å; F986-F1091 HydrophobicContact CD2-CD1 4.08Å; F986-F1091 PolarHBondContact N-O 3.13Å; F986-F1091 PolarHBondContact O-N 3.16Å; F986-P1093 HydrophobicContact CD2-CG 4.37Å; F986-P1093 HydrophobicContact CE2-CG 4.13Å; F986-F1098 HydrophobicContact CZ-CZ 4.42Å; F986-I1137 HydrophobicContact CB-CD1 3.56Å; F986-I1137 HydrophobicContact CB-CG1 4.33Å; F986-I1137 HydrophobicContact CD1-CD1 3.92Å; F986-I1137 HydrophobicContact CD1-CG1 3.87Å; F986-I1137 HydrophobicContact CD2-CD1 4.15Å; F986-I1137 HydrophobicContact CE1-CG1 4.38Å; F986-I1137 HydrophobicContact CG-CD1 3.62Å; F986-I1137 HydrophobicContact CG-CG1 4.12Å
987	E	62.1	Low	46.9	Very low	1 Å²	1	56.5 Å²	56.5	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	110.2	-175.2	-178	178.6	154.1	0	0	110.8	C940 T941 K943 R1088 L1089	C940-E987 CarbonylContact C-O 3.53Å; C940-E987 VanDerWaalsContact CA-O 3.31Å; C940-E987 WeakPolarHBondContact CA-O 3.25Å; T941-E987 PolarHBondContact N-O 2.89Å; T941-E987 PolarHBondContact O-N 2.88Å; T941-E987 PolarHBondContact OG1-O 3.18Å; K943-E987 WeakPolarHBondContact CD-OE2 3.3Å; K943-E987 IonicContact NZ-OE1 3.55Å; K943-E987 PolarHBondContact NZ-OE1 3.35Å; K943-E987 IonicContact NZ-OE2 3.68Å; K943-E987 PolarHBondContact NZ-OE2 3.09Å; E987-R1088 HydrophobicContact CG-CG 3.77Å; E987-R1088 IonicContact OE1-CZ 2.89Å; E987-R1088 IonicContact OE1-NE 3.03Å; E987-R1088 PolarHBondContact OE1-NE 2.99Å; E987-R1088 IonicContact OE1-NH2 3.64Å; E987-R1088 IonicContact OE2-CZ 2.87Å; E987-R1088 IonicContact OE2-NE 3.62Å; E987-R1088 PolarHBondContact OE2-NE 3.21Å; E987-R1088 IonicContact OE2-NH2 3.85Å; E987-R1088 PolarHBondContact OE2-NH2 3.46Å; E987-L1089 CarbonylContact C-O 3.58Å; E987-L1089 WeakPolarHBondContact CA-O 3.32Å
988	C	58.2	Low	48	Very low	4 Å²	4	53.4 Å²	53.4	3%	0.027	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	120.6	176.2	-60.3	0	0	0	0	110.5	C940 L1089 L1139	C940-C988 HydrophobicContact CB-CB 4.11Å; C940-C988 WeakPolarHBondContact CB-SG 3.21Å; C940-C988 WeakPolarHBondContact SG-CB 3.43Å; C940-C988 CovalentContact SG-SG 2.04Å; C940-C988 PolarHBondContact SG-SG 3.2Å; C988-L1089 HydrophobicContact CB-CB 4.29Å; C988-L1089 PolarHBondContact N-O 3.33Å; C988-L1089 PolarHBondContact O-N 3.01Å; C988-L1139 HydrophobicContact CB-CD1 4.31Å
989	I	59.7	Low	49.3	Very low	50 Å²	50	58.8 Å²	58.8	26%	0.256	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	126	174	-57.4	171.8	0	0	0	109.7	F939 F1056 Y1086 F1087	F939-I989 PolarHBondContact O-N 2.82Å; I989-F1056 HydrophobicContact CD1-CD2 3.86Å; I989-F1056 HydrophobicContact CD1-CE2 3.5Å; I989-F1056 HydrophobicContact CD1-CZ 4.16Å; I989-F1056 HydrophobicContact CG1-CD2 4.36Å; I989-F1056 HydrophobicContact CG1-CE2 4.43Å; I989-Y1086 HydrophobicContact CG2-CD1 4.19Å; I989-F1087 WeakPolarHBondContact CA-O 3.48Å
990	F	55	Low	50.4	Low	19 Å²	19	56 Å²	56	8%	0.083	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	156.5	178.4	66.3	-74.4	0	0	0	110.7	I992 Y1086 F1087 L1089 I1118 L1139	F990-I992 HydrophobicContact CD2-CG1 4.13Å; F990-I992 HydrophobicContact CE2-CD1 3.9Å; F990-I992 HydrophobicContact CE2-CG1 3.94Å; F990-Y1086 CarbonylContact O-C 2.94Å; F990-Y1086 WeakPolarHBondContact O-CA 3.43Å; F990-F1087 HydrophobicContact CD1-CB 3.97Å; F990-F1087 VanDerWaalsContact CD1-O 3.26Å; F990-F1087 WeakPolarHBondContact CD1-O 3.21Å; F990-F1087 HydrophobicContact CD2-CB 4.36Å; F990-F1087 HydrophobicContact CE1-CB 3.49Å; F990-F1087 VanDerWaalsContact CE1-CB 3.49Å; F990-F1087 HydrophobicContact CE2-CB 3.95Å; F990-F1087 HydrophobicContact CG-CB 4.38Å; F990-F1087 HydrophobicContact CZ-CB 3.49Å; F990-F1087 VanDerWaalsContact CZ-CB 3.49Å; F990-F1087 HydrophobicContact CZ-CG 4.29Å; F990-F1087 PolarHBondContact N-O 3.19Å; F990-F1087 PolarHBondContact O-N 3.12Å; F990-L1089 HydrophobicContact CE1-CB 4.08Å; F990-I1118 HydrophobicContact CE2-CD1 4.08Å; F990-L1139 HydrophobicContact CD1-CD1 4.47Å
991	Q	58.5	Low	51.6	Low	36 Å²	36	54.1 Å²	54.1	17%	0.168	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.6	-179.1	-162.8	-177.5	14.5	0	0	110.5	G1084 Y1086	Q991-G1084 PolarHBondContact NE2-O 3.25Å; Q991-Y1086 HydrophobicContact CB-CD1 3.76Å; Q991-Y1086 HydrophobicContact CB-CE1 3.78Å; Q991-Y1086 HydrophobicContact CB-CG 4.5Å; Q991-Y1086 HydrophobicContact CG-CD1 3.87Å; Q991-Y1086 HydrophobicContact CG-CD2 4.46Å; Q991-Y1086 HydrophobicContact CG-CE1 3.81Å; Q991-Y1086 HydrophobicContact CG-CE2 4.41Å; Q991-Y1086 HydrophobicContact CG-CG 4.22Å
992	I	59.9	Low	52.7	Low	4 Å²	4	45.3 Å²	45.3	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	108.4	172.2	-54.5	-178.2	0	0	0	107.4	P920 F990 L1002 V1004 L1078 G1084 Q1085 F1087 I1118	P920-I992 HydrophobicContact CB-CG2 3.44Å; P920-I992 VanDerWaalsContact CB-CG2 3.44Å; P920-I992 HydrophobicContact CG-CG2 3.98Å; F990-I992 HydrophobicContact CD2-CG1 4.13Å; F990-I992 HydrophobicContact CE2-CD1 3.9Å; F990-I992 HydrophobicContact CE2-CG1 3.94Å; I992-L1002 HydrophobicContact CG2-CD2 4.49Å; I992-V1004 HydrophobicContact CD1-CG1 3.89Å; I992-V1004 HydrophobicContact CG2-CG2 4.47Å; I992-L1078 HydrophobicContact CB-CD1 4.12Å; I992-L1078 HydrophobicContact CG2-CD1 3.52Å; I992-G1084 CarbonylContact O-C 3.6Å; I992-G1084 WeakPolarHBondContact O-CA 3.37Å; I992-Q1085 PolarHBondContact N-O 2.84Å; I992-Q1085 PolarHBondContact O-N 2.79Å; I992-Q1085 VanDerWaalsContact O-N 3.07Å; I992-F1087 HydrophobicContact CB-CD2 4.11Å; I992-F1087 HydrophobicContact CB-CE2 3.92Å; I992-F1087 HydrophobicContact CD1-CD2 3.6Å; I992-F1087 HydrophobicContact CD1-CE2 3.65Å; I992-F1087 HydrophobicContact CD1-CG 4.29Å; I992-F1087 HydrophobicContact CD1-CZ 4.37Å; I992-F1087 HydrophobicContact CG1-CD2 3.65Å; I992-F1087 HydrophobicContact CG1-CE2 3.88Å; I992-I1118 HydrophobicContact CD1-CD1 4.16Å
993	T	57.2	Low	53.8	Low	23 Å²	23	45.9 Å²	45.9	14%	0.141	26%	0.257	C	S	.	.			trans	-90.2	132.8	173.4	55.2	0	0	0	0	110.6	P920 Q921 P995	P920-T993 VanDerWaalsContact CA-O 3.26Å; P920-T993 WeakPolarHBondContact CA-O 3.32Å; P920-T993 VanDerWaalsContact CB-O 3.26Å; P920-T993 WeakPolarHBondContact CB-O 3.05Å; Q921-T993 PolarHBondContact N-OG1 3.38Å; Q921-T993 PolarHBondContact O-OG1 2.72Å; Q921-T993 VanDerWaalsContact O-OG1 3.08Å; T993-P995 VanDerWaalsContact O-CD 3.32Å; T993-P995 WeakPolarHBondContact O-CD 3.45Å
994	N	61.1	Low	54.5	Low	3 Å²	3	42.5 Å²	42.5	2%	0.016	24%	0.237	C	C	.	.			trans	-71.2	116.5	165.5	-174.1	-8.1	0	0	0	108.8	Q996 N1000 L1002 L1078 P1079	N994-Q996 VanDerWaalsContact C-N 3.3Å; N994-Q996 PolarHBondContact OD1-N 2.76Å; N994-Q996 VanDerWaalsContact OD1-N 3.13Å; N994-N1000 PolarHBondContact ND2-O 3Å; N994-L1002 HydrophobicContact CB-CB 4.46Å; N994-L1078 HydrophobicContact CB-CB 4.2Å; N994-L1078 PolarHBondContact ND2-O 2.99Å; N994-P1079 PolarHBondContact ND2-O 2.78Å
995	P	48.7	Very low	54.8	Low	53 Å²	53	41.3 Å²	41.3	34%	0.344	23%	0.229	S	C	.	.			trans	-81	-10.5	-175.7	35	-36.6	0	0	0	112.9	T993	T993-P995 VanDerWaalsContact O-CD 3.32Å; T993-P995 WeakPolarHBondContact O-CD 3.45Å
996	Q	49.3	Very low	54.8	Low	36 Å²	36	41.3 Å²	41.3	17%	0.168	23%	0.229	C	C	.	.			trans	-89.1	127.9	-179.5	-60.8	-164.5	-4.6	0	0	111.2	N994 T998 S1080	N994-Q996 VanDerWaalsContact C-N 3.3Å; N994-Q996 PolarHBondContact OD1-N 2.76Å; N994-Q996 VanDerWaalsContact OD1-N 3.13Å; Q996-T998 VanDerWaalsContact C-N 3.25Å; Q996-T998 PolarHBondContact O-N 3.14Å; Q996-S1080 VanDerWaalsContact O-O 3.13Å
997	S	47.3	Very low	54.5	Low	109 Å²	109	43.1 Å²	43.1	76%	0.762	24%	0.239	S	C	*	.			trans	-86.9	15	173.8	55.6	0	0	0	0	113.5
998	T	47.9	Very low	54.2	Low	84 Å²	84	43.4 Å²	43.4	52%	0.515	24%	0.241	S	C	.	.	S	Bend	trans	-137.8	92.5	-165.1	53.1	0	0	0	0	112.9	Q996 N1000	Q996-T998 VanDerWaalsContact C-N 3.25Å; Q996-T998 PolarHBondContact O-N 3.14Å; T998-N1000 PolarHBondContact O-N 3Å
999	I	53	Low	54.1	Low	145 Å²	145	46 Å²	46	74%	0.744	25%	0.25	S	S	*	.	S	Bend	trans	61.9	-46.9	158.3	-56.3	178.2	0	0	0	117.8	S1080	I999-S1080 VanDerWaalsContact C-CB 3.46Å; I999-S1080 WeakPolarHBondContact CA-OG 3.28Å; I999-S1080 PolarHBondContact O-OG 3.21Å
1000	N	50.3	Low	53.6	Low	82 Å²	82	45.8 Å²	45.8	44%	0.439	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-78.1	129.9	-170.3	-71.5	-3.8	0	0	0	112	N994 T998	N994-N1000 PolarHBondContact ND2-O 3Å; T998-N1000 PolarHBondContact O-N 3Å
1001	P	52.3	Low	53.3	Low	58 Å²	58	46.7 Å²	46.7	38%	0.377	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-79.2	143.1	175.2	31.9	-33.9	0	0	0	112	I1077 L1078 N1121	P1001-I1077 HydrophobicContact CB-CG2 3.64Å; P1001-I1077 HydrophobicContact CG-CG2 4.3Å; P1001-L1078 CarbonylContact C-O 3.51Å; P1001-L1078 VanDerWaalsContact CA-O 3.25Å; P1001-L1078 WeakPolarHBondContact CA-O 3.36Å; P1001-L1078 WeakPolarHBondContact CB-O 3.47Å; P1001-N1121 PolarHBondContact O-ND2 2.97Å
1002	L	53.4	Low	52.9	Low	2 Å²	2	46.8 Å²	46.8	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	130.6	174.5	-143	67.6	0	0	0	109.3	P920 I992 N994 V1004 I1077 L1078 N1120 L1122	P920-L1002 HydrophobicContact CB-CD2 3.98Å; P920-L1002 HydrophobicContact CG-CD2 4.38Å; I992-L1002 HydrophobicContact CG2-CD2 4.49Å; N994-L1002 HydrophobicContact CB-CB 4.46Å; L1002-V1004 HydrophobicContact CD2-CG2 4.35Å; L1002-V1004 HydrophobicContact CG-CG2 4.46Å; L1002-I1077 WeakPolarHBondContact O-CA 3.38Å; L1002-L1078 HydrophobicContact CB-CB 3.83Å; L1002-L1078 HydrophobicContact CB-CD1 4.07Å; L1002-L1078 HydrophobicContact CD2-CD1 3.82Å; L1002-L1078 PolarHBondContact N-O 2.96Å; L1002-L1078 PolarHBondContact O-N 3.43Å; L1002-N1120 WeakPolarHBondContact CD1-ND2 3.42Å; L1002-N1120 WeakPolarHBondContact CD1-OD1 3.29Å; L1002-N1120 VanDerWaalsContact CG-OD1 3.28Å; L1002-N1120 WeakPolarHBondContact CG-OD1 3.3Å; L1002-L1122 HydrophobicContact CD1-CD1 3.91Å
1003	F	54.7	Low	52.2	Low	87 Å²	87	51.2 Å²	51.2	38%	0.382	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	100	-177.4	-154.5	-87.6	0	0	0	110.4	I1077 N1120 N1121	F1003-I1077 HydrophobicContact CD2-CD1 4.22Å; F1003-I1077 HydrophobicContact CD2-CG1 3.82Å; F1003-I1077 HydrophobicContact CE2-CD1 3.8Å; F1003-I1077 HydrophobicContact CE2-CG1 3.73Å; F1003-N1120 WeakPolarHBondContact O-CA 3.25Å; F1003-N1121 HydrophobicContact CB-CB 3.81Å; F1003-N1121 PolarHBondContact N-OD1 3.41Å; F1003-N1121 PolarHBondContact O-N 2.94Å
1004	V	55.4	Low	51.6	Low	6 Å²	6	53.5 Å²	53.5	4%	0.036	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	125.7	-166.9	-178	0	0	0	0	110.8	I992 L1002 S1075 Y1076 L1078 I1118 R1119	I992-V1004 HydrophobicContact CD1-CG1 3.89Å; I992-V1004 HydrophobicContact CG2-CG2 4.47Å; L1002-V1004 HydrophobicContact CD2-CG2 4.35Å; L1002-V1004 HydrophobicContact CG-CG2 4.46Å; V1004-S1075 WeakPolarHBondContact O-CA 3.24Å; V1004-Y1076 PolarHBondContact N-O 3.37Å; V1004-Y1076 PolarHBondContact O-N 2.78Å; V1004-L1078 HydrophobicContact CG2-CD1 3.83Å; V1004-I1118 HydrophobicContact CG1-CG2 3.68Å; V1004-R1119 WeakPolarHBondContact CA-O 3.45Å
1005	Q	54.6	Low	50.9	Low	38 Å²	38	57.5 Å²	57.5	18%	0.178	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	115.3	175.9	-173.1	-177.4	42.3	0	0	111	L1007 P1073 R1119	Q1005-L1007 HydrophobicContact CG-CD1 3.98Å; Q1005-P1073 HydrophobicContact CG-CG 4.29Å; Q1005-R1119 HydrophobicContact CB-CB 4.36Å; Q1005-R1119 PolarHBondContact N-O 3.48Å; Q1005-R1119 VanDerWaalsContact O-CB 3.29Å; Q1005-R1119 WeakPolarHBondContact O-CB 3.33Å; Q1005-R1119 PolarHBondContact O-N 2.94Å
1006	P	54.1	Low	50.6	Low	8 Å²	8	58.9 Å²	58.9	5%	0.052	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	138.6	176.2	31.6	-32.2	0	0	0	112.9	I1053 L1116 I1117	P1006-I1053 HydrophobicContact CB-CD1 3.56Å; P1006-I1053 HydrophobicContact CG-CD1 3.63Å; P1006-L1116 HydrophobicContact CB-CD1 4.05Å; P1006-I1117 WeakPolarHBondContact CA-O 3.29Å
1007	L	52.4	Low	50.2	Low	58 Å²	58	60.6 Å²	60.6	30%	0.304	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	143.5	170.8	-87.5	84.3	0	0	0	110.8	Q1005 I1117	Q1005-L1007 HydrophobicContact CG-CD1 3.98Å; L1007-I1117 PolarHBondContact N-O 3.45Å; L1007-I1117 PolarHBondContact O-N 3.21Å
1008	L	55.5	Low	49.8	Very low	7 Å²	7	60.4 Å²	60.4	4%	0.037	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.3	161.4	-107.1	77.6	0	0	0	109.9	T1046 F1051 L1116	L1008-T1046 HydrophobicContact CD2-CG2 3.52Å; L1008-F1051 HydrophobicContact CD2-CD2 4.02Å; L1008-F1051 HydrophobicContact CD2-CE2 4.17Å; L1008-L1116 HydrophobicContact CD1-CB 4.47Å; L1008-L1116 HydrophobicContact CD1-CD1 3.81Å
1009	W	55	Low	49.2	Very low	59 Å²	59	61.4 Å²	61.4	22%	0.223	32%	0.318	C	S	.	.			trans	-97.2	-21.5	-179	-101.6	71.3	0	0	0	115.1	F864 E1011 V1012 Y1013 L1115 I1117	F864-W1009 HydrophobicContact CD1-CZ3 4.4Å; F864-W1009 AromaticContact CE1-CZ3 3.93Å; F864-W1009 HydrophobicContact CE1-CZ3 3.93Å; F864-W1009 HydrophobicContact CZ-CZ3 4.47Å; W1009-E1011 PolarHBondContact O-N 3.43Å; W1009-V1012 WeakPolarHBondContact O-CB 3.47Å; W1009-V1012 PolarHBondContact O-N 3.45Å; W1009-V1012 VanDerWaalsContact O-N 3.17Å; W1009-Y1013 PolarHBondContact O-N 2.91Å; W1009-L1115 PolarHBondContact N-O 3.25Å; W1009-I1117 HydrophobicContact CB-CD1 4.06Å; W1009-I1117 VanDerWaalsContact CD1-CD1 3.42Å; W1009-I1117 HydrophobicContact CD2-CD1 4.35Å; W1009-I1117 HydrophobicContact CG-CD1 3.68Å
1010	N	50.3	Low	48.5	Very low	45 Å²	45	62.1 Å²	62.1	24%	0.241	32%	0.318	C	S	.	.	H	α-helix	trans	-61.1	-40.2	-172.1	-70.1	30.3	0	0	0	113.3	K1014 R1113 L1115	N1010-K1014 WeakPolarHBondContact O-CB 3.05Å; N1010-K1014 PolarHBondContact O-N 3.38Å; N1010-R1113 PolarHBondContact ND2-O 2.92Å; N1010-L1115 VanDerWaalsContact OD1-CB 3.25Å; N1010-L1115 WeakPolarHBondContact OD1-CB 3.37Å; N1010-L1115 PolarHBondContact OD1-N 2.96Å; N1010-L1115 VanDerWaalsContact OD1-N 3.16Å
1011	E	48.5	Very low	48	Very low	37 Å²	37	62.5 Å²	62.5	17%	0.173	33%	0.328	C	S	.	.	H	α-helix	trans	-75.5	-28.5	179.1	-61	-61.6	141.8	0	0	112.2	W1009 K1014 I1015	W1009-E1011 PolarHBondContact O-N 3.43Å; E1011-K1014 WeakPolarHBondContact O-CB 3.37Å; E1011-K1014 PolarHBondContact O-N 2.88Å; E1011-K1014 IonicContact OE1-NZ 3.71Å; E1011-K1014 PolarHBondContact OE1-NZ 2.9Å; E1011-K1014 WeakPolarHBondContact OE2-CD 3.27Å; E1011-K1014 IonicContact OE2-NZ 3.76Å; E1011-K1014 PolarHBondContact OE2-NZ 2.83Å; E1011-I1015 WeakPolarHBondContact O-CG1 3.46Å; E1011-I1015 PolarHBondContact O-N 2.85Å; E1011-I1015 VanDerWaalsContact O-N 3.11Å
1012	V	50.1	Low	47.3	Very low	39 Å²	39	65 Å²	65	24%	0.236	33%	0.334	C	S	.	.	H	α-helix	trans	-62.8	-43.4	173	-177.2	0	0	0	0	111	W1009 K1014 Y1016 L1043	W1009-V1012 WeakPolarHBondContact O-CB 3.47Å; W1009-V1012 PolarHBondContact O-N 3.45Å; W1009-V1012 VanDerWaalsContact O-N 3.17Å; V1012-K1014 VanDerWaalsContact C-N 3.34Å; V1012-Y1016 PolarHBondContact O-N 2.98Å; V1012-L1043 HydrophobicContact CG2-CD2 3.9Å
1013	Y	44.9	Very low	46.7	Very low	96 Å²	96	68.8 Å²	68.8	38%	0.376	35%	0.354	S	S	.	.	H	α-helix	trans	-63.3	-39.6	174.9	-177.8	-92.3	0	0	0	112.2	F864 Y867 W1009 Y1016 A1017	F864-Y1013 HydrophobicContact CD1-CD2 4.04Å; F864-Y1013 HydrophobicContact CD1-CE2 4.43Å; F864-Y1013 AromaticContact CE1-CD2 3.9Å; F864-Y1013 HydrophobicContact CE1-CD2 3.9Å; Y867-Y1013 HydrophobicContact CD1-CD2 4.22Å; Y867-Y1013 HydrophobicContact CD1-CE2 4.26Å; Y867-Y1013 AromaticContact CE1-CD2 3.73Å; Y867-Y1013 HydrophobicContact CE1-CD2 3.73Å; Y867-Y1013 AromaticContact CE1-CE2 3.88Å; Y867-Y1013 HydrophobicContact CE1-CE2 3.88Å; Y867-Y1013 HydrophobicContact CE1-CG 4.3Å; W1009-Y1013 PolarHBondContact O-N 2.91Å; Y1013-Y1016 WeakPolarHBondContact O-CB 2.99Å; Y1013-Y1016 PolarHBondContact O-N 2.82Å; Y1013-A1017 PolarHBondContact O-N 3.33Å
1014	K	44.7	Very low	45.8	Very low	71 Å²	71	71.3 Å²	71.3	31%	0.309	37%	0.372	S	S	.	.	H	α-helix	trans	-67.2	-39.6	-176	-157.4	-173.4	-150.2	167.8	0	113.3	N1010 E1011 V1012 Y1016 Q1047	N1010-K1014 WeakPolarHBondContact O-CB 3.05Å; N1010-K1014 PolarHBondContact O-N 3.38Å; E1011-K1014 WeakPolarHBondContact O-CB 3.37Å; E1011-K1014 PolarHBondContact O-N 2.88Å; E1011-K1014 IonicContact OE1-NZ 3.71Å; E1011-K1014 PolarHBondContact OE1-NZ 2.9Å; E1011-K1014 WeakPolarHBondContact OE2-CD 3.27Å; E1011-K1014 IonicContact OE2-NZ 3.76Å; E1011-K1014 PolarHBondContact OE2-NZ 2.83Å; V1012-K1014 VanDerWaalsContact C-N 3.34Å; K1014-Y1016 VanDerWaalsContact C-N 3.32Å; K1014-Q1047 VanDerWaalsContact NZ-CD 3.27Å
1015	I	45.9	Very low	45.1	Very low	88 Å²	88	74.9 Å²	74.9	45%	0.451	39%	0.388	S	S	.	.	H	α-helix	trans	-61.6	-44.3	172	-66.7	165.6	0	0	0	109.6	E1011 A1017 T1018	E1011-I1015 WeakPolarHBondContact O-CG1 3.46Å; E1011-I1015 PolarHBondContact O-N 2.85Å; E1011-I1015 VanDerWaalsContact O-N 3.11Å; I1015-A1017 PolarHBondContact O-N 2.85Å; I1015-T1018 PolarHBondContact O-N 2.83Å; I1015-T1018 PolarHBondContact O-OG1 3.15Å; I1015-T1018 VanDerWaalsContact O-OG1 3.08Å
1016	Y	44	Very low	44.2	Very low	82 Å²	82	74.8 Å²	74.8	32%	0.322	39%	0.388	S	S	.	.	H	α-helix	trans	-62.7	-37.5	-178.8	-126.6	-84.8	0	0	0	114	F864 V1012 Y1013 K1014 T1018 L1023 L1026	F864-Y1016 HydrophobicContact CE2-CD1 4.08Å; F864-Y1016 HydrophobicContact CE2-CD2 4.02Å; F864-Y1016 AromaticContact CE2-CE1 3.95Å; F864-Y1016 HydrophobicContact CE2-CE1 3.95Å; F864-Y1016 AromaticContact CE2-CE2 3.9Å; F864-Y1016 HydrophobicContact CE2-CE2 3.9Å; F864-Y1016 HydrophobicContact CE2-CG 4.09Å; F864-Y1016 AromaticContact CE2-CZ 3.84Å; F864-Y1016 HydrophobicContact CZ-CD1 4.3Å; F864-Y1016 AromaticContact CZ-CD2 3.8Å; F864-Y1016 HydrophobicContact CZ-CD2 3.8Å; F864-Y1016 HydrophobicContact CZ-CE2 4.09Å; F864-Y1016 AromaticContact CZ-CG 3.89Å; F864-Y1016 HydrophobicContact CZ-CG 3.89Å; V1012-Y1016 PolarHBondContact O-N 2.98Å; Y1013-Y1016 WeakPolarHBondContact O-CB 2.99Å; Y1013-Y1016 PolarHBondContact O-N 2.82Å; K1014-Y1016 VanDerWaalsContact C-N 3.32Å; Y1016-T1018 PolarHBondContact O-N 3.33Å; Y1016-T1018 VanDerWaalsContact O-N 3.13Å; Y1016-L1023 HydrophobicContact CE1-CD1 4.43Å; Y1016-L1023 WeakPolarHBondContact OH-CD1 3.36Å; Y1016-L1026 HydrophobicContact CE2-CD1 3.66Å; Y1016-L1026 VanDerWaalsContact OH-CD1 3.23Å; Y1016-L1026 WeakPolarHBondContact OH-CD1 3.33Å
1017	A	40.4	Very low	43.3	Very low	72 Å²	72	82.4 Å²	82.4	60%	0.595	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-5.9	-175.5	0	0	0	0	0	114.8	Y1013 I1015	Y1013-A1017 PolarHBondContact O-N 3.33Å; I1015-A1017 PolarHBondContact O-N 2.85Å
1018	T	37.9	Very low	42.5	Very low	104 Å²	104	84.8 Å²	84.8	64%	0.638	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	-16.3	-169.7	57	0	0	0	0	116.4	I1015 Y1016	I1015-T1018 PolarHBondContact O-N 2.83Å; I1015-T1018 PolarHBondContact O-OG1 3.15Å; I1015-T1018 VanDerWaalsContact O-OG1 3.08Å; Y1016-T1018 PolarHBondContact O-N 3.33Å; Y1016-T1018 VanDerWaalsContact O-N 3.13Å
1019	N	36	Very low	41.6	Very low	106 Å²	106	87.6 Å²	87.6	57%	0.567	44%	0.443	S	S	*	.			trans	-155.9	112.6	175.2	-91.5	-59.5	0	0	0	113.2	S1021	N1019-S1021 PolarHBondContact O-N 3.39Å
1020	E	37.7	Very low	40.9	Very low	159 Å²	159	89 Å²	89	74%	0.743	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-68.5	-17.3	175.9	-160.9	179.9	-175.8	0	0	113.1	R857	R857-E1020 IonicContact NH2-OE1 3.84Å
1021	S	39.5	Very low	40.3	Very low	91 Å²	91	90 Å²	90	64%	0.636	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-75.3	-21.2	-175.2	51.9	0	0	0	0	115.1	N1019 L1023	N1019-S1021 PolarHBondContact O-N 3.39Å; S1021-L1023 VanDerWaalsContact C-N 3.27Å; S1021-L1023 PolarHBondContact O-N 2.76Å
1022	E	39	Very low	39.7	Very low	110 Å²	110	92.1 Å²	92.1	51%	0.514	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-83.3	10.1	-178.3	-75.2	-109.1	149.2	0	0	113.6	N1024 H1025 L1026	E1022-N1024 PolarHBondContact O-N 2.83Å; E1022-H1025 HydrophobicContact CB-CB 4.43Å; E1022-H1025 WeakPolarHBondContact O-CA 3.31Å; E1022-H1025 VanDerWaalsContact O-CB 3.32Å; E1022-H1025 WeakPolarHBondContact O-CB 3.33Å; E1022-H1025 PolarHBondContact O-N 2.82Å; E1022-H1025 IonicContact OE1-ND1 2.62Å; E1022-H1025 WeakPolarHBondContact OE2-CB 3.19Å; E1022-H1025 IonicContact OE2-CG 2.76Å; E1022-H1025 IonicContact OE2-ND1 3.91Å; E1022-H1025 PolarHBondContact OE2-ND1 3.21Å; E1022-L1026 PolarHBondContact O-N 3.15Å
1023	L	39.5	Very low	39.1	Very low	82 Å²	82	93.6 Å²	93.6	43%	0.429	48%	0.481	S	S	.	.	H	α-helix	trans	-55.7	-31.3	179.6	-157.5	76.7	0	0	0	113.3	Y1016 S1021 H1025 L1026	Y1016-L1023 HydrophobicContact CE1-CD1 4.43Å; Y1016-L1023 WeakPolarHBondContact OH-CD1 3.36Å; S1021-L1023 VanDerWaalsContact C-N 3.27Å; S1021-L1023 PolarHBondContact O-N 2.76Å; L1023-H1025 VanDerWaalsContact C-N 3.3Å; L1023-H1025 PolarHBondContact O-N 2.71Å; L1023-L1026 WeakPolarHBondContact O-CB 3.26Å; L1023-L1026 PolarHBondContact O-N 2.93Å
1024	N	37.1	Very low	38.8	Very low	140 Å²	140	93.5 Å²	93.5	75%	0.749	49%	0.494	S	S	*	.	H	α-helix	trans	-68.1	-26.4	173.1	-78.4	-49.1	0	0	0	113.5	E1022 L1026	E1022-N1024 PolarHBondContact O-N 2.83Å; N1024-L1026 VanDerWaalsContact C-N 3.34Å
1025	H	40.1	Very low	38.5	Very low	81 Å²	81	93.9 Å²	93.9	38%	0.375	51%	0.51	S	S	.	.	H	α-helix	trans	-75.8	-19.2	174.3	-93.6	-160.6	0	0	0	113	E1022 L1023 K1027 K1028 L1029	E1022-H1025 HydrophobicContact CB-CB 4.43Å; E1022-H1025 WeakPolarHBondContact O-CA 3.31Å; E1022-H1025 VanDerWaalsContact O-CB 3.32Å; E1022-H1025 WeakPolarHBondContact O-CB 3.33Å; E1022-H1025 PolarHBondContact O-N 2.82Å; E1022-H1025 IonicContact OE1-ND1 2.62Å; E1022-H1025 WeakPolarHBondContact OE2-CB 3.19Å; E1022-H1025 IonicContact OE2-CG 2.76Å; E1022-H1025 IonicContact OE2-ND1 3.91Å; E1022-H1025 PolarHBondContact OE2-ND1 3.21Å; L1023-H1025 VanDerWaalsContact C-N 3.3Å; L1023-H1025 PolarHBondContact O-N 2.71Å; H1025-K1027 VanDerWaalsContact C-N 3.27Å; H1025-K1027 PolarHBondContact O-N 2.95Å; H1025-K1028 PolarHBondContact NE2-NZ 2.93Å; H1025-K1028 VanDerWaalsContact NE2-NZ 3.16Å; H1025-K1028 CarbonylContact O-C 3.59Å; H1025-K1028 VanDerWaalsContact O-CA 3.3Å; H1025-K1028 WeakPolarHBondContact O-CA 2.97Å; H1025-K1028 WeakPolarHBondContact O-CB 3.21Å; H1025-K1028 PolarHBondContact O-N 2.98Å; H1025-L1029 PolarHBondContact O-N 2.91Å
1026	L	35.9	Very low	38.6	Very low	35 Å²	35	93.6 Å²	93.6	18%	0.183	51%	0.51	C	S	.	.	H	α-helix	trans	-62.6	-36.2	171.3	-146.2	177.5	0	0	0	111.7	I860 Y1016 E1022 L1023 N1024 K1028 L1029 I1030	I860-L1026 HydrophobicContact CD1-CD1 3.82Å; Y1016-L1026 HydrophobicContact CE2-CD1 3.66Å; Y1016-L1026 VanDerWaalsContact OH-CD1 3.23Å; Y1016-L1026 WeakPolarHBondContact OH-CD1 3.33Å; E1022-L1026 PolarHBondContact O-N 3.15Å; L1023-L1026 WeakPolarHBondContact O-CB 3.26Å; L1023-L1026 PolarHBondContact O-N 2.93Å; N1024-L1026 VanDerWaalsContact C-N 3.34Å; L1026-K1028 PolarHBondContact O-N 2.87Å; L1026-L1029 WeakPolarHBondContact O-CB 3.27Å; L1026-L1029 PolarHBondContact O-N 2.89Å; L1026-L1029 VanDerWaalsContact O-N 3.15Å; L1026-I1030 HydrophobicContact CD2-CD1 3.57Å; L1026-I1030 HydrophobicContact CD2-CG1 3.91Å; L1026-I1030 PolarHBondContact O-N 3.16Å
1027	K	34.8	Very low	38.7	Very low	169 Å²	169	93.6 Å²	93.6	74%	0.735	52%	0.521	S	S	*	.	H	α-helix	trans	-63.6	-24	171.7	-164	172.6	-175.3	176	0	112.7	H1025 T1031	H1025-K1027 VanDerWaalsContact C-N 3.27Å; H1025-K1027 PolarHBondContact O-N 2.95Å; K1027-T1031 WeakPolarHBondContact O-CG2 3.43Å; K1027-T1031 PolarHBondContact O-OG1 3.31Å; K1027-T1031 VanDerWaalsContact O-OG1 3.11Å
1028	K	36.7	Very low	39	Very low	107 Å²	107	94.7 Å²	94.7	47%	0.465	52%	0.521	S	S	.	.	H	α-helix	trans	-82.9	-41.6	172.2	-132.6	-179.3	-169	179	0	111.1	H1025 L1026 I1030 T1031 N1032	H1025-K1028 PolarHBondContact NE2-NZ 2.93Å; H1025-K1028 VanDerWaalsContact NE2-NZ 3.16Å; H1025-K1028 CarbonylContact O-C 3.59Å; H1025-K1028 VanDerWaalsContact O-CA 3.3Å; H1025-K1028 WeakPolarHBondContact O-CA 2.97Å; H1025-K1028 WeakPolarHBondContact O-CB 3.21Å; H1025-K1028 PolarHBondContact O-N 2.98Å; L1026-K1028 PolarHBondContact O-N 2.87Å; K1028-I1030 VanDerWaalsContact C-N 3.33Å; K1028-I1030 PolarHBondContact O-N 2.86Å; K1028-T1031 WeakPolarHBondContact CA-OG1 3.49Å; K1028-T1031 CarbonylContact O-C 3.58Å; K1028-T1031 PolarHBondContact O-N 3.27Å; K1028-T1031 PolarHBondContact O-OG1 3.25Å; K1028-T1031 VanDerWaalsContact O-OG1 3.13Å; K1028-N1032 VanDerWaalsContact O-CB 3.28Å; K1028-N1032 WeakPolarHBondContact O-CB 3.16Å; K1028-N1032 PolarHBondContact O-N 3.29Å
1029	L	36	Very low	39.4	Very low	67 Å²	67	93.1 Å²	93.1	35%	0.351	51%	0.505	S	S	.	.	H	α-helix	trans	-60	-41	-180	-168.3	153.9	0	0	0	111.2	H1025 L1026 I1033 F1039	H1025-L1029 PolarHBondContact O-N 2.91Å; L1026-L1029 WeakPolarHBondContact O-CB 3.27Å; L1026-L1029 PolarHBondContact O-N 2.89Å; L1026-L1029 VanDerWaalsContact O-N 3.15Å; L1029-I1033 VanDerWaalsContact O-CD1 3.31Å; L1029-I1033 WeakPolarHBondContact O-CD1 3.19Å; L1029-I1033 VanDerWaalsContact O-CG1 3.31Å; L1029-I1033 WeakPolarHBondContact O-CG1 3.23Å; L1029-F1039 HydrophobicContact CD1-CE1 4.22Å; L1029-F1039 HydrophobicContact CD1-CZ 3.76Å; L1029-F1039 HydrophobicContact CG-CE1 4.07Å; L1029-F1039 HydrophobicContact CG-CZ 4.12Å
1030	I	39.4	Very low	40	Very low	88 Å²	88	88.4 Å²	88.4	45%	0.451	48%	0.48	S	S	.	.	H	α-helix	trans	-73.9	-24.4	175.2	-67.2	172.9	0	0	0	112.7	V838 L1026 K1028	V838-I1030 HydrophobicContact CG2-CG2 3.72Å; L1026-I1030 HydrophobicContact CD2-CD1 3.57Å; L1026-I1030 HydrophobicContact CD2-CG1 3.91Å; L1026-I1030 PolarHBondContact O-N 3.16Å; K1028-I1030 VanDerWaalsContact C-N 3.33Å; K1028-I1030 PolarHBondContact O-N 2.86Å
1031	T	37.2	Very low	40.6	Very low	67 Å²	67	84.6 Å²	84.6	41%	0.411	47%	0.465	S	S	.	.	H	α-helix	trans	-96.7	-21.1	-179.4	59.3	0	0	0	0	115.2	V838 K1027 K1028	V838-T1031 HydrophobicContact CG1-CG2 4.41Å; K1027-T1031 WeakPolarHBondContact O-CG2 3.43Å; K1027-T1031 PolarHBondContact O-OG1 3.31Å; K1027-T1031 VanDerWaalsContact O-OG1 3.11Å; K1028-T1031 WeakPolarHBondContact CA-OG1 3.49Å; K1028-T1031 CarbonylContact O-C 3.58Å; K1028-T1031 PolarHBondContact O-N 3.27Å; K1028-T1031 PolarHBondContact O-OG1 3.25Å; K1028-T1031 VanDerWaalsContact O-OG1 3.13Å
1032	N	36.6	Very low	41.3	Very low	81 Å²	81	82.4 Å²	82.4	43%	0.433	45%	0.45	S	S	.	.	H	α-helix	trans	-107.9	6.2	-172.1	-77	22.2	0	0	0	115.2	K1028 S1034 A1035	K1028-N1032 VanDerWaalsContact O-CB 3.28Å; K1028-N1032 WeakPolarHBondContact O-CB 3.16Å; K1028-N1032 PolarHBondContact O-N 3.29Å; N1032-S1034 PolarHBondContact O-N 2.89Å; N1032-A1035 PolarHBondContact O-N 3.07Å
1033	I	38	Very low	41.7	Very low	70 Å²	70	78.8 Å²	78.8	36%	0.359	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-15.1	173.1	-83	160.4	0	0	0	113.1	L1029 I1040	L1029-I1033 VanDerWaalsContact O-CD1 3.31Å; L1029-I1033 WeakPolarHBondContact O-CD1 3.19Å; L1029-I1033 VanDerWaalsContact O-CG1 3.31Å; L1029-I1033 WeakPolarHBondContact O-CG1 3.23Å; I1033-I1040 HydrophobicContact CG1-CD1 4.33Å; I1033-I1040 HydrophobicContact CG2-CD1 4.19Å
1034	S	39.4	Very low	42.2	Very low	93 Å²	93	76.1 Å²	76.1	65%	0.65	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	20.6	174.5	76	0	0	0	0	115.6	N1032	N1032-S1034 PolarHBondContact O-N 2.89Å
1035	A	37.7	Very low	43.1	Very low	79 Å²	79	71.1 Å²	71.1	65%	0.653	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.6	-28.4	-169.8	0	0	0	0	0	118	N1032	N1032-A1035 PolarHBondContact O-N 3.07Å
1036	D	48	Very low	43.9	Very low	83 Å²	83	67.9 Å²	67.9	44%	0.444	38%	0.379	S	S	.	.			trans	-123.4	107.1	-174.9	-165.9	-31.1	0	0	0	111.2	T1038 F1039 I1040	D1036-T1038 VanDerWaalsContact C-N 3.32Å; D1036-T1038 PolarHBondContact O-N 2.85Å; D1036-T1038 WeakPolarHBondContact OD1-CB 3.23Å; D1036-T1038 PolarHBondContact OD1-N 3.26Å; D1036-T1038 PolarHBondContact OD1-OG1 3.11Å; D1036-F1039 HydrophobicContact CB-CB 4.31Å; D1036-F1039 PolarHBondContact OD1-N 2.93Å; D1036-I1040 WeakPolarHBondContact O-CG1 3.27Å; D1036-I1040 PolarHBondContact O-N 2.87Å
1037	S	46	Very low	44.6	Very low	81 Å²	81	72.7 Å²	72.7	57%	0.566	40%	0.401	S	S	*	.	H	α-helix	trans	-65.2	-36.4	179.4	59	0	0	0	0	111.9	F1039 I1040 D1041	S1037-F1039 VanDerWaalsContact C-N 3.29Å; S1037-F1039 PolarHBondContact O-N 2.81Å; S1037-I1040 CarbonylContact O-C 3.36Å; S1037-I1040 WeakPolarHBondContact O-CA 3.26Å; S1037-I1040 WeakPolarHBondContact O-CB 3.41Å; S1037-I1040 PolarHBondContact O-N 3.06Å; S1037-D1041 PolarHBondContact O-N 2.8Å; S1037-D1041 VanDerWaalsContact O-OD2 3.12Å
1038	T	46.7	Very low	45.4	Very low	96 Å²	96	68.2 Å²	68.2	59%	0.589	38%	0.38	S	S	*	.	H	α-helix	trans	-65.9	-34.1	-175	69.8	0	0	0	0	112.1	D1036 S1042	D1036-T1038 VanDerWaalsContact C-N 3.32Å; D1036-T1038 PolarHBondContact O-N 2.85Å; D1036-T1038 WeakPolarHBondContact OD1-CB 3.23Å; D1036-T1038 PolarHBondContact OD1-N 3.26Å; D1036-T1038 PolarHBondContact OD1-OG1 3.11Å; T1038-S1042 PolarHBondContact O-N 3.05Å; T1038-S1042 VanDerWaalsContact O-N 3.12Å
1039	F	45.8	Very low	46.7	Very low	70 Å²	70	63.1 Å²	63.1	31%	0.307	36%	0.358	S	S	.	.	H	α-helix	trans	-74.5	-31.7	173	-173.5	-98.1	0	0	0	112.6	L1029 D1036 S1037 S1042 L1043	L1029-F1039 HydrophobicContact CD1-CE1 4.22Å; L1029-F1039 HydrophobicContact CD1-CZ 3.76Å; L1029-F1039 HydrophobicContact CG-CE1 4.07Å; L1029-F1039 HydrophobicContact CG-CZ 4.12Å; D1036-F1039 HydrophobicContact CB-CB 4.31Å; D1036-F1039 PolarHBondContact OD1-N 2.93Å; S1037-F1039 VanDerWaalsContact C-N 3.29Å; S1037-F1039 PolarHBondContact O-N 2.81Å; F1039-S1042 PolarHBondContact O-N 3.19Å; F1039-S1042 PolarHBondContact O-OG 2.96Å; F1039-L1043 HydrophobicContact CE1-CD1 4.23Å; F1039-L1043 PolarHBondContact O-N 2.87Å
1040	I	48.3	Very low	48.1	Very low	8 Å²	8	63.9 Å²	63.9	4%	0.041	36%	0.359	C	S	.	.	H	α-helix	trans	-71	-41.7	174.8	-66.4	-68.8	0	0	0	110.9	I1033 D1036 S1037 S1042 L1043 F1044 Y1072	I1033-I1040 HydrophobicContact CG1-CD1 4.33Å; I1033-I1040 HydrophobicContact CG2-CD1 4.19Å; D1036-I1040 WeakPolarHBondContact O-CG1 3.27Å; D1036-I1040 PolarHBondContact O-N 2.87Å; S1037-I1040 CarbonylContact O-C 3.36Å; S1037-I1040 WeakPolarHBondContact O-CA 3.26Å; S1037-I1040 WeakPolarHBondContact O-CB 3.41Å; S1037-I1040 PolarHBondContact O-N 3.06Å; I1040-S1042 PolarHBondContact O-N 3.26Å; I1040-L1043 HydrophobicContact CD1-CD1 4.42Å; I1040-L1043 WeakPolarHBondContact O-CB 3.24Å; I1040-L1043 PolarHBondContact O-N 2.03Å; I1040-F1044 HydrophobicContact CG2-CE2 4.45Å; I1040-F1044 WeakPolarHBondContact O-CD2 3.21Å; I1040-Y1072 HydrophobicContact CG2-CD1 3.53Å; I1040-Y1072 HydrophobicContact CG2-CE1 4.33Å; I1040-Y1072 HydrophobicContact CG2-CG 4.33Å
1041	D	50.8	Low	49.2	Very low	78 Å²	78	59.9 Å²	59.9	42%	0.417	34%	0.339	S	S	.	.	H	α-helix	trans	-61.9	-33.5	173.2	-58.2	-30.7	0	0	0	110.7	S1037 L1043 F1044 T1045	S1037-D1041 PolarHBondContact O-N 2.8Å; S1037-D1041 VanDerWaalsContact O-OD2 3.12Å; D1041-L1043 PolarHBondContact O-N 2.85Å; D1041-F1044 PolarHBondContact O-N 2.88Å; D1041-T1045 WeakPolarHBondContact O-CG2 3.07Å; D1041-T1045 PolarHBondContact O-N 3.37Å; D1041-T1045 PolarHBondContact O-OG1 3.11Å
1042	S	55.2	Low	50.4	Low	46 Å²	46	58.3 Å²	58.3	32%	0.322	33%	0.33	S	S	.	.	H	α-helix	trans	-65.4	-17.4	173.7	86	0	0	0	0	115	T1038 F1039 I1040 T1045	T1038-S1042 PolarHBondContact O-N 3.05Å; T1038-S1042 VanDerWaalsContact O-N 3.12Å; F1039-S1042 PolarHBondContact O-N 3.19Å; F1039-S1042 PolarHBondContact O-OG 2.96Å; I1040-S1042 PolarHBondContact O-N 3.26Å; S1042-T1045 WeakPolarHBondContact CA-OG1 3.19Å
1043	L	46.8	Very low	51.6	Low	34 Å²	34	55.5 Å²	55.5	18%	0.178	32%	0.315	C	S	.	.	H	α-helix	trans	-88.3	-17.6	175.2	-67.7	168.7	0	0	0	113.2	V1012 F1039 I1040 D1041	V1012-L1043 HydrophobicContact CG2-CD2 3.9Å; F1039-L1043 HydrophobicContact CE1-CD1 4.23Å; F1039-L1043 PolarHBondContact O-N 2.87Å; I1040-L1043 HydrophobicContact CD1-CD1 4.42Å; I1040-L1043 WeakPolarHBondContact O-CB 3.24Å; I1040-L1043 PolarHBondContact O-N 2.03Å; D1041-L1043 PolarHBondContact O-N 2.85Å
1044	F	50.6	Low	52.8	Low	26 Å²	26	55.8 Å²	55.8	11%	0.114	32%	0.315	C	S	.	.	H	α-helix	trans	-103.4	-12.2	176.9	-72.7	-74.7	0	0	0	113.1	I1040 D1041 E1050 F1051 Y1072 P1073	I1040-F1044 HydrophobicContact CG2-CE2 4.45Å; I1040-F1044 WeakPolarHBondContact O-CD2 3.21Å; D1041-F1044 PolarHBondContact O-N 2.88Å; F1044-E1050 WeakPolarHBondContact O-CA 3.45Å; F1044-F1051 WeakPolarHBondContact CB-O 3.38Å; F1044-F1051 WeakPolarHBondContact CD1-O 3.21Å; F1044-F1051 PolarHBondContact O-N 2.75Å; F1044-Y1072 HydrophobicContact CE2-CE1 4.46Å; F1044-P1073 HydrophobicContact CE2-CB 3.91Å; F1044-P1073 HydrophobicContact CZ-CB 3.75Å; F1044-P1073 HydrophobicContact CZ-CG 4.48Å
1045	T	54.4	Low	53.6	Low	35 Å²	35	53.8 Å²	53.8	22%	0.215	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-95.1	132.6	172.8	50	0	0	0	0	110.6	D1041 S1042 E1050 Y1094	D1041-T1045 WeakPolarHBondContact O-CG2 3.07Å; D1041-T1045 PolarHBondContact O-N 3.37Å; D1041-T1045 PolarHBondContact O-OG1 3.11Å; S1042-T1045 WeakPolarHBondContact CA-OG1 3.19Å; T1045-E1050 HydrophobicContact CG2-CB 3.99Å; T1045-E1050 HydrophobicContact CG2-CG 3.79Å; T1045-Y1094 VanDerWaalsContact CB-OH 3.27Å; T1045-Y1094 WeakPolarHBondContact CB-OH 3.34Å; T1045-Y1094 WeakPolarHBondContact CG2-OH 3.37Å
1046	T	58.2	Low	54.3	Low	12 Å²	12	54.6 Å²	54.6	7%	0.074	29%	0.288	C	S	.	.			trans	-114.7	169.3	174.5	63.1	0	0	0	0	109.5	L1008 Y1048 G1049 F1051 Y1094	L1008-T1046 HydrophobicContact CD2-CG2 3.52Å; T1046-Y1048 PolarHBondContact O-N 3.25Å; T1046-Y1048 PolarHBondContact OG1-N 3.01Å; T1046-G1049 PolarHBondContact N-O 3.13Å; T1046-G1049 PolarHBondContact O-N 3.22Å; T1046-G1049 PolarHBondContact OG1-N 3.13Å; T1046-G1049 VanDerWaalsContact OG1-N 3.12Å; T1046-G1049 PolarHBondContact OG1-O 3.16Å; T1046-F1051 HydrophobicContact CG2-CD2 4.04Å; T1046-F1051 HydrophobicContact CG2-CE2 3.72Å; T1046-Y1094 VanDerWaalsContact O-CE2 3.27Å; T1046-Y1094 WeakPolarHBondContact O-CE2 3.28Å
1047	Q	50.6	Low	54.1	Low	137 Å²	137	57.1 Å²	57.1	64%	0.64	30%	0.301	S	S	*	.	S	Bend	trans	-54.4	-15.1	172.8	-92.4	174.6	-46.9	0	0	115.1	K1014	K1014-Q1047 VanDerWaalsContact NZ-CD 3.27Å
1048	Y	51.6	Low	53.8	Low	75 Å²	75	56.3 Å²	56.3	29%	0.294	30%	0.295	S	S	.	.	S	Bend	trans	-110.1	-37.6	-176.4	-56.5	-72.7	0	0	0	112.2	T1046 Y1094 I1097 I1112	T1046-Y1048 PolarHBondContact O-N 3.25Å; T1046-Y1048 PolarHBondContact OG1-N 3.01Å; Y1048-Y1094 WeakPolarHBondContact O-CB 3.05Å; Y1048-Y1094 PolarHBondContact O-N 3.28Å; Y1048-I1097 WeakPolarHBondContact O-CD1 3.41Å; Y1048-I1097 WeakPolarHBondContact O-CG1 3.26Å; Y1048-I1112 HydrophobicContact CD1-CD1 3.67Å; Y1048-I1112 HydrophobicContact CD2-CD1 4.06Å; Y1048-I1112 HydrophobicContact CD2-CG1 4.45Å; Y1048-I1112 HydrophobicContact CD2-CG2 3.78Å; Y1048-I1112 HydrophobicContact CE1-CD1 3.63Å; Y1048-I1112 HydrophobicContact CE1-CG1 4.41Å; Y1048-I1112 HydrophobicContact CE2-CD1 4.03Å; Y1048-I1112 HydrophobicContact CE2-CG1 4.13Å; Y1048-I1112 HydrophobicContact CE2-CG2 3.97Å; Y1048-I1112 HydrophobicContact CG-CD1 3.88Å; Y1048-I1112 HydrophobicContact CG-CG2 4.43Å
1049	G	64.2	Low	53.2	Low	0 Å²	0	57 Å²	57	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.8	-178.6	177.6	0	0	0	0	0	114.2	T1046 T1092	T1046-G1049 PolarHBondContact N-O 3.13Å; T1046-G1049 PolarHBondContact O-N 3.22Å; T1046-G1049 PolarHBondContact OG1-N 3.13Å; T1046-G1049 VanDerWaalsContact OG1-N 3.12Å; T1046-G1049 PolarHBondContact OG1-O 3.16Å; G1049-T1092 WeakPolarHBondContact CA-O 3.33Å
1050	E	65.4	Low	52.6	Low	82 Å²	82	60.4 Å²	60.4	38%	0.383	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	141.2	-175.2	-174.4	-178.6	157.4	0	0	111.8	F1044 T1045 F1091 T1092	F1044-E1050 WeakPolarHBondContact O-CA 3.45Å; T1045-E1050 HydrophobicContact CG2-CB 3.99Å; T1045-E1050 HydrophobicContact CG2-CG 3.79Å; E1050-F1091 WeakPolarHBondContact O-CA 3.33Å; E1050-F1091 WeakPolarHBondContact O-CD2 3.2Å; E1050-T1092 PolarHBondContact N-O 3.24Å; E1050-T1092 PolarHBondContact O-N 2.99Å; E1050-T1092 PolarHBondContact O-OG1 3.26Å
1051	F	61.4	Low	52	Low	5 Å²	5	64.1 Å²	64.1	2%	0.022	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.1	-179.2	-69.7	-86	0	0	0	112	L1008 F1044 T1046 L1089 I1090 F1091 L1130 I1132	L1008-F1051 HydrophobicContact CD2-CD2 4.02Å; L1008-F1051 HydrophobicContact CD2-CE2 4.17Å; F1044-F1051 WeakPolarHBondContact CB-O 3.38Å; F1044-F1051 WeakPolarHBondContact CD1-O 3.21Å; F1044-F1051 PolarHBondContact O-N 2.75Å; T1046-F1051 HydrophobicContact CG2-CD2 4.04Å; T1046-F1051 HydrophobicContact CG2-CE2 3.72Å; F1051-L1089 HydrophobicContact CD1-CD1 4.2Å; F1051-I1090 WeakPolarHBondContact CA-O 3.22Å; F1051-F1091 HydrophobicContact CD1-CB 3.99Å; F1051-F1091 AromaticContact CD1-CD2 3.6Å; F1051-F1091 HydrophobicContact CD1-CD2 3.6Å; F1051-F1091 HydrophobicContact CD1-CE2 4.5Å; F1051-F1091 HydrophobicContact CD1-CG 4.21Å; F1051-F1091 AromaticContact CD2-CD2 3.91Å; F1051-F1091 HydrophobicContact CD2-CD2 3.91Å; F1051-F1091 HydrophobicContact CD2-CE2 4.15Å; F1051-F1091 HydrophobicContact CE1-CB 3.9Å; F1051-F1091 AromaticContact CE1-CD2 3.27Å; F1051-F1091 HydrophobicContact CE1-CD2 3.27Å; F1051-F1091 AromaticContact CE1-CE2 3.94Å; F1051-F1091 HydrophobicContact CE1-CE2 3.94Å; F1051-F1091 AromaticContact CE1-CG 3.81Å; F1051-F1091 HydrophobicContact CE1-CG 3.81Å; F1051-F1091 AromaticContact CE2-CD2 3.6Å; F1051-F1091 HydrophobicContact CE2-CD2 3.6Å; F1051-F1091 AromaticContact CE2-CE2 3.54Å; F1051-F1091 HydrophobicContact CE2-CE2 3.54Å; F1051-F1091 AromaticContact CG-CD2 3.92Å; F1051-F1091 HydrophobicContact CG-CD2 3.92Å; F1051-F1091 AromaticContact CZ-CD2 3.28Å; F1051-F1091 HydrophobicContact CZ-CD2 3.28Å; F1051-F1091 AromaticContact CZ-CE2 3.43Å; F1051-F1091 HydrophobicContact CZ-CE2 3.43Å; F1051-F1091 VanDerWaalsContact CZ-CE2 3.43Å; F1051-F1091 HydrophobicContact CZ-CG 4.15Å; F1051-F1091 HydrophobicContact CZ-CZ 4.4Å; F1051-L1130 HydrophobicContact CD1-CD1 4.11Å; F1051-L1130 HydrophobicContact CE1-CD1 3.65Å; F1051-L1130 HydrophobicContact CE1-CD2 4.44Å; F1051-L1130 HydrophobicContact CZ-CD1 4.17Å; F1051-I1132 HydrophobicContact CZ-CD1 4.35Å
1052	S	62.6	Low	51	Low	34 Å²	34	69.4 Å²	69.4	24%	0.238	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	141.3	177.5	177.3	0	0	0	0	110.6	L1089 I1090	S1052-L1089 CarbonylContact O-C 3.46Å; S1052-L1089 WeakPolarHBondContact O-CA 3.29Å; S1052-I1090 PolarHBondContact N-O 2.85Å; S1052-I1090 PolarHBondContact O-N 2.99Å
1053	I	63	Low	49.9	Very low	21 Å²	21	72.9 Å²	72.9	11%	0.108	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	127	177	-66.6	170.5	0	0	0	109	P1006 Y1076 F1087 R1088 L1089 L1116	P1006-I1053 HydrophobicContact CB-CD1 3.56Å; P1006-I1053 HydrophobicContact CG-CD1 3.63Å; I1053-Y1076 HydrophobicContact CG2-CE2 4.41Å; I1053-Y1076 PolarHBondContact O-OH 2.96Å; I1053-Y1076 VanDerWaalsContact O-OH 3.13Å; I1053-F1087 HydrophobicContact CG2-CD1 4.09Å; I1053-R1088 WeakPolarHBondContact CA-O 3.46Å; I1053-L1089 HydrophobicContact CD1-CD1 3.99Å; I1053-L1089 HydrophobicContact CG1-CD1 3.49Å; I1053-L1089 VanDerWaalsContact CG1-CD1 3.49Å; I1053-L1116 HydrophobicContact CD1-CD1 4.23Å; I1053-L1116 HydrophobicContact CD1-CD2 4.48Å
1054	Q	61.7	Low	49.2	Very low	77 Å²	77	78.1 Å²	78.1	36%	0.36	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.5	-178.5	-61.2	178.6	-12.9	0	0	110.3	R1088 I1090	Q1054-R1088 HydrophobicContact CB-CB 4.36Å; Q1054-R1088 PolarHBondContact N-O 2.85Å; Q1054-R1088 WeakPolarHBondContact O-CB 3.2Å; Q1054-R1088 PolarHBondContact O-N 2.8Å; Q1054-I1090 HydrophobicContact CG-CD1 4.49Å
1055	P	57.6	Low	48	Very low	50 Å²	50	84.5 Å²	84.5	33%	0.325	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	134.8	170.2	30.5	-32.3	0	0	0	109.7	Y1076 F1087	P1055-Y1076 HydrophobicContact CB-CE1 4.36Å; P1055-Y1076 HydrophobicContact CG-CD1 4.49Å; P1055-Y1076 HydrophobicContact CG-CE1 3.92Å; P1055-F1087 HydrophobicContact CB-CE1 4.44Å
1056	F	52.7	Low	46.9	Very low	96 Å²	96	90.3 Å²	90.3	42%	0.421	47%	0.474	S	S	.	.			trans	-82.1	119.4	179.7	-158.1	-88.3	0	0	0	109.7	I989 C1058 Y1086 R1088	I989-F1056 HydrophobicContact CD1-CD2 3.86Å; I989-F1056 HydrophobicContact CD1-CE2 3.5Å; I989-F1056 HydrophobicContact CD1-CZ 4.16Å; I989-F1056 HydrophobicContact CG1-CD2 4.36Å; I989-F1056 HydrophobicContact CG1-CE2 4.43Å; F1056-C1058 PolarHBondContact O-N 3.3Å; F1056-C1058 VanDerWaalsContact O-N 3.14Å; F1056-Y1086 PolarHBondContact N-O 2.95Å; F1056-R1088 HydrophobicContact CD2-CB 4.31Å
1057	L	43.4	Very low	45.3	Very low	136 Å²	136	95.6 Å²	95.6	71%	0.712	51%	0.511	S	S	*	.			trans	-70.7	104.8	-177.6	-79.5	159	0	0	0	111.2	L1063	L1057-L1063 HydrophobicContact CD2-CD1 3.77Å
1058	C	38.7	Very low	44.4	Very low	64 Å²	64	96 Å²	96	43%	0.432	52%	0.516	S	S	.	.			trans	-83.8	137.4	161.7	-162.3	0	0	0	0	108.9	F1056 D1060 C1061	F1056-C1058 PolarHBondContact O-N 3.3Å; F1056-C1058 VanDerWaalsContact O-N 3.14Å; C1058-D1060 PolarHBondContact O-N 3.04Å; C1058-C1061 PolarHBondContact O-N 3.39Å
1059	S	34.6	Very low	43.2	Very low	112 Å²	112	99.5 Å²	99.5	78%	0.783	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-29.9	-171	37.9	0	0	0	0	115.3
1060	D	33.3	Very low	41.4	Very low	140 Å²	140	107.2 Å²	107.2	75%	0.749	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	2	-169.8	-53.4	-84.8	0	0	0	113.1	C1058 Q1062	C1058-D1060 PolarHBondContact O-N 3.04Å; D1060-Q1062 PolarHBondContact O-N 3.45Å
1061	C	34.5	Very low	39.8	Very low	86 Å²	86	107.4 Å²	107.4	58%	0.581	59%	0.588	S	S	*	*			trans	-81.4	99.9	175.6	-74.4	0	0	0	0	110.9	C1058 L1063	C1058-C1061 PolarHBondContact O-N 3.39Å; C1061-L1063 PolarHBondContact O-N 2.97Å
1062	Q	30.8	Very low	38.6	Very low	190 Å²	190	112.5 Å²	112.5	89%	0.888	61%	0.607	S	S	*	*			trans	-64.1	101.6	172.6	-70.4	-170.5	-1.5	0	0	111.5	D1060 I1064	D1060-Q1062 PolarHBondContact O-N 3.45Å; Q1062-I1064 PolarHBondContact O-N 2.89Å
1063	L	32	Very low	37.5	Very low	119 Å²	119	111.5 Å²	111.5	62%	0.623	60%	0.6	S	S	*	*			trans	-62.9	115.6	165.3	-88.6	159.8	0	0	0	109.7	L1057 C1061 N1065	L1057-L1063 HydrophobicContact CD2-CD1 3.77Å; C1061-L1063 PolarHBondContact O-N 2.97Å; L1063-N1065 PolarHBondContact O-N 2.88Å
1064	I	32.4	Very low	36.7	Very low	144 Å²	144	112.4 Å²	112.4	74%	0.738	61%	0.607	S	S	*	*			trans	-69.5	100.5	169.6	-61	178.2	0	0	0	107.7	Q1062 H1066	Q1062-I1064 PolarHBondContact O-N 2.89Å; I1064-H1066 HydrophobicContact CG2-CB 4.49Å; I1064-H1066 PolarHBondContact O-N 3.11Å
1065	N	25.8	Very low	36	Very low	160 Å²	160	111 Å²	111	86%	0.856	61%	0.606	S	S	*	*			trans	-71.8	67.7	176.3	-107.2	-9.9	0	0	0	111.2	L1063	L1063-N1065 PolarHBondContact O-N 2.88Å
1066	H	30.7	Very low	36	Very low	157 Å²	157	109.8 Å²	109.8	73%	0.727	60%	0.595	S	S	*	*			trans	-93.5	110.2	162.5	-93.8	-45.8	0	0	0	110.1	I1064 I1068	I1064-H1066 HydrophobicContact CG2-CB 4.49Å; I1064-H1066 PolarHBondContact O-N 3.11Å; H1066-I1068 PolarHBondContact O-N 3.44Å
1067	S	25	Very low	36.2	Very low	123 Å²	123	110 Å²	110	86%	0.86	60%	0.599	S	S	*	*			trans	-65.4	87.1	175.4	54.9	0	0	0	0	111.5
1068	I	30.9	Very low	37	Very low	144 Å²	144	103.5 Å²	103.5	74%	0.738	57%	0.565	S	S	*	*			trans	-95.8	129.6	159.9	-58.8	179.1	0	0	0	106.4	H1066	H1066-I1068 PolarHBondContact O-N 3.44Å
1069	N	27.4	Very low	37.7	Very low	150 Å²	150	103.9 Å²	103.9	80%	0.802	57%	0.567	S	S	*	*			trans	-54.1	145.2	178	-87	-18.4	0	0	0	111	T1071	N1069-T1071 PolarHBondContact O-N 3.45Å
1070	L	26.1	Very low	38.6	Very low	162 Å²	162	99.5 Å²	99.5	85%	0.848	54%	0.537	S	S	*	.			trans	-62.2	93.1	-179.5	-75.5	77	0	0	0	111.4
1071	T	32	Very low	39.6	Very low	86 Å²	86	99.6 Å²	99.6	53%	0.528	54%	0.537	S	S	.	.			trans	-93.1	90.7	157.4	50.6	0	0	0	0	107.9	N1069	N1069-T1071 PolarHBondContact O-N 3.45Å
1072	Y	36.4	Very low	40.3	Very low	112 Å²	112	97.6 Å²	97.6	44%	0.439	53%	0.531	S	S	.	.	S	Bend	trans	-65.7	150	174.5	-137.9	-98.6	0	0	0	109.9	I1040 F1044	I1040-Y1072 HydrophobicContact CG2-CD1 3.53Å; I1040-Y1072 HydrophobicContact CG2-CE1 4.33Å; I1040-Y1072 HydrophobicContact CG2-CG 4.33Å; F1044-Y1072 HydrophobicContact CE2-CE1 4.46Å
1073	P	38.4	Very low	41.2	Very low	12 Å²	12	91.4 Å²	91.4	8%	0.078	51%	0.509	C	S	.	.	S	Bend	cis	-73.3	151.9	-3.3	31.3	-35.2	0	0	0	113.1	Q1005 F1044 S1075	Q1005-P1073 HydrophobicContact CG-CG 4.29Å; F1044-P1073 HydrophobicContact CE2-CB 3.91Å; F1044-P1073 HydrophobicContact CZ-CB 3.75Å; F1044-P1073 HydrophobicContact CZ-CG 4.48Å; P1073-S1075 PolarHBondContact O-N 2.92Å
1074	P	45.9	Very low	42.3	Very low	40 Å²	40	86.5 Å²	86.5	26%	0.26	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-58.7	128.9	-178.2	25.5	-35.3	0	0	0	111.4	Y1076	P1074-Y1076 HydrophobicContact CB-CE1 4.1Å; P1074-Y1076 HydrophobicContact CB-CE2 4.17Å; P1074-Y1076 HydrophobicContact CG-CE2 4.14Å; P1074-Y1076 WeakPolarHBondContact CG-OH 3.43Å; P1074-Y1076 WeakPolarHBondContact O-CE2 3.44Å
1075	S	48.2	Very low	43.6	Very low	47 Å²	47	82.2 Å²	82.2	33%	0.329	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-103.3	133.4	172.5	24	0	0	0	0	109.4	V1004 P1073	V1004-S1075 WeakPolarHBondContact O-CA 3.24Å; P1073-S1075 PolarHBondContact O-N 2.92Å
1076	Y	57.6	Low	45.3	Very low	26 Å²	26	79 Å²	79	10%	0.102	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	135	-170.9	-54.2	-80.7	0	0	0	111.2	V1004 I1053 P1055 P1074 F1087	V1004-Y1076 PolarHBondContact N-O 3.37Å; V1004-Y1076 PolarHBondContact O-N 2.78Å; I1053-Y1076 HydrophobicContact CG2-CE2 4.41Å; I1053-Y1076 PolarHBondContact O-OH 2.96Å; I1053-Y1076 VanDerWaalsContact O-OH 3.13Å; P1055-Y1076 HydrophobicContact CB-CE1 4.36Å; P1055-Y1076 HydrophobicContact CG-CD1 4.49Å; P1055-Y1076 HydrophobicContact CG-CE1 3.92Å; P1074-Y1076 HydrophobicContact CB-CE1 4.1Å; P1074-Y1076 HydrophobicContact CB-CE2 4.17Å; P1074-Y1076 HydrophobicContact CG-CE2 4.14Å; P1074-Y1076 WeakPolarHBondContact CG-OH 3.43Å; P1074-Y1076 WeakPolarHBondContact O-CE2 3.44Å; Y1076-F1087 AromaticContact CD1-CE1 3.87Å; Y1076-F1087 HydrophobicContact CD1-CE1 3.87Å; Y1076-F1087 HydrophobicContact CD1-CZ 4.46Å; Y1076-F1087 HydrophobicContact CD2-CD1 4.44Å; Y1076-F1087 AromaticContact CD2-CE1 3.54Å; Y1076-F1087 HydrophobicContact CD2-CE1 3.54Å; Y1076-F1087 HydrophobicContact CD2-CZ 4.2Å; Y1076-F1087 HydrophobicContact CE1-CE1 4.16Å; Y1076-F1087 HydrophobicContact CE2-CD1 4.37Å; Y1076-F1087 AromaticContact CE2-CE1 3.83Å; Y1076-F1087 HydrophobicContact CE2-CE1 3.83Å; Y1076-F1087 AromaticContact CG-CE1 3.53Å; Y1076-F1087 HydrophobicContact CG-CE1 3.53Å; Y1076-F1087 AromaticContact CG-CZ 3.95Å; Y1076-F1087 HydrophobicContact CG-CZ 3.95Å
1077	I	57.3	Low	46.9	Very low	99 Å²	99	71.6 Å²	71.6	51%	0.508	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	108.6	-175.2	-51.9	-176.1	0	0	0	108.9	P1001 L1002 F1003	P1001-I1077 HydrophobicContact CB-CG2 3.64Å; P1001-I1077 HydrophobicContact CG-CG2 4.3Å; L1002-I1077 WeakPolarHBondContact O-CA 3.38Å; F1003-I1077 HydrophobicContact CD2-CD1 4.22Å; F1003-I1077 HydrophobicContact CD2-CG1 3.82Å; F1003-I1077 HydrophobicContact CE2-CD1 3.8Å; F1003-I1077 HydrophobicContact CE2-CG1 3.73Å
1078	L	58.9	Low	48.6	Very low	0 Å²	0	68.5 Å²	68.5	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.7	175.2	-71.3	158.3	0	0	0	110.3	I992 N994 P1001 L1002 V1004 Q1085	I992-L1078 HydrophobicContact CB-CD1 4.12Å; I992-L1078 HydrophobicContact CG2-CD1 3.52Å; N994-L1078 HydrophobicContact CB-CB 4.2Å; N994-L1078 PolarHBondContact ND2-O 2.99Å; P1001-L1078 CarbonylContact C-O 3.51Å; P1001-L1078 VanDerWaalsContact CA-O 3.25Å; P1001-L1078 WeakPolarHBondContact CA-O 3.36Å; P1001-L1078 WeakPolarHBondContact CB-O 3.47Å; L1002-L1078 HydrophobicContact CB-CB 3.83Å; L1002-L1078 HydrophobicContact CB-CD1 4.07Å; L1002-L1078 HydrophobicContact CD2-CD1 3.82Å; L1002-L1078 PolarHBondContact N-O 2.96Å; L1002-L1078 PolarHBondContact O-N 3.43Å; V1004-L1078 HydrophobicContact CG2-CD1 3.83Å; L1078-Q1085 HydrophobicContact CD2-CB 3.39Å
1079	P	54.7	Low	50.4	Low	72 Å²	72	61.8 Å²	61.8	47%	0.468	34%	0.341	S	S	.	.			trans	-68.7	163.6	177.6	26.5	-31	0	0	0	112.7	N994 N1081	N994-P1079 PolarHBondContact ND2-O 2.78Å; P1079-N1081 PolarHBondContact O-N 2.79Å
1080	S	52.3	Low	52.2	Low	21 Å²	21	55.4 Å²	55.4	15%	0.147	31%	0.307	C	S	.	.	S	Bend	trans	-88.5	19.1	-163.2	56.2	0	0	0	0	116.2	Q996 I999	Q996-S1080 VanDerWaalsContact O-O 3.13Å; I999-S1080 VanDerWaalsContact C-CB 3.46Å; I999-S1080 WeakPolarHBondContact CA-OG 3.28Å; I999-S1080 PolarHBondContact O-OG 3.21Å
1081	N	54.2	Low	54.1	Low	141 Å²	141	47.9 Å²	47.9	75%	0.754	27%	0.267	S	S	*	.	S	Bend	trans	-115.6	35.9	-174.5	-71.8	5.6	0	0	0	112.8	P1079 S1083	P1079-N1081 PolarHBondContact O-N 2.79Å; N1081-S1083 PolarHBondContact O-N 2.68Å
1082	G	48.8	Very low	55.9	Low	45 Å²	45	45.8 Å²	45.8	46%	0.464	25%	0.254	S	S	.	.	S	Bend	trans	68.6	-1.1	175.2	0	0	0	0	0	116.4	G1084	G1082-G1084 PolarHBondContact O-N 2.03Å
1083	S	50.1	Low	57	Low	59 Å²	59	41 Å²	41	41%	0.413	24%	0.237	S	C	.	.			trans	-67.3	102.2	176.6	55	0	0	0	0	111	N1081	N1081-S1083 PolarHBondContact O-N 2.68Å
1084	G	55.6	Low	58.1	Low	16 Å²	16	45.1 Å²	45.1	17%	0.165	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-80.8	124.8	176.5	0	0	0	0	0	112.8	Q991 I992 G1082	Q991-G1084 PolarHBondContact NE2-O 3.25Å; I992-G1084 CarbonylContact O-C 3.6Å; I992-G1084 WeakPolarHBondContact O-CA 3.37Å; G1082-G1084 PolarHBondContact O-N 2.03Å
1085	Q	60.4	Low	58.4	Low	54 Å²	54	50.9 Å²	50.9	25%	0.252	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	139.7	176.8	-163.9	168.7	17.8	0	0	110.2	I992 L1078 F1087	I992-Q1085 PolarHBondContact N-O 2.84Å; I992-Q1085 PolarHBondContact O-N 2.79Å; I992-Q1085 VanDerWaalsContact O-N 3.07Å; L1078-Q1085 HydrophobicContact CD2-CB 3.39Å; Q1085-F1087 HydrophobicContact CB-CE2 3.9Å; Q1085-F1087 HydrophobicContact CB-CZ 4.34Å; Q1085-F1087 HydrophobicContact CG-CE2 4.24Å; Q1085-F1087 HydrophobicContact CG-CZ 4.34Å; Q1085-F1087 WeakPolarHBondContact O-CD2 2.97Å
1086	Y	60.4	Low	58.3	Low	92 Å²	92	51 Å²	51	36%	0.361	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	137.8	175.1	-68.2	-85.2	0	0	0	110	I989 F990 Q991 F1056	I989-Y1086 HydrophobicContact CG2-CD1 4.19Å; F990-Y1086 CarbonylContact O-C 2.94Å; F990-Y1086 WeakPolarHBondContact O-CA 3.43Å; Q991-Y1086 HydrophobicContact CB-CD1 3.76Å; Q991-Y1086 HydrophobicContact CB-CE1 3.78Å; Q991-Y1086 HydrophobicContact CB-CG 4.5Å; Q991-Y1086 HydrophobicContact CG-CD1 3.87Å; Q991-Y1086 HydrophobicContact CG-CD2 4.46Å; Q991-Y1086 HydrophobicContact CG-CE1 3.81Å; Q991-Y1086 HydrophobicContact CG-CE2 4.41Å; Q991-Y1086 HydrophobicContact CG-CG 4.22Å; F1056-Y1086 PolarHBondContact N-O 2.95Å
1087	F	64.5	Low	57.7	Low	2 Å²	2	50.4 Å²	50.4	1%	0.009	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	137.9	177.9	-70.2	-88.2	0	0	0	109.5	I989 F990 I992 I1053 P1055 Y1076 Q1085	I989-F1087 WeakPolarHBondContact CA-O 3.48Å; F990-F1087 HydrophobicContact CD1-CB 3.97Å; F990-F1087 VanDerWaalsContact CD1-O 3.26Å; F990-F1087 WeakPolarHBondContact CD1-O 3.21Å; F990-F1087 HydrophobicContact CD2-CB 4.36Å; F990-F1087 HydrophobicContact CE1-CB 3.49Å; F990-F1087 VanDerWaalsContact CE1-CB 3.49Å; F990-F1087 HydrophobicContact CE2-CB 3.95Å; F990-F1087 HydrophobicContact CG-CB 4.38Å; F990-F1087 HydrophobicContact CZ-CB 3.49Å; F990-F1087 VanDerWaalsContact CZ-CB 3.49Å; F990-F1087 HydrophobicContact CZ-CG 4.29Å; F990-F1087 PolarHBondContact N-O 3.19Å; F990-F1087 PolarHBondContact O-N 3.12Å; I992-F1087 HydrophobicContact CB-CD2 4.11Å; I992-F1087 HydrophobicContact CB-CE2 3.92Å; I992-F1087 HydrophobicContact CD1-CD2 3.6Å; I992-F1087 HydrophobicContact CD1-CE2 3.65Å; I992-F1087 HydrophobicContact CD1-CG 4.29Å; I992-F1087 HydrophobicContact CD1-CZ 4.37Å; I992-F1087 HydrophobicContact CG1-CD2 3.65Å; I992-F1087 HydrophobicContact CG1-CE2 3.88Å; I1053-F1087 HydrophobicContact CG2-CD1 4.09Å; P1055-F1087 HydrophobicContact CB-CE1 4.44Å; Y1076-F1087 AromaticContact CD1-CE1 3.87Å; Y1076-F1087 HydrophobicContact CD1-CE1 3.87Å; Y1076-F1087 HydrophobicContact CD1-CZ 4.46Å; Y1076-F1087 HydrophobicContact CD2-CD1 4.44Å; Y1076-F1087 AromaticContact CD2-CE1 3.54Å; Y1076-F1087 HydrophobicContact CD2-CE1 3.54Å; Y1076-F1087 HydrophobicContact CD2-CZ 4.2Å; Y1076-F1087 HydrophobicContact CE1-CE1 4.16Å; Y1076-F1087 HydrophobicContact CE2-CD1 4.37Å; Y1076-F1087 AromaticContact CE2-CE1 3.83Å; Y1076-F1087 HydrophobicContact CE2-CE1 3.83Å; Y1076-F1087 AromaticContact CG-CE1 3.53Å; Y1076-F1087 HydrophobicContact CG-CE1 3.53Å; Y1076-F1087 AromaticContact CG-CZ 3.95Å; Y1076-F1087 HydrophobicContact CG-CZ 3.95Å; Q1085-F1087 HydrophobicContact CB-CE2 3.9Å; Q1085-F1087 HydrophobicContact CB-CZ 4.34Å; Q1085-F1087 HydrophobicContact CG-CE2 4.24Å; Q1085-F1087 HydrophobicContact CG-CZ 4.34Å; Q1085-F1087 WeakPolarHBondContact O-CD2 2.97Å
1088	R	61.4	Low	57.2	Low	58 Å²	58	50 Å²	50	22%	0.219	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	97.7	-177.3	-177.6	-168.6	-170.9	-134.8	-8.7	106.9	E987 I1053 Q1054 F1056 I1090	E987-R1088 HydrophobicContact CG-CG 3.77Å; E987-R1088 IonicContact OE1-CZ 2.89Å; E987-R1088 IonicContact OE1-NE 3.03Å; E987-R1088 PolarHBondContact OE1-NE 2.99Å; E987-R1088 IonicContact OE1-NH2 3.64Å; E987-R1088 IonicContact OE2-CZ 2.87Å; E987-R1088 IonicContact OE2-NE 3.62Å; E987-R1088 PolarHBondContact OE2-NE 3.21Å; E987-R1088 IonicContact OE2-NH2 3.85Å; E987-R1088 PolarHBondContact OE2-NH2 3.46Å; I1053-R1088 WeakPolarHBondContact CA-O 3.46Å; Q1054-R1088 HydrophobicContact CB-CB 4.36Å; Q1054-R1088 PolarHBondContact N-O 2.85Å; Q1054-R1088 WeakPolarHBondContact O-CB 3.2Å; Q1054-R1088 PolarHBondContact O-N 2.8Å; F1056-R1088 HydrophobicContact CD2-CB 4.31Å; R1088-I1090 HydrophobicContact CG-CD1 4.49Å; R1088-I1090 HydrophobicContact CG-CG1 4.11Å
1089	L	67.6	Low	56.5	Low	3 Å²	3	53.8 Å²	53.8	2%	0.016	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	130	166.9	178.5	73.3	0	0	0	107.9	E987 C988 F990 F1051 S1052 I1053 L1130 L1139	E987-L1089 CarbonylContact C-O 3.58Å; E987-L1089 WeakPolarHBondContact CA-O 3.32Å; C988-L1089 HydrophobicContact CB-CB 4.29Å; C988-L1089 PolarHBondContact N-O 3.33Å; C988-L1089 PolarHBondContact O-N 3.01Å; F990-L1089 HydrophobicContact CE1-CB 4.08Å; F1051-L1089 HydrophobicContact CD1-CD1 4.2Å; S1052-L1089 CarbonylContact O-C 3.46Å; S1052-L1089 WeakPolarHBondContact O-CA 3.29Å; I1053-L1089 HydrophobicContact CD1-CD1 3.99Å; I1053-L1089 HydrophobicContact CG1-CD1 3.49Å; I1053-L1089 VanDerWaalsContact CG1-CD1 3.49Å; L1089-L1130 HydrophobicContact CD2-CD1 4.3Å; L1089-L1130 HydrophobicContact CD2-CD2 3.61Å; L1089-L1130 HydrophobicContact CD2-CG 4.5Å; L1089-L1139 HydrophobicContact CD2-CD2 4.49Å
1090	I	66.6	Low	55.8	Low	17 Å²	17	53.6 Å²	53.6	9%	0.087	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125	174.9	-51.8	171	0	0	0	106.5	F986 F1051 S1052 Q1054 R1088	F986-I1090 CarbonylContact O-C 3.07Å; F986-I1090 WeakPolarHBondContact O-CA 3.49Å; F1051-I1090 WeakPolarHBondContact CA-O 3.22Å; S1052-I1090 PolarHBondContact N-O 2.85Å; S1052-I1090 PolarHBondContact O-N 2.99Å; Q1054-I1090 HydrophobicContact CG-CD1 4.49Å; R1088-I1090 HydrophobicContact CG-CD1 4.49Å; R1088-I1090 HydrophobicContact CG-CG1 4.11Å
1091	F	66	Low	55.3	Low	4 Å²	4	55.2 Å²	55.2	2%	0.018	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	119.3	168.2	174.7	-109.8	0	0	0	109.4	F986 E1050 F1051 P1093 I1097 I1132 I1137	F986-F1091 HydrophobicContact CB-CB 4.32Å; F986-F1091 HydrophobicContact CD2-CD1 4.08Å; F986-F1091 PolarHBondContact N-O 3.13Å; F986-F1091 PolarHBondContact O-N 3.16Å; E1050-F1091 WeakPolarHBondContact O-CA 3.33Å; E1050-F1091 WeakPolarHBondContact O-CD2 3.2Å; F1051-F1091 HydrophobicContact CD1-CB 3.99Å; F1051-F1091 AromaticContact CD1-CD2 3.6Å; F1051-F1091 HydrophobicContact CD1-CD2 3.6Å; F1051-F1091 HydrophobicContact CD1-CE2 4.5Å; F1051-F1091 HydrophobicContact CD1-CG 4.21Å; F1051-F1091 AromaticContact CD2-CD2 3.91Å; F1051-F1091 HydrophobicContact CD2-CD2 3.91Å; F1051-F1091 HydrophobicContact CD2-CE2 4.15Å; F1051-F1091 HydrophobicContact CE1-CB 3.9Å; F1051-F1091 AromaticContact CE1-CD2 3.27Å; F1051-F1091 HydrophobicContact CE1-CD2 3.27Å; F1051-F1091 AromaticContact CE1-CE2 3.94Å; F1051-F1091 HydrophobicContact CE1-CE2 3.94Å; F1051-F1091 AromaticContact CE1-CG 3.81Å; F1051-F1091 HydrophobicContact CE1-CG 3.81Å; F1051-F1091 AromaticContact CE2-CD2 3.6Å; F1051-F1091 HydrophobicContact CE2-CD2 3.6Å; F1051-F1091 AromaticContact CE2-CE2 3.54Å; F1051-F1091 HydrophobicContact CE2-CE2 3.54Å; F1051-F1091 AromaticContact CG-CD2 3.92Å; F1051-F1091 HydrophobicContact CG-CD2 3.92Å; F1051-F1091 AromaticContact CZ-CD2 3.28Å; F1051-F1091 HydrophobicContact CZ-CD2 3.28Å; F1051-F1091 AromaticContact CZ-CE2 3.43Å; F1051-F1091 HydrophobicContact CZ-CE2 3.43Å; F1051-F1091 VanDerWaalsContact CZ-CE2 3.43Å; F1051-F1091 HydrophobicContact CZ-CG 4.15Å; F1051-F1091 HydrophobicContact CZ-CZ 4.4Å; F1091-P1093 HydrophobicContact CD1-CB 4.45Å; F1091-P1093 HydrophobicContact CE1-CB 3.83Å; F1091-P1093 HydrophobicContact CZ-CB 4.37Å; F1091-P1093 WeakPolarHBondContact O-CD 3.27Å; F1091-I1097 HydrophobicContact CE1-CD1 3.97Å; F1091-I1097 HydrophobicContact CZ-CD1 3.82Å; F1091-I1132 HydrophobicContact CE1-CD1 4Å; F1091-I1132 HydrophobicContact CE2-CD1 4.41Å; F1091-I1132 HydrophobicContact CZ-CD1 3.9Å; F1091-I1137 HydrophobicContact CB-CD1 4Å; F1091-I1137 HydrophobicContact CD1-CD1 3.5Å; F1091-I1137 VanDerWaalsContact CD1-CD1 3.5Å; F1091-I1137 HydrophobicContact CE1-CD1 4.24Å; F1091-I1137 HydrophobicContact CG-CD1 4.02Å
1092	T	68.2	Low	54.6	Low	42 Å²	42	54.2 Å²	54.2	26%	0.258	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	100.9	173.4	27.6	0	0	0	0	108.5	G1049 E1050	G1049-T1092 WeakPolarHBondContact CA-O 3.33Å; E1050-T1092 PolarHBondContact N-O 3.24Å; E1050-T1092 PolarHBondContact O-N 2.99Å; E1050-T1092 PolarHBondContact O-OG1 3.26Å
1093	P	59.8	Low	54.2	Low	12 Å²	12	56 Å²	56	8%	0.078	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	138.4	178	29.8	-36.9	0	0	0	109.9	N984 F986 F1091 I1097	N984-P1093 WeakPolarHBondContact O-CD 3.39Å; F986-P1093 HydrophobicContact CD2-CG 4.37Å; F986-P1093 HydrophobicContact CE2-CG 4.13Å; F1091-P1093 HydrophobicContact CD1-CB 4.45Å; F1091-P1093 HydrophobicContact CE1-CB 3.83Å; F1091-P1093 HydrophobicContact CZ-CB 4.37Å; F1091-P1093 WeakPolarHBondContact O-CD 3.27Å; P1093-I1097 HydrophobicContact CB-CD1 3.58Å; P1093-I1097 HydrophobicContact CB-CG1 4.22Å
1094	Y	60.9	Low	53.4	Low	98 Å²	98	58.2 Å²	58.2	38%	0.384	28%	0.282	S	S	.	.			trans	-65.9	142.6	165.1	-62.1	-40	0	0	0	109.2	T1045 T1046 Y1048 N1096 I1097	T1045-Y1094 VanDerWaalsContact CB-OH 3.27Å; T1045-Y1094 WeakPolarHBondContact CB-OH 3.34Å; T1045-Y1094 WeakPolarHBondContact CG2-OH 3.37Å; T1046-Y1094 VanDerWaalsContact O-CE2 3.27Å; T1046-Y1094 WeakPolarHBondContact O-CE2 3.28Å; Y1048-Y1094 WeakPolarHBondContact O-CB 3.05Å; Y1048-Y1094 PolarHBondContact O-N 3.28Å; Y1094-N1096 PolarHBondContact O-N 2.88Å; Y1094-I1097 PolarHBondContact O-N 3.47Å
1095	Q	53.4	Low	52.2	Low	161 Å²	161	67.6 Å²	67.6	75%	0.752	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-32.4	-172.7	-70.7	167.2	-64.1	0	0	112.4	T983 I1097	T983-Q1095 HydrophobicContact CG2-CG 4.4Å; Q1095-I1097 VanDerWaalsContact C-N 3.32Å; Q1095-I1097 PolarHBondContact O-N 3.45Å
1096	N	46	Very low	50.8	Low	50 Å²	50	69 Å²	69	27%	0.267	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-14.1	178.4	-69.7	1.6	0	0	0	116	Y1094 F1098 E1099 L1100 T1599 N1600	Y1094-N1096 PolarHBondContact O-N 2.88Å; N1096-F1098 PolarHBondContact O-N 3.08Å; N1096-E1099 PolarHBondContact O-N 2.7Å; N1096-E1099 VanDerWaalsContact O-N 3.13Å; N1096-L1100 HydrophobicContact CB-CD1 3.93Å; N1096-L1100 WeakPolarHBondContact O-CD1 3.14Å; N1096-L1100 PolarHBondContact O-N 3.22Å; N1096-T1599 HydrophobicContact CB-CG2 3.91Å; N1096-T1599 WeakPolarHBondContact ND2-CG2 3.18Å; N1096-N1600 PolarHBondContact ND2-OD1 3.39Å
1097	I	45.3	Very low	49.3	Very low	12 Å²	12	71 Å²	71	6%	0.062	35%	0.348	C	S	.	.	H	α-helix	trans	-52.8	-53.7	-179.1	-78.8	-166.7	0	0	0	111.2	Y1048 F1091 P1093 Y1094 Q1095 E1099 L1100 L1101	Y1048-I1097 WeakPolarHBondContact O-CD1 3.41Å; Y1048-I1097 WeakPolarHBondContact O-CG1 3.26Å; F1091-I1097 HydrophobicContact CE1-CD1 3.97Å; F1091-I1097 HydrophobicContact CZ-CD1 3.82Å; P1093-I1097 HydrophobicContact CB-CD1 3.58Å; P1093-I1097 HydrophobicContact CB-CG1 4.22Å; Y1094-I1097 PolarHBondContact O-N 3.47Å; Q1095-I1097 VanDerWaalsContact C-N 3.32Å; Q1095-I1097 PolarHBondContact O-N 3.45Å; I1097-E1099 PolarHBondContact O-N 3.04Å; I1097-L1100 PolarHBondContact O-N 2.69Å; I1097-L1101 HydrophobicContact CG2-CD1 3.67Å; I1097-L1101 HydrophobicContact CG2-CG 4.4Å; I1097-L1101 WeakPolarHBondContact O-CB 3.49Å; I1097-L1101 WeakPolarHBondContact O-CG 3.39Å; I1097-L1101 PolarHBondContact O-N 3.28Å
1098	F	46.3	Very low	47.8	Very low	92 Å²	92	79.2 Å²	79.2	40%	0.404	39%	0.392	S	S	.	.	H	α-helix	trans	-73.7	-10.2	-173	-65.6	-80	0	0	0	112.3	F986 N1096 N1102	F986-F1098 HydrophobicContact CZ-CZ 4.42Å; N1096-F1098 PolarHBondContact O-N 3.08Å; F1098-N1102 WeakPolarHBondContact O-CB 3.16Å; F1098-N1102 PolarHBondContact O-ND2 2.81Å
1099	E	44	Very low	46.7	Very low	79 Å²	79	82.3 Å²	82.3	37%	0.369	41%	0.409	S	S	.	.	H	α-helix	trans	-93.2	-43.9	173.4	-70.5	-165.8	124.3	0	0	111.6	N1096 I1097 N1102 Q1103 L1598	N1096-E1099 PolarHBondContact O-N 2.7Å; N1096-E1099 VanDerWaalsContact O-N 3.13Å; I1097-E1099 PolarHBondContact O-N 3.04Å; E1099-N1102 PolarHBondContact O-N 3.04Å; E1099-Q1103 WeakPolarHBondContact O-CB 3.19Å; E1099-Q1103 VanDerWaalsContact O-CG 3.26Å; E1099-Q1103 WeakPolarHBondContact O-CG 3.18Å; E1099-Q1103 PolarHBondContact O-N 2.99Å; E1099-Q1103 VanDerWaalsContact O-N 3.11Å; E1099-L1598 HydrophobicContact CB-CB 4.11Å; E1099-L1598 HydrophobicContact CB-CD1 3.86Å; E1099-L1598 HydrophobicContact CB-CG 4.38Å; E1099-L1598 HydrophobicContact CG-CD1 3.89Å; E1099-L1598 VanDerWaalsContact OE1-CD1 3.26Å; E1099-L1598 WeakPolarHBondContact OE1-CD1 2.73Å; E1099-L1598 WeakPolarHBondContact OE1-CD2 3.28Å
1100	L	40.5	Very low	45	Very low	68 Å²	68	87.9 Å²	87.9	36%	0.356	44%	0.438	S	S	.	.	H	α-helix	trans	-60.3	-46.5	172	-94.8	89	0	0	0	111.8	N1096 I1097 N1102 Q1103 N1104 T1599	N1096-L1100 HydrophobicContact CB-CD1 3.93Å; N1096-L1100 WeakPolarHBondContact O-CD1 3.14Å; N1096-L1100 PolarHBondContact O-N 3.22Å; I1097-L1100 PolarHBondContact O-N 2.69Å; L1100-N1102 PolarHBondContact O-N 3.24Å; L1100-Q1103 PolarHBondContact O-N 2.91Å; L1100-N1104 PolarHBondContact O-N 2.78Å; L1100-T1599 HydrophobicContact CD1-CG2 3.62Å
1101	L	40.6	Very low	43.6	Very low	55 Å²	55	89.8 Å²	89.8	29%	0.288	45%	0.449	S	S	.	.	H	α-helix	trans	-69	-13.1	-179.9	-69.3	176.9	0	0	0	114	I1097 I1112 F1134	I1097-L1101 HydrophobicContact CG2-CD1 3.67Å; I1097-L1101 HydrophobicContact CG2-CG 4.4Å; I1097-L1101 WeakPolarHBondContact O-CB 3.49Å; I1097-L1101 WeakPolarHBondContact O-CG 3.39Å; I1097-L1101 PolarHBondContact O-N 3.28Å; L1101-I1112 HydrophobicContact CD2-CD1 4.36Å; L1101-F1134 HydrophobicContact CB-CE2 4.09Å; L1101-F1134 HydrophobicContact CB-CZ 3.79Å; L1101-F1134 HydrophobicContact CD1-CE2 4.35Å
1102	N	41	Very low	42.4	Very low	119 Å²	119	90.5 Å²	90.5	64%	0.636	45%	0.453	S	S	*	.	H	α-helix	trans	-98.7	-19.7	174.2	-91.3	-48.5	0	0	0	113.5	F1098 E1099 L1100	F1098-N1102 WeakPolarHBondContact O-CB 3.16Å; F1098-N1102 PolarHBondContact O-ND2 2.81Å; E1099-N1102 PolarHBondContact O-N 3.04Å; L1100-N1102 PolarHBondContact O-N 3.24Å
1103	Q	39.2	Very low	41.4	Very low	82 Å²	82	91 Å²	91	38%	0.383	45%	0.45	S	S	.	.	H	α-helix	trans	-92.6	-31	-176.3	-72.2	-114.9	-30	0	0	113.2	E1099 L1100 K1105 L1598	E1099-Q1103 WeakPolarHBondContact O-CB 3.19Å; E1099-Q1103 VanDerWaalsContact O-CG 3.26Å; E1099-Q1103 WeakPolarHBondContact O-CG 3.18Å; E1099-Q1103 PolarHBondContact O-N 2.99Å; E1099-Q1103 VanDerWaalsContact O-N 3.11Å; L1100-Q1103 PolarHBondContact O-N 2.91Å; Q1103-K1105 PolarHBondContact O-N 2.87Å; Q1103-L1598 HydrophobicContact CG-CB 3.99Å; Q1103-L1598 HydrophobicContact CG-CD1 4.14Å
1104	N	32.8	Very low	40.7	Very low	106 Å²	106	90.9 Å²	90.9	57%	0.567	45%	0.449	S	S	*	.			trans	-73.1	96.2	168.3	-80.5	0.1	0	0	0	109.8	L1100 V1106	L1100-N1104 PolarHBondContact O-N 2.78Å; N1104-V1106 HydrophobicContact CB-CB 4.25Å; N1104-V1106 HydrophobicContact CB-CG2 3.81Å; N1104-V1106 PolarHBondContact O-N 2.85Å
1105	K	31.7	Very low	39.9	Very low	214 Å²	214	86.6 Å²	86.6	93%	0.93	43%	0.433	S	S	*	.			trans	-67.8	70	156.8	-80.3	-171.2	174	-176.4	0	109.4	Q1103	Q1103-K1105 PolarHBondContact O-N 2.87Å
1106	V	30.1	Very low	39.7	Very low	83 Å²	83	79 Å²	79	50%	0.503	40%	0.397	S	S	.	.			trans	-115	155.3	178.5	174.1	0	0	0	0	108.3	N1104	N1104-V1106 HydrophobicContact CB-CB 4.25Å; N1104-V1106 HydrophobicContact CB-CG2 3.81Å; N1104-V1106 PolarHBondContact O-N 2.85Å
1107	N	30	Very low	39.9	Very low	134 Å²	134	77.1 Å²	77.1	72%	0.717	39%	0.387	S	S	*	.			trans	-67	169.3	-171.9	-57.9	-40.5	0	0	0	112.6	E1109	N1107-E1109 PolarHBondContact O-N 2.79Å
1108	N	31.8	Very low	40.3	Very low	174 Å²	174	77.4 Å²	77.4	93%	0.93	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	26.9	-169.6	-68.8	-37.7	0	0	0	116.8
1109	E	38.1	Very low	40.4	Very low	124 Å²	124	77.2 Å²	77.2	58%	0.579	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	-23.6	-161.8	-61	-172.1	150.2	0	0	115.5	N1107 N1111	N1107-E1109 PolarHBondContact O-N 2.79Å; E1109-N1111 VanDerWaalsContact C-N 3.29Å; E1109-N1111 PolarHBondContact O-N 2.94Å; E1109-N1111 PolarHBondContact O-ND2 3.17Å
1110	D	32.6	Very low	40.8	Very low	119 Å²	119	74.1 Å²	74.1	64%	0.636	37%	0.371	S	S	*	.			trans	-74.4	70.2	-174.2	-79.3	-23	0	0	0	114	I1112	D1110-I1112 PolarHBondContact O-N 2.92Å
1111	N	37.6	Very low	41.3	Very low	57 Å²	57	73.6 Å²	73.6	31%	0.305	37%	0.369	S	S	.	.			trans	-75.4	105.2	168.7	-64.8	-70.6	0	0	0	110	E1109 R1113 H1133	E1109-N1111 VanDerWaalsContact C-N 3.29Å; E1109-N1111 PolarHBondContact O-N 2.94Å; E1109-N1111 PolarHBondContact O-ND2 3.17Å; N1111-R1113 HydrophobicContact CB-CG 4.31Å; N1111-R1113 WeakPolarHBondContact O-CG 3.28Å; N1111-R1113 PolarHBondContact O-N 2.72Å; N1111-H1133 PolarHBondContact OD1-CE1 3.05Å; N1111-H1133 PolarHBondContact OD1-ND1 3.22Å
1112	I	40.7	Very low	41.4	Very low	20 Å²	20	72.8 Å²	72.8	10%	0.103	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	110.6	174.5	-61.9	166.1	0	0	0	108.4	Y1048 L1101 D1110 I1132	Y1048-I1112 HydrophobicContact CD1-CD1 3.67Å; Y1048-I1112 HydrophobicContact CD2-CD1 4.06Å; Y1048-I1112 HydrophobicContact CD2-CG1 4.45Å; Y1048-I1112 HydrophobicContact CD2-CG2 3.78Å; Y1048-I1112 HydrophobicContact CE1-CD1 3.63Å; Y1048-I1112 HydrophobicContact CE1-CG1 4.41Å; Y1048-I1112 HydrophobicContact CE2-CD1 4.03Å; Y1048-I1112 HydrophobicContact CE2-CG1 4.13Å; Y1048-I1112 HydrophobicContact CE2-CG2 3.97Å; Y1048-I1112 HydrophobicContact CG-CD1 3.88Å; Y1048-I1112 HydrophobicContact CG-CG2 4.43Å; L1101-I1112 HydrophobicContact CD2-CD1 4.36Å; D1110-I1112 PolarHBondContact O-N 2.92Å; I1112-I1132 HydrophobicContact CB-CB 4.31Å; I1112-I1132 HydrophobicContact CG2-CD1 4.35Å; I1112-I1132 PolarHBondContact O-N 2.97Å
1113	R	46.1	Very low	41.3	Very low	53 Å²	53	68.4 Å²	68.4	20%	0.2	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	97.1	-173.9	-78.7	173.2	168.3	149.8	-5.8	110.9	W874 N1010 N1111 W1129 L1130 E1131	W874-R1113 VanDerWaalsContact CH2-CD 3.41Å; N1010-R1113 PolarHBondContact ND2-O 2.92Å; N1111-R1113 HydrophobicContact CB-CG 4.31Å; N1111-R1113 WeakPolarHBondContact O-CG 3.28Å; N1111-R1113 PolarHBondContact O-N 2.72Å; R1113-W1129 HydrophobicContact CB-CE3 4.18Å; R1113-W1129 HydrophobicContact CB-CZ3 4.48Å; R1113-L1130 WeakPolarHBondContact CA-O 3.08Å; R1113-E1131 HydrophobicContact CG-CG 4.25Å; R1113-E1131 IonicContact CZ-OE1 2.65Å; R1113-E1131 IonicContact NE-OE1 2.92Å; R1113-E1131 PolarHBondContact NE-OE1 2.76Å; R1113-E1131 IonicContact NH2-OE1 2.72Å; R1113-E1131 PolarHBondContact NH2-OE1 2.89Å
1114	S	45	Very low	41.4	Very low	8 Å²	8	66.7 Å²	66.7	6%	0.056	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	130.7	178.7	-65.6	0	0	0	0	110.6	L1116 L1130	S1114-L1116 PolarHBondContact O-N 2.95Å; S1114-L1130 PolarHBondContact N-O 2.85Å; S1114-L1130 VanDerWaalsContact N-O 3.09Å; S1114-L1130 WeakPolarHBondContact O-CB 3.43Å; S1114-L1130 PolarHBondContact O-N 2.81Å
1115	L	44.3	Very low	41.7	Very low	8 Å²	8	65.6 Å²	65.6	4%	0.042	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	103.6	178.5	-165.3	67.1	0	0	0	110.7	Y867 W1009 N1010 I1117 P1127 W1129	Y867-L1115 HydrophobicContact CD2-CD2 4.36Å; Y867-L1115 HydrophobicContact CE2-CD2 3.86Å; W1009-L1115 PolarHBondContact N-O 3.25Å; N1010-L1115 VanDerWaalsContact OD1-CB 3.25Å; N1010-L1115 WeakPolarHBondContact OD1-CB 3.37Å; N1010-L1115 PolarHBondContact OD1-N 2.96Å; N1010-L1115 VanDerWaalsContact OD1-N 3.16Å; L1115-I1117 HydrophobicContact CD2-CD1 3.78Å; L1115-I1117 HydrophobicContact CD2-CG1 4.25Å; L1115-I1117 HydrophobicContact CG-CD1 4.2Å; L1115-I1117 HydrophobicContact CG-CG1 4.15Å; L1115-P1127 HydrophobicContact CD1-CB 3.68Å; L1115-W1129 HydrophobicContact CD1-CD2 3.75Å; L1115-W1129 HydrophobicContact CD1-CE3 3.95Å; L1115-W1129 HydrophobicContact CD1-CG 4.33Å; L1115-W1129 HydrophobicContact CD1-CH2 4.05Å; L1115-W1129 HydrophobicContact CD1-CZ2 3.86Å; L1115-W1129 HydrophobicContact CD1-CZ3 4.09Å
1116	L	51	Low	42.2	Very low	2 Å²	2	56.8 Å²	56.8	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	116.1	168.3	177.8	67	0	0	0	108.3	P1006 L1008 I1053 S1114 L1128 L1130	P1006-L1116 HydrophobicContact CB-CD1 4.05Å; L1008-L1116 HydrophobicContact CD1-CB 4.47Å; L1008-L1116 HydrophobicContact CD1-CD1 3.81Å; I1053-L1116 HydrophobicContact CD1-CD1 4.23Å; I1053-L1116 HydrophobicContact CD1-CD2 4.48Å; S1114-L1116 PolarHBondContact O-N 2.95Å; L1116-L1128 HydrophobicContact CB-CB 4.27Å; L1116-L1128 PolarHBondContact N-O 3.37Å; L1116-L1128 WeakPolarHBondContact O-CA 3.42Å; L1116-L1128 WeakPolarHBondContact O-CB 3.5Å; L1116-L1128 PolarHBondContact O-N 3.46Å; L1116-L1128 VanDerWaalsContact O-O 3.09Å; L1116-L1130 HydrophobicContact CB-CD1 3.96Å; L1116-L1130 HydrophobicContact CD2-CD1 4.41Å
1117	I	50.2	Low	42.9	Very low	11 Å²	11	55 Å²	55	6%	0.056	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.5	177	-83.2	168.4	0	0	0	108.5	P1006 L1007 W1009 L1115 I1125	P1006-I1117 WeakPolarHBondContact CA-O 3.29Å; L1007-I1117 PolarHBondContact N-O 3.45Å; L1007-I1117 PolarHBondContact O-N 3.21Å; W1009-I1117 HydrophobicContact CB-CD1 4.06Å; W1009-I1117 VanDerWaalsContact CD1-CD1 3.42Å; W1009-I1117 HydrophobicContact CD2-CD1 4.35Å; W1009-I1117 HydrophobicContact CG-CD1 3.68Å; L1115-I1117 HydrophobicContact CD2-CD1 3.78Å; L1115-I1117 HydrophobicContact CD2-CG1 4.25Å; L1115-I1117 HydrophobicContact CG-CD1 4.2Å; L1115-I1117 HydrophobicContact CG-CG1 4.15Å; I1117-I1125 HydrophobicContact CB-CG2 4.1Å; I1117-I1125 HydrophobicContact CD1-CG2 3.7Å; I1117-I1125 HydrophobicContact CG1-CG2 3.54Å; I1117-I1125 HydrophobicContact CG2-CB 4.18Å; I1117-I1125 HydrophobicContact CG2-CD1 4.13Å; I1117-I1125 HydrophobicContact CG2-CG1 3.76Å; I1117-I1125 HydrophobicContact CG2-CG2 3.55Å
1118	I	53.7	Low	43.6	Very low	17 Å²	17	48.9 Å²	48.9	9%	0.087	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.1	168.4	-64.1	-174.8	0	0	0	108	F990 I992 V1004 E1126 L1128	F990-I1118 HydrophobicContact CE2-CD1 4.08Å; I992-I1118 HydrophobicContact CD1-CD1 4.16Å; V1004-I1118 HydrophobicContact CG1-CG2 3.68Å; I1118-E1126 PolarHBondContact N-O 3Å; I1118-E1126 PolarHBondContact O-N 3.26Å; I1118-L1128 HydrophobicContact CD1-CD1 3.4Å; I1118-L1128 VanDerWaalsContact CD1-CD1 3.4Å; I1118-L1128 HydrophobicContact CG1-CD1 3.84Å
1119	R	48.3	Very low	44.5	Very low	88 Å²	88	42 Å²	42	33%	0.332	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	139.4	172.3	-177.3	-174.2	-179.8	-172.9	5.3	109.7	V1004 Q1005	V1004-R1119 WeakPolarHBondContact CA-O 3.45Å; Q1005-R1119 HydrophobicContact CB-CB 4.36Å; Q1005-R1119 PolarHBondContact N-O 3.48Å; Q1005-R1119 VanDerWaalsContact O-CB 3.29Å; Q1005-R1119 WeakPolarHBondContact O-CB 3.33Å; Q1005-R1119 PolarHBondContact O-N 2.94Å
1120	N	51.3	Low	45.1	Very low	14 Å²	14	36.1 Å²	36.1	8%	0.075	19%	0.185	C	C	.	.			trans	-121.4	166.3	175.4	-170.1	15	0	0	0	110.4	L1002 F1003	L1002-N1120 WeakPolarHBondContact CD1-ND2 3.42Å; L1002-N1120 WeakPolarHBondContact CD1-OD1 3.29Å; L1002-N1120 VanDerWaalsContact CG-OD1 3.28Å; L1002-N1120 WeakPolarHBondContact CG-OD1 3.3Å; F1003-N1120 WeakPolarHBondContact O-CA 3.25Å
1121	N	50.4	Low	45.7	Very low	57 Å²	57	32 Å²	32	31%	0.305	16%	0.162	S	C	.	.	S	Bend	trans	-86.8	-18.5	172.3	57.2	-24.4	0	0	0	114.5	P1001 F1003	P1001-N1121 PolarHBondContact O-ND2 2.97Å; F1003-N1121 HydrophobicContact CB-CB 3.81Å; F1003-N1121 PolarHBondContact N-OD1 3.41Å; F1003-N1121 PolarHBondContact O-N 2.94Å
1122	L	42.7	Very low	46	Very low	39 Å²	39	30.4 Å²	30.4	20%	0.204	15%	0.154	C	C	.	.	S	Bend	trans	-104.3	-22.1	-169.7	-68.2	172.2	0	0	0	115.7	L1002	L1002-L1122 HydrophobicContact CD1-CD1 3.91Å
1123	T	38.7	Very low	46	Very low	26 Å²	26	33.2 Å²	33.2	16%	0.16	17%	0.166	C	C	.	.	S	Bend	trans	-159.9	-179.8	168.5	35.2	0	0	0	0	111.1	F680 M918	F680-T1123 HydrophobicContact CE2-CG2 4.12Å; M918-T1123 HydrophobicContact CE-CG2 3.28Å
1124	S	41.4	Very low	45.3	Very low	47 Å²	47	37.2 Å²	37.2	33%	0.329	19%	0.185	S	C	.	.			trans	-56.4	-177.6	-169.8	49.1	0	0	0	0	116.8	W919	W919-S1124 WeakPolarHBondContact CH2-O 3.34Å; W919-S1124 WeakPolarHBondContact CH2-OG 3.4Å; W919-S1124 WeakPolarHBondContact CZ3-O 3.44Å
1125	I	40.4	Very low	44.9	Very low	82 Å²	82	38.3 Å²	38.3	42%	0.421	20%	0.198	S	C	.	.			trans	-68.2	131.4	-177	-76.4	166.5	0	0	0	112.1	I1117	I1117-I1125 HydrophobicContact CB-CG2 4.1Å; I1117-I1125 HydrophobicContact CD1-CG2 3.7Å; I1117-I1125 HydrophobicContact CG1-CG2 3.54Å; I1117-I1125 HydrophobicContact CG2-CB 4.18Å; I1117-I1125 HydrophobicContact CG2-CD1 4.13Å; I1117-I1125 HydrophobicContact CG2-CG1 3.76Å; I1117-I1125 HydrophobicContact CG2-CG2 3.55Å
1126	E	41.8	Very low	44.9	Very low	29 Å²	29	47.1 Å²	47.1	14%	0.136	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	119.7	165.2	-144.8	178.1	-127.6	0	0	110.3	W919 I1118 L1128 L1141	W919-E1126 HydrophobicContact CE3-CB 3.82Å; W919-E1126 HydrophobicContact CE3-CG 3.81Å; W919-E1126 HydrophobicContact CZ3-CB 3.61Å; W919-E1126 HydrophobicContact CZ3-CG 3.95Å; I1118-E1126 PolarHBondContact N-O 3Å; I1118-E1126 PolarHBondContact O-N 3.26Å; E1126-L1128 PolarHBondContact O-N 3.38Å; E1126-L1141 HydrophobicContact CG-CD2 4.25Å
1127	P	45.1	Very low	44.5	Very low	45 Å²	45	47.7 Å²	47.7	29%	0.292	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	106.3	176.6	29.8	-31.5	0	0	0	111.9	L1115 G1142	L1115-P1127 HydrophobicContact CD1-CB 3.68Å; P1127-G1142 PolarHBondContact O-N 2.85Å
1128	L	45.4	Very low	44.1	Very low	6 Å²	6	48.3 Å²	48.3	3%	0.031	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	115.1	165	-82.2	148.9	0	0	0	109.2	I922 L1116 I1118 E1126 L1139 L1141	I922-L1128 HydrophobicContact CD1-CD1 4.3Å; I922-L1128 HydrophobicContact CD1-CD2 4.09Å; L1116-L1128 HydrophobicContact CB-CB 4.27Å; L1116-L1128 PolarHBondContact N-O 3.37Å; L1116-L1128 WeakPolarHBondContact O-CA 3.42Å; L1116-L1128 WeakPolarHBondContact O-CB 3.5Å; L1116-L1128 PolarHBondContact O-N 3.46Å; L1116-L1128 VanDerWaalsContact O-O 3.09Å; I1118-L1128 HydrophobicContact CD1-CD1 3.4Å; I1118-L1128 VanDerWaalsContact CD1-CD1 3.4Å; I1118-L1128 HydrophobicContact CG1-CD1 3.84Å; E1126-L1128 PolarHBondContact O-N 3.38Å; L1128-L1139 HydrophobicContact CD2-CD2 4.4Å; L1128-L1141 HydrophobicContact CD2-CG 4.28Å
1129	W	49.9	Very low	43.8	Very low	30 Å²	30	50 Å²	50	11%	0.114	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	121.2	173	-64.2	90.6	0	0	0	109.4	Y871 R1113 L1115 T1140	Y871-W1129 HydrophobicContact CD2-CH2 4.22Å; R1113-W1129 HydrophobicContact CB-CE3 4.18Å; R1113-W1129 HydrophobicContact CB-CZ3 4.48Å; L1115-W1129 HydrophobicContact CD1-CD2 3.75Å; L1115-W1129 HydrophobicContact CD1-CE3 3.95Å; L1115-W1129 HydrophobicContact CD1-CG 4.33Å; L1115-W1129 HydrophobicContact CD1-CH2 4.05Å; L1115-W1129 HydrophobicContact CD1-CZ2 3.86Å; L1115-W1129 HydrophobicContact CD1-CZ3 4.09Å; W1129-T1140 WeakPolarHBondContact CB-OG1 3.38Å; W1129-T1140 PolarHBondContact N-O 3.48Å; W1129-T1140 PolarHBondContact O-N 2.63Å; W1129-T1140 PolarHBondContact O-OG1 2.77Å
1130	L	50.1	Low	43.6	Very low	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	102.2	166.1	-82.3	158.2	0	0	0	108.6	F1051 L1089 R1113 S1114 L1116 I1137 L1139	F1051-L1130 HydrophobicContact CD1-CD1 4.11Å; F1051-L1130 HydrophobicContact CE1-CD1 3.65Å; F1051-L1130 HydrophobicContact CE1-CD2 4.44Å; F1051-L1130 HydrophobicContact CZ-CD1 4.17Å; L1089-L1130 HydrophobicContact CD2-CD1 4.3Å; L1089-L1130 HydrophobicContact CD2-CD2 3.61Å; L1089-L1130 HydrophobicContact CD2-CG 4.5Å; R1113-L1130 WeakPolarHBondContact CA-O 3.08Å; S1114-L1130 PolarHBondContact N-O 2.85Å; S1114-L1130 VanDerWaalsContact N-O 3.09Å; S1114-L1130 WeakPolarHBondContact O-CB 3.43Å; S1114-L1130 PolarHBondContact O-N 2.81Å; L1116-L1130 HydrophobicContact CB-CD1 3.96Å; L1116-L1130 HydrophobicContact CD2-CD1 4.41Å; L1130-I1137 HydrophobicContact CD2-CG2 3.9Å; L1130-L1139 HydrophobicContact CD2-CD2 3.5Å; L1130-L1139 VanDerWaalsContact CD2-CD2 3.5Å; L1130-L1139 HydrophobicContact CD2-CG 4.17Å; L1130-L1139 HydrophobicContact CG-CD2 3.84Å
1131	E	46.4	Very low	43.1	Very low	33 Å²	33	51.5 Å²	51.5	15%	0.154	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	115.3	174	-52.7	-162.4	105.2	0	0	109.4	R1113 I1137 G1138 T1140	R1113-E1131 HydrophobicContact CG-CG 4.25Å; R1113-E1131 IonicContact CZ-OE1 2.65Å; R1113-E1131 IonicContact NE-OE1 2.92Å; R1113-E1131 PolarHBondContact NE-OE1 2.76Å; R1113-E1131 IonicContact NH2-OE1 2.72Å; R1113-E1131 PolarHBondContact NH2-OE1 2.89Å; E1131-I1137 CarbonylContact O-C 3.6Å; E1131-I1137 WeakPolarHBondContact O-CA 3.44Å; E1131-G1138 PolarHBondContact N-O 2.87Å; E1131-G1138 PolarHBondContact O-N 3.43Å; E1131-T1140 HydrophobicContact CG-CG2 4.47Å; E1131-T1140 VanDerWaalsContact OE2-CG2 3.26Å; E1131-T1140 WeakPolarHBondContact OE2-CG2 3.24Å
1132	I	44	Very low	42.3	Very low	24 Å²	24	51.1 Å²	51.1	12%	0.123	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	109.5	173.7	-54.3	-179.9	0	0	0	108.5	F1051 F1091 I1112 I1137	F1051-I1132 HydrophobicContact CZ-CD1 4.35Å; F1091-I1132 HydrophobicContact CE1-CD1 4Å; F1091-I1132 HydrophobicContact CE2-CD1 4.41Å; F1091-I1132 HydrophobicContact CZ-CD1 3.9Å; I1112-I1132 HydrophobicContact CB-CB 4.31Å; I1112-I1132 HydrophobicContact CG2-CD1 4.35Å; I1112-I1132 PolarHBondContact O-N 2.97Å; I1132-I1137 HydrophobicContact CG1-CD1 4.36Å; I1132-I1137 HydrophobicContact CG1-CG1 4.26Å; I1132-I1137 HydrophobicContact CG2-CG1 4.42Å
1133	H	39.1	Very low	41.7	Very low	79 Å²	79	57.4 Å²	57.4	37%	0.366	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	163.4	170.3	-56.7	-77	0	0	0	110.5	N1111 G1135 R1136	N1111-H1133 PolarHBondContact OD1-CE1 3.05Å; N1111-H1133 PolarHBondContact OD1-ND1 3.22Å; H1133-G1135 PolarHBondContact O-N 3.32Å; H1133-R1136 PolarHBondContact N-O 2.68Å; H1133-R1136 PolarHBondContact O-N 3.26Å
1134	F	32.3	Very low	41.1	Very low	137 Å²	137	61.5 Å²	61.5	60%	0.601	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	110.6	172.1	-94.9	-93.3	0	0	0	111.6	L1101 R1136	L1101-F1134 HydrophobicContact CB-CE2 4.09Å; L1101-F1134 HydrophobicContact CB-CZ 3.79Å; L1101-F1134 HydrophobicContact CD1-CE2 4.35Å; F1134-R1136 VanDerWaalsContact C-N 3.34Å; F1134-R1136 PolarHBondContact O-N 2.76Å
1135	G	37.4	Very low	40.3	Very low	31 Å²	31	63 Å²	63	32%	0.32	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	8.5	179.5	0	0	0	0	0	116.4	H1133	H1133-G1135 PolarHBondContact O-N 3.32Å
1136	R	42.3	Very low	39.5	Very low	193 Å²	193	64.8 Å²	64.8	73%	0.728	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.1	127	177.6	-66.3	-175.7	-179.6	171.3	1.8	112.4	H1133 F1134	H1133-R1136 PolarHBondContact N-O 2.68Å; H1133-R1136 PolarHBondContact O-N 3.26Å; F1134-R1136 VanDerWaalsContact C-N 3.34Å; F1134-R1136 PolarHBondContact O-N 2.76Å
1137	I	44.2	Very low	38.6	Very low	13 Å²	13	69.8 Å²	69.8	7%	0.067	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	128.8	158.9	-57.6	-170.7	0	0	0	108.1	C940 F986 F1091 L1130 E1131 I1132	C940-I1137 PolarHBondContact SG-O 2.68Å; F986-I1137 HydrophobicContact CB-CD1 3.56Å; F986-I1137 HydrophobicContact CB-CG1 4.33Å; F986-I1137 HydrophobicContact CD1-CD1 3.92Å; F986-I1137 HydrophobicContact CD1-CG1 3.87Å; F986-I1137 HydrophobicContact CD2-CD1 4.15Å; F986-I1137 HydrophobicContact CE1-CG1 4.38Å; F986-I1137 HydrophobicContact CG-CD1 3.62Å; F986-I1137 HydrophobicContact CG-CG1 4.12Å; F1091-I1137 HydrophobicContact CB-CD1 4Å; F1091-I1137 HydrophobicContact CD1-CD1 3.5Å; F1091-I1137 VanDerWaalsContact CD1-CD1 3.5Å; F1091-I1137 HydrophobicContact CE1-CD1 4.24Å; F1091-I1137 HydrophobicContact CG-CD1 4.02Å; L1130-I1137 HydrophobicContact CD2-CG2 3.9Å; E1131-I1137 CarbonylContact O-C 3.6Å; E1131-I1137 WeakPolarHBondContact O-CA 3.44Å; I1132-I1137 HydrophobicContact CG1-CD1 4.36Å; I1132-I1137 HydrophobicContact CG1-CG1 4.26Å; I1132-I1137 HydrophobicContact CG2-CG1 4.42Å
1138	G	42.2	Very low	37.6	Very low	24 Å²	24	75.8 Å²	75.8	25%	0.247	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	140.1	173.2	0	0	0	0	0	111	E1131	E1131-G1138 PolarHBondContact N-O 2.87Å; E1131-G1138 PolarHBondContact O-N 3.43Å
1139	L	45.7	Very low	36.5	Very low	54 Å²	54	82 Å²	82	28%	0.283	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	111.9	162.9	-77.9	168	0	0	0	108	C988 F990 L1089 L1128 L1130	C988-L1139 HydrophobicContact CB-CD1 4.31Å; F990-L1139 HydrophobicContact CD1-CD1 4.47Å; L1089-L1139 HydrophobicContact CD2-CD2 4.49Å; L1128-L1139 HydrophobicContact CD2-CD2 4.4Å; L1130-L1139 HydrophobicContact CD2-CD2 3.5Å; L1130-L1139 VanDerWaalsContact CD2-CD2 3.5Å; L1130-L1139 HydrophobicContact CD2-CG 4.17Å; L1130-L1139 HydrophobicContact CG-CD2 3.84Å
1140	T	44.5	Very low	35.3	Very low	52 Å²	52	89.1 Å²	89.1	32%	0.319	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.1	174.1	48.9	0	0	0	0	110.8	W1129 E1131 G1142	W1129-T1140 WeakPolarHBondContact CB-OG1 3.38Å; W1129-T1140 PolarHBondContact N-O 3.48Å; W1129-T1140 PolarHBondContact O-N 2.63Å; W1129-T1140 PolarHBondContact O-OG1 2.77Å; E1131-T1140 HydrophobicContact CG-CG2 4.47Å; E1131-T1140 VanDerWaalsContact OE2-CG2 3.26Å; E1131-T1140 WeakPolarHBondContact OE2-CG2 3.24Å; T1140-G1142 PolarHBondContact O-N 2.8Å
1141	L	40.7	Very low	34	Very low	81 Å²	81	93.4 Å²	93.4	42%	0.424	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	129.6	163.8	-92.7	149.4	0	0	0	109.3	I922 E1126 L1128 K1143	I922-L1141 HydrophobicContact CB-CD1 4.34Å; I922-L1141 HydrophobicContact CD1-CD1 4.28Å; E1126-L1141 HydrophobicContact CG-CD2 4.25Å; L1128-L1141 HydrophobicContact CD2-CG 4.28Å; L1141-K1143 VanDerWaalsContact C-N 3.27Å; L1141-K1143 PolarHBondContact O-N 2.68Å
1142	G	33.8	Very low	32.9	Very low	49 Å²	49	101.7 Å²	101.7	51%	0.505	55%	0.545	S	S	.	.			trans	-66.9	79.7	176.5	0	0	0	0	0	112.5	P1127 T1140	P1127-G1142 PolarHBondContact O-N 2.85Å; T1140-G1142 PolarHBondContact O-N 2.8Å
1143	K	31.2	Very low	32	Very low	171 Å²	171	107.9 Å²	107.9	74%	0.743	58%	0.578	S	S	*	*			trans	-106.7	112.5	-179	-171.8	170.1	-173.2	172.9	0	111.7	L1141 S1145	L1141-K1143 VanDerWaalsContact C-N 3.27Å; L1141-K1143 PolarHBondContact O-N 2.68Å; K1143-S1145 PolarHBondContact O-N 3.14Å; K1143-S1145 VanDerWaalsContact O-N 3.11Å
1144	L	24.2	Very low	31.2	Very low	112 Å²	112	110.2 Å²	110.2	59%	0.586	60%	0.598	S	S	*	*			trans	-66.1	107.3	171	-155.9	75.4	0	0	0	108.8	T1146	L1144-T1146 PolarHBondContact O-N 2.81Å
1145	S	24.9	Very low	30.8	Very low	78 Å²	78	113 Å²	113	55%	0.545	61%	0.609	S	S	.	*			trans	-88.6	102.9	-174.5	64.4	0	0	0	0	111.5	K1143	K1143-S1145 PolarHBondContact O-N 3.14Å; K1143-S1145 VanDerWaalsContact O-N 3.11Å
1146	T	23.5	Very low	30.1	Very low	120 Å²	120	116.4 Å²	116.4	74%	0.736	63%	0.629	S	S	*	*			trans	-55.3	141.4	164.8	44.7	0	0	0	0	111.1	L1144 K1148	L1144-T1146 PolarHBondContact O-N 2.81Å; T1146-K1148 PolarHBondContact O-N 2.79Å; T1146-K1148 VanDerWaalsContact O-N 3.15Å
1147	T	23.5	Very low	29.3	Very low	134 Å²	134	115 Å²	115	82%	0.822	63%	0.634	S	S	*	*	S	Bend	trans	-81.1	95.3	-161.4	36.6	0	0	0	0	113.6
1148	K	23.4	Very low	28.3	Very low	170 Å²	170	119.2 Å²	119.2	74%	0.739	66%	0.664	S	S	*	*			trans	-157.5	79.1	164.8	-116.5	160	-171.9	172.5	0	114.3	T1146	T1146-K1148 PolarHBondContact O-N 2.79Å; T1146-K1148 VanDerWaalsContact O-N 3.15Å
1149	T	23.4	Very low	27.4	Very low	137 Å²	137	122.5 Å²	122.5	84%	0.84	69%	0.689	S	S	*	*			trans	-158.4	48.7	158.1	0.7	0	0	0	0	114.6
1150	I	23.5	Very low	26.4	Very low	180 Å²	180	129.2 Å²	129.2	92%	0.923	72%	0.717	S	S	*	*			trans	-110.7	74.5	161.7	-55	-179	0	0	0	108.3
1151	S	23.4	Very low	25.4	Very low	89 Å²	89	133.8 Å²	133.8	62%	0.622	74%	0.744	S	S	*	*			trans	-156.6	36	-178.2	52.8	0	0	0	0	112.9
1152	K	23.3	Very low	24.5	Very low	208 Å²	208	135.2 Å²	135.2	90%	0.904	76%	0.761	S	S	*	*	S	Bend	trans	-149.7	42.2	173.6	-125.9	168.7	-170.8	175.2	0	115.6
1153	L	24.9	Very low	23.9	Very low	154 Å²	154	142 Å²	142	81%	0.806	78%	0.777	S	S	*	*	S	Bend	trans	-119.8	25.1	158.2	-155.3	73.6	0	0	0	111.8
1154	T	23.5	Very low	23.5	Very low	128 Å²	128	143.8 Å²	143.8	79%	0.785	78%	0.784	S	S	*	*			trans	-113	44.6	-174.6	-15.6	0	0	0	0	111.4
1155	K	23.6	Very low	23.4	Very low	194 Å²	194	146.5 Å²	146.5	84%	0.843	79%	0.794	S	S	*	*	S	Bend	trans	-155.1	42.3	171.3	-121	173	-173.4	-177.7	0	113.9
1156	S	23.2	Very low	23.3	Very low	104 Å²	104	149.1 Å²	149.1	73%	0.727	80%	0.802	S	S	*	*	S	Bend	trans	-133.2	19.2	169.7	-59.2	0	0	0	0	113.4
1157	I	24.7	Very low	23.2	Very low	163 Å²	163	150.9 Å²	150.9	84%	0.836	81%	0.807	S	S	*	*	S	Bend	trans	-125.6	48.5	176.7	-45.4	178.6	0	0	0	109
1158	S	23.6	Very low	23.3	Very low	101 Å²	101	149.4 Å²	149.4	71%	0.706	80%	0.8	S	S	*	*	S	Bend	trans	-146.2	41.1	176.2	66.2	0	0	0	0	110.8
1159	A	22.9	Very low	23.2	Very low	94 Å²	94	146.1 Å²	146.1	78%	0.777	80%	0.798	S	S	*	*	S	Bend	trans	-151	19.7	176.8	0	0	0	0	0	112.1
1160	F	24.5	Very low	23.2	Very low	195 Å²	195	147.9 Å²	147.9	86%	0.855	80%	0.797	S	S	*	*	S	Bend	trans	-132.9	23.4	-175.5	-150.4	-98.6	0	0	0	112.5
1161	V	23	Very low	23.2	Very low	147 Å²	147	146.4 Å²	146.4	89%	0.891	79%	0.789	S	S	*	*			trans	-135.7	75.3	177.2	-175.3	0	0	0	0	108.3
1162	S	22.3	Very low	23.2	Very low	112 Å²	112	151.4 Å²	151.4	78%	0.783	80%	0.799	S	S	*	*	S	Bend	trans	-173.7	43.6	167.9	59.3	0	0	0	0	113
1163	K	21.6	Very low	23.3	Very low	192 Å²	192	149.1 Å²	149.1	84%	0.835	79%	0.792	S	S	*	*			trans	-174.1	102.3	157.8	-113.7	-179.3	-178.8	-170.1	0	111.9
1164	F	22.3	Very low	23.2	Very low	207 Å²	207	146.4 Å²	146.4	91%	0.908	79%	0.786	S	S	*	*				-177.5	103.2	119.1	-102	-67	0	0	0	108.1
1165	E	21.6	Very low	23.3	Very low	169 Å²	169	147.6 Å²	147.6	79%	0.79	79%	0.786	S	S	*	*			trans	-147.1	130.3	-179.6	-167.8	173.4	-131.1	0	0	106.5
1166	N	22.9	Very low	23.3	Very low	133 Å²	133	141.7 Å²	141.7	71%	0.711	77%	0.769	S	S	*	*			trans	65.5	142.7	-176.5	-47.2	-40.3	0	0	0	114.6
1167	D	22.6	Very low	23.4	Very low	158 Å²	158	138.9 Å²	138.9	85%	0.845	75%	0.748	S	S	*	*			cis	-133.1	161.1	25	-95.6	-40.9	0	0	0	115.2
1168	P	24.7	Very low	23.5	Very low	102 Å²	102	133.5 Å²	133.5	66%	0.662	72%	0.721	S	S	*	*			trans	-98.4	-178.8	172.2	39.6	-35.4	0	0	0	114.5
1169	S	21.3	Very low	23.7	Very low	102 Å²	102	129.9 Å²	129.9	71%	0.713	69%	0.693	S	S	*	*			trans	76.3	145.2	178.6	83.9	0	0	0	0	115.4
1170	H	24	Very low	24.1	Very low	174 Å²	174	127.1 Å²	127.1	81%	0.806	67%	0.665	S	S	*	*			cis	-143.1	148.8	24.6	-107.7	-77	0	0	0	113.7
1171	I	22.9	Very low	24.2	Very low	149 Å²	149	120.5 Å²	120.5	76%	0.764	64%	0.639	S	S	*	*			trans	-88.5	136.9	169.5	-62	168.4	0	0	0	110.7
1172	K	23.5	Very low	24.5	Very low	193 Å²	193	118.8 Å²	118.8	84%	0.839	62%	0.617	S	S	*	*			trans	-145.6	135.1	157.5	-80.5	-165	175.1	-180	0	112.2
1173	H	25.4	Very low	24.8	Very low	161 Å²	161	116 Å²	116	75%	0.745	59%	0.593	S	S	*	*			trans	-78.6	148.8	176.1	-60.8	-102.5	0	0	0	112.7
1174	S	22.5	Very low	25.1	Very low	97 Å²	97	116.7 Å²	116.7	68%	0.678	59%	0.59	S	S	*	*			trans	-164.8	113.9	140.3	63.8	0	0	0	0	114
1175	I	26	Very low	25.4	Very low	153 Å²	153	113.3 Å²	113.3	79%	0.785	58%	0.581	S	S	*	*			trans	60.6	96.3	144.3	-48.3	167.8	0	0	0	117.1
1176	S	24.4	Very low	25.7	Very low	69 Å²	69	111 Å²	111	48%	0.483	58%	0.579	S	S	.	*			trans	-134.2	164.1	161.1	49.9	0	0	0	0	109.8	N1178	S1176-N1178 PolarHBondContact O-N 2.62Å
1177	P	25.3	Very low	25.8	Very low	45 Å²	45	109.8 Å²	109.8	29%	0.292	58%	0.578	S	S	.	*			trans	-75.1	123.8	175.3	-8.1	24.8	0	0	0	110.4	I1259 L1475	P1177-I1259 HydrophobicContact CB-CD1 4.01Å; P1177-I1259 HydrophobicContact CG-CD1 4.18Å; P1177-I1259 WeakPolarHBondContact O-CD1 3.02Å; P1177-L1475 HydrophobicContact CB-CD2 4.35Å; P1177-L1475 HydrophobicContact CG-CD1 4.31Å; P1177-L1475 HydrophobicContact CG-CD2 4.01Å
1178	N	26.1	Very low	25.9	Very low	50 Å²	50	108.2 Å²	108.2	27%	0.267	58%	0.576	S	S	.	*			trans	-105.8	135.4	178.9	-66.7	-29.5	0	0	0	111.8	S1176 D1180 T1223	S1176-N1178 PolarHBondContact O-N 2.62Å; N1178-D1180 VanDerWaalsContact CB-OD1 3.23Å; N1178-D1180 WeakPolarHBondContact CB-OD1 3.32Å; N1178-T1223 WeakPolarHBondContact ND2-CG2 2.99Å
1179	I	28.6	Very low	25.9	Very low	25 Å²	25	108.7 Å²	108.7	13%	0.128	58%	0.583	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.8	113.9	147.1	-62.4	168.1	0	0	0	104.4	R1309	I1179-R1309 PolarHBondContact O-NH1 2.94Å; I1179-R1309 PolarHBondContact O-NH2 2.9Å
1180	D	30.1	Very low	26.1	Very low	36 Å²	36	109.8 Å²	109.8	19%	0.193	59%	0.59	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-85	132.7	-179.1	-66.5	-35	0	0	0	109.4	N1178 Y1182 Q1468	N1178-D1180 VanDerWaalsContact CB-OD1 3.23Å; N1178-D1180 WeakPolarHBondContact CB-OD1 3.32Å; D1180-Y1182 HydrophobicContact CB-CD2 4.21Å; D1180-Y1182 HydrophobicContact CB-CE2 3.48Å; D1180-Y1182 VanDerWaalsContact CB-CE2 3.48Å; D1180-Q1468 PolarHBondContact N-O 2.86Å; D1180-Q1468 PolarHBondContact O-N 2.82Å
1181	L	27.3	Very low	26.2	Very low	56 Å²	56	106.2 Å²	106.2	29%	0.293	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.1	106.2	-178.8	-97.1	148.5	0	0	0	108.5	F1254 I1465 L1467	L1181-F1254 HydrophobicContact CD1-CE1 3.7Å; L1181-F1254 HydrophobicContact CD1-CZ 3.58Å; L1181-I1465 HydrophobicContact CD2-CG2 3.31Å; L1181-L1467 HydrophobicContact CD2-CD2 3.7Å; L1181-L1467 HydrophobicContact CG-CD2 4.34Å
1182	Y	29.1	Very low	26.3	Very low	111 Å²	111	104.4 Å²	104.4	44%	0.435	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.1	103.5	-180	-64.1	-79.4	0	0	0	109.6	D1180 S1466	D1180-Y1182 HydrophobicContact CB-CD2 4.21Å; D1180-Y1182 HydrophobicContact CB-CE2 3.48Å; D1180-Y1182 VanDerWaalsContact CB-CE2 3.48Å; Y1182-S1466 PolarHBondContact N-O 2.86Å; Y1182-S1466 PolarHBondContact O-N 2.96Å; Y1182-S1466 PolarHBondContact O-OG 3.4Å
1183	I	28.2	Very low	26.4	Very low	54 Å²	54	101.2 Å²	101.2	28%	0.277	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.9	123.5	163	-59.6	-173	0	0	0	107.5	I1227 P1463	I1183-I1227 HydrophobicContact CD1-CD1 3.64Å; I1183-I1227 HydrophobicContact CD1-CG2 4.48Å; I1183-I1227 HydrophobicContact CG1-CD1 4.4Å; I1183-P1463 HydrophobicContact CG2-CB 4.35Å; I1183-P1463 HydrophobicContact CG2-CG 4.23Å
1184	R	28.2	Very low	26.5	Very low	206 Å²	206	97.1 Å²	97.1	78%	0.777	59%	0.588	S	S	*	*			trans	-106.8	100.7	-179.4	-160.1	179.9	-160.9	-169.5	5.4	109.5
1185	N	29.2	Very low	26.9	Very low	136 Å²	136	97.6 Å²	97.6	73%	0.727	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-54.9	146.9	175.1	-74	4.3	0	0	0	111.2
1186	V	27.2	Very low	26.9	Very low	122 Å²	122	94.6 Å²	94.6	74%	0.739	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-54.2	138.5	-179	-177.7	0	0	0	0	110
1187	P	25.4	Very low	27.1	Very low	107 Å²	107	97 Å²	97	70%	0.695	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-57.1	132.6	175.7	-22.7	33.2	0	0	0	110.6	S1189	P1187-S1189 PolarHBondContact O-N 3.21Å
1188	P	24.2	Very low	27.1	Very low	124 Å²	124	98.8 Å²	98.8	81%	0.805	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-61	128.6	176.4	25.7	-33.6	0	0	0	109.2	S1190	P1188-S1190 PolarHBondContact O-N 3.36Å
1189	S	24.2	Very low	27.1	Very low	113 Å²	113	100.4 Å²	100.4	79%	0.79	63%	0.63	S	S	*	*			trans	-70.3	90.6	-176.7	39.3	0	0	0	0	110.8	P1187 S1191	P1187-S1189 PolarHBondContact O-N 3.21Å; S1189-S1191 PolarHBondContact O-N 3.13Å
1190	S	26.5	Very low	27.2	Very low	124 Å²	124	105 Å²	105	87%	0.867	66%	0.664	S	S	*	*			trans	-69.2	75.8	171.4	62	0	0	0	0	110.7	P1188	P1188-S1190 PolarHBondContact O-N 3.36Å
1191	S	25.4	Very low	26.9	Very low	100 Å²	100	107.2 Å²	107.2	70%	0.699	68%	0.683	S	S	*	*			trans	-77.8	142.6	170.3	58.9	0	0	0	0	110.7	S1189	S1189-S1191 PolarHBondContact O-N 3.13Å
1192	S	26	Very low	26.8	Very low	110 Å²	110	108.8 Å²	108.8	77%	0.769	70%	0.698	S	S	*	*			trans	170.5	141.1	136.9	41.3	0	0	0	0	111.7
1193	S	25.7	Very low	26.6	Very low	127 Å²	127	108.1 Å²	108.1	89%	0.888	71%	0.71	S	S	*	*			trans	58.1	131.8	169.1	66.3	0	0	0	0	117.6
1194	G	26.1	Very low	26.4	Very low	74 Å²	74	112 Å²	112	76%	0.763	73%	0.73	S	S	*	*			cis	-165.5	172.3	-7.5	0	0	0	0	0	108.4
1195	S	30.9	Very low	26.2	Very low	108 Å²	108	107.8 Å²	107.8	76%	0.755	72%	0.722	S	S	*	*			cis	-161.2	157.4	10.9	49.1	0	0	0	0	110.3
1196	S	26.3	Very low	26	Very low	90 Å²	90	104.6 Å²	104.6	63%	0.629	72%	0.722	S	S	*	*			trans	35.2	124.3	151.4	59.7	0	0	0	0	119.8	S1198	S1196-S1198 VanDerWaalsContact CA-OG 3.32Å; S1196-S1198 WeakPolarHBondContact CA-OG 3.45Å; S1196-S1198 VanDerWaalsContact CB-OG 3.22Å; S1196-S1198 WeakPolarHBondContact CB-OG 3.14Å
1197	S	29.1	Very low	25.8	Very low	118 Å²	118	107.2 Å²	107.2	83%	0.825	72%	0.724	S	S	*	*	S	Bend	cis	-97	139.2	20.5	41.6	0	0	0	0	114.3
1198	S	26.3	Very low	25.7	Very low	83 Å²	83	105.9 Å²	105.9	58%	0.58	72%	0.717	S	S	*	*			cis	62.3	142.5	-3.9	102.2	0	0	0	0	117.6	S1196	S1196-S1198 VanDerWaalsContact CA-OG 3.32Å; S1196-S1198 WeakPolarHBondContact CA-OG 3.45Å; S1196-S1198 VanDerWaalsContact CB-OG 3.22Å; S1196-S1198 WeakPolarHBondContact CB-OG 3.14Å
1199	S	25.5	Very low	25.7	Very low	85 Å²	85	105.3 Å²	105.3	59%	0.594	71%	0.711	S	S	*	*			cis	-179	126.5	-13	40.5	0	0	0	0	110.2
1200	S	30.1	Very low	25.7	Very low	120 Å²	120	107.6 Å²	107.6	84%	0.839	71%	0.713	S	S	*	*			trans	-159.6	92.1	157.7	51.4	0	0	0	0	109.2
1201	S	25.1	Very low	25.6	Very low	84 Å²	84	109.4 Å²	109.4	59%	0.587	71%	0.706	S	S	*	*			cis	64.5	147.1	16.9	115.1	0	0	0	0	112.2
1202	S	25	Very low	25.5	Very low	88 Å²	88	111.4 Å²	111.4	62%	0.615	71%	0.709	S	S	*	*			cis	-173.5	145	5.3	31.9	0	0	0	0	112.7
1203	S	24	Very low	25.5	Very low	97 Å²	97	112.1 Å²	112.1	68%	0.678	70%	0.704	S	S	*	*			trans	69.6	-170.4	134.2	79.5	0	0	0	0	115.7
1204	I	24.5	Very low	25.4	Very low	136 Å²	136	110 Å²	110	70%	0.697	68%	0.682	S	S	*	*			cis	-144.3	154.6	17.6	-142.7	156.3	0	0	0	113.4
1205	N	23.7	Very low	25.3	Very low	117 Å²	117	113.9 Å²	113.9	63%	0.626	68%	0.684	S	S	*	*			trans	14.1	140.4	156.6	-54	-8.9	0	0	0	119.8	F1207	N1205-F1207 HydrophobicContact CB-CD2 4.05Å; N1205-F1207 HydrophobicContact CB-CE2 4.28Å
1206	G	25	Very low	24.8	Very low	69 Å²	69	112.9 Å²	112.9	71%	0.711	68%	0.677	S	S	*	*			cis	99	179.4	14.5	0	0	0	0	0	113.5
1207	F	22.1	Very low	24.6	Very low	178 Å²	178	113.6 Å²	113.6	78%	0.781	68%	0.682	S	S	*	*			trans	72.8	149.9	-179	-65.9	-101.2	0	0	0	117.5	N1205	N1205-F1207 HydrophobicContact CB-CD2 4.05Å; N1205-F1207 HydrophobicContact CB-CE2 4.28Å
1208	S	23.7	Very low	24.3	Very low	78 Å²	78	114 Å²	114	55%	0.545	67%	0.674	S	S	.	*			cis	-176.5	169.9	-28.1	59.2	0	0	0	0	111.7
1209	T	24.2	Very low	24.1	Very low	113 Å²	113	119.5 Å²	119.5	69%	0.693	69%	0.687	S	S	*	*			trans	65.7	149.6	156.3	49.1	0	0	0	0	117.1
1210	L	25.1	Very low	23.9	Very low	160 Å²	160	120 Å²	120	84%	0.838	68%	0.682	S	S	*	*			cis	-118	152	14.7	-60.6	147.2	0	0	0	109.7
1211	K	22.9	Very low	23.5	Very low	162 Å²	162	121.8 Å²	121.8	70%	0.704	68%	0.683	S	S	*	*			cis	79.2	85.3	25	-157.4	-159.3	173.1	-173.7	0	116
1212	D	24.2	Very low	23.5	Very low	143 Å²	143	124.5 Å²	124.5	77%	0.765	69%	0.686	S	S	*	*				-175	123.8	116.1	-92.8	-18.4	0	0	0	111.2
1213	N	26	Very low	23.5	Very low	124 Å²	124	123.1 Å²	123.1	66%	0.663	67%	0.674	S	S	*	*			trans	-161	84.7	157.8	-133.6	-13.7	0	0	0	112.4
1214	L	23.6	Very low	23.7	Very low	82 Å²	82	123.9 Å²	123.9	43%	0.429	67%	0.67	S	S	.	*			trans	53.7	166.6	150	-82.1	165.9	0	0	0	123.2	E2346 A2347 E2348	L1214-E2346 HydrophobicContact CD1-CB 4.17Å; L1214-E2346 HydrophobicContact CD1-CG 4.34Å; L1214-E2346 HydrophobicContact CD2-CG 4.11Å; L1214-E2346 HydrophobicContact CG-CG 4.33Å; L1214-A2347 VanDerWaalsContact CD1-N 3.34Å; L1214-E2348 HydrophobicContact CD1-CB 4.27Å
1215	I	23.6	Very low	23.9	Very low	157 Å²	157	122 Å²	122	81%	0.805	66%	0.655	S	S	*	*			trans	-131.1	127.2	-170.7	-62.8	169.3	0	0	0	109.7
1216	S	21.9	Very low	24.3	Very low	87 Å²	87	119.8 Å²	119.8	61%	0.608	64%	0.643	S	S	*	*			trans	-141.8	133.8	148.9	63.6	0	0	0	0	108.3
1217	S	22	Very low	24.9	Very low	104 Å²	104	118.3 Å²	118.3	73%	0.727	62%	0.618	S	S	*	*			cis	81.3	43	35.3	91.2	0	0	0	0	115.3
1218	L	21.1	Very low	25.7	Very low	127 Å²	127	115.2 Å²	115.2	67%	0.665	61%	0.61	S	S	*	*			trans	-131.7	119.2	168.6	-76.2	164	0	0	0	106.6	I1220	L1218-I1220 HydrophobicContact CB-CD1 4.16Å; L1218-I1220 HydrophobicContact CB-CG1 4.02Å; L1218-I1220 HydrophobicContact CD1-CD1 4.33Å; L1218-I1220 HydrophobicContact CD2-CD1 4.23Å; L1218-I1220 HydrophobicContact CD2-CG1 3.78Å; L1218-I1220 HydrophobicContact CG-CD1 4.47Å; L1218-I1220 HydrophobicContact CG-CG1 4.37Å
1219	K	22.1	Very low	26.5	Very low	198 Å²	198	113.3 Å²	113.3	86%	0.861	59%	0.593	S	S	*	*			cis	63.7	55	10.9	-137.8	-168.4	-174.2	-163.3	0	114.6
1220	I	22.4	Very low	27.1	Very low	96 Å²	96	113.5 Å²	113.5	49%	0.492	59%	0.59	S	S	.	*			trans	-119.7	120.4	165.7	-60.6	163.9	0	0	0	107.7	L1218 Q1222	L1218-I1220 HydrophobicContact CB-CD1 4.16Å; L1218-I1220 HydrophobicContact CB-CG1 4.02Å; L1218-I1220 HydrophobicContact CD1-CD1 4.33Å; L1218-I1220 HydrophobicContact CD2-CD1 4.23Å; L1218-I1220 HydrophobicContact CD2-CG1 3.78Å; L1218-I1220 HydrophobicContact CG-CD1 4.47Å; L1218-I1220 HydrophobicContact CG-CG1 4.37Å; I1220-Q1222 HydrophobicContact CG2-CB 3.81Å; I1220-Q1222 HydrophobicContact CG2-CG 3.59Å; I1220-Q1222 PolarHBondContact O-N 3.29Å
1221	D	21.6	Very low	27.9	Very low	158 Å²	158	106.5 Å²	106.5	85%	0.845	55%	0.553	S	S	*	*			trans	-76.1	95.4	164.5	-57.2	-65.6	0	0	0	107.5
1222	Q	24.1	Very low	28.6	Very low	141 Å²	141	102 Å²	102	66%	0.659	54%	0.539	S	S	*	.			trans	-116.6	112.3	-176.2	-120.4	171.9	7.8	0	0	111.3	I1220 L1224	I1220-Q1222 HydrophobicContact CG2-CB 3.81Å; I1220-Q1222 HydrophobicContact CG2-CG 3.59Å; I1220-Q1222 PolarHBondContact O-N 3.29Å; Q1222-L1224 PolarHBondContact O-N 2.95Å; Q1222-L1224 VanDerWaalsContact O-N 3.16Å
1223	T	25.8	Very low	29.1	Very low	58 Å²	58	99.9 Å²	99.9	36%	0.356	54%	0.535	S	S	.	.			trans	-79.5	94.5	176.4	55.5	0	0	0	0	108.7	N1178 Y1225	N1178-T1223 WeakPolarHBondContact ND2-CG2 2.99Å; T1223-Y1225 WeakPolarHBondContact O-CD2 3.29Å
1224	L	28.2	Very low	29.6	Very low	114 Å²	114	98.5 Å²	98.5	60%	0.597	53%	0.527	S	S	*	.			trans	-68.9	137.8	-179.1	-68.5	160.5	0	0	0	110.9	Q1222 I1227	Q1222-L1224 PolarHBondContact O-N 2.95Å; Q1222-L1224 VanDerWaalsContact O-N 3.16Å; L1224-I1227 HydrophobicContact CB-CD1 4.31Å; L1224-I1227 HydrophobicContact CB-CG1 4.35Å; L1224-I1227 HydrophobicContact CD1-CD1 4.05Å
1225	Y	28.9	Very low	30.2	Very low	97 Å²	97	98 Å²	98	38%	0.38	52%	0.522	S	S	.	.	S	Bend	trans	-111.5	-22.5	-176.7	-89.7	-81.7	0	0	0	114.6	T1223	T1223-Y1225 WeakPolarHBondContact O-CD2 3.29Å
1226	D	31.3	Very low	30.5	Very low	69 Å²	69	98.1 Å²	98.1	37%	0.369	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	144.6	173.8	-71.6	-90.8	0	0	0	107.6	K1251	D1226-K1251 IonicContact OD1-NZ 2.83Å; D1226-K1251 PolarHBondContact OD1-NZ 3.28Å
1227	I	38.5	Very low	31	Very low	39 Å²	39	99.5 Å²	99.5	20%	0.2	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	116.2	173.7	-58	-179.8	0	0	0	109.2	I1183 L1224 L1229 F1252	I1183-I1227 HydrophobicContact CD1-CD1 3.64Å; I1183-I1227 HydrophobicContact CD1-CG2 4.48Å; I1183-I1227 HydrophobicContact CG1-CD1 4.4Å; L1224-I1227 HydrophobicContact CB-CD1 4.31Å; L1224-I1227 HydrophobicContact CB-CG1 4.35Å; L1224-I1227 HydrophobicContact CD1-CD1 4.05Å; I1227-L1229 HydrophobicContact CG2-CD2 3.84Å; I1227-L1229 HydrophobicContact CG2-CG 4.25Å; I1227-F1252 PolarHBondContact N-O 3.05Å; I1227-F1252 PolarHBondContact O-N 2.8Å
1228	D	37.8	Very low	31.5	Very low	113 Å²	113	103.4 Å²	103.4	60%	0.604	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.1	163.5	-64.4	-48.1	0	0	0	108.6	K1251	D1228-K1251 WeakPolarHBondContact OD1-CB 3.25Å; D1228-K1251 WeakPolarHBondContact OD1-CD 3.32Å; D1228-K1251 VanDerWaalsContact OD1-CG 3.27Å; D1228-K1251 WeakPolarHBondContact OD1-CG 3.16Å
1229	L	40.2	Very low	32.1	Very low	38 Å²	38	102.1 Å²	102.1	20%	0.199	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	101.3	175.5	-71.8	-176	0	0	0	110.4	I1227 F1231 L1250 F1252 L1462 P1463	I1227-L1229 HydrophobicContact CG2-CD2 3.84Å; I1227-L1229 HydrophobicContact CG2-CG 4.25Å; L1229-F1231 WeakPolarHBondContact O-CD2 3.36Å; L1229-F1231 WeakPolarHBondContact O-CE2 3.45Å; L1229-F1231 PolarHBondContact O-N 3.46Å; L1229-L1250 PolarHBondContact N-O 3.46Å; L1229-F1252 HydrophobicContact CD1-CD2 4.23Å; L1229-F1252 HydrophobicContact CD1-CE2 3.66Å; L1229-F1252 HydrophobicContact CD1-CZ 4.26Å; L1229-F1252 HydrophobicContact CG-CD2 4.31Å; L1229-F1252 HydrophobicContact CG-CE2 4.15Å; L1229-L1462 HydrophobicContact CD1-CD2 3.63Å; L1229-P1463 HydrophobicContact CD1-CG 4.31Å
1230	D	37	Very low	32.7	Very low	116 Å²	116	98.3 Å²	98.3	62%	0.62	52%	0.524	S	S	*	.			trans	-74.7	113.3	169.7	-174.3	-20.5	0	0	0	110.4	T1232	D1230-T1232 PolarHBondContact O-N 2.96Å; D1230-T1232 VanDerWaalsContact OD1-CB 3.23Å; D1230-T1232 WeakPolarHBondContact OD1-CB 3.38Å; D1230-T1232 WeakPolarHBondContact OD1-CG2 3.38Å; D1230-T1232 PolarHBondContact OD1-N 2.93Å; D1230-T1232 PolarHBondContact OD1-OG1 3.09Å; D1230-T1232 PolarHBondContact OD2-OG1 3.34Å
1231	F	43.6	Very low	33.2	Very low	14 Å²	14	97.3 Å²	97.3	6%	0.061	52%	0.517	C	S	.	.	G	3₁₀ helix	trans	-76.9	0.1	-178	-67.8	-79.8	0	0	0	114.5	L1229 S1233 L1234 F1235 L1248 L1250 I1460 L1462	L1229-F1231 WeakPolarHBondContact O-CD2 3.36Å; L1229-F1231 WeakPolarHBondContact O-CE2 3.45Å; L1229-F1231 PolarHBondContact O-N 3.46Å; F1231-S1233 PolarHBondContact O-N 3.05Å; F1231-L1234 HydrophobicContact CD1-CD1 3.93Å; F1231-L1234 HydrophobicContact CE1-CD1 4.49Å; F1231-L1234 PolarHBondContact O-N 2.95Å; F1231-F1235 HydrophobicContact CB-CD2 4.36Å; F1231-F1235 HydrophobicContact CB-CE2 3.91Å; F1231-L1248 HydrophobicContact CD2-CD2 4.16Å; F1231-L1248 HydrophobicContact CE2-CD2 4.22Å; F1231-L1250 HydrophobicContact CE2-CB 4.1Å; F1231-L1250 HydrophobicContact CE2-CD1 4.17Å; F1231-L1250 HydrophobicContact CE2-CG 4.43Å; F1231-L1250 HydrophobicContact CZ-CB 4.32Å; F1231-L1250 HydrophobicContact CZ-CD1 3.86Å; F1231-I1460 HydrophobicContact CD1-CG2 4.12Å; F1231-I1460 HydrophobicContact CE1-CG2 3.59Å; F1231-I1460 HydrophobicContact CZ-CG2 4.29Å; F1231-L1462 HydrophobicContact CE1-CD2 4.06Å; F1231-L1462 HydrophobicContact CZ-CD2 4.02Å
1232	T	35.9	Very low	33.9	Very low	66 Å²	66	98.7 Å²	98.7	41%	0.405	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-52.3	-25.7	177.6	45.1	0	0	0	0	114.3	D1230	D1230-T1232 PolarHBondContact O-N 2.96Å; D1230-T1232 VanDerWaalsContact OD1-CB 3.23Å; D1230-T1232 WeakPolarHBondContact OD1-CB 3.38Å; D1230-T1232 WeakPolarHBondContact OD1-CG2 3.38Å; D1230-T1232 PolarHBondContact OD1-N 2.93Å; D1230-T1232 PolarHBondContact OD1-OG1 3.09Å; D1230-T1232 PolarHBondContact OD2-OG1 3.34Å
1233	S	35.8	Very low	34.5	Very low	99 Å²	99	100.4 Å²	100.4	69%	0.692	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-78.3	-12.8	178.5	62.7	0	0	0	0	115.6	F1231	F1231-S1233 PolarHBondContact O-N 3.05Å
1234	L	36.3	Very low	35.1	Very low	95 Å²	95	101.1 Å²	101.1	50%	0.497	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-20	-175.3	-81.3	160	0	0	0	114.3	F1231	F1231-L1234 HydrophobicContact CD1-CD1 3.93Å; F1231-L1234 HydrophobicContact CE1-CD1 4.49Å; F1231-L1234 PolarHBondContact O-N 2.95Å
1235	F	34.9	Very low	35.4	Very low	71 Å²	71	100.3 Å²	100.3	31%	0.311	52%	0.518	S	S	.	.			trans	-107	84.2	-172.2	-62.1	-59.5	0	0	0	113.4	F1231 N1237 H1241 L1458 I1460	F1231-F1235 HydrophobicContact CB-CD2 4.36Å; F1231-F1235 HydrophobicContact CB-CE2 3.91Å; F1235-N1237 VanDerWaalsContact C-N 3.33Å; F1235-N1237 PolarHBondContact O-N 2.92Å; F1235-H1241 WeakPolarHBondContact CB-NE2 3.47Å; F1235-H1241 PolarHBondContact O-CE1 3.42Å; F1235-H1241 PolarHBondContact O-NE2 2.95Å; F1235-L1458 HydrophobicContact CD1-CD2 4.17Å; F1235-L1458 HydrophobicContact CE1-CD2 3.63Å; F1235-I1460 HydrophobicContact CZ-CD1 4.4Å; F1235-I1460 HydrophobicContact CZ-CG1 4.36Å
1236	N	30.1	Very low	36.1	Very low	161 Å²	161	103.5 Å²	103.5	86%	0.861	54%	0.536	S	S	*	.			trans	-82.8	16.7	-167.7	-116.7	-23.9	0	0	0	116.5
1237	N	34.2	Very low	36.9	Very low	116 Å²	116	102.1 Å²	102.1	62%	0.62	53%	0.529	S	S	*	.			trans	-132.6	116.1	-171	-130.6	-19	0	0	0	114	F1235 A1239 H1241	F1235-N1237 VanDerWaalsContact C-N 3.33Å; F1235-N1237 PolarHBondContact O-N 2.92Å; N1237-A1239 VanDerWaalsContact C-N 3.3Å; N1237-A1239 PolarHBondContact O-N 2.93Å; N1237-H1241 PolarHBondContact O-CD2 2.83Å
1238	K	31	Very low	37.3	Very low	186 Å²	186	101.4 Å²	101.4	81%	0.809	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	2.1	-159.2	-71.7	-175.6	173	-177.5	0	117.6
1239	A	33.5	Very low	38.1	Very low	99 Å²	99	98.2 Å²	98.2	82%	0.818	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-20.5	-170.5	0	0	0	0	0	115.3	N1237	N1237-A1239 VanDerWaalsContact C-N 3.3Å; N1237-A1239 PolarHBondContact O-N 2.93Å
1240	I	34.9	Very low	38.5	Very low	119 Å²	119	96.5 Å²	96.5	61%	0.61	50%	0.502	S	S	*	.	S	Bend	trans	-111.6	13	-176.7	-46.8	-179.2	0	0	0	110.6	Q1242 I1244	I1240-Q1242 PolarHBondContact O-N 3.23Å; I1240-Q1242 VanDerWaalsContact O-N 3.11Å; I1240-I1244 HydrophobicContact CG2-CD1 3.63Å; I1240-I1244 HydrophobicContact CG2-CG1 4.2Å
1241	H	32.7	Very low	39.5	Very low	74 Å²	74	92.9 Å²	92.9	34%	0.343	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	16.6	-155.8	-111.2	-126.9	0	0	0	117	F1235 N1237 H1245	F1235-H1241 WeakPolarHBondContact CB-NE2 3.47Å; F1235-H1241 PolarHBondContact O-CE1 3.42Å; F1235-H1241 PolarHBondContact O-NE2 2.95Å; N1237-H1241 PolarHBondContact O-CD2 2.83Å; H1241-H1245 VanDerWaalsContact C-CD2 3.42Å; H1241-H1245 AromaticContact CE1-NE2 3.39Å; H1241-H1245 PolarHBondContact CE1-NE2 2.88Å; H1241-H1245 AromaticContact ND1-NE2 3.68Å; H1241-H1245 PolarHBondContact O-CD2 3.29Å; H1241-H1245 VanDerWaalsContact O-CD2 3.24Å
1242	Q	36.2	Very low	39.7	Very low	188 Å²	188	92.8 Å²	92.8	88%	0.879	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.6	-11.2	-178.5	-78.3	-170.9	-23.1	0	0	117	I1240	I1240-Q1242 PolarHBondContact O-N 3.23Å; I1240-Q1242 VanDerWaalsContact O-N 3.11Å
1243	K	36.7	Very low	40.3	Very low	176 Å²	176	92.9 Å²	92.9	77%	0.765	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-52.3	172.1	-94.7	-171.4	170.1	-173.5	0	113.1	H1245	K1243-H1245 PolarHBondContact O-N 3.46Å; K1243-H1245 VanDerWaalsContact O-N 3.09Å
1244	I	39.8	Very low	40.8	Very low	73 Å²	73	90 Å²	90	37%	0.374	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-65.4	-19.8	-176.3	-54.7	-178.1	0	0	0	112.5	I1240 Q1246 D1247 L1248	I1240-I1244 HydrophobicContact CG2-CD1 3.63Å; I1240-I1244 HydrophobicContact CG2-CG1 4.2Å; I1244-Q1246 PolarHBondContact O-N 2.85Å; I1244-Q1246 VanDerWaalsContact O-N 3.14Å; I1244-D1247 PolarHBondContact O-N 2.79Å; I1244-L1248 HydrophobicContact CG2-CB 4.45Å
1245	H	34.7	Very low	41.4	Very low	97 Å²	97	89 Å²	89	45%	0.449	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-64.3	-14.9	-175.4	-87	-105.7	0	0	0	116.4	H1241 K1243	H1241-H1245 VanDerWaalsContact C-CD2 3.42Å; H1241-H1245 AromaticContact CE1-NE2 3.39Å; H1241-H1245 PolarHBondContact CE1-NE2 2.88Å; H1241-H1245 AromaticContact ND1-NE2 3.68Å; H1241-H1245 PolarHBondContact O-CD2 3.29Å; H1241-H1245 VanDerWaalsContact O-CD2 3.24Å; K1243-H1245 PolarHBondContact O-N 3.46Å; K1243-H1245 VanDerWaalsContact O-N 3.09Å
1246	Q	42	Very low	41.8	Very low	165 Å²	165	88.9 Å²	88.9	77%	0.771	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-109.6	-2.6	174.4	-67.7	-173.8	-31.1	0	0	112.9	I1244	I1244-Q1246 PolarHBondContact O-N 2.85Å; I1244-Q1246 VanDerWaalsContact O-N 3.14Å
1247	D	48.1	Very low	42.1	Very low	40 Å²	40	87.7 Å²	87.7	21%	0.214	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	0.9	-162.1	-64.6	-13.8	0	0	0	113.4	I1244 G1317 Q1318 V1319	I1244-D1247 PolarHBondContact O-N 2.79Å; D1247-G1317 CarbonylContact O-C 3.58Å; D1247-G1317 WeakPolarHBondContact O-CA 3.03Å; D1247-Q1318 HydrophobicContact CB-CB 4.04Å; D1247-Q1318 PolarHBondContact O-N 3.41Å; D1247-Q1318 PolarHBondContact OD1-NE2 2.98Å; D1247-V1319 HydrophobicContact CB-CG2 4.04Å; D1247-V1319 PolarHBondContact O-N 3.21Å
1248	L	47.2	Very low	42	Very low	24 Å²	24	88.1 Å²	88.1	13%	0.126	44%	0.444	C	S	.	.			trans	-148	90.2	-173	-152.9	157	0	0	0	112.2	F1231 I1244 L1321 P1433 I1460	F1231-L1248 HydrophobicContact CD2-CD2 4.16Å; F1231-L1248 HydrophobicContact CE2-CD2 4.22Å; I1244-L1248 HydrophobicContact CG2-CB 4.45Å; L1248-L1321 HydrophobicContact CD1-CD2 4.04Å; L1248-L1321 HydrophobicContact CD2-CD2 4.26Å; L1248-L1321 HydrophobicContact CG-CD2 4.11Å; L1248-P1433 HydrophobicContact CD1-CG 4.13Å; L1248-I1460 HydrophobicContact CD1-CD1 4.13Å; L1248-I1460 HydrophobicContact CD2-CD1 3.9Å
1249	S	54.3	Low	42	Very low	45 Å²	45	83.1 Å²	83.1	32%	0.315	43%	0.426	S	S	.	.			trans	-135.6	145.8	177.1	53.9	0	0	0	0	111.3	N1315 T1316 G1317	S1249-N1315 PolarHBondContact O-OD1 2.85Å; S1249-T1316 WeakPolarHBondContact CB-OG1 3.47Å; S1249-T1316 PolarHBondContact O-N 2.81Å; S1249-T1316 PolarHBondContact O-OG1 3.32Å; S1249-T1316 VanDerWaalsContact OG-C 3.3Å; S1249-T1316 PolarHBondContact OG-OG1 3.28Å; S1249-G1317 PolarHBondContact O-N 3.13Å; S1249-G1317 PolarHBondContact OG-N 3.03Å
1250	L	50.1	Low	42.1	Very low	2 Å²	2	81 Å²	81	1%	0.01	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	122.1	-178.5	-84	163	0	0	0	110.1	L1229 F1231 F1252 N1315 L1321 L1431	L1229-L1250 PolarHBondContact N-O 3.46Å; F1231-L1250 HydrophobicContact CE2-CB 4.1Å; F1231-L1250 HydrophobicContact CE2-CD1 4.17Å; F1231-L1250 HydrophobicContact CE2-CG 4.43Å; F1231-L1250 HydrophobicContact CZ-CB 4.32Å; F1231-L1250 HydrophobicContact CZ-CD1 3.86Å; L1250-F1252 HydrophobicContact CB-CE2 4.19Å; L1250-N1315 HydrophobicContact CD2-CB 4.35Å; L1250-L1321 HydrophobicContact CD1-CD1 3.83Å; L1250-L1321 HydrophobicContact CD2-CD1 4.07Å; L1250-L1321 HydrophobicContact CG-CD1 3.93Å; L1250-L1431 HydrophobicContact CD1-CD1 4.32Å; L1250-L1431 HydrophobicContact CD1-CD2 3.87Å
1251	K	56.9	Low	42.2	Very low	40 Å²	40	81.8 Å²	81.8	17%	0.174	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.6	175.1	178.3	166.6	-167.3	-82.2	0	110.5	D1226 D1228 E1253 L1314 T1316	D1226-K1251 IonicContact OD1-NZ 2.83Å; D1226-K1251 PolarHBondContact OD1-NZ 3.28Å; D1228-K1251 WeakPolarHBondContact OD1-CB 3.25Å; D1228-K1251 WeakPolarHBondContact OD1-CD 3.32Å; D1228-K1251 VanDerWaalsContact OD1-CG 3.27Å; D1228-K1251 WeakPolarHBondContact OD1-CG 3.16Å; K1251-E1253 IonicContact NZ-OE2 3.37Å; K1251-E1253 PolarHBondContact NZ-OE2 2.9Å; K1251-L1314 HydrophobicContact CB-CB 4.37Å; K1251-L1314 PolarHBondContact N-O 3.41Å; K1251-L1314 PolarHBondContact O-N 2.79Å; K1251-T1316 HydrophobicContact CB-CG2 4.18Å
1252	F	48	Very low	42.4	Very low	12 Å²	12	85 Å²	85	5%	0.053	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	116.2	174.9	-69.4	-105.4	0	0	0	109.8	I1227 L1229 L1250 L1311 V1312 L1313 I1429 L1462 I1465	I1227-F1252 PolarHBondContact N-O 3.05Å; I1227-F1252 PolarHBondContact O-N 2.8Å; L1229-F1252 HydrophobicContact CD1-CD2 4.23Å; L1229-F1252 HydrophobicContact CD1-CE2 3.66Å; L1229-F1252 HydrophobicContact CD1-CZ 4.26Å; L1229-F1252 HydrophobicContact CG-CD2 4.31Å; L1229-F1252 HydrophobicContact CG-CE2 4.15Å; L1250-F1252 HydrophobicContact CB-CE2 4.19Å; F1252-L1311 HydrophobicContact CB-CD1 4.2Å; F1252-L1311 HydrophobicContact CD1-CD1 3.88Å; F1252-L1311 HydrophobicContact CD1-CD2 4.27Å; F1252-L1311 HydrophobicContact CD1-CG 4.47Å; F1252-V1312 WeakPolarHBondContact CA-O 3.46Å; F1252-L1313 HydrophobicContact CD1-CD1 3.98Å; F1252-L1313 HydrophobicContact CD1-CG 4.12Å; F1252-L1313 HydrophobicContact CE1-CD1 3.64Å; F1252-L1313 HydrophobicContact CE1-CD2 4.08Å; F1252-L1313 HydrophobicContact CE1-CG 3.62Å; F1252-L1313 HydrophobicContact CZ-CD1 4.45Å; F1252-L1313 HydrophobicContact CZ-CD2 4.12Å; F1252-L1313 HydrophobicContact CZ-CG 3.95Å; F1252-I1429 HydrophobicContact CE1-CD1 4.28Å; F1252-L1462 HydrophobicContact CZ-CD1 4.13Å; F1252-L1462 HydrophobicContact CZ-CD2 4.25Å; F1252-I1465 HydrophobicContact CE1-CD1 4.48Å
1253	E	49.8	Very low	42.2	Very low	69 Å²	69	77.5 Å²	77.5	32%	0.322	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	139.9	-175.1	-179.3	163	172.9	0	0	111.8	K1251 V1312	K1251-E1253 IonicContact NZ-OE2 3.37Å; K1251-E1253 PolarHBondContact NZ-OE2 2.9Å; E1253-V1312 HydrophobicContact CB-CB 4.33Å; E1253-V1312 PolarHBondContact N-O 3.46Å; E1253-V1312 WeakPolarHBondContact O-CB 3.38Å; E1253-V1312 PolarHBondContact O-N 3.24Å
1254	F	46.1	Very low	42	Very low	39 Å²	39	76.1 Å²	76.1	17%	0.171	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	109.3	-177.2	-67.2	-85.1	0	0	0	111.5	L1181 E1256 L1311	L1181-F1254 HydrophobicContact CD1-CE1 3.7Å; L1181-F1254 HydrophobicContact CD1-CZ 3.58Å; F1254-E1256 PolarHBondContact O-N 3.19Å; F1254-L1311 HydrophobicContact CD1-CB 4.41Å; F1254-L1311 HydrophobicContact CD1-CD1 4.17Å; F1254-L1311 HydrophobicContact CE1-CB 4.03Å; F1254-L1311 HydrophobicContact CE1-CD1 3.56Å; F1254-L1311 HydrophobicContact CE1-CG 4.32Å; F1254-L1311 HydrophobicContact CE2-CD1 4.08Å; F1254-L1311 HydrophobicContact CZ-CD1 3.51Å
1255	T	47.2	Very low	41.5	Very low	73 Å²	73	75.9 Å²	75.9	45%	0.448	40%	0.404	S	S	.	.			trans	-79.9	-13.8	-170.2	42.5	0	0	0	0	114.9	R1310 V1312	T1255-R1310 VanDerWaalsContact OG1-CB 3.28Å; T1255-R1310 WeakPolarHBondContact OG1-CB 3.47Å; T1255-V1312 HydrophobicContact CG2-CG2 3.67Å
1256	E	43.7	Very low	41.1	Very low	68 Å²	68	76.6 Å²	76.6	32%	0.318	42%	0.417	S	S	.	.			trans	-109.3	89	-178.2	-70.7	175.8	159.2	0	0	111.8	F1254 T1258 R1309 R1310	F1254-E1256 PolarHBondContact O-N 3.19Å; E1256-T1258 VanDerWaalsContact C-N 3.31Å; E1256-T1258 PolarHBondContact O-N 2.68Å; E1256-R1309 WeakPolarHBondContact OE2-CA 2.99Å; E1256-R1310 PolarHBondContact OE2-N 3.44Å
1257	K	37.9	Very low	40.3	Very low	136 Å²	136	77.3 Å²	77.3	59%	0.591	42%	0.418	S	S	*	.			trans	-78	-6.6	-177.9	-69.3	175.9	179.5	168.7	0	114.7
1258	T	31	Very low	39.5	Very low	125 Å²	125	80.9 Å²	80.9	77%	0.767	44%	0.441	S	S	*	.	S	Bend	trans	-141.3	128	-178.4	52.1	0	0	0	0	112.4	E1256	E1256-T1258 VanDerWaalsContact C-N 3.31Å; E1256-T1258 PolarHBondContact O-N 2.68Å
1259	I	32.3	Very low	38.4	Very low	82 Å²	82	86.3 Å²	86.3	42%	0.421	46%	0.464	S	S	.	.			trans	-66.6	146.8	165	-65.8	173.2	0	0	0	109.1	P1177 L1307	P1177-I1259 HydrophobicContact CB-CD1 4.01Å; P1177-I1259 HydrophobicContact CG-CD1 4.18Å; P1177-I1259 WeakPolarHBondContact O-CD1 3.02Å; I1259-L1307 HydrophobicContact CD1-CD2 4.12Å; I1259-L1307 HydrophobicContact CG1-CD2 4.42Å; I1259-L1307 HydrophobicContact CG2-CD2 4.18Å
1260	G	35.6	Very low	37.1	Very low	53 Å²	53	89.5 Å²	89.5	55%	0.546	49%	0.486	S	S	.	.			trans	-55.7	160.1	-173.1	0	0	0	0	0	116	F1262	G1260-F1262 PolarHBondContact O-N 3.15Å
1261	T	36.3	Very low	35.9	Very low	137 Å²	137	97.3 Å²	97.3	84%	0.84	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	9.7	-165	46.9	0	0	0	0	117.8
1262	F	35.5	Very low	34.4	Very low	141 Å²	141	102.3 Å²	102.3	62%	0.618	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-6.6	-175.4	-75.7	-86.5	0	0	0	115.2	G1260	G1260-F1262 PolarHBondContact O-N 3.15Å
1263	C	33.4	Very low	33.4	Very low	30 Å²	30	109.3 Å²	109.3	20%	0.203	59%	0.593	C	S	.	*			trans	-137.2	53	176	-72.3	0	0	0	0	114.6	C1479	C1263-C1479 WeakPolarHBondContact CB-SG 3.46Å; C1263-C1479 VanDerWaalsContact SG-CA 3.56Å; C1263-C1479 WeakPolarHBondContact SG-CB 3.44Å; C1263-C1479 CovalentContact SG-SG 2.05Å; C1263-C1479 PolarHBondContact SG-SG 3.48Å
1264	E	31.4	Very low	32.2	Very low	147 Å²	147	113.6 Å²	113.6	69%	0.687	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-79.9	125.8	158.4	-90.8	-158	117.3	0	0	110.6
1265	P	29.1	Very low	31.2	Very low	68 Å²	68	117.5 Å²	117.5	44%	0.442	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-75.4	149	168.9	31.6	-33.7	0	0	0	111.2	K1267	P1265-K1267 PolarHBondContact O-N 2.98Å
1266	P	27.4	Very low	30.1	Very low	112 Å²	112	118.8 Å²	118.8	73%	0.727	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-68.8	119.7	-176.9	27.4	-34.3	0	0	0	112.1	T1268	P1266-T1268 PolarHBondContact O-N 3.31Å
1267	K	25.9	Very low	29.5	Very low	181 Å²	181	120.3 Å²	120.3	79%	0.787	67%	0.674	S	S	*	*			trans	-67.2	100.2	174.3	-67	178.8	-177.9	171.1	0	110.9	P1265	P1265-K1267 PolarHBondContact O-N 2.98Å
1268	T	29.8	Very low	28.8	Very low	115 Å²	115	121.6 Å²	121.6	71%	0.706	68%	0.68	S	S	*	*			trans	-135.7	118.1	173.5	46.9	0	0	0	0	112.7	P1266 S1270	P1266-T1268 PolarHBondContact O-N 3.31Å; T1268-S1270 PolarHBondContact O-N 2.93Å
1269	K	25.5	Very low	28.4	Very low	138 Å²	138	122.8 Å²	122.8	60%	0.6	68%	0.677	S	S	*	*			trans	-73	97.4	164.7	-76.6	169	172.8	157.1	0	110.4	D1749 E1750	K1269-D1749 IonicContact NZ-OD2 2.67Å; K1269-D1749 PolarHBondContact NZ-OD2 3.26Å; K1269-E1750 WeakPolarHBondContact CE-OE2 3.48Å; K1269-E1750 IonicContact NZ-OE2 3.41Å; K1269-E1750 PolarHBondContact NZ-OE2 3.07Å
1270	S	26.8	Very low	28	Very low	111 Å²	111	122.6 Å²	122.6	78%	0.776	68%	0.683	S	S	*	*			trans	178.8	97.9	144.6	55.6	0	0	0	0	109.7	T1268	T1268-S1270 PolarHBondContact O-N 2.93Å
1271	I	24.4	Very low	27.5	Very low	167 Å²	167	128.2 Å²	128.2	86%	0.856	69%	0.692	S	S	*	*			trans	-88.5	127.1	162.8	-66.4	172.5	0	0	0	106.8
1272	D	26.3	Very low	27.1	Very low	145 Å²	145	128.6 Å²	128.6	78%	0.775	68%	0.684	S	S	*	*			trans	-160.3	156.4	144	-106.9	-33.9	0	0	0	110.3
1273	N	26.1	Very low	26.5	Very low	158 Å²	158	130.7 Å²	130.7	85%	0.845	69%	0.688	S	S	*	*			trans	70.1	77.7	-179.1	-54.1	-53.3	0	0	0	117.3
1274	L	24.1	Very low	26	Very low	159 Å²	159	136.7 Å²	136.7	83%	0.832	71%	0.711	S	S	*	*			trans	-96.3	150.5	138	-143.7	80.6	0	0	0	107.5
1275	P	25.6	Very low	25.6	Very low	122 Å²	122	136.6 Å²	136.6	79%	0.792	71%	0.71	S	S	*	*				-148	175.7	87.6	37.7	-19.1	0	0	0	116.2
1276	S	24	Very low	25.3	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	72%	0.715	S	S	*	*			trans	-89.6	-160.5	174	60.9	0	0	0	0	110.6
1277	P	30.4	Very low	25	Very low	100 Å²	100	136.4 Å²	136.4	65%	0.649	71%	0.713	S	S	*	*			cis	-136	-143.3	5.2	36	-9.1	0	0	0	112.6
1278	F	23	Very low	25	Very low	163 Å²	163	135.7 Å²	135.7	72%	0.715	72%	0.718	S	S	*	*			cis	-166.3	149.8	5.5	-131.2	-2.6	0	0	0	112
1279	Q	23.8	Very low	24.6	Very low	151 Å²	151	134.9 Å²	134.9	71%	0.706	72%	0.717	S	S	*	*			trans	60.8	154.4	140.4	-72.6	179.3	22.5	0	0	122
1280	S	24.7	Very low	24.5	Very low	77 Å²	77	134.9 Å²	134.9	54%	0.538	72%	0.724	S	S	.	*			cis	-173.7	174.1	-14	57.7	0	0	0	0	112.7
1281	K	23.3	Very low	24.4	Very low	171 Å²	171	138 Å²	138	74%	0.743	73%	0.725	S	S	*	*			trans	75.1	148	161.1	-61.3	168	-177.8	170.7	0	115.9
1282	H	28.1	Very low	24.4	Very low	146 Å²	146	139.3 Å²	139.3	68%	0.676	73%	0.725	S	S	*	*			cis	-171.5	172	-3.2	-107.1	-1.7	0	0	0	109.1
1283	R	22.8	Very low	24.3	Very low	184 Å²	184	136.3 Å²	136.3	69%	0.694	72%	0.721	S	S	*	*			cis	172.6	129.6	-20	168.4	-171.8	-169.8	-153.1	7.8	110.7
1284	K	23	Very low	24.2	Very low	157 Å²	157	136 Å²	136	68%	0.683	72%	0.719	S	S	*	*			trans	66.7	160.8	171.2	-69.5	173.9	160.6	-115.6	0	114.7
1285	Q	24.1	Very low	24.3	Very low	145 Å²	145	136.4 Å²	136.4	68%	0.678	72%	0.72	S	S	*	*			cis	-171.5	172.1	-12.5	-107	-174	-113.4	0	0	107.1
1286	S	21.9	Very low	24.4	Very low	79 Å²	79	138.4 Å²	138.4	55%	0.552	72%	0.724	S	S	*	*			cis	-174	174.4	-26.5	50.5	0	0	0	0	110
1287	S	22	Very low	24.6	Very low	96 Å²	96	140.3 Å²	140.3	67%	0.671	73%	0.727	S	S	*	*			trans	54.4	114.4	157	54.8	0	0	0	0	119.8
1288	D	25.7	Very low	24.4	Very low	166 Å²	166	144.1 Å²	144.1	89%	0.888	74%	0.735	S	S	*	*				-166.6	-174.8	109.5	-93.9	-8.7	0	0	0	111
1289	S	22.1	Very low	24.8	Very low	99 Å²	99	143.3 Å²	143.3	69%	0.692	73%	0.734	S	S	*	*			trans	-111.4	161.2	-153	58.5	0	0	0	0	117.1
1290	N	23.1	Very low	25.1	Very low	138 Å²	138	139.2 Å²	139.2	74%	0.738	73%	0.732	S	S	*	*			trans	56.8	98.7	154.9	-60.2	-4	0	0	0	119.7
1291	H	23	Very low	25.5	Very low	176 Å²	176	143 Å²	143	82%	0.815	75%	0.745	S	S	*	*				177.4	-179.9	123.5	-95.6	-52	0	0	0	111
1292	F	24.4	Very low	26	Very low	194 Å²	194	139.3 Å²	139.3	85%	0.851	73%	0.734	S	S	*	*			trans	70.4	119.4	-178	-56	-79.5	0	0	0	113.6
1293	A	24.4	Very low	26.5	Very low	83 Å²	83	137 Å²	137	69%	0.686	73%	0.73	S	S	*	*			cis	61.6	121.1	11.3	0	0	0	0	0	115.2
1294	D	25.6	Very low	27.3	Very low	152 Å²	152	133.8 Å²	133.8	81%	0.813	73%	0.731	S	S	*	*			trans	56.9	115.4	-173.5	-61.6	-24.7	0	0	0	117
1295	I	26	Very low	27.9	Very low	166 Å²	166	129.1 Å²	129.1	85%	0.851	71%	0.713	S	S	*	*				-167.9	90	122.4	-88	146.8	0	0	0	105.5
1296	D	27	Very low	29	Very low	164 Å²	164	124.9 Å²	124.9	88%	0.877	70%	0.699	S	S	*	*			trans	-127.9	68.4	168.7	-140	-11.3	0	0	0	107.9
1297	N	27.6	Very low	30.3	Very low	140 Å²	140	123 Å²	123	75%	0.749	68%	0.683	S	S	*	*			trans	-161.8	149.3	171.6	-107.2	-52.1	0	0	0	111.1
1298	H	27.9	Very low	31.9	Very low	179 Å²	179	123.5 Å²	123.5	83%	0.829	67%	0.67	S	S	*	*			trans	68.2	58.5	-179.7	-53.2	-49.7	0	0	0	118.6
1299	Q	31.3	Very low	33.5	Very low	146 Å²	146	118.3 Å²	118.3	68%	0.682	64%	0.638	S	S	*	*			trans	-128.9	80.6	147.1	-73.7	-156.8	20.2	0	0	112.3
1300	G	29.7	Very low	35.4	Very low	65 Å²	65	117.8 Å²	117.8	67%	0.67	62%	0.621	S	S	*	*			trans	-70.1	157.9	164.5	0	0	0	0	0	112	L1302	G1300-L1302 VanDerWaalsContact C-N 3.26Å; G1300-L1302 PolarHBondContact O-N 3.45Å
1301	L	32.9	Very low	37.5	Very low	156 Å²	156	111.6 Å²	111.6	82%	0.817	59%	0.588	S	S	*	*	S	Bend	trans	71.4	-20.6	168.7	-120.5	147.3	0	0	0	118.2
1302	L	34	Very low	39.6	Very low	94 Å²	94	103.4 Å²	103.4	49%	0.492	55%	0.55	S	S	.	*	S	Bend	trans	-94.3	-15.2	175.6	-82.1	168	0	0	0	115.1	G1300 T1304 L1305	G1300-L1302 VanDerWaalsContact C-N 3.26Å; G1300-L1302 PolarHBondContact O-N 3.45Å; L1302-T1304 PolarHBondContact O-N 2.9Å; L1302-T1304 VanDerWaalsContact O-N 3.08Å; L1302-L1305 PolarHBondContact O-N 3.49Å
1303	T	38.1	Very low	41.8	Very low	97 Å²	97	94.1 Å²	94.1	60%	0.595	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-4.3	-175.6	48.3	0	0	0	0	115.5	L1305	T1303-L1305 VanDerWaalsContact C-N 3.34Å
1304	T	39.7	Very low	44	Very low	117 Å²	117	92.2 Å²	92.2	72%	0.718	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-7.6	-179.8	52	0	0	0	0	114.1	L1302	L1302-T1304 PolarHBondContact O-N 2.9Å; L1302-T1304 VanDerWaalsContact O-N 3.08Å
1305	L	35.8	Very low	46.5	Very low	59 Å²	59	85 Å²	85	31%	0.309	45%	0.449	S	S	.	.			trans	-101.4	81.3	178.1	-68.7	167.3	0	0	0	111.2	L1302 T1303 P1416 F1418 L1483	L1302-L1305 PolarHBondContact O-N 3.49Å; T1303-L1305 VanDerWaalsContact C-N 3.34Å; L1305-P1416 WeakPolarHBondContact O-CD 3.41Å; L1305-F1418 HydrophobicContact CD1-CZ 4.4Å; L1305-L1483 HydrophobicContact CD1-CD1 3.67Å; L1305-L1483 HydrophobicContact CD1-CD2 3.65Å; L1305-L1483 HydrophobicContact CD1-CG 4.32Å; L1305-L1483 HydrophobicContact CD2-CD2 3.61Å; L1305-L1483 HydrophobicContact CG-CD2 4.19Å
1306	S	46.5	Very low	48.5	Very low	56 Å²	56	80.3 Å²	80.3	39%	0.392	43%	0.428	S	S	.	.			trans	-103.5	129.8	165.5	57.1	0	0	0	0	110.7	R1308	S1306-R1308 PolarHBondContact O-N 3.09Å
1307	L	50.4	Low	50.4	Low	40 Å²	40	72.6 Å²	72.6	21%	0.209	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	94.3	169.5	-81.9	162.2	0	0	0	108.4	I1259 H1414 F1471	I1259-L1307 HydrophobicContact CD1-CD2 4.12Å; I1259-L1307 HydrophobicContact CG1-CD2 4.42Å; I1259-L1307 HydrophobicContact CG2-CD2 4.18Å; L1307-H1414 HydrophobicContact CB-CB 4.23Å; L1307-H1414 PolarHBondContact N-O 2.72Å; L1307-H1414 PolarHBondContact O-N 2.84Å; L1307-F1471 HydrophobicContact CD1-CE1 3.81Å; L1307-F1471 HydrophobicContact CD1-CZ 3.69Å
1308	R	54.6	Low	52.2	Low	106 Å²	106	72.4 Å²	72.4	40%	0.4	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	140.4	169.6	-163.9	178.5	-147.9	175.8	4.7	109.9	S1306 E1411 L1412	S1306-R1308 PolarHBondContact O-N 3.09Å; R1308-E1411 HydrophobicContact CG-CG 3.99Å; R1308-E1411 WeakPolarHBondContact CG-OE1 3.45Å; R1308-E1411 IonicContact CZ-OE1 2.82Å; R1308-E1411 IonicContact CZ-OE2 3.6Å; R1308-E1411 IonicContact NE-OE1 2.8Å; R1308-E1411 PolarHBondContact NE-OE1 2.76Å; R1308-E1411 IonicContact NE-OE2 2.74Å; R1308-E1411 PolarHBondContact NE-OE2 2.03Å; R1308-E1411 IonicContact NH2-OE1 3.68Å; R1308-E1411 PolarHBondContact NH2-OE1 3.33Å; R1308-E1411 IonicContact NH2-OE2 3.68Å; R1308-E1411 PolarHBondContact NH2-OE2 3.03Å; R1308-L1412 CarbonylContact C-O 3.53Å
1309	R	59.5	Low	53.8	Low	58 Å²	58	65 Å²	65	22%	0.219	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	138.5	152.9	-84.2	-167	172.9	-179.4	1.9	109.3	I1179 E1256 L1412	I1179-R1309 PolarHBondContact O-NH1 2.94Å; I1179-R1309 PolarHBondContact O-NH2 2.9Å; E1256-R1309 WeakPolarHBondContact OE2-CA 2.99Å; R1309-L1412 PolarHBondContact N-O 2.65Å; R1309-L1412 PolarHBondContact O-N 3.16Å
1310	R	62.2	Low	55.7	Low	88 Å²	88	59.8 Å²	59.8	33%	0.332	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.2	170.9	-72.4	171.7	163.6	-169	-8	110.4	T1255 E1256 I1409	T1255-R1310 VanDerWaalsContact OG1-CB 3.28Å; T1255-R1310 WeakPolarHBondContact OG1-CB 3.47Å; E1256-R1310 PolarHBondContact OE2-N 3.44Å; R1310-I1409 HydrophobicContact CB-CG2 3.98Å; R1310-I1409 HydrophobicContact CG-CG2 3.97Å
1311	L	66.4	Low	57.7	Low	8 Å²	8	56.7 Å²	56.7	4%	0.042	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.3	170.1	168.3	65.5	0	0	0	108.3	F1252 F1254 L1313 I1409 I1410	F1252-L1311 HydrophobicContact CB-CD1 4.2Å; F1252-L1311 HydrophobicContact CD1-CD1 3.88Å; F1252-L1311 HydrophobicContact CD1-CD2 4.27Å; F1252-L1311 HydrophobicContact CD1-CG 4.47Å; F1254-L1311 HydrophobicContact CD1-CB 4.41Å; F1254-L1311 HydrophobicContact CD1-CD1 4.17Å; F1254-L1311 HydrophobicContact CE1-CB 4.03Å; F1254-L1311 HydrophobicContact CE1-CD1 3.56Å; F1254-L1311 HydrophobicContact CE1-CG 4.32Å; F1254-L1311 HydrophobicContact CE2-CD1 4.08Å; F1254-L1311 HydrophobicContact CZ-CD1 3.51Å; L1311-L1313 HydrophobicContact CD2-CD1 4.01Å; L1311-L1313 HydrophobicContact CG-CD1 4.08Å; L1311-I1409 CarbonylContact O-C 3.59Å; L1311-I1410 HydrophobicContact CB-CB 4.42Å; L1311-I1410 HydrophobicContact CD2-CD1 4.38Å; L1311-I1410 PolarHBondContact N-O 3.08Å; L1311-I1410 PolarHBondContact O-N 3.47Å
1312	V	68.2	Low	59.6	Low	3 Å²	3	49.3 Å²	49.3	2%	0.018	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.7	175.8	-175.1	0	0	0	0	108.8	F1252 E1253 T1255 Q1407 I1408 I1409	F1252-V1312 WeakPolarHBondContact CA-O 3.46Å; E1253-V1312 HydrophobicContact CB-CB 4.33Å; E1253-V1312 PolarHBondContact N-O 3.46Å; E1253-V1312 WeakPolarHBondContact O-CB 3.38Å; E1253-V1312 PolarHBondContact O-N 3.24Å; T1255-V1312 HydrophobicContact CG2-CG2 3.67Å; V1312-Q1407 HydrophobicContact CG1-CB 3.76Å; V1312-Q1407 HydrophobicContact CG1-CG 4.46Å; V1312-Q1407 VanDerWaalsContact CG1-OE1 3.25Å; V1312-I1408 WeakPolarHBondContact CA-O 3.38Å; V1312-I1409 HydrophobicContact CG2-CG1 4.42Å
1313	L	70.4	Confident	61.5	Low	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	116.4	160.3	-84	73.1	0	0	0	107.6	F1252 L1311 Q1407 I1408 I1410 I1429	F1252-L1313 HydrophobicContact CD1-CD1 3.98Å; F1252-L1313 HydrophobicContact CD1-CG 4.12Å; F1252-L1313 HydrophobicContact CE1-CD1 3.64Å; F1252-L1313 HydrophobicContact CE1-CD2 4.08Å; F1252-L1313 HydrophobicContact CE1-CG 3.62Å; F1252-L1313 HydrophobicContact CZ-CD1 4.45Å; F1252-L1313 HydrophobicContact CZ-CD2 4.12Å; F1252-L1313 HydrophobicContact CZ-CG 3.95Å; L1311-L1313 HydrophobicContact CD2-CD1 4.01Å; L1311-L1313 HydrophobicContact CG-CD1 4.08Å; L1313-Q1407 CarbonylContact O-C 3.26Å; L1313-Q1407 VanDerWaalsContact O-CA 3.23Å; L1313-Q1407 WeakPolarHBondContact O-CA 3.2Å; L1313-I1408 PolarHBondContact N-O 3.06Å; L1313-I1408 PolarHBondContact O-N 3.11Å; L1313-I1410 HydrophobicContact CD1-CD1 3.51Å; L1313-I1410 HydrophobicContact CD1-CG1 4.21Å; L1313-I1429 HydrophobicContact CD1-CD1 4.33Å; L1313-I1429 HydrophobicContact CD2-CD1 4.22Å; L1313-I1429 HydrophobicContact CD2-CG2 4.43Å
1314	L	71	Confident	62.9	Low	43 Å²	43	41.4 Å²	41.4	23%	0.225	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	120.4	172.7	176.5	69	0	0	0	109	K1251 T1316 G1405 Q1407	K1251-L1314 HydrophobicContact CB-CB 4.37Å; K1251-L1314 PolarHBondContact N-O 3.41Å; K1251-L1314 PolarHBondContact O-N 2.79Å; L1314-T1316 HydrophobicContact CD2-CG2 3.66Å; L1314-T1316 HydrophobicContact CG-CG2 3.8Å; L1314-T1316 PolarHBondContact O-N 3.24Å; L1314-G1405 WeakPolarHBondContact CD1-O 3.41Å; L1314-Q1407 HydrophobicContact CD1-CB 4.03Å
1315	N	76.9	Confident	64.3	Low	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	105.1	170.3	-176.6	9.4	0	0	0	108.9	S1249 L1250 G1317 V1319 I1402 G1405 Q1406	S1249-N1315 PolarHBondContact O-OD1 2.85Å; L1250-N1315 HydrophobicContact CD2-CB 4.35Å; N1315-G1317 PolarHBondContact OD1-N 2.83Å; N1315-G1317 VanDerWaalsContact OD1-N 3.16Å; N1315-V1319 PolarHBondContact ND2-O 2.97Å; N1315-I1402 HydrophobicContact CB-CB 4.36Å; N1315-I1402 HydrophobicContact CB-CG2 3.66Å; N1315-I1402 PolarHBondContact ND2-O 3.14Å; N1315-G1405 WeakPolarHBondContact O-CA 3.38Å; N1315-G1405 PolarHBondContact O-N 3.22Å; N1315-Q1406 PolarHBondContact N-O 2.83Å; N1315-Q1406 VanDerWaalsContact N-O 3.11Å
1316	T	68.8	Low	66.2	Low	68 Å²	68	33.4 Å²	33.4	42%	0.417	16%	0.163	S	C	.	.			trans	-94.1	-3.1	178.4	51.3	0	0	0	0	112.8	S1249 K1251 L1314	S1249-T1316 WeakPolarHBondContact CB-OG1 3.47Å; S1249-T1316 PolarHBondContact O-N 2.81Å; S1249-T1316 PolarHBondContact O-OG1 3.32Å; S1249-T1316 VanDerWaalsContact OG-C 3.3Å; S1249-T1316 PolarHBondContact OG-OG1 3.28Å; K1251-T1316 HydrophobicContact CB-CG2 4.18Å; L1314-T1316 HydrophobicContact CD2-CG2 3.66Å; L1314-T1316 HydrophobicContact CG-CG2 3.8Å; L1314-T1316 PolarHBondContact O-N 3.24Å
1317	G	66.5	Low	67.6	Low	2 Å²	2	30.7 Å²	30.7	2%	0.021	15%	0.145	C	C	.	.	S	Bend	trans	-83.6	169.1	174.1	0	0	0	0	0	114	D1247 S1249 N1315 P1404	D1247-G1317 CarbonylContact O-C 3.58Å; D1247-G1317 WeakPolarHBondContact O-CA 3.03Å; S1249-G1317 PolarHBondContact O-N 3.13Å; S1249-G1317 PolarHBondContact OG-N 3.03Å; N1315-G1317 PolarHBondContact OD1-N 2.83Å; N1315-G1317 VanDerWaalsContact OD1-N 3.16Å; G1317-P1404 WeakPolarHBondContact O-CA 3.44Å; G1317-P1404 VanDerWaalsContact O-CB 3.22Å; G1317-P1404 WeakPolarHBondContact O-CB 3.03Å
1318	Q	64.6	Low	68.7	Low	135 Å²	135	28.8 Å²	28.8	63%	0.631	14%	0.135	S	C	*	.	S	Bend	trans	-85	-8.2	176.6	-57.1	-171.2	59.7	0	0	114	D1247 P1404	D1247-Q1318 HydrophobicContact CB-CB 4.04Å; D1247-Q1318 PolarHBondContact O-N 3.41Å; D1247-Q1318 PolarHBondContact OD1-NE2 2.98Å; Q1318-P1404 VanDerWaalsContact C-CG 3.4Å; Q1318-P1404 WeakPolarHBondContact O-CG 3.4Å
1319	V	62.4	Low	69.3	Low	23 Å²	23	24.7 Å²	24.7	14%	0.139	12%	0.121	C	C	.	.	S	Bend	trans	-101.1	137.8	180	171.7	0	0	0	0	111.9	D1247 N1315 P1433 L1435	D1247-V1319 HydrophobicContact CB-CG2 4.04Å; D1247-V1319 PolarHBondContact O-N 3.21Å; N1315-V1319 PolarHBondContact ND2-O 2.97Å; V1319-P1433 HydrophobicContact CG1-CB 3.8Å; V1319-L1435 HydrophobicContact CG1-CD1 4.08Å; V1319-L1435 HydrophobicContact CG2-CD1 4.16Å
1320	T	70.9	Confident	68.9	Low	38 Å²	38	24 Å²	24	23%	0.233	12%	0.123	C	C	.	.			trans	-69.1	133.2	173.3	12.4	0	0	0	0	111.7	I1402 L1403 P1433 T1434	T1320-I1402 WeakPolarHBondContact CA-O 3.47Å; T1320-L1403 HydrophobicContact CG2-CB 4.33Å; T1320-L1403 HydrophobicContact CG2-CD2 3.59Å; T1320-L1403 HydrophobicContact CG2-CG 3.95Å; T1320-P1433 WeakPolarHBondContact O-CA 3.36Å; T1320-T1434 VanDerWaalsContact CB-OG1 3.26Å; T1320-T1434 WeakPolarHBondContact CB-OG1 3.45Å; T1320-T1434 HydrophobicContact CG2-CG2 4.5Å; T1320-T1434 PolarHBondContact O-N 3.43Å; T1320-T1434 PolarHBondContact O-OG1 2.04Å; T1320-T1434 PolarHBondContact OG1-OG1 3.06Å
1321	L	72.9	Confident	68.4	Low	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	135	-177.1	-63.9	174	0	0	0	111.2	L1248 L1250 T1401 I1402 P1433	L1248-L1321 HydrophobicContact CD1-CD2 4.04Å; L1248-L1321 HydrophobicContact CD2-CD2 4.26Å; L1248-L1321 HydrophobicContact CG-CD2 4.11Å; L1250-L1321 HydrophobicContact CD1-CD1 3.83Å; L1250-L1321 HydrophobicContact CD2-CD1 4.07Å; L1250-L1321 HydrophobicContact CG-CD1 3.93Å; L1321-T1401 CarbonylContact O-C 3.53Å; L1321-T1401 WeakPolarHBondContact O-CA 3.02Å; L1321-I1402 PolarHBondContact N-O 2.88Å; L1321-I1402 PolarHBondContact O-N 3.44Å; L1321-P1433 HydrophobicContact CD2-CB 4.48Å; L1321-P1433 HydrophobicContact CD2-CG 4.48Å
1322	S	70.9	Confident	67.1	Low	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	118.8	178.1	-63.2	0	0	0	0	111.1	I1400 L1431 Y1432 T1434	S1322-I1400 CarbonylContact C-O 3.41Å; S1322-L1431 CarbonylContact O-C 3.56Å; S1322-L1431 WeakPolarHBondContact O-CA 3.08Å; S1322-L1431 VanDerWaalsContact O-CB 3.25Å; S1322-L1431 WeakPolarHBondContact O-CB 3.47Å; S1322-Y1432 PolarHBondContact N-O 3.05Å; S1322-Y1432 PolarHBondContact O-N 3.19Å; S1322-T1434 WeakPolarHBondContact OG-CG2 3.4Å
1323	I	75.4	Confident	65.6	Low	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	125.3	166.6	-46.2	-179.5	0	0	0	108.9	M1325 L1326 I1374 I1399 I1400 I1402 I1408 I1429 L1431	I1323-M1325 WeakPolarHBondContact CG2-O 3.35Å; I1323-L1326 HydrophobicContact CG2-CB 4.27Å; I1323-L1326 HydrophobicContact CG2-CD1 4.37Å; I1323-I1374 HydrophobicContact CB-CD1 3.99Å; I1323-I1374 HydrophobicContact CG2-CD1 3.7Å; I1323-I1399 WeakPolarHBondContact O-CA 3.21Å; I1323-I1400 PolarHBondContact N-O 3.23Å; I1323-I1400 PolarHBondContact O-N 3.25Å; I1323-I1402 HydrophobicContact CD1-CD1 3.98Å; I1323-I1402 HydrophobicContact CG1-CD1 3.99Å; I1323-I1402 HydrophobicContact CG1-CG1 4.39Å; I1323-I1408 HydrophobicContact CD1-CD1 3.8Å; I1323-I1429 HydrophobicContact CG2-CG2 4.4Å; I1323-L1431 HydrophobicContact CG1-CD2 4.34Å
1324	F	66.2	Low	63.6	Low	25 Å²	25	38.7 Å²	38.7	11%	0.11	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	-8.4	176.1	73.2	-82.9	0	0	0	113.5	I1399 Q1430 Y1432 L1459	F1324-I1399 HydrophobicContact CB-CG1 4.28Å; F1324-Q1430 HydrophobicContact CD1-CB 4.2Å; F1324-Q1430 WeakPolarHBondContact CD1-O 3.36Å; F1324-Q1430 HydrophobicContact CE1-CB 3.4Å; F1324-Q1430 VanDerWaalsContact CE1-CB 3.4Å; F1324-Q1430 HydrophobicContact CE2-CB 4.11Å; F1324-Q1430 HydrophobicContact CZ-CB 3.34Å; F1324-Q1430 HydrophobicContact CZ-CG 4.19Å; F1324-Q1430 PolarHBondContact N-O 3.13Å; F1324-Y1432 HydrophobicContact CB-CE1 4.23Å; F1324-Y1432 AromaticContact CD1-CD1 3.66Å; F1324-Y1432 HydrophobicContact CD1-CD1 3.66Å; F1324-Y1432 HydrophobicContact CD1-CE1 4.11Å; F1324-Y1432 HydrophobicContact CE1-CD1 4.23Å; F1324-Y1432 HydrophobicContact CG-CD1 4.4Å; F1324-Y1432 HydrophobicContact CG-CE1 4.44Å; F1324-L1459 HydrophobicContact CE1-CD2 3.53Å; F1324-L1459 HydrophobicContact CZ-CD2 3.52Å
1325	M	69.1	Low	61.4	Low	8 Å²	8	48.2 Å²	48.2	4%	0.039	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	129.9	168.4	-173.1	-168.1	-69	0	0	110.6	I1323 Y1358 L1361 P1376 I1428 I1429 Q1430	I1323-M1325 WeakPolarHBondContact CG2-O 3.35Å; M1325-Y1358 HydrophobicContact CE-CD1 4.42Å; M1325-Y1358 HydrophobicContact CE-CE1 3.62Å; M1325-L1361 HydrophobicContact CE-CD1 3.97Å; M1325-L1361 HydrophobicContact SD-CD1 4.34Å; M1325-L1361 HydrophobicContact SD-CD2 4.14Å; M1325-P1376 HydrophobicContact CE-CG 4.22Å; M1325-I1428 HydrophobicContact SD-CG2 3.98Å; M1325-I1429 WeakPolarHBondContact O-CA 3.11Å; M1325-Q1430 HydrophobicContact CB-CB 4.12Å; M1325-Q1430 HydrophobicContact CB-CG 4.17Å; M1325-Q1430 PolarHBondContact O-N 3.46Å; M1325-Q1430 HydrophobicContact SD-CG 4.32Å; M1325-Q1430 PolarHBondContact SD-OE1 2.93Å
1326	L	76.9	Confident	59	Low	0 Å²	0	57 Å²	57	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	102.1	174.2	-161.8	83.7	0	0	0	109	I1323 L1370 I1374 I1410 I1428 I1429	I1323-L1326 HydrophobicContact CG2-CB 4.27Å; I1323-L1326 HydrophobicContact CG2-CD1 4.37Å; L1326-L1370 HydrophobicContact CD2-CD2 4.28Å; L1326-L1370 HydrophobicContact CG-CD2 4.11Å; L1326-I1374 HydrophobicContact CB-CB 3.7Å; L1326-I1374 HydrophobicContact CB-CD1 3.88Å; L1326-I1374 HydrophobicContact CB-CG1 3.85Å; L1326-I1374 PolarHBondContact N-O 3.26Å; L1326-I1374 PolarHBondContact O-N 2.84Å; L1326-I1410 HydrophobicContact CD1-CD1 3.66Å; L1326-I1410 HydrophobicContact CD2-CD1 3.82Å; L1326-I1410 HydrophobicContact CD2-CG1 3.98Å; L1326-I1410 HydrophobicContact CD2-CG2 4.32Å; L1326-I1410 HydrophobicContact CG-CD1 4.28Å; L1326-I1428 WeakPolarHBondContact CA-O 3.26Å; L1326-I1429 HydrophobicContact CD1-CB 4.03Å; L1326-I1429 HydrophobicContact CD1-CD1 3.99Å; L1326-I1429 HydrophobicContact CD1-CG1 3.62Å; L1326-I1429 HydrophobicContact CD1-CG2 3.72Å
1327	S	76.2	Confident	56.9	Low	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	165.1	-166.8	62.1	0	0	0	0	114	L1361 I1428	S1327-L1361 WeakPolarHBondContact OG-CD2 3.41Å; S1327-I1428 PolarHBondContact N-O 3.39Å; S1327-I1428 VanDerWaalsContact N-O 3.17Å; S1327-I1428 PolarHBondContact O-N 3.27Å
1328	L	72.1	Confident	55	Low	0 Å²	0	71.9 Å²	71.9	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	139	174.1	-60.7	171.8	0	0	0	110.8	S1362 L1365 F1368 L1370 N1426 L1427 L1467	L1328-S1362 WeakPolarHBondContact CB-O 3.48Å; L1328-S1362 PolarHBondContact N-O 3.16Å; L1328-S1362 PolarHBondContact O-N 2.76Å; L1328-S1362 VanDerWaalsContact O-N 3.12Å; L1328-L1365 HydrophobicContact CB-CB 3.92Å; L1328-L1365 HydrophobicContact CB-CD2 4.43Å; L1328-L1365 HydrophobicContact CD1-CB 4.17Å; L1328-F1368 HydrophobicContact CD1-CB 3.92Å; L1328-F1368 WeakPolarHBondContact CD1-O 3.45Å; L1328-L1370 HydrophobicContact CD1-CB 4.38Å; L1328-L1370 HydrophobicContact CG-CB 4.46Å; L1328-N1426 WeakPolarHBondContact CA-O 3.48Å; L1328-L1427 HydrophobicContact CD2-CB 4.28Å; L1328-L1427 HydrophobicContact CD2-CD1 4.26Å; L1328-L1467 HydrophobicContact CD2-CD1 3.76Å
1329	L	67.5	Low	53	Low	20 Å²	20	70.5 Å²	70.5	11%	0.105	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.7	178.2	-161.6	82.1	0	0	0	110.6	L1357 H1360 L1361 N1426 I1428	L1329-L1357 HydrophobicContact CD1-CD2 4.37Å; L1329-L1357 HydrophobicContact CD2-CD2 3.79Å; L1329-H1360 HydrophobicContact CD1-CB 4.37Å; L1329-L1361 HydrophobicContact CD1-CD2 3.79Å; L1329-N1426 PolarHBondContact N-O 2.72Å; L1329-N1426 PolarHBondContact O-N 2.95Å; L1329-I1428 HydrophobicContact CB-CD1 3.93Å; L1329-I1428 HydrophobicContact CD2-CD1 3.82Å; L1329-I1428 HydrophobicContact CG-CD1 4.36Å
1330	P	52.2	Low	51.3	Low	42 Å²	42	78.5 Å²	78.5	27%	0.273	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	140.2	179.6	16.6	-30.3	0	0	0	115	M1332 H1360 L1365	P1330-M1332 PolarHBondContact O-N 2.91Å; P1330-H1360 WeakPolarHBondContact CD-O 3.04Å; P1330-H1360 HydrophobicContact CG-CB 4.27Å; P1330-L1365 HydrophobicContact CB-CD2 4.23Å
1331	S	50.6	Low	49	Very low	43 Å²	43	83.7 Å²	83.7	30%	0.301	42%	0.423	S	S	.	.			trans	-75.7	89.2	-178.5	-175.1	0	0	0	0	112	N1333 T1424	S1331-N1333 VanDerWaalsContact C-N 3.27Å; S1331-N1333 PolarHBondContact O-N 3.12Å; S1331-T1424 WeakPolarHBondContact CB-O 3.43Å; S1331-T1424 WeakPolarHBondContact CB-OG1 3.31Å; S1331-T1424 PolarHBondContact OG-OG1 2.97Å
1332	M	39.8	Very low	46.6	Very low	141 Å²	141	93.6 Å²	93.6	70%	0.695	47%	0.467	S	S	*	.			trans	-73.5	71.3	175.4	-77.9	-72.4	178.1	0	0	112.4	P1330 W1356	P1330-M1332 PolarHBondContact O-N 2.91Å; M1332-W1356 HydrophobicContact CE-CZ3 4.49Å
1333	N	35.9	Very low	44.3	Very low	147 Å²	147	98.3 Å²	98.3	79%	0.786	50%	0.499	S	S	*	.			trans	-160.6	101.5	158.5	-111.8	-65.4	0	0	0	113.5	S1331	S1331-N1333 VanDerWaalsContact C-N 3.27Å; S1331-N1333 PolarHBondContact O-N 3.12Å
1334	G	28.5	Very low	41.8	Very low	77 Å²	77	105.4 Å²	105.4	79%	0.794	54%	0.536	S	S	*	.	S	Bend	trans	-147.2	25.7	-173.5	0	0	0	0	0	116.3
1335	R	26.3	Very low	39.8	Very low	243 Å²	243	109.4 Å²	109.4	92%	0.917	56%	0.563	S	S	*	*			trans	51.3	83.6	179.7	-73.8	-177.1	167.3	178.9	-2.2	115.9
1336	Q	26.6	Very low	37.6	Very low	184 Å²	184	116.2 Å²	116.2	86%	0.86	60%	0.6	S	S	*	*			trans	-122.9	147.6	138.4	-70.3	-161.9	10.1	0	0	109.7
1337	K	24.4	Very low	35.1	Very low	178 Å²	178	123.1 Å²	123.1	77%	0.774	64%	0.636	S	S	*	*			trans	-87.8	122.1	174	-72.7	-174.5	174.8	-170	0	108.8
1338	F	25.7	Very low	32.5	Very low	205 Å²	205	130.7 Å²	130.7	90%	0.899	68%	0.676	S	S	*	*			trans	-118.7	93	142.9	-90.6	-80	0	0	0	108.2
1339	T	22.8	Very low	30.3	Very low	106 Å²	106	136.3 Å²	136.3	65%	0.65	72%	0.715	S	S	*	*			trans	-97.5	103.4	166.3	45.2	0	0	0	0	107.6
1340	E	25.8	Very low	28.6	Very low	192 Å²	192	142.6 Å²	142.6	90%	0.897	75%	0.747	S	S	*	*			trans	-163.9	156.8	147.6	-113.3	156.2	-139.1	0	0	110.5
1341	N	22.9	Very low	27.9	Very low	147 Å²	147	145.3 Å²	145.3	79%	0.786	77%	0.765	S	S	*	*			trans	-87.9	140.6	-164.1	-50.8	-52.7	0	0	0	111.8
1342	F	22.3	Very low	26.8	Very low	208 Å²	208	149 Å²	149	91%	0.912	79%	0.786	S	S	*	*			trans	-137.2	131.6	145.2	-98.3	-76.9	0	0	0	110.8
1343	S	23.1	Very low	26.2	Very low	98 Å²	98	146.9 Å²	146.9	69%	0.685	79%	0.785	S	S	*	*			trans	-132.4	113	-177	55.8	0	0	0	0	109.7
1344	L	24	Very low	26.1	Very low	149 Å²	149	147.8 Å²	147.8	78%	0.78	78%	0.779	S	S	*	*			trans	-144.4	131.6	157.4	-82.3	106.5	0	0	0	106.3
1345	T	22.3	Very low	26.3	Very low	110 Å²	110	148.3 Å²	148.3	68%	0.675	77%	0.77	S	S	*	*			cis	64.4	87.5	39.8	78.6	0	0	0	0	114.1
1346	N	24.6	Very low	26.7	Very low	151 Å²	151	145.2 Å²	145.2	81%	0.807	76%	0.758	S	S	*	*			trans	59.3	141.5	154.3	-62	9.1	0	0	0	120.5
1347	N	23.7	Very low	27.2	Very low	144 Å²	144	140 Å²	140	77%	0.77	74%	0.736	S	S	*	*			trans	81	111.9	156.2	-67.4	-0.5	0	0	0	120.4
1348	L	22.5	Very low	28.2	Very low	160 Å²	160	136.8 Å²	136.8	84%	0.838	72%	0.72	S	S	*	*			trans	76.9	146.7	152.7	-79	79.2	0	0	0	120.6
1349	S	24.1	Very low	28.9	Very low	117 Å²	117	130.3 Å²	130.3	82%	0.818	70%	0.7	S	S	*	*			trans	69.2	95.4	166.8	34	0	0	0	0	120.4
1350	I	33.6	Very low	30.2	Very low	152 Å²	152	129.1 Å²	129.1	78%	0.779	69%	0.687	S	S	*	*			trans	-50.1	141.7	144.5	-55.1	155.9	0	0	0	108.4
1351	P	36.9	Very low	31.5	Very low	100 Å²	100	121.2 Å²	121.2	65%	0.649	65%	0.651	S	S	*	*				-148.9	-165.4	54.8	32.8	-6.9	0	0	0	117.7
1352	T	26.5	Very low	33.3	Very low	119 Å²	119	115.7 Å²	115.7	73%	0.73	62%	0.624	S	S	*	*			trans	101.7	-17.6	154.7	72.1	0	0	0	0	121.4	Y1354	T1352-Y1354 PolarHBondContact O-N 2.92Å
1353	S	28.7	Very low	35.5	Very low	97 Å²	97	107.8 Å²	107.8	68%	0.678	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-29	-171.7	50.7	0	0	0	0	116.4
1354	Y	32	Very low	37.7	Very low	167 Å²	167	107.8 Å²	107.8	66%	0.655	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-28.2	-176.7	-81.8	-92.8	0	0	0	114.4	T1352 W1356 L1357 Y1358	T1352-Y1354 PolarHBondContact O-N 2.92Å; Y1354-W1356 PolarHBondContact O-N 2.76Å; Y1354-W1356 VanDerWaalsContact O-N 3.08Å; Y1354-L1357 PolarHBondContact O-N 3.12Å; Y1354-L1357 VanDerWaalsContact O-N 3.13Å; Y1354-Y1358 WeakPolarHBondContact O-CD2 3.44Å
1355	S	32.8	Very low	39.8	Very low	87 Å²	87	102.1 Å²	102.1	61%	0.608	56%	0.557	S	S	*	*	H	α-helix	trans	-60.5	-25.3	-175.6	-173.4	0	0	0	0	113.5	S1359	S1355-S1359 PolarHBondContact O-N 3.36Å; S1355-S1359 PolarHBondContact O-OG 2.85Å
1356	W	35.9	Very low	41.7	Very low	178 Å²	178	100.4 Å²	100.4	67%	0.674	54%	0.543	S	S	*	.	H	α-helix	trans	-82.6	-13.8	-177.2	-134.1	67.8	0	0	0	114	M1332 Y1354 S1359 H1360	M1332-W1356 HydrophobicContact CE-CZ3 4.49Å; Y1354-W1356 PolarHBondContact O-N 2.76Å; Y1354-W1356 VanDerWaalsContact O-N 3.08Å; W1356-S1359 WeakPolarHBondContact CA-OG 3.3Å; W1356-S1359 PolarHBondContact O-OG 3.01Å; W1356-H1360 PolarHBondContact O-CD2 3.38Å
1357	L	37.7	Very low	43.5	Very low	76 Å²	76	94.3 Å²	94.3	40%	0.398	52%	0.516	S	S	.	.	H	α-helix	trans	-78.9	-48.1	168.7	-81.6	164.8	0	0	0	110.3	L1329 Y1354 S1359 H1360	L1329-L1357 HydrophobicContact CD1-CD2 4.37Å; L1329-L1357 HydrophobicContact CD2-CD2 3.79Å; Y1354-L1357 PolarHBondContact O-N 3.12Å; Y1354-L1357 VanDerWaalsContact O-N 3.13Å; L1357-S1359 VanDerWaalsContact C-N 3.3Å; L1357-S1359 PolarHBondContact O-N 2.89Å; L1357-H1360 PolarHBondContact O-N 3.44Å
1358	Y	44.3	Very low	45.5	Very low	109 Å²	109	87.7 Å²	87.7	43%	0.427	48%	0.48	S	S	.	.	H	α-helix	trans	-66.3	-27.7	-178.5	-68.2	-82.5	0	0	0	113.5	M1325 Y1354 H1360 L1361 P1376	M1325-Y1358 HydrophobicContact CE-CD1 4.42Å; M1325-Y1358 HydrophobicContact CE-CE1 3.62Å; Y1354-Y1358 WeakPolarHBondContact O-CD2 3.44Å; Y1358-H1360 PolarHBondContact O-N 2.73Å; Y1358-L1361 HydrophobicContact CD1-CD1 3.56Å; Y1358-L1361 HydrophobicContact CE1-CD1 4.18Å; Y1358-L1361 HydrophobicContact CG-CD1 4.31Å; Y1358-P1376 HydrophobicContact CD1-CG 4.09Å; Y1358-P1376 HydrophobicContact CE1-CG 3.9Å
1359	S	40.9	Very low	47.9	Very low	70 Å²	70	84 Å²	84	49%	0.49	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-5.2	175.2	61.6	0	0	0	0	115.2	S1355 W1356 L1357	S1355-S1359 PolarHBondContact O-N 3.36Å; S1355-S1359 PolarHBondContact O-OG 2.85Å; W1356-S1359 WeakPolarHBondContact CA-OG 3.3Å; W1356-S1359 PolarHBondContact O-OG 3.01Å; L1357-S1359 VanDerWaalsContact C-N 3.3Å; L1357-S1359 PolarHBondContact O-N 2.89Å
1360	H	49.5	Very low	50.4	Low	80 Å²	80	78.5 Å²	78.5	37%	0.37	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.6	12.2	-176.9	-68.6	-44.8	0	0	0	114	L1329 P1330 W1356 L1357 Y1358	L1329-H1360 HydrophobicContact CD1-CB 4.37Å; P1330-H1360 WeakPolarHBondContact CD-O 3.04Å; P1330-H1360 HydrophobicContact CG-CB 4.27Å; W1356-H1360 PolarHBondContact O-CD2 3.38Å; L1357-H1360 PolarHBondContact O-N 3.44Å; Y1358-H1360 PolarHBondContact O-N 2.73Å
1361	L	54.3	Low	52.2	Low	27 Å²	27	74.1 Å²	74.1	14%	0.141	40%	0.397	C	S	.	.			trans	-75.6	130	167.4	-55.5	171	0	0	0	109.1	M1325 S1327 L1329 Y1358 L1375 P1376	M1325-L1361 HydrophobicContact CE-CD1 3.97Å; M1325-L1361 HydrophobicContact SD-CD1 4.34Å; M1325-L1361 HydrophobicContact SD-CD2 4.14Å; S1327-L1361 WeakPolarHBondContact OG-CD2 3.41Å; L1329-L1361 HydrophobicContact CD1-CD2 3.79Å; Y1358-L1361 HydrophobicContact CD1-CD1 3.56Å; Y1358-L1361 HydrophobicContact CE1-CD1 4.18Å; Y1358-L1361 HydrophobicContact CG-CD1 4.31Å; L1361-L1375 HydrophobicContact CB-CD2 3.68Å; L1361-P1376 HydrophobicContact CD1-CG 4.45Å
1362	S	60.5	Low	53.5	Low	30 Å²	30	71.5 Å²	71.5	21%	0.21	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-143.7	158.4	170.8	75.9	0	0	0	0	113.2	L1328 N1364 L1365	L1328-S1362 WeakPolarHBondContact CB-O 3.48Å; L1328-S1362 PolarHBondContact N-O 3.16Å; L1328-S1362 PolarHBondContact O-N 2.76Å; L1328-S1362 VanDerWaalsContact O-N 3.12Å; S1362-N1364 VanDerWaalsContact C-N 3.32Å; S1362-N1364 VanDerWaalsContact OG-C 3.31Å; S1362-N1364 PolarHBondContact OG-O 2.87Å; S1362-L1365 WeakPolarHBondContact OG-CD1 3.33Å
1363	C	68.4	Low	55.7	Low	42 Å²	42	67.5 Å²	67.5	28%	0.284	36%	0.357	S	S	.	.	S	Bend	trans	-82.9	-10.7	171.5	-53.9	0	0	0	0	113.2	K1369 L1370 C1373	C1363-K1369 WeakPolarHBondContact O-CA 3.18Å; C1363-L1370 PolarHBondContact O-N 2.89Å; C1363-C1373 WeakPolarHBondContact CA-SG 3.47Å; C1363-C1373 HydrophobicContact CB-CB 3.61Å; C1363-C1373 WeakPolarHBondContact CB-SG 3.44Å; C1363-C1373 WeakPolarHBondContact SG-CB 3.42Å; C1363-C1373 CovalentContact SG-SG 2.03Å; C1363-C1373 PolarHBondContact SG-SG 3.37Å
1364	N	69.6	Low	57.7	Low	99 Å²	99	63 Å²	63	53%	0.529	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	117.7	180	-175.3	10.4	0	0	0	109	S1362 F1368	S1362-N1364 VanDerWaalsContact C-N 3.32Å; S1362-N1364 VanDerWaalsContact OG-C 3.31Å; S1362-N1364 PolarHBondContact OG-O 2.87Å; N1364-F1368 CarbonylContact C-O 3.56Å; N1364-F1368 VanDerWaalsContact CA-O 3.3Å; N1364-F1368 WeakPolarHBondContact CA-O 3.43Å; N1364-F1368 PolarHBondContact OD1-O 3.07Å
1365	L	66.3	Low	59.1	Low	30 Å²	30	57.4 Å²	57.4	16%	0.157	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	131.2	-176.3	-159.2	87.6	0	0	0	110.5	L1328 P1330 S1362 G1367 F1368 A1425	L1328-L1365 HydrophobicContact CB-CB 3.92Å; L1328-L1365 HydrophobicContact CB-CD2 4.43Å; L1328-L1365 HydrophobicContact CD1-CB 4.17Å; P1330-L1365 HydrophobicContact CB-CD2 4.23Å; S1362-L1365 WeakPolarHBondContact OG-CD1 3.33Å; L1365-G1367 PolarHBondContact O-N 3.46Å; L1365-F1368 PolarHBondContact N-O 3.01Å; L1365-F1368 WeakPolarHBondContact O-CB 3.42Å; L1365-F1368 PolarHBondContact O-N 3.4Å; L1365-A1425 HydrophobicContact CD2-CB 4.21Å
1366	N	63.6	Low	60	Low	74 Å²	74	54.7 Å²	54.7	40%	0.396	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	40.4	177.2	-65	-12.7	0	0	0	113.4	F1368 L1423 T1424	N1366-F1368 HydrophobicContact CB-CD2 4.42Å; N1366-F1368 VanDerWaalsContact O-CD2 3.32Å; N1366-F1368 WeakPolarHBondContact O-CD2 3.48Å; N1366-F1368 PolarHBondContact O-N 3.45Å; N1366-L1423 HydrophobicContact CB-CD2 4.31Å; N1366-T1424 PolarHBondContact ND2-O 2.89Å
1367	G	61.5	Low	60.5	Low	23 Å²	23	51 Å²	51	24%	0.237	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	-3.5	-177.4	0	0	0	0	0	115.4	L1365 H1414 Y1415	L1365-G1367 PolarHBondContact O-N 3.46Å; G1367-H1414 CarbonylContact O-C 3.46Å; G1367-H1414 WeakPolarHBondContact O-CA 3.26Å; G1367-H1414 PolarHBondContact O-ND1 3.4Å; G1367-Y1415 PolarHBondContact O-N 3.13Å
1368	F	66.7	Low	60.6	Low	4 Å²	4	53.6 Å²	53.6	2%	0.018	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.6	171.3	-62.1	-93	0	0	0	110.2	L1328 N1364 L1365 N1366 H1414 L1423 A1425 A1469	L1328-F1368 HydrophobicContact CD1-CB 3.92Å; L1328-F1368 WeakPolarHBondContact CD1-O 3.45Å; N1364-F1368 CarbonylContact C-O 3.56Å; N1364-F1368 VanDerWaalsContact CA-O 3.3Å; N1364-F1368 WeakPolarHBondContact CA-O 3.43Å; N1364-F1368 PolarHBondContact OD1-O 3.07Å; L1365-F1368 PolarHBondContact N-O 3.01Å; L1365-F1368 WeakPolarHBondContact O-CB 3.42Å; L1365-F1368 PolarHBondContact O-N 3.4Å; N1366-F1368 HydrophobicContact CB-CD2 4.42Å; N1366-F1368 VanDerWaalsContact O-CD2 3.32Å; N1366-F1368 WeakPolarHBondContact O-CD2 3.48Å; N1366-F1368 PolarHBondContact O-N 3.45Å; F1368-H1414 HydrophobicContact CD1-CB 3.88Å; F1368-H1414 AromaticContact CD1-ND1 3.73Å; F1368-H1414 AromaticContact CD2-ND1 3.75Å; F1368-H1414 HydrophobicContact CE1-CB 4.02Å; F1368-H1414 AromaticContact CE1-CG 3.94Å; F1368-H1414 AromaticContact CE1-ND1 3.75Å; F1368-H1414 AromaticContact CE2-ND1 3.78Å; F1368-H1414 AromaticContact CG-ND1 3.73Å; F1368-H1414 AromaticContact CZ-ND1 3.79Å; F1368-L1423 HydrophobicContact CE2-CB 4.24Å; F1368-A1425 HydrophobicContact CD2-CB 4.34Å; F1368-A1469 HydrophobicContact CE1-CB 4.49Å; F1368-A1469 HydrophobicContact CZ-CB 3.75Å
1369	K	72.8	Confident	60	Low	82 Å²	82	54.2 Å²	54.2	36%	0.357	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	137.9	169	177.6	172.8	177.7	171.9	0	110.3	C1363 R1413 Y1415	C1363-K1369 WeakPolarHBondContact O-CA 3.18Å; K1369-R1413 HydrophobicContact CB-CB 4.42Å; K1369-R1413 PolarHBondContact N-O 3.41Å; K1369-R1413 PolarHBondContact O-N 3.4Å; K1369-Y1415 HydrophobicContact CB-CE2 4.21Å
1370	L	76.5	Confident	59.5	Low	3 Å²	3	58.3 Å²	58.3	2%	0.016	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.8	179.7	-166.3	71.9	0	0	0	110.3	L1326 L1328 C1363 I1410 L1412 L1427	L1326-L1370 HydrophobicContact CD2-CD2 4.28Å; L1326-L1370 HydrophobicContact CG-CD2 4.11Å; L1328-L1370 HydrophobicContact CD1-CB 4.38Å; L1328-L1370 HydrophobicContact CG-CB 4.46Å; C1363-L1370 PolarHBondContact O-N 2.89Å; L1370-I1410 HydrophobicContact CD1-CG2 3.55Å; L1370-I1410 HydrophobicContact CG-CG2 4.41Å; L1370-L1412 HydrophobicContact CD1-CD2 3.67Å; L1370-L1412 HydrophobicContact CD1-CG 4.08Å; L1370-L1427 HydrophobicContact CD1-CD1 3.88Å; L1370-L1427 HydrophobicContact CD2-CD1 4.01Å
1371	D	71.3	Confident	58.4	Low	59 Å²	59	60.6 Å²	60.6	32%	0.316	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	114.6	-174.8	-162.7	0.8	0	0	0	110.1	E1411 R1413	D1371-E1411 HydrophobicContact CB-CB 4.33Å; D1371-E1411 PolarHBondContact N-O 3Å; D1371-E1411 WeakPolarHBondContact O-CA 3.39Å; D1371-E1411 WeakPolarHBondContact O-CB 3.4Å; D1371-E1411 PolarHBondContact O-N 3.33Å; D1371-R1413 IonicContact OD2-CZ 3.27Å; D1371-R1413 IonicContact OD2-NH1 2.71Å; D1371-R1413 PolarHBondContact OD2-NH1 3.46Å; D1371-R1413 IonicContact OD2-NH2 3.41Å; D1371-R1413 PolarHBondContact OD2-NH2 3.12Å
1372	P	64.3	Low	56.9	Low	46 Å²	46	65.8 Å²	65.8	30%	0.299	39%	0.386	S	S	.	.	S	Bend	cis	-65.9	165.1	-3.9	31.3	-37.1	0	0	0	112
1373	C	71.4	Confident	55.2	Low	34 Å²	34	69.1 Å²	69.1	23%	0.23	42%	0.415	C	S	.	.			trans	-123.2	132.3	173.8	-177.3	0	0	0	0	109.8	C1363	C1363-C1373 WeakPolarHBondContact CA-SG 3.47Å; C1363-C1373 HydrophobicContact CB-CB 3.61Å; C1363-C1373 WeakPolarHBondContact CB-SG 3.44Å; C1363-C1373 WeakPolarHBondContact SG-CB 3.42Å; C1363-C1373 CovalentContact SG-SG 2.03Å; C1363-C1373 PolarHBondContact SG-SG 3.37Å
1374	I	70.6	Confident	53	Low	4 Å²	4	76.7 Å²	76.7	2%	0.021	44%	0.444	C	S	.	.	B	Isolated β-bridge	trans	-120.7	92.9	-176.6	-51.7	173	0	0	0	107.6	I1323 L1326 N1398 I1400	I1323-I1374 HydrophobicContact CB-CD1 3.99Å; I1323-I1374 HydrophobicContact CG2-CD1 3.7Å; L1326-I1374 HydrophobicContact CB-CB 3.7Å; L1326-I1374 HydrophobicContact CB-CD1 3.88Å; L1326-I1374 HydrophobicContact CB-CG1 3.85Å; L1326-I1374 PolarHBondContact N-O 3.26Å; L1326-I1374 PolarHBondContact O-N 2.84Å; I1374-N1398 HydrophobicContact CG2-CB 4.22Å; I1374-N1398 WeakPolarHBondContact CG2-O 3.31Å; I1374-I1400 HydrophobicContact CD1-CB 4.26Å; I1374-I1400 HydrophobicContact CD1-CD1 3.64Å; I1374-I1400 HydrophobicContact CD1-CG1 3.73Å; I1374-I1400 HydrophobicContact CG1-CD1 4.12Å; I1374-I1400 HydrophobicContact CG1-CG1 4.4Å
1375	L	62.5	Low	50.8	Low	48 Å²	48	80.7 Å²	80.7	25%	0.251	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-95.4	131.7	170.4	-67.1	174.9	0	0	0	109.4	L1361 N1398	L1361-L1375 HydrophobicContact CB-CD2 3.68Å; L1375-N1398 PolarHBondContact O-ND2 3.11Å
1376	P	51.5	Low	48.7	Very low	31 Å²	31	87.9 Å²	87.9	20%	0.201	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-65.9	148.2	172.4	27.8	-33.2	0	0	0	110.4	M1325 Y1358 L1361 T1378	M1325-P1376 HydrophobicContact CE-CG 4.22Å; Y1358-P1376 HydrophobicContact CD1-CG 4.09Å; Y1358-P1376 HydrophobicContact CE1-CG 3.9Å; L1361-P1376 HydrophobicContact CD1-CG 4.45Å; P1376-T1378 PolarHBondContact O-N 3.16Å
1377	P	47.2	Very low	46.8	Very low	100 Å²	100	89.6 Å²	89.6	65%	0.649	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-61.7	120.1	-169.8	22.3	-33.3	0	0	0	112.8	T1379	P1377-T1379 VanDerWaalsContact C-N 3.3Å; P1377-T1379 PolarHBondContact O-N 2.72Å
1378	T	38.4	Very low	45.1	Very low	131 Å²	131	96.3 Å²	96.3	80%	0.804	54%	0.543	S	S	*	.			trans	-84.6	61.1	-172.8	55.3	0	0	0	0	112.7	P1376	P1376-T1378 PolarHBondContact O-N 3.16Å
1379	T	32.5	Very low	43.1	Very low	121 Å²	121	103 Å²	103	74%	0.742	58%	0.578	S	S	*	*			trans	-130.2	37.1	-174.9	48.7	0	0	0	0	114.6	P1377	P1377-T1379 VanDerWaalsContact C-N 3.3Å; P1377-T1379 PolarHBondContact O-N 2.72Å
1380	M	29.6	Very low	40.9	Very low	157 Å²	157	106.7 Å²	106.7	77%	0.773	60%	0.602	S	S	*	*			trans	-131.3	80.5	166.4	-79.8	-157.1	174.2	0	0	113.5
1381	T	26.5	Very low	38.6	Very low	128 Å²	128	112.3 Å²	112.3	79%	0.785	64%	0.639	S	S	*	*			trans	-121.6	97.1	164.5	51.1	0	0	0	0	111.5
1382	T	24.1	Very low	36.4	Very low	136 Å²	136	116.9 Å²	116.9	83%	0.834	66%	0.664	S	S	*	*	S	Bend	trans	55.5	92.7	152.5	56.7	0	0	0	0	119.3
1383	A	24.3	Very low	34.9	Very low	100 Å²	100	122.4 Å²	122.4	83%	0.826	68%	0.683	S	S	*	*			trans	65.5	88.2	133.9	0	0	0	0	0	120.4
1384	K	22.8	Very low	32.9	Very low	201 Å²	201	128.6 Å²	128.6	87%	0.874	71%	0.714	S	S	*	*			trans	-160.8	160.5	131.1	-119.8	172.4	-175	177.1	0	113.8
1385	M	23.3	Very low	30.8	Very low	182 Å²	182	135 Å²	135	90%	0.897	75%	0.748	S	S	*	*			trans	68.1	106.9	168.6	-73	173.9	160.3	0	0	118.3
1386	M	21.5	Very low	29.4	Very low	181 Å²	181	138 Å²	138	89%	0.892	77%	0.773	S	S	*	*			trans	-80.9	168.4	148.7	-68.3	169.4	160	0	0	110.1
1387	S	23.7	Very low	28.8	Very low	111 Å²	111	140.2 Å²	140.2	78%	0.776	79%	0.789	S	S	*	*			trans	87.7	149.1	163	80	0	0	0	0	118.9
1388	I	26.2	Very low	29	Very low	163 Å²	163	139.7 Å²	139.7	84%	0.836	78%	0.781	S	S	*	*			trans	83.9	133.6	-176.3	-52.7	176.6	0	0	0	113.3
1389	N	24.2	Very low	29.8	Very low	144 Å²	144	137.5 Å²	137.5	77%	0.77	76%	0.764	S	S	*	*			trans	-97.8	145.2	-170.6	-42.5	-36.9	0	0	0	110.1
1390	D	26.6	Very low	31.3	Very low	160 Å²	160	134.8 Å²	134.8	86%	0.856	74%	0.744	S	S	*	*			trans	-172.2	126.2	136.5	-93	-26.9	0	0	0	109.3	D1392	D1390-D1392 PolarHBondContact O-N 3.17Å
1391	P	28.2	Very low	33.3	Very low	122 Å²	122	130.4 Å²	130.4	79%	0.792	73%	0.726	S	S	*	*			trans	-100.4	56.1	-171.2	39.7	-36.3	0	0	0	113.9
1392	D	26.1	Very low	35.6	Very low	155 Å²	155	124.3 Å²	124.3	83%	0.829	69%	0.689	S	S	*	*			trans	-140	96.8	178.5	-101.7	-45.7	0	0	0	113.4	D1390	D1390-D1392 PolarHBondContact O-N 3.17Å
1393	K	32	Very low	38	Very low	162 Å²	162	122.4 Å²	122.4	70%	0.704	67%	0.673	S	S	*	*			trans	-169.8	99.9	154.9	-112.8	172.8	-177.3	-174.6	0	111.9	E75 N1395	E75-K1393 IonicContact OE1-NZ 2.64Å; K1393-N1395 PolarHBondContact O-N 3.17Å
1394	N	28.3	Very low	40.3	Very low	163 Å²	163	120.6 Å²	120.6	87%	0.872	65%	0.653	S	S	*	*			trans	-74.1	84.6	174.5	-90.4	-24.2	0	0	0	112.1	S1396	N1394-S1396 PolarHBondContact O-N 2.92Å
1395	N	27.5	Very low	42.2	Very low	138 Å²	138	113.6 Å²	113.6	74%	0.738	64%	0.638	S	S	*	*			trans	-97.2	61.7	171.1	-81.9	-6.1	0	0	0	111.8	K1393 S1397	K1393-N1395 PolarHBondContact O-N 3.17Å; N1395-S1397 VanDerWaalsContact C-N 3.31Å; N1395-S1397 PolarHBondContact O-N 3.33Å
1396	S	32.2	Very low	44.6	Very low	113 Å²	113	108.8 Å²	108.8	79%	0.79	61%	0.613	S	S	*	*			trans	-87.7	59.6	176.5	63.3	0	0	0	0	112.3	N1394	N1394-S1396 PolarHBondContact O-N 2.92Å
1397	S	40.6	Very low	47.3	Very low	77 Å²	77	105.6 Å²	105.6	54%	0.538	60%	0.596	S	S	.	*			trans	-87.7	148.7	175.3	48.9	0	0	0	0	112.3	N1395	N1395-S1397 VanDerWaalsContact C-N 3.31Å; N1395-S1397 PolarHBondContact O-N 3.33Å
1398	N	51.4	Low	49.7	Very low	89 Å²	89	101.1 Å²	101.1	48%	0.476	56%	0.563	S	S	.	*	S	Bend	trans	65.9	43.8	170	-55.1	-4.6	0	0	0	117.1	I1374 L1375	I1374-N1398 HydrophobicContact CG2-CB 4.22Å; I1374-N1398 WeakPolarHBondContact CG2-O 3.31Å; L1375-N1398 PolarHBondContact O-ND2 3.11Å
1399	I	53.9	Low	52.1	Low	85 Å²	85	97.1 Å²	97.1	44%	0.436	54%	0.542	S	S	.	.			trans	-122.7	125.5	156.6	-59	178.7	0	0	0	107.6	I1323 F1324	I1323-I1399 WeakPolarHBondContact O-CA 3.21Å; F1324-I1399 HydrophobicContact CB-CG1 4.28Å
1400	I	64.7	Low	54.5	Low	63 Å²	63	90.2 Å²	90.2	32%	0.323	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.7	178.3	-49.9	-173.9	0	0	0	109.5	S1322 I1323 I1374 I1408	S1322-I1400 CarbonylContact C-O 3.41Å; I1323-I1400 PolarHBondContact N-O 3.23Å; I1323-I1400 PolarHBondContact O-N 3.25Å; I1374-I1400 HydrophobicContact CD1-CB 4.26Å; I1374-I1400 HydrophobicContact CD1-CD1 3.64Å; I1374-I1400 HydrophobicContact CD1-CG1 3.73Å; I1374-I1400 HydrophobicContact CG1-CD1 4.12Å; I1374-I1400 HydrophobicContact CG1-CG1 4.4Å; I1400-I1408 HydrophobicContact CB-CD1 4.3Å; I1400-I1408 HydrophobicContact CG2-CD1 3.59Å
1401	T	72.3	Confident	56.8	Low	66 Å²	66	83.4 Å²	83.4	41%	0.405	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	144.6	176.3	46	0	0	0	0	111.8	L1321 T1434	L1321-T1401 CarbonylContact O-C 3.53Å; L1321-T1401 WeakPolarHBondContact O-CA 3.02Å; T1401-T1434 HydrophobicContact CG2-CG2 4.26Å
1402	I	72.9	Confident	58.8	Low	0 Å²	0	78.5 Å²	78.5	0%	0	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	108.7	176	-36.7	177.3	0	0	0	108.2	N1315 T1320 L1321 I1323 Q1406 I1408	N1315-I1402 HydrophobicContact CB-CB 4.36Å; N1315-I1402 HydrophobicContact CB-CG2 3.66Å; N1315-I1402 PolarHBondContact ND2-O 3.14Å; T1320-I1402 WeakPolarHBondContact CA-O 3.47Å; L1321-I1402 PolarHBondContact N-O 2.88Å; L1321-I1402 PolarHBondContact O-N 3.44Å; I1323-I1402 HydrophobicContact CD1-CD1 3.98Å; I1323-I1402 HydrophobicContact CG1-CD1 3.99Å; I1323-I1402 HydrophobicContact CG1-CG1 4.39Å; I1402-Q1406 HydrophobicContact CG2-CB 3.99Å; I1402-Q1406 HydrophobicContact CG2-CG 4.47Å; I1402-Q1406 WeakPolarHBondContact CG2-O 3.26Å; I1402-I1408 HydrophobicContact CD1-CD1 4.03Å; I1402-I1408 HydrophobicContact CG1-CD1 3.71Å; I1402-I1408 HydrophobicContact CG1-CG1 4.35Å
1403	L	75.9	Confident	60.7	Low	96 Å²	96	73.5 Å²	73.5	50%	0.503	41%	0.405	S	S	.	.			trans	-68	156.6	171.4	-71.6	148	0	0	0	111.4	T1320 G1405 Q1406	T1320-L1403 HydrophobicContact CG2-CB 4.33Å; T1320-L1403 HydrophobicContact CG2-CD2 3.59Å; T1320-L1403 HydrophobicContact CG2-CG 3.95Å; L1403-G1405 PolarHBondContact O-N 3.2Å; L1403-Q1406 HydrophobicContact CB-CB 4.02Å; L1403-Q1406 WeakPolarHBondContact O-CB 3.4Å; L1403-Q1406 PolarHBondContact O-N 3.41Å
1404	P	72.2	Confident	62.3	Low	62 Å²	62	66 Å²	66	40%	0.403	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.1	129.2	164.4	-32.6	39.8	0	0	0	112	G1317 Q1318 Q1406	G1317-P1404 WeakPolarHBondContact O-CA 3.44Å; G1317-P1404 VanDerWaalsContact O-CB 3.22Å; G1317-P1404 WeakPolarHBondContact O-CB 3.03Å; Q1318-P1404 VanDerWaalsContact C-CG 3.4Å; Q1318-P1404 WeakPolarHBondContact O-CG 3.4Å; P1404-Q1406 PolarHBondContact O-N 2.87Å
1405	G	63.2	Low	64	Low	54 Å²	54	62.6 Å²	62.6	56%	0.557	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	-6.7	-176.2	0	0	0	0	0	115.5	L1314 N1315 L1403	L1314-G1405 WeakPolarHBondContact CD1-O 3.41Å; N1315-G1405 WeakPolarHBondContact O-CA 3.38Å; N1315-G1405 PolarHBondContact O-N 3.22Å; L1403-G1405 PolarHBondContact O-N 3.2Å
1406	Q	72	Confident	65.3	Low	80 Å²	80	57.2 Å²	57.2	37%	0.374	32%	0.32	S	S	.	.			trans	-79.9	146.3	176.8	-166.3	-179.5	8	0	0	110.9	N1315 I1402 L1403 P1404	N1315-Q1406 PolarHBondContact N-O 2.83Å; N1315-Q1406 VanDerWaalsContact N-O 3.11Å; I1402-Q1406 HydrophobicContact CG2-CB 3.99Å; I1402-Q1406 HydrophobicContact CG2-CG 4.47Å; I1402-Q1406 WeakPolarHBondContact CG2-O 3.26Å; L1403-Q1406 HydrophobicContact CB-CB 4.02Å; L1403-Q1406 WeakPolarHBondContact O-CB 3.4Å; L1403-Q1406 PolarHBondContact O-N 3.41Å; P1404-Q1406 PolarHBondContact O-N 2.87Å
1407	Q	78.3	Confident	66.3	Low	114 Å²	114	55.6 Å²	55.6	53%	0.533	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	142.4	177.1	61.4	177.9	-13.9	0	0	112.3	V1312 L1313 L1314	V1312-Q1407 HydrophobicContact CG1-CB 3.76Å; V1312-Q1407 HydrophobicContact CG1-CG 4.46Å; V1312-Q1407 VanDerWaalsContact CG1-OE1 3.25Å; L1313-Q1407 CarbonylContact O-C 3.26Å; L1313-Q1407 VanDerWaalsContact O-CA 3.23Å; L1313-Q1407 WeakPolarHBondContact O-CA 3.2Å; L1314-Q1407 HydrophobicContact CD1-CB 4.03Å
1408	I	75.1	Confident	66.6	Low	18 Å²	18	56.2 Å²	56.2	9%	0.092	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.6	167.2	-77.2	-178.8	0	0	0	108.8	V1312 L1313 I1323 I1400 I1402 I1410	V1312-I1408 WeakPolarHBondContact CA-O 3.38Å; L1313-I1408 PolarHBondContact N-O 3.06Å; L1313-I1408 PolarHBondContact O-N 3.11Å; I1323-I1408 HydrophobicContact CD1-CD1 3.8Å; I1400-I1408 HydrophobicContact CB-CD1 4.3Å; I1400-I1408 HydrophobicContact CG2-CD1 3.59Å; I1402-I1408 HydrophobicContact CD1-CD1 4.03Å; I1402-I1408 HydrophobicContact CG1-CD1 3.71Å; I1402-I1408 HydrophobicContact CG1-CG1 4.35Å; I1408-I1410 HydrophobicContact CG2-CG1 4.05Å
1409	I	76.3	Confident	66.4	Low	78 Å²	78	56.9 Å²	56.9	40%	0.4	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	108.2	172.3	-52.3	-179.4	0	0	0	108.3	R1310 L1311 V1312	R1310-I1409 HydrophobicContact CB-CG2 3.98Å; R1310-I1409 HydrophobicContact CG-CG2 3.97Å; L1311-I1409 CarbonylContact O-C 3.59Å; V1312-I1409 HydrophobicContact CG2-CG1 4.42Å
1410	I	74.8	Confident	66	Low	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	119.9	167.4	-55.9	176.2	0	0	0	108	L1311 L1313 L1326 L1370 I1408 I1429	L1311-I1410 HydrophobicContact CB-CB 4.42Å; L1311-I1410 HydrophobicContact CD2-CD1 4.38Å; L1311-I1410 PolarHBondContact N-O 3.08Å; L1311-I1410 PolarHBondContact O-N 3.47Å; L1313-I1410 HydrophobicContact CD1-CD1 3.51Å; L1313-I1410 HydrophobicContact CD1-CG1 4.21Å; L1326-I1410 HydrophobicContact CD1-CD1 3.66Å; L1326-I1410 HydrophobicContact CD2-CD1 3.82Å; L1326-I1410 HydrophobicContact CD2-CG1 3.98Å; L1326-I1410 HydrophobicContact CD2-CG2 4.32Å; L1326-I1410 HydrophobicContact CG-CD1 4.28Å; L1370-I1410 HydrophobicContact CD1-CG2 3.55Å; L1370-I1410 HydrophobicContact CG-CG2 4.41Å; I1408-I1410 HydrophobicContact CG2-CG1 4.05Å; I1410-I1429 HydrophobicContact CD1-CD1 4.13Å
1411	E	74.8	Confident	64.8	Low	16 Å²	16	59.9 Å²	59.9	8%	0.075	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	123.4	172.3	-169.9	-176.8	159.9	0	0	111.1	R1308 D1371 R1413	R1308-E1411 HydrophobicContact CG-CG 3.99Å; R1308-E1411 WeakPolarHBondContact CG-OE1 3.45Å; R1308-E1411 IonicContact CZ-OE1 2.82Å; R1308-E1411 IonicContact CZ-OE2 3.6Å; R1308-E1411 IonicContact NE-OE1 2.8Å; R1308-E1411 PolarHBondContact NE-OE1 2.76Å; R1308-E1411 IonicContact NE-OE2 2.74Å; R1308-E1411 PolarHBondContact NE-OE2 2.03Å; R1308-E1411 IonicContact NH2-OE1 3.68Å; R1308-E1411 PolarHBondContact NH2-OE1 3.33Å; R1308-E1411 IonicContact NH2-OE2 3.68Å; R1308-E1411 PolarHBondContact NH2-OE2 3.03Å; D1371-E1411 HydrophobicContact CB-CB 4.33Å; D1371-E1411 PolarHBondContact N-O 3Å; D1371-E1411 WeakPolarHBondContact O-CA 3.39Å; D1371-E1411 WeakPolarHBondContact O-CB 3.4Å; D1371-E1411 PolarHBondContact O-N 3.33Å; E1411-R1413 HydrophobicContact CG-CG 4.17Å; E1411-R1413 WeakPolarHBondContact OE1-CG 3.49Å; E1411-R1413 IonicContact OE1-CZ 2.71Å; E1411-R1413 VanDerWaalsContact OE1-CZ 3.3Å; E1411-R1413 IonicContact OE1-NE 2.85Å; E1411-R1413 PolarHBondContact OE1-NE 2.94Å; E1411-R1413 IonicContact OE1-NH2 2.65Å; E1411-R1413 PolarHBondContact OE1-NH2 3.37Å; E1411-R1413 VanDerWaalsContact OE1-NH2 3.16Å; E1411-R1413 IonicContact OE2-CZ 3.16Å; E1411-R1413 IonicContact OE2-NE 3.51Å; E1411-R1413 IonicContact OE2-NH2 2.59Å; E1411-R1413 PolarHBondContact OE2-NH2 2.87Å
1412	L	69.6	Low	63.3	Low	19 Å²	19	62 Å²	62	10%	0.099	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	113.5	168.2	-80.2	158.7	0	0	0	108.5	R1308 R1309 L1370 L1467	R1308-L1412 CarbonylContact C-O 3.53Å; R1309-L1412 PolarHBondContact N-O 2.65Å; R1309-L1412 PolarHBondContact O-N 3.16Å; L1370-L1412 HydrophobicContact CD1-CD2 3.67Å; L1370-L1412 HydrophobicContact CD1-CG 4.08Å; L1412-L1467 HydrophobicContact CD1-CD1 4.27Å; L1412-L1467 HydrophobicContact CD1-CD2 3.94Å; L1412-L1467 HydrophobicContact CD2-CD1 3.92Å
1413	R	67.4	Low	62.5	Low	51 Å²	51	63.2 Å²	63.2	19%	0.192	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	111.3	170.9	-63.2	-177.7	-172.1	117.9	26.3	108.8	K1369 D1371 E1411 Y1415	K1369-R1413 HydrophobicContact CB-CB 4.42Å; K1369-R1413 PolarHBondContact N-O 3.41Å; K1369-R1413 PolarHBondContact O-N 3.4Å; D1371-R1413 IonicContact OD2-CZ 3.27Å; D1371-R1413 IonicContact OD2-NH1 2.71Å; D1371-R1413 PolarHBondContact OD2-NH1 3.46Å; D1371-R1413 IonicContact OD2-NH2 3.41Å; D1371-R1413 PolarHBondContact OD2-NH2 3.12Å; E1411-R1413 HydrophobicContact CG-CG 4.17Å; E1411-R1413 WeakPolarHBondContact OE1-CG 3.49Å; E1411-R1413 IonicContact OE1-CZ 2.71Å; E1411-R1413 VanDerWaalsContact OE1-CZ 3.3Å; E1411-R1413 IonicContact OE1-NE 2.85Å; E1411-R1413 PolarHBondContact OE1-NE 2.94Å; E1411-R1413 IonicContact OE1-NH2 2.65Å; E1411-R1413 PolarHBondContact OE1-NH2 3.37Å; E1411-R1413 VanDerWaalsContact OE1-NH2 3.16Å; E1411-R1413 IonicContact OE2-CZ 3.16Å; E1411-R1413 IonicContact OE2-NE 3.51Å; E1411-R1413 IonicContact OE2-NH2 2.59Å; E1411-R1413 PolarHBondContact OE2-NH2 2.87Å; R1413-Y1415 HydrophobicContact CB-CE2 3.97Å
1414	H	65.3	Low	61.4	Low	3 Å²	3	60 Å²	60	1%	0.014	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	118.8	168.6	-176.5	63	0	0	0	110.4	L1307 G1367 F1368 F1471	L1307-H1414 HydrophobicContact CB-CB 4.23Å; L1307-H1414 PolarHBondContact N-O 2.72Å; L1307-H1414 PolarHBondContact O-N 2.84Å; G1367-H1414 CarbonylContact O-C 3.46Å; G1367-H1414 WeakPolarHBondContact O-CA 3.26Å; G1367-H1414 PolarHBondContact O-ND1 3.4Å; F1368-H1414 HydrophobicContact CD1-CB 3.88Å; F1368-H1414 AromaticContact CD1-ND1 3.73Å; F1368-H1414 AromaticContact CD2-ND1 3.75Å; F1368-H1414 HydrophobicContact CE1-CB 4.02Å; F1368-H1414 AromaticContact CE1-CG 3.94Å; F1368-H1414 AromaticContact CE1-ND1 3.75Å; F1368-H1414 AromaticContact CE2-ND1 3.78Å; F1368-H1414 AromaticContact CG-ND1 3.73Å; F1368-H1414 AromaticContact CZ-ND1 3.79Å; H1414-F1471 AromaticContact NE2-CE2 3.83Å
1415	Y	64.3	Low	60.8	Low	93 Å²	93	57 Å²	57	37%	0.365	30%	0.297	S	S	.	.			trans	-91.8	112.6	168.7	-63	-87.9	0	0	0	107.6	G1367 K1369 R1413 D1417	G1367-Y1415 PolarHBondContact O-N 3.13Å; K1369-Y1415 HydrophobicContact CB-CE2 4.21Å; R1413-Y1415 HydrophobicContact CB-CE2 3.97Å; Y1415-D1417 PolarHBondContact O-N 3.44Å; Y1415-D1417 VanDerWaalsContact O-N 3.11Å
1416	P	53	Low	60.7	Low	24 Å²	24	56 Å²	56	16%	0.156	28%	0.278	C	S	.	.			trans	-76	103	-173	30.3	-32.6	0	0	0	110.6	L1305 F1418 F1471	L1305-P1416 WeakPolarHBondContact O-CD 3.41Å; P1416-F1418 HydrophobicContact CB-CE1 4.42Å; P1416-F1418 HydrophobicContact CB-CE2 4.48Å; P1416-F1418 HydrophobicContact CB-CZ 4.22Å; P1416-F1418 HydrophobicContact CG-CE1 4.48Å; P1416-F1418 HydrophobicContact CG-CE2 4.04Å; P1416-F1418 HydrophobicContact CG-CZ 3.83Å; P1416-F1418 VanDerWaalsContact O-CD2 3.26Å; P1416-F1418 WeakPolarHBondContact O-CD2 3.3Å; P1416-F1418 WeakPolarHBondContact O-CE2 3.01Å; P1416-F1418 PolarHBondContact O-N 3.09Å; P1416-F1418 VanDerWaalsContact O-N 3.11Å; P1416-F1471 HydrophobicContact CB-CZ 4.22Å
1417	D	54.3	Low	60.6	Low	80 Å²	80	52.3 Å²	52.3	43%	0.428	26%	0.261	S	S	.	.			trans	-71	102.3	164.3	-175.4	-14.6	0	0	0	109.2	Y1415 T1419 H1420	Y1415-D1417 PolarHBondContact O-N 3.44Å; Y1415-D1417 VanDerWaalsContact O-N 3.11Å; D1417-T1419 PolarHBondContact O-N 3.08Å; D1417-T1419 WeakPolarHBondContact OD1-CB 3.32Å; D1417-T1419 WeakPolarHBondContact OD1-CG2 3.48Å; D1417-T1419 PolarHBondContact OD1-N 2.92Å; D1417-T1419 PolarHBondContact OD1-OG1 2.9Å; D1417-T1419 PolarHBondContact OD2-OG1 3.41Å; D1417-H1420 PolarHBondContact O-N 3.37Å; D1417-H1420 VanDerWaalsContact O-N 3.1Å
1418	F	47.2	Very low	60.1	Low	90 Å²	90	47.8 Å²	47.8	40%	0.395	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-2.3	-177.5	-65.2	-78.1	0	0	0	114.5	L1305 P1416 L1476	L1305-F1418 HydrophobicContact CD1-CZ 4.4Å; P1416-F1418 HydrophobicContact CB-CE1 4.42Å; P1416-F1418 HydrophobicContact CB-CE2 4.48Å; P1416-F1418 HydrophobicContact CB-CZ 4.22Å; P1416-F1418 HydrophobicContact CG-CE1 4.48Å; P1416-F1418 HydrophobicContact CG-CE2 4.04Å; P1416-F1418 HydrophobicContact CG-CZ 3.83Å; P1416-F1418 VanDerWaalsContact O-CD2 3.26Å; P1416-F1418 WeakPolarHBondContact O-CD2 3.3Å; P1416-F1418 WeakPolarHBondContact O-CE2 3.01Å; P1416-F1418 PolarHBondContact O-N 3.09Å; P1416-F1418 VanDerWaalsContact O-N 3.11Å; F1418-L1476 HydrophobicContact CD1-CD1 4.08Å; F1418-L1476 HydrophobicContact CE1-CD1 3.99Å
1419	T	46.2	Very low	59.9	Low	102 Å²	102	47.1 Å²	47.1	63%	0.626	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-23.4	171.2	66.9	0	0	0	0	113.6	D1417	D1417-T1419 PolarHBondContact O-N 3.08Å; D1417-T1419 WeakPolarHBondContact OD1-CB 3.32Å; D1417-T1419 WeakPolarHBondContact OD1-CG2 3.48Å; D1417-T1419 PolarHBondContact OD1-N 2.92Å; D1417-T1419 PolarHBondContact OD1-OG1 2.9Å; D1417-T1419 PolarHBondContact OD2-OG1 3.41Å
1420	H	45.3	Very low	59.4	Low	112 Å²	112	44.6 Å²	44.6	52%	0.519	22%	0.223	S	C	.	.			trans	-121.3	111.1	-172	-72.9	-66.4	0	0	0	113	D1417 F1422 L1423	D1417-H1420 PolarHBondContact O-N 3.37Å; D1417-H1420 VanDerWaalsContact O-N 3.1Å; H1420-F1422 VanDerWaalsContact C-N 3.34Å; H1420-F1422 PolarHBondContact O-N 2.83Å; H1420-L1423 HydrophobicContact CB-CD1 4.26Å; H1420-L1423 HydrophobicContact CB-CD2 3.91Å; H1420-L1423 HydrophobicContact CB-CG 4.13Å
1421	T	40.3	Very low	59	Low	100 Å²	100	44.6 Å²	44.6	61%	0.613	22%	0.223	S	C	*	.	S	Bend	trans	-80.1	-6.1	-172.5	51.5	0	0	0	0	115.9
1422	F	41.2	Very low	58.7	Low	111 Å²	111	44.4 Å²	44.4	49%	0.487	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	117.3	-178.8	-177.7	-89.2	0	0	0	109.3	H1420 T1424 Q1468 I1470	H1420-F1422 VanDerWaalsContact C-N 3.34Å; H1420-F1422 PolarHBondContact O-N 2.83Å; F1422-T1424 HydrophobicContact CE1-CG2 3.68Å; F1422-T1424 HydrophobicContact CZ-CG2 3.8Å; F1422-Q1468 HydrophobicContact CE2-CG 4.02Å; F1422-Q1468 HydrophobicContact CZ-CG 4.16Å; F1422-I1470 HydrophobicContact CD2-CG1 4.42Å; F1422-I1470 HydrophobicContact CE2-CG1 4.36Å
1423	L	55.7	Low	58.1	Low	25 Å²	25	43.9 Å²	43.9	13%	0.131	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	134.8	-179	-67.4	170.3	0	0	0	109.7	N1366 F1368 H1420 A1469	N1366-L1423 HydrophobicContact CB-CD2 4.31Å; F1368-L1423 HydrophobicContact CE2-CB 4.24Å; H1420-L1423 HydrophobicContact CB-CD1 4.26Å; H1420-L1423 HydrophobicContact CB-CD2 3.91Å; H1420-L1423 HydrophobicContact CB-CG 4.13Å; L1423-A1469 PolarHBondContact N-O 2.94Å; L1423-A1469 PolarHBondContact O-N 2.76Å; L1423-A1469 VanDerWaalsContact O-N 3.11Å
1424	T	52.1	Low	57.8	Low	28 Å²	28	42.9 Å²	42.9	17%	0.172	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	143.8	176.3	52.6	0	0	0	0	111.4	S1331 N1366 F1422 L1467 Q1468	S1331-T1424 WeakPolarHBondContact CB-O 3.43Å; S1331-T1424 WeakPolarHBondContact CB-OG1 3.31Å; S1331-T1424 PolarHBondContact OG-OG1 2.97Å; N1366-T1424 PolarHBondContact ND2-O 2.89Å; F1422-T1424 HydrophobicContact CE1-CG2 3.68Å; F1422-T1424 HydrophobicContact CZ-CG2 3.8Å; T1424-L1467 VanDerWaalsContact CA-O 3.25Å; T1424-L1467 WeakPolarHBondContact CA-O 3.41Å; T1424-Q1468 HydrophobicContact CG2-CB 4.03Å; T1424-Q1468 HydrophobicContact CG2-CG 3.84Å
1425	A	60.8	Low	57.3	Low	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	155.9	174.1	0	0	0	0	0	108.8	L1365 F1368 L1467	L1365-A1425 HydrophobicContact CD2-CB 4.21Å; F1368-A1425 HydrophobicContact CD2-CB 4.34Å; A1425-L1467 PolarHBondContact N-O 2.86Å; A1425-L1467 VanDerWaalsContact N-O 3.13Å; A1425-L1467 WeakPolarHBondContact O-CB 3.4Å; A1425-L1467 PolarHBondContact O-N 2.97Å
1426	N	60.5	Low	56.5	Low	32 Å²	32	48 Å²	48	17%	0.171	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.5	172.9	-64	-52.7	0	0	0	109.2	L1328 L1329 I1465	L1328-N1426 WeakPolarHBondContact CA-O 3.48Å; L1329-N1426 PolarHBondContact N-O 2.72Å; L1329-N1426 PolarHBondContact O-N 2.95Å; N1426-I1465 WeakPolarHBondContact CA-O 3.34Å
1427	L	69.9	Low	56.1	Low	2 Å²	2	51 Å²	51	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	131.5	167.9	174.2	65.1	0	0	0	108.9	L1328 L1370 I1429 I1465 L1467	L1328-L1427 HydrophobicContact CD2-CB 4.28Å; L1328-L1427 HydrophobicContact CD2-CD1 4.26Å; L1370-L1427 HydrophobicContact CD1-CD1 3.88Å; L1370-L1427 HydrophobicContact CD2-CD1 4.01Å; L1427-I1429 HydrophobicContact CD2-CD1 4.36Å; L1427-I1429 HydrophobicContact CG-CG1 4.23Å; L1427-I1465 HydrophobicContact CB-CB 4.24Å; L1427-I1465 HydrophobicContact CD2-CD1 4.47Å; L1427-I1465 PolarHBondContact N-O 3.03Å; L1427-I1465 PolarHBondContact O-N 2.92Å; L1427-L1467 HydrophobicContact CB-CD1 4.09Å; L1427-L1467 HydrophobicContact CB-CG 4.39Å
1428	I	68	Low	55.4	Low	20 Å²	20	51.3 Å²	51.3	10%	0.103	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.1	175.5	-62.1	-179.8	0	0	0	108.5	M1325 L1326 S1327 L1329 Q1430	M1325-I1428 HydrophobicContact SD-CG2 3.98Å; L1326-I1428 WeakPolarHBondContact CA-O 3.26Å; S1327-I1428 PolarHBondContact N-O 3.39Å; S1327-I1428 VanDerWaalsContact N-O 3.17Å; S1327-I1428 PolarHBondContact O-N 3.27Å; L1329-I1428 HydrophobicContact CB-CD1 3.93Å; L1329-I1428 HydrophobicContact CD2-CD1 3.82Å; L1329-I1428 HydrophobicContact CG-CD1 4.36Å; I1428-Q1430 HydrophobicContact CG2-CG 4.05Å
1429	I	71.7	Confident	55.2	Low	3 Å²	3	51.9 Å²	51.9	2%	0.015	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	122.6	175.2	-45.1	-172.2	0	0	0	106.4	F1252 L1313 I1323 M1325 L1326 I1410 L1427 L1431 L1462 I1465	F1252-I1429 HydrophobicContact CE1-CD1 4.28Å; L1313-I1429 HydrophobicContact CD1-CD1 4.33Å; L1313-I1429 HydrophobicContact CD2-CD1 4.22Å; L1313-I1429 HydrophobicContact CD2-CG2 4.43Å; I1323-I1429 HydrophobicContact CG2-CG2 4.4Å; M1325-I1429 WeakPolarHBondContact O-CA 3.11Å; L1326-I1429 HydrophobicContact CD1-CB 4.03Å; L1326-I1429 HydrophobicContact CD1-CD1 3.99Å; L1326-I1429 HydrophobicContact CD1-CG1 3.62Å; L1326-I1429 HydrophobicContact CD1-CG2 3.72Å; I1410-I1429 HydrophobicContact CD1-CD1 4.13Å; L1427-I1429 HydrophobicContact CD2-CD1 4.36Å; L1427-I1429 HydrophobicContact CG-CG1 4.23Å; I1429-L1431 HydrophobicContact CG2-CD2 4.44Å; I1429-L1462 HydrophobicContact CB-CB 4.38Å; I1429-L1462 HydrophobicContact CB-CD1 3.73Å; I1429-L1462 HydrophobicContact CD1-CD1 4.46Å; I1429-L1462 HydrophobicContact CG2-CD1 3.63Å; I1429-L1462 PolarHBondContact O-N 2.97Å; I1429-I1465 HydrophobicContact CD1-CD1 4.38Å
1430	Q	64.9	Low	54.8	Low	26 Å²	26	48.7 Å²	48.7	12%	0.121	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.2	173.1	-53.7	-171.9	-69.2	0	0	109.5	F1324 M1325 I1428 D1461	F1324-Q1430 HydrophobicContact CD1-CB 4.2Å; F1324-Q1430 WeakPolarHBondContact CD1-O 3.36Å; F1324-Q1430 HydrophobicContact CE1-CB 3.4Å; F1324-Q1430 VanDerWaalsContact CE1-CB 3.4Å; F1324-Q1430 HydrophobicContact CE2-CB 4.11Å; F1324-Q1430 HydrophobicContact CZ-CB 3.34Å; F1324-Q1430 HydrophobicContact CZ-CG 4.19Å; F1324-Q1430 PolarHBondContact N-O 3.13Å; M1325-Q1430 HydrophobicContact CB-CB 4.12Å; M1325-Q1430 HydrophobicContact CB-CG 4.17Å; M1325-Q1430 PolarHBondContact O-N 3.46Å; M1325-Q1430 HydrophobicContact SD-CG 4.32Å; M1325-Q1430 PolarHBondContact SD-OE1 2.93Å; I1428-Q1430 HydrophobicContact CG2-CG 4.05Å; Q1430-D1461 WeakPolarHBondContact CG-OD1 3.38Å; Q1430-D1461 PolarHBondContact NE2-OD1 2.9Å
1431	L	67.3	Low	54.4	Low	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	155.3	-179.3	32.4	67.2	0	0	0	113.2	L1250 S1322 I1323 I1429 I1460 L1462	L1250-L1431 HydrophobicContact CD1-CD1 4.32Å; L1250-L1431 HydrophobicContact CD1-CD2 3.87Å; S1322-L1431 CarbonylContact O-C 3.56Å; S1322-L1431 WeakPolarHBondContact O-CA 3.08Å; S1322-L1431 VanDerWaalsContact O-CB 3.25Å; S1322-L1431 WeakPolarHBondContact O-CB 3.47Å; I1323-L1431 HydrophobicContact CG1-CD2 4.34Å; I1429-L1431 HydrophobicContact CG2-CD2 4.44Å; L1431-I1460 HydrophobicContact CD1-CB 3.7Å; L1431-I1460 HydrophobicContact CD1-CG2 3.65Å; L1431-I1460 WeakPolarHBondContact CD1-O 3.42Å; L1431-I1460 PolarHBondContact N-O 2.78Å; L1431-I1460 WeakPolarHBondContact O-CA 3.13Å; L1431-I1460 WeakPolarHBondContact O-CB 3.46Å; L1431-I1460 PolarHBondContact O-N 2.83Å; L1431-L1462 HydrophobicContact CD1-CD1 4.17Å; L1431-L1462 HydrophobicContact CD1-CG 4.39Å; L1431-L1462 HydrophobicContact CD2-CD1 4.09Å; L1431-L1462 HydrophobicContact CG-CD1 4.14Å
1432	Y	66.8	Low	54.2	Low	12 Å²	12	51 Å²	51	5%	0.047	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	153.5	178.7	68.1	-95.1	0	0	0	111.4	S1322 F1324 Q1437 I1440	S1322-Y1432 PolarHBondContact N-O 3.05Å; S1322-Y1432 PolarHBondContact O-N 3.19Å; F1324-Y1432 HydrophobicContact CB-CE1 4.23Å; F1324-Y1432 AromaticContact CD1-CD1 3.66Å; F1324-Y1432 HydrophobicContact CD1-CD1 3.66Å; F1324-Y1432 HydrophobicContact CD1-CE1 4.11Å; F1324-Y1432 HydrophobicContact CE1-CD1 4.23Å; F1324-Y1432 HydrophobicContact CG-CD1 4.4Å; F1324-Y1432 HydrophobicContact CG-CE1 4.44Å; Y1432-Q1437 HydrophobicContact CE2-CB 4.23Å; Y1432-Q1437 HydrophobicContact CE2-CG 4.49Å; Y1432-I1440 HydrophobicContact CD1-CD1 4.41Å; Y1432-I1440 HydrophobicContact CD2-CD1 3.6Å; Y1432-I1440 HydrophobicContact CE2-CD1 4.04Å; Y1432-I1440 HydrophobicContact CG-CD1 3.83Å
1433	P	58.6	Low	54	Low	8 Å²	8	50.9 Å²	50.9	5%	0.052	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	133.5	175	-12	28	0	0	0	111.9	L1248 V1319 T1320 L1321 L1435 F1436 I1460	L1248-P1433 HydrophobicContact CD1-CG 4.13Å; V1319-P1433 HydrophobicContact CG1-CB 3.8Å; T1320-P1433 WeakPolarHBondContact O-CA 3.36Å; L1321-P1433 HydrophobicContact CD2-CB 4.48Å; L1321-P1433 HydrophobicContact CD2-CG 4.48Å; P1433-L1435 PolarHBondContact O-N 2.72Å; P1433-F1436 HydrophobicContact CB-CD2 3.95Å; P1433-F1436 HydrophobicContact CB-CE2 4.16Å; P1433-F1436 HydrophobicContact CG-CD2 4Å; P1433-F1436 HydrophobicContact CG-CE2 4.03Å; P1433-F1436 PolarHBondContact O-N 3.4Å; P1433-I1460 HydrophobicContact CG-CD1 4.4Å
1434	T	60.2	Low	53	Low	30 Å²	30	57.4 Å²	57.4	18%	0.184	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-57.1	-24.4	-178.5	54.7	0	0	0	0	114.1	T1320 S1322 T1401 F1436 Q1437	T1320-T1434 VanDerWaalsContact CB-OG1 3.26Å; T1320-T1434 WeakPolarHBondContact CB-OG1 3.45Å; T1320-T1434 HydrophobicContact CG2-CG2 4.5Å; T1320-T1434 PolarHBondContact O-N 3.43Å; T1320-T1434 PolarHBondContact O-OG1 2.04Å; T1320-T1434 PolarHBondContact OG1-OG1 3.06Å; S1322-T1434 WeakPolarHBondContact OG-CG2 3.4Å; T1401-T1434 HydrophobicContact CG2-CG2 4.26Å; T1434-F1436 PolarHBondContact O-N 2.74Å; T1434-Q1437 WeakPolarHBondContact O-CB 3.3Å; T1434-Q1437 PolarHBondContact O-N 3.34Å
1435	L	54.4	Low	52.1	Low	129 Å²	129	62.3 Å²	62.3	68%	0.675	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-53.3	-16.9	171.9	-75.5	163.2	0	0	0	114.1	V1319 P1433	V1319-L1435 HydrophobicContact CG1-CD1 4.08Å; V1319-L1435 HydrophobicContact CG2-CD1 4.16Å; P1433-L1435 PolarHBondContact O-N 2.72Å
1436	F	48.6	Very low	50.7	Low	73 Å²	73	67.2 Å²	67.2	32%	0.32	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-106.2	2.6	177	-59.8	-78	0	0	0	114.3	P1433 T1434 S1438 N1439 I1440 L1458	P1433-F1436 HydrophobicContact CB-CD2 3.95Å; P1433-F1436 HydrophobicContact CB-CE2 4.16Å; P1433-F1436 HydrophobicContact CG-CD2 4Å; P1433-F1436 HydrophobicContact CG-CE2 4.03Å; P1433-F1436 PolarHBondContact O-N 3.4Å; T1434-F1436 PolarHBondContact O-N 2.74Å; F1436-S1438 VanDerWaalsContact C-N 3.33Å; F1436-S1438 PolarHBondContact O-N 2.69Å; F1436-N1439 PolarHBondContact O-N 2.84Å; F1436-N1439 VanDerWaalsContact O-N 3.1Å; F1436-I1440 HydrophobicContact CB-CD1 3.94Å; F1436-I1440 HydrophobicContact CB-CG1 4.43Å; F1436-I1440 WeakPolarHBondContact O-CG1 3.29Å; F1436-I1440 PolarHBondContact O-N 3.17Å; F1436-I1440 VanDerWaalsContact O-N 3.12Å; F1436-L1458 HydrophobicContact CE1-CD1 4.17Å; F1436-L1458 HydrophobicContact CE2-CB 4.49Å; F1436-L1458 HydrophobicContact CE2-CD1 3.87Å; F1436-L1458 HydrophobicContact CZ-CD1 3.5Å; F1436-L1458 VanDerWaalsContact CZ-CD1 3.5Å
1437	Q	44.4	Very low	49.4	Very low	89 Å²	89	71.5 Å²	71.5	42%	0.416	35%	0.352	S	S	.	.	H	α-helix	trans	-64	-31.2	-169.7	-173.9	164.1	-17.9	0	0	114.1	Y1432 T1434	Y1432-Q1437 HydrophobicContact CE2-CB 4.23Å; Y1432-Q1437 HydrophobicContact CE2-CG 4.49Å; T1434-Q1437 WeakPolarHBondContact O-CB 3.3Å; T1434-Q1437 PolarHBondContact O-N 3.34Å
1438	S	39.8	Very low	47.7	Very low	85 Å²	85	78.6 Å²	78.6	59%	0.594	39%	0.385	S	S	*	.	H	α-helix	trans	-66.3	-39	173.9	54.4	0	0	0	0	112.7	F1436	F1436-S1438 VanDerWaalsContact C-N 3.33Å; F1436-S1438 PolarHBondContact O-N 2.69Å
1439	N	42	Very low	45.7	Very low	103 Å²	103	80.5 Å²	80.5	55%	0.551	40%	0.4	S	S	*	.	H	α-helix	trans	-76.9	-42.5	-176.6	-69.1	11.3	0	0	0	110.9	F1436 L1441 Q1442 W1443	F1436-N1439 PolarHBondContact O-N 2.84Å; F1436-N1439 VanDerWaalsContact O-N 3.1Å; N1439-L1441 VanDerWaalsContact C-N 3.3Å; N1439-L1441 PolarHBondContact O-N 2.95Å; N1439-Q1442 PolarHBondContact O-N 2.82Å; N1439-W1443 WeakPolarHBondContact O-CB 3.38Å; N1439-W1443 PolarHBondContact O-N 3.27Å
1440	I	38.5	Very low	43.6	Very low	34 Å²	34	88.1 Å²	88.1	17%	0.174	44%	0.441	C	S	.	.	H	α-helix	trans	-60.8	-36.6	-173.1	-69.4	166.3	0	0	0	112.2	Y1432 F1436 W1444	Y1432-I1440 HydrophobicContact CD1-CD1 4.41Å; Y1432-I1440 HydrophobicContact CD2-CD1 3.6Å; Y1432-I1440 HydrophobicContact CE2-CD1 4.04Å; Y1432-I1440 HydrophobicContact CG-CD1 3.83Å; F1436-I1440 HydrophobicContact CB-CD1 3.94Å; F1436-I1440 HydrophobicContact CB-CG1 4.43Å; F1436-I1440 WeakPolarHBondContact O-CG1 3.29Å; F1436-I1440 PolarHBondContact O-N 3.17Å; F1436-I1440 VanDerWaalsContact O-N 3.12Å; I1440-W1444 HydrophobicContact CG2-CE3 3.88Å; I1440-W1444 HydrophobicContact CG2-CZ3 3.82Å; I1440-W1444 PolarHBondContact O-N 2.91Å
1441	L	37.5	Very low	41.9	Very low	127 Å²	127	95.7 Å²	95.7	67%	0.665	47%	0.474	S	S	*	.	H	α-helix	trans	-68.3	-49.4	178.1	-127.5	73.6	0	0	0	112.1	N1439 W1443 W1444	N1439-L1441 VanDerWaalsContact C-N 3.3Å; N1439-L1441 PolarHBondContact O-N 2.95Å; L1441-W1443 VanDerWaalsContact C-N 3.26Å; L1441-W1443 PolarHBondContact O-N 3.5Å; L1441-W1444 PolarHBondContact O-N 2.78Å
1442	Q	35.5	Very low	40	Very low	135 Å²	135	101.9 Å²	101.9	63%	0.631	51%	0.512	S	S	*	.	H	α-helix	trans	-64.4	-31.5	176.4	-69.2	-172.7	-28.6	0	0	112.7	N1439 W1444 L1446	N1439-Q1442 PolarHBondContact O-N 2.82Å; Q1442-W1444 VanDerWaalsContact C-N 3.31Å; Q1442-W1444 PolarHBondContact O-N 2.87Å; Q1442-L1446 WeakPolarHBondContact O-CG 3.48Å; Q1442-L1446 PolarHBondContact O-N 2.82Å; Q1442-L1446 VanDerWaalsContact O-N 3.14Å
1443	W	36.3	Very low	38.1	Very low	107 Å²	107	108.5 Å²	108.5	41%	0.405	55%	0.548	S	S	.	.	H	α-helix	trans	-70	-27.7	-179.1	-160	85.6	0	0	0	112.7	N1439 L1441 Q1447 I1457	N1439-W1443 WeakPolarHBondContact O-CB 3.38Å; N1439-W1443 PolarHBondContact O-N 3.27Å; L1441-W1443 VanDerWaalsContact C-N 3.26Å; L1441-W1443 PolarHBondContact O-N 3.5Å; W1443-Q1447 HydrophobicContact CD2-CG 4.23Å; W1443-Q1447 HydrophobicContact CE3-CG 3.72Å; W1443-Q1447 HydrophobicContact CH2-CG 3.77Å; W1443-Q1447 HydrophobicContact CZ2-CG 4.27Å; W1443-Q1447 VanDerWaalsContact CZ2-NE2 3.3Å; W1443-Q1447 HydrophobicContact CZ3-CG 3.48Å; W1443-Q1447 VanDerWaalsContact CZ3-CG 3.48Å; W1443-Q1447 WeakPolarHBondContact O-CG 3.14Å; W1443-Q1447 PolarHBondContact O-N 3.23Å; W1443-I1457 HydrophobicContact CE3-CD1 4.39Å; W1443-I1457 HydrophobicContact CH2-CD1 3.23Å; W1443-I1457 HydrophobicContact CZ2-CD1 3.46Å; W1443-I1457 VanDerWaalsContact CZ2-CD1 3.46Å; W1443-I1457 HydrophobicContact CZ2-CG1 4.37Å; W1443-I1457 HydrophobicContact CZ3-CD1 3.74Å
1444	W	34.9	Very low	36.8	Very low	162 Å²	162	116 Å²	116	61%	0.614	59%	0.587	S	S	*	*	H	α-helix	trans	-72.6	-36.4	177.5	-124.2	-58.3	0	0	0	113.2	I1440 L1441 Q1442	I1440-W1444 HydrophobicContact CG2-CE3 3.88Å; I1440-W1444 HydrophobicContact CG2-CZ3 3.82Å; I1440-W1444 PolarHBondContact O-N 2.91Å; L1441-W1444 PolarHBondContact O-N 2.78Å; Q1442-W1444 VanDerWaalsContact C-N 3.31Å; Q1442-W1444 PolarHBondContact O-N 2.87Å
1445	D	34	Very low	35.2	Very low	132 Å²	132	119 Å²	119	71%	0.706	61%	0.61	S	S	*	*	H	α-helix	trans	-69.6	-43.7	171.5	-73.5	-34.4	0	0	0	111.1	Q1447 Q1448	D1445-Q1447 VanDerWaalsContact C-N 3.28Å; D1445-Q1447 PolarHBondContact O-N 3.27Å; D1445-Q1448 PolarHBondContact O-N 3.08Å
1446	L	32.1	Very low	34.2	Very low	103 Å²	103	121.3 Å²	121.3	54%	0.539	62%	0.617	S	S	.	*	H	α-helix	trans	-62.6	-30.2	178.9	-79.7	165.4	0	0	0	113.4	Q1442 Q1448 S1449	Q1442-L1446 WeakPolarHBondContact O-CG 3.48Å; Q1442-L1446 PolarHBondContact O-N 2.82Å; Q1442-L1446 VanDerWaalsContact O-N 3.14Å; L1446-Q1448 PolarHBondContact O-N 2.83Å; L1446-Q1448 VanDerWaalsContact O-N 3.1Å; L1446-S1449 CarbonylContact O-C 3.55Å; L1446-S1449 PolarHBondContact O-N 3.11Å; L1446-S1449 PolarHBondContact O-OG 2.95Å
1447	Q	32.6	Very low	33.5	Very low	121 Å²	121	122.1 Å²	122.1	57%	0.565	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-17.6	175.9	-88.4	-77.1	-52.3	0	0	114.3	W1443 D1445	W1443-Q1447 HydrophobicContact CD2-CG 4.23Å; W1443-Q1447 HydrophobicContact CE3-CG 3.72Å; W1443-Q1447 HydrophobicContact CH2-CG 3.77Å; W1443-Q1447 HydrophobicContact CZ2-CG 4.27Å; W1443-Q1447 VanDerWaalsContact CZ2-NE2 3.3Å; W1443-Q1447 HydrophobicContact CZ3-CG 3.48Å; W1443-Q1447 VanDerWaalsContact CZ3-CG 3.48Å; W1443-Q1447 WeakPolarHBondContact O-CG 3.14Å; W1443-Q1447 PolarHBondContact O-N 3.23Å; D1445-Q1447 VanDerWaalsContact C-N 3.28Å; D1445-Q1447 PolarHBondContact O-N 3.27Å
1448	Q	34.1	Very low	33.1	Very low	151 Å²	151	121.1 Å²	121.1	71%	0.706	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-10.4	172.9	-60.6	-156.1	14.9	0	0	113.9	D1445 L1446	D1445-Q1448 PolarHBondContact O-N 3.08Å; L1446-Q1448 PolarHBondContact O-N 2.83Å; L1446-Q1448 VanDerWaalsContact O-N 3.1Å
1449	S	26.7	Very low	33	Very low	61 Å²	61	121.2 Å²	121.2	43%	0.427	61%	0.614	S	S	.	*	S	Bend	trans	-126.9	107.5	-177.1	63.5	0	0	0	0	113.2	L1446	L1446-S1449 CarbonylContact O-C 3.55Å; L1446-S1449 PolarHBondContact O-N 3.11Å; L1446-S1449 PolarHBondContact O-OG 2.95Å
1450	N	26.9	Very low	33.3	Very low	163 Å²	163	116.7 Å²	116.7	87%	0.872	59%	0.59	S	S	*	*			trans	77.9	143.1	173.9	-55.4	-41	0	0	0	117.3
1451	K	29.9	Very low	33.5	Very low	185 Å²	185	119.4 Å²	119.4	80%	0.804	60%	0.604	S	S	*	*			trans	-98.6	128.2	173.3	-53.5	164.1	-178.5	169.2	0	108.7
1452	T	26.4	Very low	34	Very low	130 Å²	130	113.9 Å²	113.9	80%	0.798	58%	0.576	S	S	*	*			trans	-169.9	109.5	141.6	34.3	0	0	0	0	109.1
1453	D	28	Very low	34.5	Very low	150 Å²	150	109.3 Å²	109.3	80%	0.802	56%	0.558	S	S	*	*			trans	35.9	136.6	138.3	-46.7	-19.9	0	0	0	122.1
1454	D	29.5	Very low	34.9	Very low	165 Å²	165	110 Å²	110	88%	0.882	56%	0.564	S	S	*	*			trans	54.1	89.2	153.8	-65.7	-4.6	0	0	0	120.9
1455	S	27.8	Very low	35.8	Very low	94 Å²	94	103.1 Å²	103.1	66%	0.657	54%	0.538	S	S	*	.			trans	-144.8	142	141	50	0	0	0	0	111.5
1456	H	33.1	Very low	36.3	Very low	178 Å²	178	98.2 Å²	98.2	82%	0.824	51%	0.514	S	S	*	.			trans	-78.8	123.7	-177.2	-65.8	-66.5	0	0	0	111.7
1457	I	34.1	Very low	37	Very low	89 Å²	89	93.5 Å²	93.5	46%	0.456	49%	0.49	S	S	.	.			trans	-98	126	-178.8	-53.7	166	0	0	0	109.7	W1443 L1459	W1443-I1457 HydrophobicContact CE3-CD1 4.39Å; W1443-I1457 HydrophobicContact CH2-CD1 3.23Å; W1443-I1457 HydrophobicContact CZ2-CD1 3.46Å; W1443-I1457 VanDerWaalsContact CZ2-CD1 3.46Å; W1443-I1457 HydrophobicContact CZ2-CG1 4.37Å; W1443-I1457 HydrophobicContact CZ3-CD1 3.74Å; I1457-L1459 VanDerWaalsContact C-N 3.25Å; I1457-L1459 HydrophobicContact CG2-CD1 4.26Å; I1457-L1459 HydrophobicContact CG2-CG 4.15Å; I1457-L1459 PolarHBondContact O-N 3.45Å
1458	L	35	Very low	37.7	Very low	69 Å²	69	89.7 Å²	89.7	36%	0.361	47%	0.472	S	S	.	.			trans	-83.6	62.9	-179.9	-73.1	165.6	0	0	0	112.3	F1235 F1436	F1235-L1458 HydrophobicContact CD1-CD2 4.17Å; F1235-L1458 HydrophobicContact CE1-CD2 3.63Å; F1436-L1458 HydrophobicContact CE1-CD1 4.17Å; F1436-L1458 HydrophobicContact CE2-CB 4.49Å; F1436-L1458 HydrophobicContact CE2-CD1 3.87Å; F1436-L1458 HydrophobicContact CZ-CD1 3.5Å; F1436-L1458 VanDerWaalsContact CZ-CD1 3.5Å
1459	L	38.2	Very low	38.1	Very low	87 Å²	87	82.5 Å²	82.5	46%	0.455	44%	0.439	S	S	.	.			trans	-83.4	121.1	163.6	-83.2	165.7	0	0	0	109.3	F1324 I1457 D1461	F1324-L1459 HydrophobicContact CE1-CD2 3.53Å; F1324-L1459 HydrophobicContact CZ-CD2 3.52Å; I1457-L1459 VanDerWaalsContact C-N 3.25Å; I1457-L1459 HydrophobicContact CG2-CD1 4.26Å; I1457-L1459 HydrophobicContact CG2-CG 4.15Å; I1457-L1459 PolarHBondContact O-N 3.45Å; L1459-D1461 PolarHBondContact O-N 3.36Å
1460	I	47.9	Very low	38.8	Very low	8 Å²	8	83.4 Å²	83.4	4%	0.041	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	87.9	177.2	-56.8	175.6	0	0	0	107.7	F1231 F1235 L1248 L1431 P1433 L1462	F1231-I1460 HydrophobicContact CD1-CG2 4.12Å; F1231-I1460 HydrophobicContact CE1-CG2 3.59Å; F1231-I1460 HydrophobicContact CZ-CG2 4.29Å; F1235-I1460 HydrophobicContact CZ-CD1 4.4Å; F1235-I1460 HydrophobicContact CZ-CG1 4.36Å; L1248-I1460 HydrophobicContact CD1-CD1 4.13Å; L1248-I1460 HydrophobicContact CD2-CD1 3.9Å; L1431-I1460 HydrophobicContact CD1-CB 3.7Å; L1431-I1460 HydrophobicContact CD1-CG2 3.65Å; L1431-I1460 WeakPolarHBondContact CD1-O 3.42Å; L1431-I1460 PolarHBondContact N-O 2.78Å; L1431-I1460 WeakPolarHBondContact O-CA 3.13Å; L1431-I1460 WeakPolarHBondContact O-CB 3.46Å; L1431-I1460 PolarHBondContact O-N 2.83Å; P1433-I1460 HydrophobicContact CG-CD1 4.4Å; I1460-L1462 PolarHBondContact O-N 3.02Å
1461	D	44	Very low	39.4	Very low	90 Å²	90	78.5 Å²	78.5	48%	0.481	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	110.3	169	-92	3.6	0	0	0	109.5	Q1430 L1459	Q1430-D1461 WeakPolarHBondContact CG-OD1 3.38Å; Q1430-D1461 PolarHBondContact NE2-OD1 2.9Å; L1459-D1461 PolarHBondContact O-N 3.36Å
1462	L	47.1	Very low	40	Very low	12 Å²	12	74.5 Å²	74.5	6%	0.063	40%	0.396	C	S	.	.			trans	-69.4	145.6	173.9	-78.5	160.5	0	0	0	110.7	L1229 F1231 F1252 I1429 L1431 I1460 K1464	L1229-L1462 HydrophobicContact CD1-CD2 3.63Å; F1231-L1462 HydrophobicContact CE1-CD2 4.06Å; F1231-L1462 HydrophobicContact CZ-CD2 4.02Å; F1252-L1462 HydrophobicContact CZ-CD1 4.13Å; F1252-L1462 HydrophobicContact CZ-CD2 4.25Å; I1429-L1462 HydrophobicContact CB-CB 4.38Å; I1429-L1462 HydrophobicContact CB-CD1 3.73Å; I1429-L1462 HydrophobicContact CD1-CD1 4.46Å; I1429-L1462 HydrophobicContact CG2-CD1 3.63Å; I1429-L1462 PolarHBondContact O-N 2.97Å; L1431-L1462 HydrophobicContact CD1-CD1 4.17Å; L1431-L1462 HydrophobicContact CD1-CG 4.39Å; L1431-L1462 HydrophobicContact CD2-CD1 4.09Å; L1431-L1462 HydrophobicContact CG-CD1 4.14Å; I1460-L1462 PolarHBondContact O-N 3.02Å; L1462-K1464 PolarHBondContact O-N 3.1Å
1463	P	46.2	Very low	40.6	Very low	39 Å²	39	71.7 Å²	71.7	25%	0.253	39%	0.386	S	S	.	.			trans	-61	126.6	-177.9	25.2	-34.1	0	0	0	110.6	I1183 L1229 I1465	I1183-P1463 HydrophobicContact CG2-CB 4.35Å; I1183-P1463 HydrophobicContact CG2-CG 4.23Å; L1229-P1463 HydrophobicContact CD1-CG 4.31Å; P1463-I1465 VanDerWaalsContact O-CG1 3.31Å; P1463-I1465 WeakPolarHBondContact O-CG1 3.26Å; P1463-I1465 PolarHBondContact O-N 3.32Å
1464	K	45.1	Very low	41.4	Very low	122 Å²	122	70.9 Å²	70.9	53%	0.53	38%	0.382	S	S	.	.			trans	-52.8	114.6	-172.4	-65.1	-174.8	179.3	-177.8	0	111.6	L1462 S1466	L1462-K1464 PolarHBondContact O-N 3.1Å; K1464-S1466 PolarHBondContact O-N 3.34Å
1465	I	54	Low	41.9	Very low	16 Å²	16	65.4 Å²	65.4	8%	0.082	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	111.1	-172.3	-58.5	179.5	0	0	0	108.3	L1181 F1252 N1426 L1427 I1429 P1463	L1181-I1465 HydrophobicContact CD2-CG2 3.31Å; F1252-I1465 HydrophobicContact CE1-CD1 4.48Å; N1426-I1465 WeakPolarHBondContact CA-O 3.34Å; L1427-I1465 HydrophobicContact CB-CB 4.24Å; L1427-I1465 HydrophobicContact CD2-CD1 4.47Å; L1427-I1465 PolarHBondContact N-O 3.03Å; L1427-I1465 PolarHBondContact O-N 2.92Å; I1429-I1465 HydrophobicContact CD1-CD1 4.38Å; P1463-I1465 VanDerWaalsContact O-CG1 3.31Å; P1463-I1465 WeakPolarHBondContact O-CG1 3.26Å; P1463-I1465 PolarHBondContact O-N 3.32Å
1466	S	44.4	Very low	42.8	Very low	29 Å²	29	62.7 Å²	62.7	20%	0.203	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	118.3	177.9	68.1	0	0	0	0	111.2	Y1182 K1464	Y1182-S1466 PolarHBondContact N-O 2.86Å; Y1182-S1466 PolarHBondContact O-N 2.96Å; Y1182-S1466 PolarHBondContact O-OG 3.4Å; K1464-S1466 PolarHBondContact O-N 3.34Å
1467	L	46.1	Very low	43.3	Very low	4 Å²	4	56.1 Å²	56.1	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	124.1	175.8	-63.2	171.2	0	0	0	108.9	L1181 L1328 L1412 T1424 A1425 L1427	L1181-L1467 HydrophobicContact CD2-CD2 3.7Å; L1181-L1467 HydrophobicContact CG-CD2 4.34Å; L1328-L1467 HydrophobicContact CD2-CD1 3.76Å; L1412-L1467 HydrophobicContact CD1-CD1 4.27Å; L1412-L1467 HydrophobicContact CD1-CD2 3.94Å; L1412-L1467 HydrophobicContact CD2-CD1 3.92Å; T1424-L1467 VanDerWaalsContact CA-O 3.25Å; T1424-L1467 WeakPolarHBondContact CA-O 3.41Å; A1425-L1467 PolarHBondContact N-O 2.86Å; A1425-L1467 VanDerWaalsContact N-O 3.13Å; A1425-L1467 WeakPolarHBondContact O-CB 3.4Å; A1425-L1467 PolarHBondContact O-N 2.97Å; L1427-L1467 HydrophobicContact CB-CD1 4.09Å; L1427-L1467 HydrophobicContact CB-CG 4.39Å
1468	Q	46.5	Very low	43.7	Very low	41 Å²	41	54.5 Å²	54.5	19%	0.192	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	110.7	-177.3	-175.9	169.3	-40.6	0	0	111.4	D1180 F1422 T1424 I1470	D1180-Q1468 PolarHBondContact N-O 2.86Å; D1180-Q1468 PolarHBondContact O-N 2.82Å; F1422-Q1468 HydrophobicContact CE2-CG 4.02Å; F1422-Q1468 HydrophobicContact CZ-CG 4.16Å; T1424-Q1468 HydrophobicContact CG2-CB 4.03Å; T1424-Q1468 HydrophobicContact CG2-CG 3.84Å; Q1468-I1470 HydrophobicContact CG-CD1 4.32Å; Q1468-I1470 HydrophobicContact CG-CG1 3.93Å
1469	A	42.5	Very low	44	Very low	1 Å²	1	52.4 Å²	52.4	1%	0.008	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	122	171.5	0	0	0	0	0	110.2	F1368 L1423 F1471	F1368-A1469 HydrophobicContact CE1-CB 4.49Å; F1368-A1469 HydrophobicContact CZ-CB 3.75Å; L1423-A1469 PolarHBondContact N-O 2.94Å; L1423-A1469 PolarHBondContact O-N 2.76Å; L1423-A1469 VanDerWaalsContact O-N 3.11Å; A1469-F1471 HydrophobicContact CB-CE2 4.19Å
1470	I	41.2	Very low	44.2	Very low	79 Å²	79	52 Å²	52	41%	0.405	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	112.6	176.9	-42	176.9	0	0	0	109.1	F1422 Q1468	F1422-I1470 HydrophobicContact CD2-CG1 4.42Å; F1422-I1470 HydrophobicContact CE2-CG1 4.36Å; Q1468-I1470 HydrophobicContact CG-CD1 4.32Å; Q1468-I1470 HydrophobicContact CG-CG1 3.93Å
1471	F	39.4	Very low	44	Very low	60 Å²	60	55.8 Å²	55.8	26%	0.263	32%	0.323	S	S	.	.			trans	-95.3	106.6	175.3	-68.4	-80.1	0	0	0	110.7	L1307 H1414 P1416 A1469 A1473 L1476	L1307-F1471 HydrophobicContact CD1-CE1 3.81Å; L1307-F1471 HydrophobicContact CD1-CZ 3.69Å; H1414-F1471 AromaticContact NE2-CE2 3.83Å; P1416-F1471 HydrophobicContact CB-CZ 4.22Å; A1469-F1471 HydrophobicContact CB-CE2 4.19Å; F1471-A1473 PolarHBondContact O-N 3.45Å; F1471-A1473 VanDerWaalsContact O-N 3.17Å; F1471-L1476 HydrophobicContact CB-CD1 4.39Å; F1471-L1476 HydrophobicContact CD1-CD1 4.37Å
1472	N	43.1	Very low	43.7	Very low	102 Å²	102	55.7 Å²	55.7	55%	0.545	32%	0.322	S	S	.	.			trans	-61	116.9	171.7	176.1	-20.2	0	0	0	109.4	N1474 L1475 L1476	N1472-N1474 PolarHBondContact O-N 2.88Å; N1472-N1474 VanDerWaalsContact O-N 3.08Å; N1472-N1474 PolarHBondContact OD1-N 3.28Å; N1472-L1475 HydrophobicContact CB-CB 4.2Å; N1472-L1475 CarbonylContact O-C 3.43Å; N1472-L1475 WeakPolarHBondContact O-CA 3.18Å; N1472-L1475 PolarHBondContact O-N 2.82Å; N1472-L1476 PolarHBondContact O-N 3.07Å
1473	A	39.7	Very low	42.9	Very low	71 Å²	71	57 Å²	57	59%	0.587	33%	0.329	S	S	*	.	H	α-helix	trans	-54.5	-31.2	-174.9	0	0	0	0	0	114.5	F1471 G1477	F1471-A1473 PolarHBondContact O-N 3.45Å; F1471-A1473 VanDerWaalsContact O-N 3.17Å; A1473-G1477 PolarHBondContact O-N 2.89Å
1474	N	44.8	Very low	42.2	Very low	132 Å²	132	60 Å²	60	71%	0.706	35%	0.348	S	S	*	.	H	α-helix	trans	-75	-34.2	176.6	-69.1	-10.3	0	0	0	112.1	N1472 S1478	N1472-N1474 PolarHBondContact O-N 2.88Å; N1472-N1474 VanDerWaalsContact O-N 3.08Å; N1472-N1474 PolarHBondContact OD1-N 3.28Å; N1474-S1478 WeakPolarHBondContact O-CB 3.42Å; N1474-S1478 PolarHBondContact O-N 2.81Å; N1474-S1478 PolarHBondContact O-OG 3.02Å
1475	L	40.5	Very low	41.5	Very low	51 Å²	51	62.3 Å²	62.3	27%	0.267	35%	0.354	S	S	.	.	H	α-helix	trans	-79.8	-31.8	175.3	-164.5	139.4	0	0	0	111.3	P1177 N1472 S1478 C1479	P1177-L1475 HydrophobicContact CB-CD2 4.35Å; P1177-L1475 HydrophobicContact CG-CD1 4.31Å; P1177-L1475 HydrophobicContact CG-CD2 4.01Å; N1472-L1475 HydrophobicContact CB-CB 4.2Å; N1472-L1475 CarbonylContact O-C 3.43Å; N1472-L1475 WeakPolarHBondContact O-CA 3.18Å; N1472-L1475 PolarHBondContact O-N 2.82Å; L1475-S1478 WeakPolarHBondContact O-CB 3.14Å; L1475-S1478 PolarHBondContact O-N 2.94Å; L1475-C1479 WeakPolarHBondContact O-CB 3.44Å; L1475-C1479 PolarHBondContact O-N 3.16Å
1476	L	45.6	Very low	40.5	Very low	37 Å²	37	63.9 Å²	63.9	19%	0.194	37%	0.365	C	S	.	.	H	α-helix	trans	-61.6	-46.7	167.3	-169.8	70.6	0	0	0	110.5	F1418 F1471 N1472 S1478 C1479 L1480	F1418-L1476 HydrophobicContact CD1-CD1 4.08Å; F1418-L1476 HydrophobicContact CE1-CD1 3.99Å; F1471-L1476 HydrophobicContact CB-CD1 4.39Å; F1471-L1476 HydrophobicContact CD1-CD1 4.37Å; N1472-L1476 PolarHBondContact O-N 3.07Å; L1476-S1478 VanDerWaalsContact C-N 3.3Å; L1476-S1478 PolarHBondContact O-N 2.93Å; L1476-C1479 PolarHBondContact O-N 3.32Å; L1476-L1480 HydrophobicContact CG-CD1 4.05Å; L1476-L1480 VanDerWaalsContact O-CB 3.28Å; L1476-L1480 WeakPolarHBondContact O-CB 3.18Å; L1476-L1480 VanDerWaalsContact O-CG 3.24Å; L1476-L1480 WeakPolarHBondContact O-CG 3.32Å; L1476-L1480 PolarHBondContact O-N 3.31Å
1477	G	43.1	Very low	40	Very low	40 Å²	40	67.1 Å²	67.1	41%	0.412	39%	0.388	S	S	.	.	H	α-helix	trans	-61.5	-35.2	172.2	0	0	0	0	0	113.4	A1473 S1481	A1473-G1477 PolarHBondContact O-N 2.89Å; G1477-S1481 PolarHBondContact O-N 3.39Å
1478	S	44.5	Very low	39.7	Very low	55 Å²	55	72 Å²	72	39%	0.385	41%	0.413	S	S	.	.	H	α-helix	trans	-69.4	-47.1	175.2	-58.7	0	0	0	0	111.7	N1474 L1475 L1476 S1481 L1482	N1474-S1478 WeakPolarHBondContact O-CB 3.42Å; N1474-S1478 PolarHBondContact O-N 2.81Å; N1474-S1478 PolarHBondContact O-OG 3.02Å; L1475-S1478 WeakPolarHBondContact O-CB 3.14Å; L1475-S1478 PolarHBondContact O-N 2.94Å; L1476-S1478 VanDerWaalsContact C-N 3.3Å; L1476-S1478 PolarHBondContact O-N 2.93Å; S1478-S1481 CarbonylContact O-C 3.52Å; S1478-S1481 WeakPolarHBondContact O-CA 3.5Å; S1478-S1481 WeakPolarHBondContact O-CB 3.43Å; S1478-S1481 PolarHBondContact O-N 3.45Å; S1478-S1481 PolarHBondContact O-OG 3.23Å; S1478-L1482 PolarHBondContact O-N 3.11Å
1479	C	41.1	Very low	39.2	Very low	24 Å²	24	76.1 Å²	76.1	16%	0.162	43%	0.432	C	S	.	.	H	α-helix	trans	-62.5	-41.7	173	-75.3	0	0	0	0	111.4	C1263 L1475 L1476 S1481 L1482 L1483	C1263-C1479 WeakPolarHBondContact CB-SG 3.46Å; C1263-C1479 VanDerWaalsContact SG-CA 3.56Å; C1263-C1479 WeakPolarHBondContact SG-CB 3.44Å; C1263-C1479 CovalentContact SG-SG 2.05Å; C1263-C1479 PolarHBondContact SG-SG 3.48Å; L1475-C1479 WeakPolarHBondContact O-CB 3.44Å; L1475-C1479 PolarHBondContact O-N 3.16Å; L1476-C1479 PolarHBondContact O-N 3.32Å; C1479-S1481 PolarHBondContact O-N 3.21Å; C1479-L1482 PolarHBondContact O-N 2.9Å; C1479-L1483 VanDerWaalsContact O-CB 3.32Å; C1479-L1483 WeakPolarHBondContact O-CB 3.33Å; C1479-L1483 WeakPolarHBondContact O-CG 3.48Å; C1479-L1483 PolarHBondContact O-N 3.02Å
1480	L	42.4	Very low	39	Very low	78 Å²	78	79.5 Å²	79.5	41%	0.408	46%	0.456	S	S	.	.	H	α-helix	trans	-64.8	-5.2	171.7	-71.8	167	0	0	0	114.2	L1476 L1483	L1476-L1480 HydrophobicContact CG-CD1 4.05Å; L1476-L1480 VanDerWaalsContact O-CB 3.28Å; L1476-L1480 WeakPolarHBondContact O-CB 3.18Å; L1476-L1480 VanDerWaalsContact O-CG 3.24Å; L1476-L1480 WeakPolarHBondContact O-CG 3.32Å; L1476-L1480 PolarHBondContact O-N 3.31Å; L1480-L1483 HydrophobicContact CD2-CD1 4.4Å
1481	S	41.9	Very low	39.2	Very low	88 Å²	88	82 Å²	82	62%	0.615	46%	0.464	S	S	*	.	H	α-helix	trans	-109.2	-15.9	170.3	78.7	0	0	0	0	114.5	G1477 S1478 C1479	G1477-S1481 PolarHBondContact O-N 3.39Å; S1478-S1481 CarbonylContact O-C 3.52Å; S1478-S1481 WeakPolarHBondContact O-CA 3.5Å; S1478-S1481 WeakPolarHBondContact O-CB 3.43Å; S1478-S1481 PolarHBondContact O-N 3.45Å; S1478-S1481 PolarHBondContact O-OG 3.23Å; C1479-S1481 PolarHBondContact O-N 3.21Å
1482	L	37.9	Very low	39.4	Very low	89 Å²	89	83.4 Å²	83.4	47%	0.466	47%	0.474	S	S	.	.	H	α-helix	trans	-101.5	-29.9	178.9	-81.2	167	0	0	0	113.1	S1478 C1479	S1478-L1482 PolarHBondContact O-N 3.11Å; C1479-L1482 PolarHBondContact O-N 2.9Å
1483	L	31.1	Very low	39.3	Very low	38 Å²	38	82.1 Å²	82.1	20%	0.199	47%	0.472	C	S	.	.	S	Bend	trans	-52.1	144.2	158.9	-72.4	175.2	0	0	0	108.7	L1305 C1479 L1480 R1485	L1305-L1483 HydrophobicContact CD1-CD1 3.67Å; L1305-L1483 HydrophobicContact CD1-CD2 3.65Å; L1305-L1483 HydrophobicContact CD1-CG 4.32Å; L1305-L1483 HydrophobicContact CD2-CD2 3.61Å; L1305-L1483 HydrophobicContact CG-CD2 4.19Å; C1479-L1483 VanDerWaalsContact O-CB 3.32Å; C1479-L1483 WeakPolarHBondContact O-CB 3.33Å; C1479-L1483 WeakPolarHBondContact O-CG 3.48Å; C1479-L1483 PolarHBondContact O-N 3.02Å; L1480-L1483 HydrophobicContact CD2-CD1 4.4Å; L1483-R1485 PolarHBondContact O-N 3.22Å
1484	P	31.8	Very low	39.9	Very low	102 Å²	102	83.9 Å²	83.9	66%	0.662	47%	0.47	S	S	*	.			trans	-66	88.2	161.3	31.1	-33.1	0	0	0	108.2	P1486	P1484-P1486 WeakPolarHBondContact O-CD 3.48Å; P1484-P1486 VanDerWaalsContact O-N 3.1Å
1485	R	29.2	Very low	40.3	Very low	171 Å²	171	79.6 Å²	79.6	65%	0.645	45%	0.449	S	S	*	.			trans	-40.9	119.6	130.2	-77.2	-170.8	-179.2	-149.8	-2.6	104.3	L1483 S1487	L1483-R1485 PolarHBondContact O-N 3.22Å; R1485-S1487 PolarHBondContact O-N 3.01Å; R1485-S1487 VanDerWaalsContact O-N 3.14Å
1486	P	33.3	Very low	41.4	Very low	49 Å²	49	81 Å²	81	32%	0.318	46%	0.459	S	S	.	.			trans	-50.6	133.4	-175	-27.5	33.7	0	0	0	108.1	P1484 I1488 E1489	P1484-P1486 WeakPolarHBondContact O-CD 3.48Å; P1484-P1486 VanDerWaalsContact O-N 3.1Å; P1486-I1488 HydrophobicContact CB-CB 3.57Å; P1486-I1488 HydrophobicContact CB-CG2 3.52Å; P1486-I1488 CarbonylContact O-C 3.52Å; P1486-I1488 PolarHBondContact O-N 2.98Å; P1486-E1489 HydrophobicContact CB-CB 4.21Å; P1486-E1489 HydrophobicContact CG-CB 4.28Å; P1486-E1489 PolarHBondContact O-N 3.33Å
1487	S	33.7	Very low	42.4	Very low	98 Å²	98	85 Å²	85	69%	0.685	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	49.1	168.6	51.6	0	0	0	0	108.9	R1485 F1491	R1485-S1487 PolarHBondContact O-N 3.01Å; R1485-S1487 VanDerWaalsContact O-N 3.14Å; S1487-F1491 WeakPolarHBondContact O-CB 3.47Å
1488	I	39.9	Very low	43.6	Very low	105 Å²	105	87.5 Å²	87.5	54%	0.538	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-172.1	-17.6	-151.1	-94.6	164.6	0	0	0	108.2	P1486 F1491 L1492	P1486-I1488 HydrophobicContact CB-CB 3.57Å; P1486-I1488 HydrophobicContact CB-CG2 3.52Å; P1486-I1488 CarbonylContact O-C 3.52Å; P1486-I1488 PolarHBondContact O-N 2.98Å; I1488-F1491 VanDerWaalsContact N-CB 3.32Å; I1488-L1492 HydrophobicContact CB-CD1 4.16Å; I1488-L1492 HydrophobicContact CG1-CD1 4.01Å; I1488-L1492 HydrophobicContact CG2-CD1 4.17Å; I1488-L1492 WeakPolarHBondContact O-CA 3.15Å; I1488-L1492 WeakPolarHBondContact O-CB 3.23Å; I1488-L1492 WeakPolarHBondContact O-CD1 3.26Å; I1488-L1492 WeakPolarHBondContact O-CG 3.34Å; I1488-L1492 PolarHBondContact O-N 3.11Å
1489	E	36.7	Very low	44.7	Very low	129 Å²	129	90.6 Å²	90.6	60%	0.603	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-42.2	168.4	-163.7	-172	-124.5	0	0	111.5	P1486 S1493	P1486-E1489 HydrophobicContact CB-CB 4.21Å; P1486-E1489 HydrophobicContact CG-CB 4.28Å; P1486-E1489 PolarHBondContact O-N 3.33Å; E1489-S1493 VanDerWaalsContact O-CA 3.3Å; E1489-S1493 WeakPolarHBondContact O-CA 3.38Å; E1489-S1493 WeakPolarHBondContact O-CB 3.29Å; E1489-S1493 PolarHBondContact O-N 3.39Å
1490	S	38.3	Very low	46.1	Very low	72 Å²	72	96.4 Å²	96.4	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-76.6	-17.2	159.5	-164.9	0	0	0	0	111.7	M1494	S1490-M1494 WeakPolarHBondContact O-CB 3.5Å; S1490-M1494 WeakPolarHBondContact O-CG 3.1Å; S1490-M1494 PolarHBondContact O-N 3.34Å
1491	F	45.5	Very low	47.6	Very low	131 Å²	131	96.4 Å²	96.4	58%	0.575	51%	0.505	S	S	*	.	H	α-helix	trans	-98.7	-24.3	175.1	-148.7	-90.9	0	0	0	113.5	S1487 I1488 T1495	S1487-F1491 WeakPolarHBondContact O-CB 3.47Å; I1488-F1491 VanDerWaalsContact N-CB 3.32Å; F1491-T1495 VanDerWaalsContact CD1-OG1 3.28Å; F1491-T1495 WeakPolarHBondContact CD1-OG1 3.39Å; F1491-T1495 WeakPolarHBondContact CE1-OG1 3.5Å; F1491-T1495 VanDerWaalsContact O-CA 3.29Å; F1491-T1495 WeakPolarHBondContact O-CA 3.05Å; F1491-T1495 WeakPolarHBondContact O-CB 3.07Å; F1491-T1495 PolarHBondContact O-N 3.38Å; F1491-T1495 PolarHBondContact O-OG1 3.48Å
1492	L	44.2	Very low	48.9	Very low	90 Å²	90	96.7 Å²	96.7	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-83.3	-22.4	155.6	-81.3	63.4	0	0	0	111.1	I1488 V1496	I1488-L1492 HydrophobicContact CB-CD1 4.16Å; I1488-L1492 HydrophobicContact CG1-CD1 4.01Å; I1488-L1492 HydrophobicContact CG2-CD1 4.17Å; I1488-L1492 WeakPolarHBondContact O-CA 3.15Å; I1488-L1492 WeakPolarHBondContact O-CB 3.23Å; I1488-L1492 WeakPolarHBondContact O-CD1 3.26Å; I1488-L1492 WeakPolarHBondContact O-CG 3.34Å; I1488-L1492 PolarHBondContact O-N 3.11Å; L1492-V1496 HydrophobicContact CB-CG2 3.91Å; L1492-V1496 HydrophobicContact CD2-CG2 4.41Å; L1492-V1496 HydrophobicContact CG-CG2 4.21Å; L1492-V1496 VanDerWaalsContact O-CA 3.23Å; L1492-V1496 WeakPolarHBondContact O-CA 3.33Å; L1492-V1496 WeakPolarHBondContact O-CB 3.21Å; L1492-V1496 WeakPolarHBondContact O-CG2 3.34Å; L1492-V1496 PolarHBondContact O-N 3.33Å
1493	S	40.7	Very low	50.3	Low	74 Å²	74	96.8 Å²	96.8	52%	0.517	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-50.9	164	-175.9	0	0	0	0	108.6	E1489 T1495 F1497	E1489-S1493 VanDerWaalsContact O-CA 3.3Å; E1489-S1493 WeakPolarHBondContact O-CA 3.38Å; E1489-S1493 WeakPolarHBondContact O-CB 3.29Å; E1489-S1493 PolarHBondContact O-N 3.39Å; S1493-T1495 PolarHBondContact O-N 2.92Å; S1493-F1497 WeakPolarHBondContact O-CA 3.27Å; S1493-F1497 WeakPolarHBondContact O-CB 3.38Å; S1493-F1497 PolarHBondContact O-N 3.41Å
1494	M	51.2	Low	52.3	Low	109 Å²	109	98.2 Å²	98.2	54%	0.537	51%	0.507	S	S	.	.	H	α-helix	trans	-70.9	-26.2	174.6	-78.1	-68.7	-176.6	0	0	115.1	S1490 L1498	S1490-M1494 WeakPolarHBondContact O-CB 3.5Å; S1490-M1494 WeakPolarHBondContact O-CG 3.1Å; S1490-M1494 PolarHBondContact O-N 3.34Å; M1494-L1498 WeakPolarHBondContact O-CA 3.37Å; M1494-L1498 WeakPolarHBondContact O-CB 2.91Å; M1494-L1498 WeakPolarHBondContact O-CD1 3.48Å; M1494-L1498 PolarHBondContact O-N 2.92Å
1495	T	53.1	Low	54.3	Low	42 Å²	42	96 Å²	96	26%	0.258	49%	0.492	S	S	.	.	H	α-helix	trans	-97.2	-21.4	-179.8	-52.3	0	0	0	0	113.1	F1491 S1493 F1499	F1491-T1495 VanDerWaalsContact CD1-OG1 3.28Å; F1491-T1495 WeakPolarHBondContact CD1-OG1 3.39Å; F1491-T1495 WeakPolarHBondContact CE1-OG1 3.5Å; F1491-T1495 VanDerWaalsContact O-CA 3.29Å; F1491-T1495 WeakPolarHBondContact O-CA 3.05Å; F1491-T1495 WeakPolarHBondContact O-CB 3.07Å; F1491-T1495 PolarHBondContact O-N 3.38Å; F1491-T1495 PolarHBondContact O-OG1 3.48Å; S1493-T1495 PolarHBondContact O-N 2.92Å; T1495-F1499 HydrophobicContact CG2-CD2 3.72Å; T1495-F1499 HydrophobicContact CG2-CE2 3.65Å; T1495-F1499 HydrophobicContact CG2-CZ 4.46Å; T1495-F1499 WeakPolarHBondContact O-CA 3.41Å; T1495-F1499 WeakPolarHBondContact O-CB 3.46Å; T1495-F1499 WeakPolarHBondContact O-CD2 3.45Å; T1495-F1499 VanDerWaalsContact O-CG 3.23Å; T1495-F1499 WeakPolarHBondContact O-CG 3.31Å; T1495-F1499 PolarHBondContact O-N 3.17Å
1496	V	64.3	Low	56.1	Low	80 Å²	80	89.6 Å²	89.6	49%	0.485	48%	0.475	S	S	.	.	H	α-helix	trans	-79	-36.1	160	-179.4	0	0	0	0	109.1	L1492 F1499 Y1500	L1492-V1496 HydrophobicContact CB-CG2 3.91Å; L1492-V1496 HydrophobicContact CD2-CG2 4.41Å; L1492-V1496 HydrophobicContact CG-CG2 4.21Å; L1492-V1496 VanDerWaalsContact O-CA 3.23Å; L1492-V1496 WeakPolarHBondContact O-CA 3.33Å; L1492-V1496 WeakPolarHBondContact O-CB 3.21Å; L1492-V1496 WeakPolarHBondContact O-CG2 3.34Å; L1492-V1496 PolarHBondContact O-N 3.33Å; V1496-F1499 CarbonylContact O-C 3.52Å; V1496-F1499 PolarHBondContact O-N 2.72Å; V1496-Y1500 WeakPolarHBondContact O-CA 3.46Å; V1496-Y1500 WeakPolarHBondContact O-CB 3.27Å; V1496-Y1500 PolarHBondContact O-N 3.06Å
1497	F	67.7	Low	57.9	Low	120 Å²	120	92.5 Å²	92.5	53%	0.526	49%	0.487	S	S	.	.	H	α-helix	trans	-73.3	-28.5	170.9	-158.2	-102.7	0	0	0	111.8	S1493 L1501	S1493-F1497 WeakPolarHBondContact O-CA 3.27Å; S1493-F1497 WeakPolarHBondContact O-CB 3.38Å; S1493-F1497 PolarHBondContact O-N 3.41Å; F1497-L1501 HydrophobicContact CD1-CD1 3.65Å; F1497-L1501 HydrophobicContact CD1-CG 4.47Å; F1497-L1501 HydrophobicContact CE1-CD1 3.6Å; F1497-L1501 HydrophobicContact CE1-CG 4.42Å; F1497-L1501 WeakPolarHBondContact O-CA 3.08Å; F1497-L1501 WeakPolarHBondContact O-CB 3.41Å; F1497-L1501 WeakPolarHBondContact O-CG 3.25Å; F1497-L1501 PolarHBondContact O-N 3.2Å
1498	L	67.4	Low	59.8	Low	94 Å²	94	92.7 Å²	92.7	49%	0.492	48%	0.48	S	S	.	.	H	α-helix	trans	-77.7	-28.7	163.7	-98.7	84.3	0	0	0	112.9	M1494 Y1500 L1502	M1494-L1498 WeakPolarHBondContact O-CA 3.37Å; M1494-L1498 WeakPolarHBondContact O-CB 2.91Å; M1494-L1498 WeakPolarHBondContact O-CD1 3.48Å; M1494-L1498 PolarHBondContact O-N 2.92Å; L1498-Y1500 VanDerWaalsContact C-N 3.31Å; L1498-L1502 WeakPolarHBondContact O-CA 3.33Å; L1498-L1502 WeakPolarHBondContact O-CB 3.45Å; L1498-L1502 WeakPolarHBondContact O-CD1 3.41Å; L1498-L1502 VanDerWaalsContact O-CG 3.23Å; L1498-L1502 WeakPolarHBondContact O-CG 3.17Å; L1498-L1502 PolarHBondContact O-N 3.35Å
1499	F	67	Low	61.2	Low	120 Å²	120	93.5 Å²	93.5	53%	0.526	48%	0.484	S	S	.	.	H	α-helix	trans	-79	-17.3	169.6	-81.9	-51.5	0	0	0	111.7	T1495 V1496 N1503	T1495-F1499 HydrophobicContact CG2-CD2 3.72Å; T1495-F1499 HydrophobicContact CG2-CE2 3.65Å; T1495-F1499 HydrophobicContact CG2-CZ 4.46Å; T1495-F1499 WeakPolarHBondContact O-CA 3.41Å; T1495-F1499 WeakPolarHBondContact O-CB 3.46Å; T1495-F1499 WeakPolarHBondContact O-CD2 3.45Å; T1495-F1499 VanDerWaalsContact O-CG 3.23Å; T1495-F1499 WeakPolarHBondContact O-CG 3.31Å; T1495-F1499 PolarHBondContact O-N 3.17Å; V1496-F1499 CarbonylContact O-C 3.52Å; V1496-F1499 PolarHBondContact O-N 2.72Å; F1499-N1503 WeakPolarHBondContact O-CA 3.49Å; F1499-N1503 WeakPolarHBondContact O-CB 3.43Å; F1499-N1503 PolarHBondContact O-N 2.98Å; F1499-N1503 PolarHBondContact O-ND2 3.02Å; F1499-N1503 VanDerWaalsContact O-ND2 3.16Å; F1499-N1503 PolarHBondContact O-OD1 2.88Å
1500	Y	71.3	Confident	62.7	Low	146 Å²	146	92 Å²	92	57%	0.573	48%	0.479	S	S	*	.	H	α-helix	trans	-94.4	-27.7	175.1	-164.4	-100.3	0	0	0	109.8	V1496 L1498 I1504	V1496-Y1500 WeakPolarHBondContact O-CA 3.46Å; V1496-Y1500 WeakPolarHBondContact O-CB 3.27Å; V1496-Y1500 PolarHBondContact O-N 3.06Å; L1498-Y1500 VanDerWaalsContact C-N 3.31Å; Y1500-I1504 HydrophobicContact CD1-CD1 3.6Å; Y1500-I1504 HydrophobicContact CD1-CG1 4.42Å; Y1500-I1504 HydrophobicContact CE1-CD1 3.43Å; Y1500-I1504 VanDerWaalsContact CE1-CD1 3.43Å; Y1500-I1504 HydrophobicContact CE1-CG1 4.45Å; Y1500-I1504 HydrophobicContact CG-CD1 4.42Å; Y1500-I1504 WeakPolarHBondContact O-CA 3.48Å; Y1500-I1504 WeakPolarHBondContact O-CB 2.95Å; Y1500-I1504 WeakPolarHBondContact O-CG1 3.42Å; Y1500-I1504 PolarHBondContact O-N 2.87Å
1501	L	72.7	Confident	63.8	Low	78 Å²	78	91.2 Å²	91.2	41%	0.408	47%	0.474	S	S	.	.	H	α-helix	trans	-78.8	-28.6	160.8	-84.6	160.8	0	0	0	112.5	F1497 T1505	F1497-L1501 HydrophobicContact CD1-CD1 3.65Å; F1497-L1501 HydrophobicContact CD1-CG 4.47Å; F1497-L1501 HydrophobicContact CE1-CD1 3.6Å; F1497-L1501 HydrophobicContact CE1-CG 4.42Å; F1497-L1501 WeakPolarHBondContact O-CA 3.08Å; F1497-L1501 WeakPolarHBondContact O-CB 3.41Å; F1497-L1501 WeakPolarHBondContact O-CG 3.25Å; F1497-L1501 PolarHBondContact O-N 3.2Å; L1501-T1505 WeakPolarHBondContact O-CA 3.33Å; L1501-T1505 WeakPolarHBondContact O-CB 3.36Å; L1501-T1505 WeakPolarHBondContact O-CG2 3.32Å; L1501-T1505 PolarHBondContact O-N 2.89Å; L1501-T1505 PolarHBondContact O-OG1 2.82Å
1502	L	71.2	Confident	64.9	Low	93 Å²	93	92.7 Å²	92.7	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-79.2	-31.3	168.7	-82.3	160.9	0	0	0	110.7	L1498 A1506	L1498-L1502 WeakPolarHBondContact O-CA 3.33Å; L1498-L1502 WeakPolarHBondContact O-CB 3.45Å; L1498-L1502 WeakPolarHBondContact O-CD1 3.41Å; L1498-L1502 VanDerWaalsContact O-CG 3.23Å; L1498-L1502 WeakPolarHBondContact O-CG 3.17Å; L1498-L1502 PolarHBondContact O-N 3.35Å; L1502-A1506 VanDerWaalsContact O-CA 3.3Å; L1502-A1506 WeakPolarHBondContact O-CA 3.25Å; L1502-A1506 WeakPolarHBondContact O-CB 3.4Å; L1502-A1506 PolarHBondContact O-N 2.98Å
1503	N	66.5	Low	65.7	Low	91 Å²	91	89.8 Å²	89.8	49%	0.487	47%	0.468	S	S	.	.	H	α-helix	trans	-77.3	-33.3	169.3	-72	-17.6	0	0	0	110.9	F1499 I1507	F1499-N1503 WeakPolarHBondContact O-CA 3.49Å; F1499-N1503 WeakPolarHBondContact O-CB 3.43Å; F1499-N1503 PolarHBondContact O-N 2.98Å; F1499-N1503 PolarHBondContact O-ND2 3.02Å; F1499-N1503 VanDerWaalsContact O-ND2 3.16Å; F1499-N1503 PolarHBondContact O-OD1 2.88Å; N1503-I1507 WeakPolarHBondContact O-CA 3.45Å; N1503-I1507 WeakPolarHBondContact O-CB 3.29Å; N1503-I1507 VanDerWaalsContact O-CD1 3.28Å; N1503-I1507 WeakPolarHBondContact O-CD1 3.46Å; N1503-I1507 WeakPolarHBondContact O-CG1 3.44Å; N1503-I1507 PolarHBondContact O-N 2.94Å
1504	I	73.3	Confident	66.3	Low	69 Å²	69	90.1 Å²	90.1	35%	0.354	46%	0.464	S	S	.	.	H	α-helix	trans	-74.8	-38.5	172	-74.7	170.8	0	0	0	111.1	Y1500 I1507 L1508	Y1500-I1504 HydrophobicContact CD1-CD1 3.6Å; Y1500-I1504 HydrophobicContact CD1-CG1 4.42Å; Y1500-I1504 HydrophobicContact CE1-CD1 3.43Å; Y1500-I1504 VanDerWaalsContact CE1-CD1 3.43Å; Y1500-I1504 HydrophobicContact CE1-CG1 4.45Å; Y1500-I1504 HydrophobicContact CG-CD1 4.42Å; Y1500-I1504 WeakPolarHBondContact O-CA 3.48Å; Y1500-I1504 WeakPolarHBondContact O-CB 2.95Å; Y1500-I1504 WeakPolarHBondContact O-CG1 3.42Å; Y1500-I1504 PolarHBondContact O-N 2.87Å; I1504-I1507 CarbonylContact O-C 3.31Å; I1504-L1508 HydrophobicContact CG2-CD1 3.74Å; I1504-L1508 HydrophobicContact CG2-CG 4.33Å; I1504-L1508 WeakPolarHBondContact O-CA 3.46Å; I1504-L1508 WeakPolarHBondContact O-CB 3.44Å; I1504-L1508 WeakPolarHBondContact O-CG 3.48Å; I1504-L1508 PolarHBondContact O-N 2.83Å
1505	T	72.7	Confident	66.6	Low	56 Å²	56	87.5 Å²	87.5	34%	0.344	46%	0.46	S	S	.	.	H	α-helix	trans	-76.8	-29.6	173.5	60.1	0	0	0	0	112.4	L1501 L1508 I1509	L1501-T1505 WeakPolarHBondContact O-CA 3.33Å; L1501-T1505 WeakPolarHBondContact O-CB 3.36Å; L1501-T1505 WeakPolarHBondContact O-CG2 3.32Å; L1501-T1505 PolarHBondContact O-N 2.89Å; L1501-T1505 PolarHBondContact O-OG1 2.82Å; T1505-L1508 CarbonylContact O-C 3.55Å; T1505-L1508 PolarHBondContact O-N 2.75Å; T1505-I1509 WeakPolarHBondContact O-CA 3.31Å; T1505-I1509 WeakPolarHBondContact O-CB 3.35Å; T1505-I1509 WeakPolarHBondContact O-CD1 3.34Å; T1505-I1509 WeakPolarHBondContact O-CG1 3.01Å; T1505-I1509 PolarHBondContact O-N 3.07Å
1506	A	67.8	Low	66.6	Low	35 Å²	35	91.5 Å²	91.5	29%	0.289	47%	0.474	S	S	.	.	H	α-helix	trans	-72	-39.6	166.8	0	0	0	0	0	110.8	L1502 L1508 I1509 I1510	L1502-A1506 VanDerWaalsContact O-CA 3.3Å; L1502-A1506 WeakPolarHBondContact O-CA 3.25Å; L1502-A1506 WeakPolarHBondContact O-CB 3.4Å; L1502-A1506 PolarHBondContact O-N 2.98Å; A1506-L1508 VanDerWaalsContact C-N 3.25Å; A1506-L1508 PolarHBondContact O-N 2.95Å; A1506-I1509 CarbonylContact O-C 3.58Å; A1506-I1509 PolarHBondContact O-N 2.94Å; A1506-I1510 HydrophobicContact CB-CD1 4.28Å; A1506-I1510 WeakPolarHBondContact O-CA 2.97Å; A1506-I1510 WeakPolarHBondContact O-CB 3.01Å; A1506-I1510 WeakPolarHBondContact O-CD1 3.43Å; A1506-I1510 WeakPolarHBondContact O-CG1 3.34Å; A1506-I1510 PolarHBondContact O-N 3.06Å
1507	I	71.7	Confident	65.6	Low	110 Å²	110	92 Å²	92	56%	0.564	47%	0.471	S	S	*	.	H	α-helix	trans	-68.2	-25.8	171.8	-70.3	163.4	0	0	0	110.6	N1503 I1504 S1511	N1503-I1507 WeakPolarHBondContact O-CA 3.45Å; N1503-I1507 WeakPolarHBondContact O-CB 3.29Å; N1503-I1507 VanDerWaalsContact O-CD1 3.28Å; N1503-I1507 WeakPolarHBondContact O-CD1 3.46Å; N1503-I1507 WeakPolarHBondContact O-CG1 3.44Å; N1503-I1507 PolarHBondContact O-N 2.94Å; I1504-I1507 CarbonylContact O-C 3.31Å; I1507-S1511 WeakPolarHBondContact O-CA 3.36Å; I1507-S1511 WeakPolarHBondContact O-CB 3.48Å; I1507-S1511 PolarHBondContact O-N 3.13Å; I1507-S1511 PolarHBondContact O-OG 3.07Å
1508	L	72.1	Confident	65	Low	102 Å²	102	91.5 Å²	91.5	53%	0.534	47%	0.473	S	S	.	.	H	α-helix	trans	-83.8	-26.7	170.9	-74.7	167.4	0	0	0	113	I1504 T1505 A1506 S1511 Y1512	I1504-L1508 HydrophobicContact CG2-CD1 3.74Å; I1504-L1508 HydrophobicContact CG2-CG 4.33Å; I1504-L1508 WeakPolarHBondContact O-CA 3.46Å; I1504-L1508 WeakPolarHBondContact O-CB 3.44Å; I1504-L1508 WeakPolarHBondContact O-CG 3.48Å; I1504-L1508 PolarHBondContact O-N 2.83Å; T1505-L1508 CarbonylContact O-C 3.55Å; T1505-L1508 PolarHBondContact O-N 2.75Å; A1506-L1508 VanDerWaalsContact C-N 3.25Å; A1506-L1508 PolarHBondContact O-N 2.95Å; L1508-S1511 WeakPolarHBondContact CA-OG 3.49Å; L1508-Y1512 WeakPolarHBondContact O-CA 3.47Å; L1508-Y1512 WeakPolarHBondContact O-CB 3.37Å; L1508-Y1512 PolarHBondContact O-N 3.42Å
1509	I	70.7	Confident	64.4	Low	123 Å²	123	94.9 Å²	94.9	63%	0.631	48%	0.48	S	S	*	.	H	α-helix	trans	-87.6	-24.6	175.4	-70.9	163.6	0	0	0	110.8	T1505 A1506 G1513	T1505-I1509 WeakPolarHBondContact O-CA 3.31Å; T1505-I1509 WeakPolarHBondContact O-CB 3.35Å; T1505-I1509 WeakPolarHBondContact O-CD1 3.34Å; T1505-I1509 WeakPolarHBondContact O-CG1 3.01Å; T1505-I1509 PolarHBondContact O-N 3.07Å; A1506-I1509 CarbonylContact O-C 3.58Å; A1506-I1509 PolarHBondContact O-N 2.94Å; I1509-G1513 WeakPolarHBondContact O-CA 3.34Å; I1509-G1513 PolarHBondContact O-N 3.49Å
1510	I	66.7	Low	63.6	Low	98 Å²	98	92.2 Å²	92.2	50%	0.503	47%	0.473	S	S	.	.	H	α-helix	trans	-83	-41.9	167.6	-64.8	164.1	0	0	0	108.7	A1506 G1513 D1514	A1506-I1510 HydrophobicContact CB-CD1 4.28Å; A1506-I1510 WeakPolarHBondContact O-CA 2.97Å; A1506-I1510 WeakPolarHBondContact O-CB 3.01Å; A1506-I1510 WeakPolarHBondContact O-CD1 3.43Å; A1506-I1510 WeakPolarHBondContact O-CG1 3.34Å; A1506-I1510 PolarHBondContact O-N 3.06Å; I1510-G1513 CarbonylContact O-C 3.41Å; I1510-G1513 PolarHBondContact O-N 2.77Å; I1510-D1514 WeakPolarHBondContact CG2-OD2 3.37Å; I1510-D1514 WeakPolarHBondContact O-CA 3.26Å; I1510-D1514 WeakPolarHBondContact O-CB 3.41Å; I1510-D1514 PolarHBondContact O-N 3.13Å
1511	S	62.6	Low	62.2	Low	55 Å²	55	92.8 Å²	92.8	39%	0.385	48%	0.475	S	S	.	.	H	α-helix	trans	-76.6	-23.4	172.5	67.5	0	0	0	0	113.9	I1507 L1508 A1515	I1507-S1511 WeakPolarHBondContact O-CA 3.36Å; I1507-S1511 WeakPolarHBondContact O-CB 3.48Å; I1507-S1511 PolarHBondContact O-N 3.13Å; I1507-S1511 PolarHBondContact O-OG 3.07Å; L1508-S1511 WeakPolarHBondContact CA-OG 3.49Å; S1511-A1515 WeakPolarHBondContact O-CA 3.35Å; S1511-A1515 WeakPolarHBondContact O-CB 3.41Å; S1511-A1515 PolarHBondContact O-N 2.68Å
1512	Y	68.8	Low	61.2	Low	161 Å²	161	94.4 Å²	94.4	63%	0.631	48%	0.48	S	S	*	.	H	α-helix	trans	-81	-28.4	164.2	-174.1	-102.7	0	0	0	111.5	L1508 K1516	L1508-Y1512 WeakPolarHBondContact O-CA 3.47Å; L1508-Y1512 WeakPolarHBondContact O-CB 3.37Å; L1508-Y1512 PolarHBondContact O-N 3.42Å; Y1512-K1516 HydrophobicContact CE1-CD 4.41Å; Y1512-K1516 WeakPolarHBondContact O-CB 3.38Å; Y1512-K1516 PolarHBondContact O-N 3.05Å
1513	G	60.1	Low	60.4	Low	29 Å²	29	94.3 Å²	94.3	30%	0.299	48%	0.479	S	S	.	.	H	α-helix	trans	-65.3	-57.5	172	0	0	0	0	0	110.3	I1509 I1510 K1516 E1517	I1509-G1513 WeakPolarHBondContact O-CA 3.34Å; I1509-G1513 PolarHBondContact O-N 3.49Å; I1510-G1513 CarbonylContact O-C 3.41Å; I1510-G1513 PolarHBondContact O-N 2.77Å; G1513-K1516 CarbonylContact O-C 3.54Å; G1513-K1516 PolarHBondContact O-N 3.48Å; G1513-E1517 WeakPolarHBondContact O-CA 3.37Å; G1513-E1517 WeakPolarHBondContact O-CB 3.44Å; G1513-E1517 PolarHBondContact O-N 3.35Å
1514	D	52.9	Low	59.3	Low	82 Å²	82	97 Å²	97	44%	0.439	49%	0.486	S	S	.	.	H	α-helix	trans	-59.7	-42.5	169.1	-65.1	-21.8	0	0	0	111.6	I1510 K1516 E1517 I1518	I1510-D1514 WeakPolarHBondContact CG2-OD2 3.37Å; I1510-D1514 WeakPolarHBondContact O-CA 3.26Å; I1510-D1514 WeakPolarHBondContact O-CB 3.41Å; I1510-D1514 PolarHBondContact O-N 3.13Å; D1514-K1516 VanDerWaalsContact C-N 3.34Å; D1514-K1516 PolarHBondContact O-N 2.82Å; D1514-E1517 PolarHBondContact O-N 2.98Å; D1514-I1518 HydrophobicContact CB-CD1 4.3Å; D1514-I1518 WeakPolarHBondContact O-CA 3.44Å; D1514-I1518 WeakPolarHBondContact O-CB 3.38Å; D1514-I1518 WeakPolarHBondContact O-CD1 3.26Å; D1514-I1518 WeakPolarHBondContact O-CG1 3.26Å; D1514-I1518 PolarHBondContact O-N 3.17Å
1515	A	58.2	Low	57.6	Low	54 Å²	54	98.4 Å²	98.4	45%	0.446	49%	0.494	S	S	.	.	H	α-helix	trans	-65.4	-39.8	175	0	0	0	0	0	111.1	S1511 Y1519	S1511-A1515 WeakPolarHBondContact O-CA 3.35Å; S1511-A1515 WeakPolarHBondContact O-CB 3.41Å; S1511-A1515 PolarHBondContact O-N 2.68Å; A1515-Y1519 WeakPolarHBondContact O-CB 3.12Å; A1515-Y1519 PolarHBondContact O-N 3.24Å
1516	K	53.4	Low	55.9	Low	125 Å²	125	104.3 Å²	104.3	54%	0.543	51%	0.51	S	S	.	.	H	α-helix	trans	-72.8	-33.7	176.5	-174.9	176.4	179.7	-179.6	0	112.2	Y1512 G1513 D1514 T1520	Y1512-K1516 HydrophobicContact CE1-CD 4.41Å; Y1512-K1516 WeakPolarHBondContact O-CB 3.38Å; Y1512-K1516 PolarHBondContact O-N 3.05Å; G1513-K1516 CarbonylContact O-C 3.54Å; G1513-K1516 PolarHBondContact O-N 3.48Å; D1514-K1516 VanDerWaalsContact C-N 3.34Å; D1514-K1516 PolarHBondContact O-N 2.82Å; K1516-T1520 WeakPolarHBondContact O-CB 3.35Å; K1516-T1520 PolarHBondContact O-N 2.88Å; K1516-T1520 PolarHBondContact O-OG1 3.01Å
1517	E	43.8	Very low	54.5	Low	92 Å²	92	109.4 Å²	109.4	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-78.7	-44.1	178.1	177	149.9	-156.3	0	0	110.5	G1513 D1514 Y1519 T1520 R1521	G1513-E1517 WeakPolarHBondContact O-CA 3.37Å; G1513-E1517 WeakPolarHBondContact O-CB 3.44Å; G1513-E1517 PolarHBondContact O-N 3.35Å; D1514-E1517 PolarHBondContact O-N 2.98Å; E1517-Y1519 VanDerWaalsContact C-N 3.34Å; E1517-Y1519 PolarHBondContact O-N 3.42Å; E1517-T1520 PolarHBondContact O-N 3.43Å; E1517-R1521 HydrophobicContact CG-CG 4.03Å; E1517-R1521 VanDerWaalsContact CG-NE 3.33Å; E1517-R1521 WeakPolarHBondContact O-CA 3.48Å; E1517-R1521 WeakPolarHBondContact O-CB 3.06Å; E1517-R1521 WeakPolarHBondContact O-CG 3.27Å; E1517-R1521 PolarHBondContact O-N 3.12Å; E1517-R1521 IonicContact OE1-CZ 3.59Å; E1517-R1521 IonicContact OE1-NE 2.68Å; E1517-R1521 PolarHBondContact OE1-NE 2.63Å; E1517-R1521 IonicContact OE1-NH2 3.14Å; E1517-R1521 PolarHBondContact OE1-NH2 2.71Å
1518	I	54.5	Low	52.7	Low	109 Å²	109	112 Å²	112	56%	0.559	53%	0.531	S	S	*	.	H	α-helix	trans	-55.1	-48.9	165.6	-68.3	164.4	0	0	0	108.9	D1514 R1521 H1522	D1514-I1518 HydrophobicContact CB-CD1 4.3Å; D1514-I1518 WeakPolarHBondContact O-CA 3.44Å; D1514-I1518 WeakPolarHBondContact O-CB 3.38Å; D1514-I1518 WeakPolarHBondContact O-CD1 3.26Å; D1514-I1518 WeakPolarHBondContact O-CG1 3.26Å; D1514-I1518 PolarHBondContact O-N 3.17Å; I1518-R1521 CarbonylContact O-C 3.55Å; I1518-R1521 PolarHBondContact O-N 3.39Å; I1518-H1522 WeakPolarHBondContact O-CA 3.4Å; I1518-H1522 WeakPolarHBondContact O-CB 3.35Å; I1518-H1522 PolarHBondContact O-N 2.67Å
1519	Y	55.2	Low	51.2	Low	165 Å²	165	111.9 Å²	111.9	65%	0.647	53%	0.53	S	S	*	.	H	α-helix	trans	-66.2	-42.1	-180	-164.9	-97.1	0	0	0	113	A1515 E1517 H1522 I1523	A1515-Y1519 WeakPolarHBondContact O-CB 3.12Å; A1515-Y1519 PolarHBondContact O-N 3.24Å; E1517-Y1519 VanDerWaalsContact C-N 3.34Å; E1517-Y1519 PolarHBondContact O-N 3.42Å; Y1519-H1522 PolarHBondContact O-N 2.91Å; Y1519-I1523 HydrophobicContact CD1-CD1 3.81Å; Y1519-I1523 HydrophobicContact CE1-CD1 3.62Å; Y1519-I1523 WeakPolarHBondContact O-CG1 3.31Å; Y1519-I1523 PolarHBondContact O-N 3.1Å
1520	T	48.5	Very low	49.6	Very low	63 Å²	63	112.1 Å²	112.1	39%	0.387	53%	0.532	S	S	.	.	H	α-helix	trans	-71.7	-36.4	177.7	-53.7	0	0	0	0	111.6	K1516 E1517 K1524	K1516-T1520 WeakPolarHBondContact O-CB 3.35Å; K1516-T1520 PolarHBondContact O-N 2.88Å; K1516-T1520 PolarHBondContact O-OG1 3.01Å; E1517-T1520 PolarHBondContact O-N 3.43Å; T1520-K1524 WeakPolarHBondContact O-CB 3.45Å; T1520-K1524 WeakPolarHBondContact O-CG 3.48Å; T1520-K1524 PolarHBondContact O-N 3.49Å
1521	R	42	Very low	47.8	Very low	159 Å²	159	114.8 Å²	114.8	60%	0.6	54%	0.543	S	S	*	.	H	α-helix	trans	-66.6	-38.2	167.8	-72.1	177.1	-177	-154.9	8.7	110	E1517 I1518 I1523 K1524 L1525	E1517-R1521 HydrophobicContact CG-CG 4.03Å; E1517-R1521 VanDerWaalsContact CG-NE 3.33Å; E1517-R1521 WeakPolarHBondContact O-CA 3.48Å; E1517-R1521 WeakPolarHBondContact O-CB 3.06Å; E1517-R1521 WeakPolarHBondContact O-CG 3.27Å; E1517-R1521 PolarHBondContact O-N 3.12Å; E1517-R1521 IonicContact OE1-CZ 3.59Å; E1517-R1521 IonicContact OE1-NE 2.68Å; E1517-R1521 PolarHBondContact OE1-NE 2.63Å; E1517-R1521 IonicContact OE1-NH2 3.14Å; E1517-R1521 PolarHBondContact OE1-NH2 2.71Å; I1518-R1521 CarbonylContact O-C 3.55Å; I1518-R1521 PolarHBondContact O-N 3.39Å; R1521-I1523 VanDerWaalsContact C-N 3.31Å; R1521-I1523 PolarHBondContact O-N 3.2Å; R1521-K1524 PolarHBondContact O-N 3.3Å; R1521-L1525 WeakPolarHBondContact O-CA 3.48Å; R1521-L1525 WeakPolarHBondContact O-CB 3.23Å; R1521-L1525 PolarHBondContact O-N 3.25Å
1522	H	52.9	Low	46.7	Very low	112 Å²	112	117.9 Å²	117.9	52%	0.519	55%	0.554	S	S	.	*	H	α-helix	trans	-67.4	-33.7	-179.6	-149.1	-39.9	0	0	0	111.7	I1518 Y1519 R1526	I1518-H1522 WeakPolarHBondContact O-CA 3.4Å; I1518-H1522 WeakPolarHBondContact O-CB 3.35Å; I1518-H1522 PolarHBondContact O-N 2.67Å; Y1519-H1522 PolarHBondContact O-N 2.91Å; H1522-R1526 WeakPolarHBondContact O-CB 3.09Å; H1522-R1526 PolarHBondContact O-N 2.95Å
1523	I	53.9	Low	44.8	Very low	90 Å²	90	114.9 Å²	114.9	46%	0.462	56%	0.555	S	S	.	*	H	α-helix	trans	-72.4	-45.5	172.3	-69.5	169	0	0	0	111	Y1519 R1521 R1526 H1527	Y1519-I1523 HydrophobicContact CD1-CD1 3.81Å; Y1519-I1523 HydrophobicContact CE1-CD1 3.62Å; Y1519-I1523 WeakPolarHBondContact O-CG1 3.31Å; Y1519-I1523 PolarHBondContact O-N 3.1Å; R1521-I1523 VanDerWaalsContact C-N 3.31Å; R1521-I1523 PolarHBondContact O-N 3.2Å; I1523-R1526 PolarHBondContact O-N 3.15Å; I1523-H1527 PolarHBondContact O-N 3.28Å; I1523-H1527 VanDerWaalsContact O-N 3.09Å
1524	K	42.5	Very low	43.3	Very low	149 Å²	149	121.1 Å²	121.1	65%	0.648	58%	0.576	S	S	*	*	H	α-helix	trans	-66.8	-39	176.3	-75.9	-177.5	175.1	-176.3	0	113.1	T1520 R1521 H1527 Y1528	T1520-K1524 WeakPolarHBondContact O-CB 3.45Å; T1520-K1524 WeakPolarHBondContact O-CG 3.48Å; T1520-K1524 PolarHBondContact O-N 3.49Å; R1521-K1524 PolarHBondContact O-N 3.3Å; K1524-H1527 CarbonylContact O-C 3.5Å; K1524-H1527 WeakPolarHBondContact O-CB 3.22Å; K1524-H1527 PolarHBondContact O-N 3.48Å; K1524-Y1528 WeakPolarHBondContact O-CB 3.34Å; K1524-Y1528 PolarHBondContact O-N 3.38Å
1525	L	38.4	Very low	42.1	Very low	98 Å²	98	123.3 Å²	123.3	51%	0.513	59%	0.588	S	S	.	*	H	α-helix	trans	-71.8	-36.2	177.9	-163.7	86.8	0	0	0	110.3	R1521 H1527 Y1528 I1529	R1521-L1525 WeakPolarHBondContact O-CA 3.48Å; R1521-L1525 WeakPolarHBondContact O-CB 3.23Å; R1521-L1525 PolarHBondContact O-N 3.25Å; L1525-H1527 VanDerWaalsContact C-N 3.3Å; L1525-H1527 PolarHBondContact O-N 2.78Å; L1525-Y1528 CarbonylContact O-C 3.56Å; L1525-Y1528 PolarHBondContact O-N 2.92Å; L1525-I1529 HydrophobicContact CD2-CD1 3.81Å; L1525-I1529 HydrophobicContact CG-CD1 3.75Å; L1525-I1529 HydrophobicContact CG-CG1 4.25Å; L1525-I1529 VanDerWaalsContact O-CB 3.32Å; L1525-I1529 WeakPolarHBondContact O-CB 3.45Å; L1525-I1529 VanDerWaalsContact O-CG1 3.24Å; L1525-I1529 WeakPolarHBondContact O-CG1 3.17Å; L1525-I1529 PolarHBondContact O-N 3.03Å
1526	R	37.8	Very low	40.8	Very low	180 Å²	180	126.2 Å²	126.2	68%	0.679	60%	0.6	S	S	*	*	H	α-helix	trans	-60.4	-40.8	168.2	177.8	170.1	-88.5	-179.8	-6.8	111.2	H1522 I1523 Y1528	H1522-R1526 WeakPolarHBondContact O-CB 3.09Å; H1522-R1526 PolarHBondContact O-N 2.95Å; I1523-R1526 PolarHBondContact O-N 3.15Å; R1526-Y1528 VanDerWaalsContact C-N 3.27Å; R1526-Y1528 PolarHBondContact O-N 3.26Å
1527	H	37	Very low	39.5	Very low	142 Å²	142	128 Å²	128	66%	0.657	61%	0.614	S	S	*	*	H	α-helix	trans	-71.8	-11.4	171.6	-91.4	-58.7	0	0	0	115.5	I1523 K1524 L1525	I1523-H1527 PolarHBondContact O-N 3.28Å; I1523-H1527 VanDerWaalsContact O-N 3.09Å; K1524-H1527 CarbonylContact O-C 3.5Å; K1524-H1527 WeakPolarHBondContact O-CB 3.22Å; K1524-H1527 PolarHBondContact O-N 3.48Å; L1525-H1527 VanDerWaalsContact C-N 3.3Å; L1525-H1527 PolarHBondContact O-N 2.78Å
1528	Y	34.9	Very low	38.6	Very low	165 Å²	165	128.6 Å²	128.6	65%	0.647	63%	0.629	S	S	*	*	H	α-helix	trans	-105.6	-18.8	178.8	-143.4	-82.1	0	0	0	112.4	K1524 L1525 R1526 E1531	K1524-Y1528 WeakPolarHBondContact O-CB 3.34Å; K1524-Y1528 PolarHBondContact O-N 3.38Å; L1525-Y1528 CarbonylContact O-C 3.56Å; L1525-Y1528 PolarHBondContact O-N 2.92Å; R1526-Y1528 VanDerWaalsContact C-N 3.27Å; R1526-Y1528 PolarHBondContact O-N 3.26Å; Y1528-E1531 CarbonylContact O-C 3.56Å; Y1528-E1531 PolarHBondContact O-N 3.03Å
1529	I	39.8	Very low	37.1	Very low	98 Å²	98	130.6 Å²	130.6	50%	0.503	64%	0.641	S	S	.	*	H	α-helix	trans	-79.4	-22.6	174.7	-76.1	167.5	0	0	0	111.1	L1525 E1531 L1532	L1525-I1529 HydrophobicContact CD2-CD1 3.81Å; L1525-I1529 HydrophobicContact CG-CD1 3.75Å; L1525-I1529 HydrophobicContact CG-CG1 4.25Å; L1525-I1529 VanDerWaalsContact O-CB 3.32Å; L1525-I1529 WeakPolarHBondContact O-CB 3.45Å; L1525-I1529 VanDerWaalsContact O-CG1 3.24Å; L1525-I1529 WeakPolarHBondContact O-CG1 3.17Å; L1525-I1529 PolarHBondContact O-N 3.03Å; I1529-E1531 PolarHBondContact O-N 3.16Å; I1529-L1532 HydrophobicContact CG1-CD1 4.39Å
1530	D	38.5	Very low	35.6	Very low	128 Å²	128	127 Å²	127	68%	0.684	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-8.3	166.9	-64.8	-26.2	0	0	0	112.6
1531	E	29.1	Very low	34.5	Very low	154 Å²	154	128.7 Å²	128.7	72%	0.72	65%	0.654	S	S	*	*	S	Bend	trans	-130.4	69.3	177	-69.2	-168.6	166.3	0	0	112.4	Y1528 I1529	Y1528-E1531 CarbonylContact O-C 3.56Å; Y1528-E1531 PolarHBondContact O-N 3.03Å; I1529-E1531 PolarHBondContact O-N 3.16Å
1532	L	38.7	Very low	33.8	Very low	120 Å²	120	132.7 Å²	132.7	63%	0.628	67%	0.669	S	S	*	*			trans	-128.6	142.7	171.2	-86	170.5	0	0	0	109.8	I1529	I1529-L1532 HydrophobicContact CG1-CD1 4.39Å
1533	P	29	Very low	32.3	Very low	99 Å²	99	137.5 Å²	137.5	64%	0.643	68%	0.683	S	S	*	*				-146.4	170	81.9	40.8	-24.7	0	0	0	116.6
1534	E	27.5	Very low	30.8	Very low	160 Å²	160	141.6 Å²	141.6	75%	0.748	70%	0.697	S	S	*	*			trans	66	132.9	148.7	-77.5	166.6	-140.2	0	0	118.9
1535	N	29.1	Very low	30.1	Very low	127 Å²	127	141.4 Å²	141.4	68%	0.679	70%	0.703	S	S	*	*			cis	-153.6	147.5	24.2	-100.9	-47.7	0	0	0	114.5
1536	V	29.7	Very low	29.4	Very low	116 Å²	116	143.1 Å²	143.1	70%	0.703	71%	0.713	S	S	*	*			trans	56.7	114.7	138.6	-175.4	0	0	0	0	121.4
1537	L	26.2	Very low	28.7	Very low	162 Å²	162	141.5 Å²	141.5	85%	0.848	72%	0.718	S	S	*	*				20.8	149.2	124.4	-72.5	156.1	0	0	0	120.4
1538	S	25.7	Very low	28.3	Very low	105 Å²	105	141.2 Å²	141.2	73%	0.734	72%	0.717	S	S	*	*			cis	-159.3	177.4	7.5	57.8	0	0	0	0	113.4
1539	D	23.5	Very low	28.4	Very low	151 Å²	151	136.3 Å²	136.3	81%	0.807	71%	0.705	S	S	*	*			trans	-51.9	168.6	165.7	-173.5	22.5	0	0	0	116.1
1540	S	24	Very low	27.7	Very low	90 Å²	90	133.2 Å²	133.2	63%	0.629	69%	0.692	S	S	*	*			trans	108.5	108.1	147.5	79.3	0	0	0	0	122.2
1541	S	24.7	Very low	27.2	Very low	98 Å²	98	131.7 Å²	131.7	69%	0.685	68%	0.683	S	S	*	*				84.9	132.6	121.6	80.4	0	0	0	0	123.9
1542	R	26	Very low	27.1	Very low	242 Å²	242	130.7 Å²	130.7	91%	0.913	68%	0.677	S	S	*	*			trans	168	107.7	138.1	-93	168.2	-168.7	-153.5	3.1	106.9
1543	R	23.3	Very low	26.4	Very low	213 Å²	213	131.1 Å²	131.1	80%	0.804	68%	0.679	S	S	*	*			cis	81.6	130.4	26.1	-140	-177.6	-157.6	-164.6	6.5	113.8
1544	F	21	Very low	26.2	Very low	176 Å²	176	130.8 Å²	130.8	77%	0.772	68%	0.678	S	S	*	*			trans	71.9	127.6	-169.6	-56.6	-83.4	0	0	0	114.5
1545	N	28.4	Very low	26.1	Very low	145 Å²	145	129.5 Å²	129.5	78%	0.775	68%	0.675	S	S	*	*			cis	89.7	147.4	18.2	-157.4	18.3	0	0	0	115.9
1546	L	23	Very low	25.9	Very low	135 Å²	135	130 Å²	130	71%	0.707	68%	0.678	S	S	*	*			trans	89.8	137.9	-179.9	-58.8	165.5	0	0	0	118.1
1547	N	23.2	Very low	25.6	Very low	146 Å²	146	129.2 Å²	129.2	78%	0.781	68%	0.676	S	S	*	*			trans	69.1	82.1	152.4	-57.5	-3.9	0	0	0	121.7
1548	Q	29	Very low	25.5	Very low	136 Å²	136	127.2 Å²	127.2	64%	0.636	68%	0.675	S	S	*	*				-6.4	167.2	103.1	-100.2	-171.7	16.1	0	0	117.4	G8 K9	G8-Q1548 PolarHBondContact O-OE1 2.78Å; K9-Q1548 HydrophobicContact CB-CB 3.55Å; K9-Q1548 HydrophobicContact CB-CG 4.07Å; K9-Q1548 VanDerWaalsContact O-CG 3.27Å; K9-Q1548 WeakPolarHBondContact O-CG 2.8Å; K9-Q1548 PolarHBondContact O-NE2 3.46Å; K9-Q1548 PolarHBondContact O-OE1 3.07Å
1549	P	37	Very low	25.7	Very low	61 Å²	61	129.8 Å²	129.8	40%	0.396	68%	0.678	S	S	.	*			cis	-83	-173.2	-20.5	-0.5	2	0	0	0	124.3	K9 T10	K9-P1549 VanDerWaalsContact C-CA 3.46Å; K9-P1549 HydrophobicContact CB-CB 2.29Å; K9-P1549 HydrophobicContact CB-CG 2.29Å; K9-P1549 HydrophobicContact CD-CB 3.84Å; K9-P1549 HydrophobicContact CD-CG 3.74Å; K9-P1549 WeakPolarHBondContact CD-O 3.49Å; K9-P1549 WeakPolarHBondContact CE-O 3.22Å; K9-P1549 HydrophobicContact CG-CB 2.29Å; K9-P1549 HydrophobicContact CG-CG 2.32Å; K9-P1549 WeakPolarHBondContact CG-O 3.42Å; K9-P1549 PolarHBondContact NZ-O 3.35Å; T10-P1549 VanDerWaalsContact N-CB 3.26Å; T10-P1549 CarbonylContact O-C 3.51Å; T10-P1549 VanDerWaalsContact O-CA 3.23Å; T10-P1549 WeakPolarHBondContact O-CA 3.18Å
1550	S	25.6	Very low	25.9	Very low	33 Å²	33	129.6 Å²	129.6	23%	0.231	68%	0.677	C	S	.	*			trans	44.2	159.2	132	84.8	0	0	0	0	122.7	K9 T10	K9-S1550 PolarHBondContact NZ-O 3.36Å; K9-S1550 PolarHBondContact NZ-OG 2.62Å; T10-S1550 PolarHBondContact O-N 2.8Å
1551	D	28.2	Very low	26.1	Very low	96 Å²	96	131 Å²	131	51%	0.513	68%	0.678	S	S	.	*			cis	-142.4	138.1	22.5	-102.5	-64.9	0	0	0	110.9	N11	N11-D1551 WeakPolarHBondContact ND2-CA 3.39Å
1552	K	26.1	Very low	26.3	Very low	134 Å²	134	134.5 Å²	134.5	58%	0.583	68%	0.681	S	S	*	*				69.4	125.2	114	-74.3	-174.6	-172	97.4	0	116.1	N11 H12	N11-K1552 PolarHBondContact ND2-N 3.33Å; H12-K1552 WeakPolarHBondContact NE2-CA 3.48Å; H12-K1552 PolarHBondContact NE2-N 3.39Å
1553	L	24.7	Very low	26.5	Very low	129 Å²	129	128.9 Å²	128.9	68%	0.675	67%	0.669	S	S	*	*				59.4	134.3	98.9	-52.7	177.7	0	0	0	113.3
1554	C	24.3	Very low	26.8	Very low	92 Å²	92	126.3 Å²	126.3	62%	0.622	67%	0.67	S	S	*	*			cis	-167.5	170.1	14.3	-131	0	0	0	0	114.5
1555	I	26.4	Very low	27.2	Very low	132 Å²	132	122.9 Å²	122.9	68%	0.677	67%	0.667	S	S	*	*			trans	66.5	97	140.3	-73.7	160.3	0	0	0	118.7
1556	N	23.6	Very low	27.2	Very low	138 Å²	138	123.3 Å²	123.3	74%	0.738	67%	0.669	S	S	*	*				83.2	148.7	114.8	-71.7	3.9	0	0	0	124.3
1557	C	23.8	Very low	27.6	Very low	100 Å²	100	122 Å²	122	68%	0.676	67%	0.669	S	S	*	*			trans	78.9	95.8	141.2	-77.9	0	0	0	0	119.9
1558	C	24.7	Very low	27.9	Very low	120 Å²	120	120.2 Å²	120.2	81%	0.811	67%	0.668	S	S	*	*				74.6	177.2	129	-58.6	0	0	0	0	113.6
1559	I	28.1	Very low	28.1	Very low	158 Å²	158	120.1 Å²	120.1	81%	0.81	67%	0.672	S	S	*	*			cis	-133.8	155.1	20.8	-64.3	169.6	0	0	0	112
1560	N	27.9	Very low	27.6	Very low	147 Å²	147	126 Å²	126	79%	0.786	69%	0.686	S	S	*	*			trans	-49.4	164.9	170.4	-58.7	-30.2	0	0	0	113.7
1561	D	28.6	Very low	27.6	Very low	121 Å²	121	130.9 Å²	130.9	65%	0.647	71%	0.705	S	S	*	*	S	Bend	trans	-138.4	130.5	146.2	-141	15.8	0	0	0	106.6
1562	K	30.1	Very low	27.4	Very low	170 Å²	170	132.4 Å²	132.4	74%	0.739	71%	0.713	S	S	*	*	S	Bend	cis	-138.1	125.3	24.2	-77.4	169.7	-178.5	179.6	0	114.9
1563	N	30.5	Very low	27.3	Very low	125 Å²	125	134 Å²	134	67%	0.668	72%	0.72	S	S	*	*			trans	59	113.4	132.7	-54.8	-31.1	0	0	0	122
1564	L	29.2	Very low	27.3	Very low	158 Å²	158	133.3 Å²	133.3	83%	0.827	72%	0.721	S	S	*	*				-164.5	135.4	98.3	-130	75.1	0	0	0	115
1565	C	29	Very low	27.3	Very low	105 Å²	105	134.8 Å²	134.8	71%	0.709	73%	0.728	S	S	*	*			trans	62.4	118	149.5	-70.1	0	0	0	0	125.6
1566	N	27.8	Very low	27.2	Very low	154 Å²	154	133 Å²	133	82%	0.824	73%	0.727	S	S	*	*			trans	85.1	151.4	132.9	-80.4	-0.9	0	0	0	123.3
1567	P	32	Very low	27.2	Very low	108 Å²	108	133.3 Å²	133.3	70%	0.701	73%	0.728	S	S	*	*			trans	-142.3	-163.8	-141.4	43.9	-22.8	0	0	0	117
1568	S	29.9	Very low	27.2	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	73%	0.729	S	S	*	*			trans	82.3	148.5	167.1	83.2	0	0	0	0	116.6
1569	N	31.7	Very low	27.1	Very low	135 Å²	135	135.3 Å²	135.3	72%	0.722	73%	0.727	S	S	*	*			cis	-153.9	134.7	3.6	-132.1	1.5	0	0	0	114.3
1570	R	27.8	Very low	27	Very low	183 Å²	183	135.2 Å²	135.2	69%	0.691	73%	0.727	S	S	*	*			trans	42.1	134.1	137.8	-64.9	175.5	86.4	159.5	4.8	124
1571	E	26.2	Very low	26.8	Very low	136 Å²	136	132.8 Å²	132.8	64%	0.636	72%	0.722	S	S	*	*			trans	73	147.6	130.9	-74	168.1	-156.2	0	0	119.8
1572	L	23.7	Very low	26.6	Very low	129 Å²	129	136 Å²	136	68%	0.675	73%	0.726	S	S	*	*			cis	-165	169.6	-16.6	-153.3	51.8	0	0	0	111.1
1573	F	24.3	Very low	26.2	Very low	166 Å²	166	132.6 Å²	132.6	73%	0.728	72%	0.724	S	S	*	*			trans	58.5	105.5	154	-76	-47.9	0	0	0	124.1
1574	T	23.4	Very low	26.2	Very low	116 Å²	116	133.3 Å²	133.3	71%	0.712	73%	0.733	S	S	*	*				65.2	149.5	123.8	51	0	0	0	0	125.5
1575	T	24.1	Very low	26	Very low	123 Å²	123	132.9 Å²	132.9	76%	0.755	73%	0.73	S	S	*	*			trans	89.9	121.5	143.5	27.5	0	0	0	0	122.6
1576	S	24.2	Very low	26.3	Very low	94 Å²	94	133.6 Å²	133.6	66%	0.657	73%	0.731	S	S	*	*			trans	70.6	115.7	137.4	62.7	0	0	0	0	122.5
1577	N	24.2	Very low	26.2	Very low	144 Å²	144	131.6 Å²	131.6	77%	0.77	73%	0.725	S	S	*	*				70.4	104.6	123.4	-61.8	4.8	0	0	0	121.5
1578	S	23.9	Very low	26.6	Very low	100 Å²	100	131.5 Å²	131.5	70%	0.699	73%	0.727	S	S	*	*				88.2	151.1	111.5	77.6	0	0	0	0	121.4
1579	Q	23.7	Very low	26.8	Very low	163 Å²	163	133 Å²	133	76%	0.762	73%	0.726	S	S	*	*			trans	73.2	128.9	158.6	-73.8	-173.4	-8.8	0	0	119.8
1580	L	24.7	Very low	26.7	Very low	155 Å²	155	131.6 Å²	131.6	81%	0.812	72%	0.723	S	S	*	*			trans	62	139.6	141.4	-59.2	166.7	0	0	0	118.4
1581	S	23.9	Very low	26.9	Very low	97 Å²	97	128.1 Å²	128.1	68%	0.678	73%	0.733	S	S	*	*			cis	-163.3	176.8	-11.2	54.5	0	0	0	0	110.3
1582	Y	23.5	Very low	27.3	Very low	188 Å²	188	124.3 Å²	124.3	74%	0.737	72%	0.716	S	S	*	*			trans	-42	150.8	152	-62	-89.9	0	0	0	111.8
1583	S	23.7	Very low	27.7	Very low	99 Å²	99	122.7 Å²	122.7	69%	0.692	71%	0.708	S	S	*	*			cis	-173.4	149.4	-8.2	46	0	0	0	0	109.6
1584	T	29.8	Very low	28	Very low	139 Å²	139	122.3 Å²	122.3	85%	0.853	71%	0.711	S	S	*	*			trans	-144.7	120.3	162.8	4.9	0	0	0	0	112.2
1585	I	25.7	Very low	28.3	Very low	150 Å²	150	122.7 Å²	122.7	77%	0.769	70%	0.702	S	S	*	*			trans	-84.8	111.7	165.1	-65.2	167.8	0	0	0	107.6	T1587	I1585-T1587 HydrophobicContact CG2-CG2 3.67Å
1586	T	34.5	Very low	28.3	Very low	119 Å²	119	124.4 Å²	124.4	73%	0.73	70%	0.699	S	S	*	*			trans	-144.5	106.8	148.1	38.7	0	0	0	0	107.4
1587	T	26.4	Very low	28.2	Very low	113 Å²	113	127.2 Å²	127.2	69%	0.693	70%	0.702	S	S	*	*				49.1	75.2	61.4	76	0	0	0	0	114.1	I1585	I1585-T1587 HydrophobicContact CG2-CG2 3.67Å
1588	S	38.7	Very low	28.1	Very low	106 Å²	106	122.1 Å²	122.1	74%	0.741	68%	0.675	S	S	*	*			trans	-159.3	96.2	136.7	37.4	0	0	0	0	111.3	T1590	S1588-T1590 PolarHBondContact O-N 3.18Å
1589	N	34.1	Very low	28.1	Very low	137 Å²	137	119.7 Å²	119.7	73%	0.733	66%	0.655	S	S	*	*			trans	20.4	89	145.4	-53.5	-12	0	0	0	114.7
1590	T	29.6	Very low	28.3	Very low	106 Å²	106	117 Å²	117	65%	0.65	65%	0.647	S	S	*	*				37	142.6	90.9	55.5	0	0	0	0	115.4	S1588 I1592	S1588-T1590 PolarHBondContact O-N 3.18Å; T1590-I1592 WeakPolarHBondContact O-CB 3.41Å; T1590-I1592 WeakPolarHBondContact O-CG1 3.24Å; T1590-I1592 WeakPolarHBondContact OG1-CD1 3.23Å
1591	A	32.2	Very low	28.4	Very low	111 Å²	111	114.3 Å²	114.3	92%	0.917	64%	0.64	S	S	*	*	S	Bend	trans	23.1	-109.3	175.9	0	0	0	0	0	120.1
1592	I	34.4	Very low	28.7	Very low	55 Å²	55	117.2 Å²	117.2	28%	0.282	65%	0.647	S	S	.	*			cis	-173.2	173.9	21.3	-113.9	-171.9	0	0	0	108.4	T1590 M1594 K1595	T1590-I1592 WeakPolarHBondContact O-CB 3.41Å; T1590-I1592 WeakPolarHBondContact O-CG1 3.24Å; T1590-I1592 WeakPolarHBondContact OG1-CD1 3.23Å; I1592-M1594 HydrophobicContact CD1-CE 4.05Å; I1592-M1594 HydrophobicContact CD1-SD 4.09Å; I1592-M1594 HydrophobicContact CG1-CE 3.96Å; I1592-M1594 HydrophobicContact CG1-SD 3.8Å; I1592-K1595 PolarHBondContact O-NZ 3.14Å
1593	L	32.8	Very low	29.1	Very low	96 Å²	96	114.8 Å²	114.8	50%	0.503	65%	0.645	S	S	.	*			cis	-104.1	168.4	-16.6	-68.9	63.3	0	0	0	104.8	K1595	L1593-K1595 HydrophobicContact CB-CB 3.54Å; L1593-K1595 HydrophobicContact CB-CD 4.08Å; L1593-K1595 HydrophobicContact CB-CG 3.69Å; L1593-K1595 HydrophobicContact CD1-CD 4.44Å; L1593-K1595 HydrophobicContact CD1-CG 4.08Å; L1593-K1595 HydrophobicContact CG-CB 4.3Å; L1593-K1595 HydrophobicContact CG-CG 4.08Å
1594	M	31.1	Very low	29.4	Very low	158 Å²	158	117.7 Å²	117.7	78%	0.778	65%	0.648	S	S	*	*				38.6	-88.1	72.9	-24.7	97.8	161.6	0	0	114.2	I1592 K1596	I1592-M1594 HydrophobicContact CD1-CE 4.05Å; I1592-M1594 HydrophobicContact CD1-SD 4.09Å; I1592-M1594 HydrophobicContact CG1-CE 3.96Å; I1592-M1594 HydrophobicContact CG1-SD 3.8Å; M1594-K1596 PolarHBondContact O-N 3Å
1595	K	30.1	Very low	29.5	Very low	123 Å²	123	115.6 Å²	115.6	54%	0.535	63%	0.631	S	S	.	*			trans	80.4	16.8	150.9	-126.1	151.7	-140.4	175	0	116.5	I1592 L1593 Q1597	I1592-K1595 PolarHBondContact O-NZ 3.14Å; L1593-K1595 HydrophobicContact CB-CB 3.54Å; L1593-K1595 HydrophobicContact CB-CD 4.08Å; L1593-K1595 HydrophobicContact CB-CG 3.69Å; L1593-K1595 HydrophobicContact CD1-CD 4.44Å; L1593-K1595 HydrophobicContact CD1-CG 4.08Å; L1593-K1595 HydrophobicContact CG-CB 4.3Å; L1593-K1595 HydrophobicContact CG-CG 4.08Å; K1595-Q1597 VanDerWaalsContact O-O 3.05Å
1596	K	23	Very low	29.7	Very low	160 Å²	160	112.7 Å²	112.7	70%	0.696	62%	0.617	S	S	*	*			trans	-125.8	113.4	179.1	-65.1	-163.8	173.7	-168.8	0	113.6	M1594 L1598	M1594-K1596 PolarHBondContact O-N 3Å; K1596-L1598 HydrophobicContact CD-CD2 4.29Å
1597	Q	22.6	Very low	29.5	Very low	152 Å²	152	110.2 Å²	110.2	71%	0.71	60%	0.597	S	S	*	*	S	Bend	cis	45.3	68.4	-7.9	-158.3	178	25.6	0	0	117	K1595 T1599	K1595-Q1597 VanDerWaalsContact O-O 3.05Å; Q1597-T1599 PolarHBondContact O-N 3.29Å
1598	L	22.4	Very low	29.8	Very low	38 Å²	38	108.1 Å²	108.1	20%	0.199	58%	0.581	C	S	.	*	S	Bend	trans	-55.9	126.3	152.1	-72.8	154.5	0	0	0	105.7	E1099 Q1103 K1596	E1099-L1598 HydrophobicContact CB-CB 4.11Å; E1099-L1598 HydrophobicContact CB-CD1 3.86Å; E1099-L1598 HydrophobicContact CB-CG 4.38Å; E1099-L1598 HydrophobicContact CG-CD1 3.89Å; E1099-L1598 VanDerWaalsContact OE1-CD1 3.26Å; E1099-L1598 WeakPolarHBondContact OE1-CD1 2.73Å; E1099-L1598 WeakPolarHBondContact OE1-CD2 3.28Å; Q1103-L1598 HydrophobicContact CG-CB 3.99Å; Q1103-L1598 HydrophobicContact CG-CD1 4.14Å; K1596-L1598 HydrophobicContact CD-CD2 4.29Å
1599	T	24.3	Very low	29.2	Very low	48 Å²	48	105.5 Å²	105.5	29%	0.294	56%	0.563	S	S	.	*			cis	-134.9	152.1	30.7	53.4	0	0	0	0	111.5	N1096 L1100 Q1597	N1096-T1599 HydrophobicContact CB-CG2 3.91Å; N1096-T1599 WeakPolarHBondContact ND2-CG2 3.18Å; L1100-T1599 HydrophobicContact CD1-CG2 3.62Å; Q1597-T1599 PolarHBondContact O-N 3.29Å
1600	N	26.3	Very low	28.9	Very low	108 Å²	108	105.5 Å²	105.5	58%	0.578	57%	0.568	S	S	*	*				-172.8	154	66.5	-105.1	-40.2	0	0	0	112.7	N1096	N1096-N1600 PolarHBondContact ND2-OD1 3.39Å
1601	S	28.7	Very low	28.8	Very low	97 Å²	97	108 Å²	108	68%	0.678	58%	0.577	S	S	*	*			trans	41.8	146.4	138.9	73.8	0	0	0	0	122.9
1602	I	29	Very low	28.5	Very low	159 Å²	159	109.8 Å²	109.8	82%	0.815	57%	0.571	S	S	*	*			cis	-165.2	156.7	-6.9	-114.2	162.5	0	0	0	108.9
1603	I	32.5	Very low	28	Very low	137 Å²	137	111 Å²	111	70%	0.703	58%	0.584	S	S	*	*			trans	108.6	99.1	170.4	-54.5	-165.9	0	0	0	116.8
1604	E	30	Very low	27.7	Very low	159 Å²	159	111.4 Å²	111.4	74%	0.743	59%	0.591	S	S	*	*			trans	49	145	131.9	-54.2	176.1	172.7	0	0	122.6
1605	N	30.5	Very low	27.5	Very low	95 Å²	95	107.4 Å²	107.4	51%	0.508	58%	0.576	S	S	.	*			cis	-163.7	146.8	-10.9	-97.2	-5.6	0	0	0	111.6	S978	S978-N1605 WeakPolarHBondContact CB-OD1 3.46Å; S978-N1605 PolarHBondContact OG-OD1 3.24Å
1606	D	31.7	Very low	27.3	Very low	89 Å²	89	107.5 Å²	107.5	48%	0.476	59%	0.587	S	S	.	*			trans	64.6	150.9	135.6	-64.2	-20	0	0	0	129.1	S978	S978-D1606 VanDerWaalsContact C-OD1 3.26Å; S978-D1606 WeakPolarHBondContact CA-OD1 3.33Å; S978-D1606 VanDerWaalsContact CB-CG 3.44Å; S978-D1606 WeakPolarHBondContact CB-OD1 3.44Å; S978-D1606 WeakPolarHBondContact CB-OD2 3.5Å; S978-D1606 PolarHBondContact N-OD1 3.45Å; S978-D1606 VanDerWaalsContact OG-CG 3.3Å; S978-D1606 PolarHBondContact OG-OD1 3Å; S978-D1606 PolarHBondContact OG-OD2 3.46Å
1607	E	30.4	Very low	27.4	Very low	67 Å²	67	103.2 Å²	103.2	31%	0.313	59%	0.587	S	S	.	*			cis	-171.1	175.7	-39.1	-124.3	-165.3	-158.1	0	0	114.5	L976 L977 S978	L976-E1607 VanDerWaalsContact C-OE1 3.28Å; L976-E1607 WeakPolarHBondContact CA-OE1 3.18Å; L976-E1607 HydrophobicContact CB-CG 4.27Å; L976-E1607 WeakPolarHBondContact CB-OE1 3.4Å; L976-E1607 HydrophobicContact CG-CG 4.04Å; L976-E1607 WeakPolarHBondContact CG-OE1 3.45Å; L977-E1607 PolarHBondContact N-OE1 3.41Å; S978-E1607 PolarHBondContact N-OE1 2.91Å; S978-E1607 VanDerWaalsContact O-CD 3.26Å
1608	I	30.7	Very low	27.6	Very low	69 Å²	69	101.7 Å²	101.7	35%	0.354	59%	0.589	S	S	.	*			trans	64.3	82.3	152.2	-84.5	169.7	0	0	0	121.1	L976 L979 K2469	L976-I1608 HydrophobicContact CD1-CG1 4.36Å; L976-I1608 HydrophobicContact CD2-CD1 4.05Å; L976-I1608 HydrophobicContact CD2-CG1 3.78Å; L976-I1608 HydrophobicContact CG-CG1 3.98Å; L979-I1608 HydrophobicContact CD1-CD1 3.99Å; I1608-K2469 PolarHBondContact O-NZ 3.25Å
1609	S	26.4	Very low	27.7	Very low	52 Å²	52	109.3 Å²	109.3	36%	0.364	62%	0.62	S	S	.	*				70.9	169.4	101.1	93.8	0	0	0	0	124.8	K2469	S1609-K2469 WeakPolarHBondContact O-CE 3.13Å; S1609-K2469 PolarHBondContact O-NZ 3.36Å
1610	T	27.5	Very low	27.6	Very low	137 Å²	137	115.3 Å²	115.3	84%	0.84	65%	0.649	S	S	*	*			trans	79.3	133.9	152.3	44.5	0	0	0	0	123.7
1611	L	27.7	Very low	27.6	Very low	157 Å²	157	118.1 Å²	118.1	82%	0.822	66%	0.657	S	S	*	*			trans	-115.1	173.2	-171.6	-133	79.5	0	0	0	109.8
1612	N	25.8	Very low	27.3	Very low	150 Å²	150	124.2 Å²	124.2	80%	0.802	67%	0.665	S	S	*	*				-154.5	157.1	125.8	-118.5	-38.3	0	0	0	114.2
1613	S	24.9	Very low	27	Very low	79 Å²	79	123.3 Å²	123.3	55%	0.552	66%	0.655	S	S	*	*			trans	-40.6	149.4	-179.8	39.5	0	0	0	0	117.2
1614	T	25.7	Very low	26.7	Very low	106 Å²	106	122.2 Å²	122.2	65%	0.65	65%	0.65	S	S	*	*			cis	65.4	141.1	47.5	72.3	0	0	0	0	113.5
1615	T	27.3	Very low	26.3	Very low	74 Å²	74	124 Å²	124	45%	0.454	66%	0.656	S	S	.	*			cis	-150.5	173	-5.7	3.5	0	0	0	0	110.8	T2483	T1615-T2483 WeakPolarHBondContact CG2-O 3.28Å; T1615-T2483 PolarHBondContact OG1-O 2.85Å
1616	T	25.8	Very low	26	Very low	125 Å²	125	125.8 Å²	125.8	77%	0.767	66%	0.664	S	S	*	*			trans	-93.6	162.6	178.6	57.3	0	0	0	0	113.9
1617	G	24.7	Very low	25.7	Very low	69 Å²	69	128.7 Å²	128.7	71%	0.711	68%	0.68	S	S	*	*			trans	-109.4	95.9	175.2	0	0	0	0	0	114.7
1618	T	26.4	Very low	25.4	Very low	120 Å²	120	128 Å²	128	74%	0.736	68%	0.682	S	S	*	*			trans	50.4	102.4	153.1	61.1	0	0	0	0	121.7
1619	K	24.9	Very low	25.2	Very low	199 Å²	199	132.4 Å²	132.4	87%	0.865	71%	0.706	S	S	*	*				44.9	121.1	126.6	-65.7	171.2	178.9	165.3	0	120.6
1620	L	22.7	Very low	25.1	Very low	173 Å²	173	136.2 Å²	136.2	91%	0.906	72%	0.718	S	S	*	*				-162.6	155.5	101.6	-107.4	166.6	0	0	0	113.4
1621	K	25.4	Very low	24.8	Very low	167 Å²	167	137.5 Å²	137.5	73%	0.726	72%	0.715	S	S	*	*			trans	-75.1	166.4	175.1	-74.7	-177.7	177.2	179.5	0	110.3
1622	W	22.5	Very low	24.7	Very low	225 Å²	225	139.4 Å²	139.4	85%	0.852	72%	0.716	S	S	*	*			cis	-143.5	137.9	45	-77.4	71.8	0	0	0	110.4
1623	K	23.5	Very low	24.6	Very low	141 Å²	141	139.5 Å²	139.5	61%	0.613	72%	0.716	S	S	*	*				58.2	128.8	82	-70.5	-151	121.8	-131.4	0	113.6
1624	D	25.4	Very low	24.4	Very low	113 Å²	113	144.3 Å²	144.3	60%	0.604	73%	0.727	S	S	*	*			cis	-154.1	160	-1.4	-82.5	-42	0	0	0	111.5
1625	K	22	Very low	24.4	Very low	198 Å²	198	148.8 Å²	148.8	86%	0.861	73%	0.734	S	S	*	*			trans	-147.1	98.1	151.6	-148.6	174	-175	-172.1	0	106.6
1626	I	25.1	Very low	24.3	Very low	131 Å²	131	152.7 Å²	152.7	67%	0.672	75%	0.746	S	S	*	*				64.7	109.8	90.5	-62.5	168.3	0	0	0	112.4
1627	N	24.5	Very low	24.2	Very low	151 Å²	151	153.9 Å²	153.9	81%	0.807	75%	0.747	S	S	*	*			trans	-178.8	129.2	145.6	-100.4	30.3	0	0	0	103.2
1628	S	23.9	Very low	24.3	Very low	51 Å²	51	157.7 Å²	157.7	36%	0.357	75%	0.75	S	S	.	*			cis	58	139.4	24.9	51.2	0	0	0	0	114.8	E1630	S1628-E1630 VanDerWaalsContact CB-CD 3.43Å; S1628-E1630 VanDerWaalsContact CB-CG 3.44Å; S1628-E1630 WeakPolarHBondContact CB-OE1 3.36Å; S1628-E1630 PolarHBondContact OG-OE1 2.85Å
1629	D	26.2	Very low	24.2	Very low	163 Å²	163	157.4 Å²	157.4	87%	0.872	75%	0.748	S	S	*	*			cis	-72.6	148.4	27.3	-47.9	-78.5	0	0	0	117.3
1630	E	24.4	Very low	24.2	Very low	132 Å²	132	153.5 Å²	153.5	62%	0.617	74%	0.741	S	S	*	*			cis	98.1	119.4	9.6	-75.6	170.4	-145.1	0	0	121.1	S1628	S1628-E1630 VanDerWaalsContact CB-CD 3.43Å; S1628-E1630 VanDerWaalsContact CB-CG 3.44Å; S1628-E1630 WeakPolarHBondContact CB-OE1 3.36Å; S1628-E1630 PolarHBondContact OG-OE1 2.85Å
1631	Q	23	Very low	24.2	Very low	163 Å²	163	155.9 Å²	155.9	76%	0.762	74%	0.738	S	S	*	*			trans	31	121.5	135.2	-55.2	-176.9	20.2	0	0	121.6
1632	K	24.7	Very low	24.2	Very low	197 Å²	197	154.9 Å²	154.9	86%	0.857	74%	0.74	S	S	*	*			trans	174.9	154.1	134.8	-96.7	147	-172	165.8	0	110.4
1633	L	23.9	Very low	24.6	Very low	152 Å²	152	148.1 Å²	148.1	80%	0.796	72%	0.72	S	S	*	*			cis	-159.9	-175.3	-23.9	-152	64.2	0	0	0	109.5
1634	K	21.2	Very low	24.7	Very low	181 Å²	181	152 Å²	152	79%	0.787	73%	0.731	S	S	*	*			trans	-55	150.9	173	-62.5	175.6	170.9	-179.1	0	114.8
1635	Y	25.5	Very low	25	Very low	200 Å²	200	152.1 Å²	152.1	78%	0.784	73%	0.731	S	S	*	*			trans	54.3	146	138.2	-83.6	-120	0	0	0	118.8
1636	E	24.4	Very low	25.4	Very low	155 Å²	155	147.3 Å²	147.3	72%	0.724	72%	0.715	S	S	*	*			cis	-148.5	177	-4.5	-137.2	172.4	-176.8	0	0	105.5
1637	I	23.9	Very low	25.8	Very low	151 Å²	151	148.5 Å²	148.5	77%	0.774	71%	0.712	S	S	*	*				-161.6	156.9	59.1	-70.6	172.8	0	0	0	107.1
1638	L	25.9	Very low	26.3	Very low	148 Å²	148	149.9 Å²	149.9	78%	0.775	71%	0.707	S	S	*	*	S	Bend	trans	80.5	102.9	171.4	-143.8	77.6	0	0	0	116.2
1639	T	25.4	Very low	26.8	Very low	114 Å²	114	153.2 Å²	153.2	70%	0.699	72%	0.715	S	S	*	*			trans	48.2	125.9	149.7	57.5	0	0	0	0	120.3
1640	T	25	Very low	27.1	Very low	118 Å²	118	151.4 Å²	151.4	72%	0.724	70%	0.702	S	S	*	*			cis	-164.2	128.8	-8.2	6.2	0	0	0	0	105.3
1641	R	23.2	Very low	27.7	Very low	223 Å²	223	153.6 Å²	153.6	84%	0.842	70%	0.704	S	S	*	*				70.3	127.3	96	-152	-172	-157.5	-174.3	7.2	113.1
1642	L	24.9	Very low	28.4	Very low	146 Å²	146	150.2 Å²	150.2	76%	0.764	69%	0.691	S	S	*	*			trans	71.2	142.7	-164.5	-62.8	89.9	0	0	0	112.6
1643	D	30.5	Very low	29.2	Very low	82 Å²	82	144.6 Å²	144.6	44%	0.439	67%	0.67	S	S	.	*			cis	-130	122.5	5.6	-103.7	-50.9	0	0	0	114.2	I1645	D1643-I1645 VanDerWaalsContact C-N 3.26Å; D1643-I1645 HydrophobicContact CB-CB 4.49Å
1644	W	25.5	Very low	30	Very low	222 Å²	222	139.1 Å²	139.1	84%	0.841	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	7.2	165.8	-115.9	33.9	0	0	0	113.5	N1646	W1644-N1646 VanDerWaalsContact C-N 3.3Å
1645	I	31.8	Very low	31	Very low	116 Å²	116	134.2 Å²	134.2	60%	0.595	63%	0.632	S	S	*	*	H	α-helix	trans	-65.2	-38	161.5	-64.5	176.1	0	0	0	109.8	D1643 Y1647 Y1648 F1649	D1643-I1645 VanDerWaalsContact C-N 3.26Å; D1643-I1645 HydrophobicContact CB-CB 4.49Å; I1645-Y1647 VanDerWaalsContact C-N 3.27Å; I1645-Y1647 PolarHBondContact O-N 2.91Å; I1645-Y1648 PolarHBondContact O-N 3.05Å; I1645-F1649 WeakPolarHBondContact O-CB 3.19Å; I1645-F1649 PolarHBondContact O-N 2.88Å
1646	N	31.3	Very low	31.6	Very low	97 Å²	97	129.4 Å²	129.4	52%	0.519	62%	0.619	S	S	.	*	H	α-helix	trans	-65.5	-22.2	179.8	-90.1	-36.6	0	0	0	114.5	W1644 Q1650	W1644-N1646 VanDerWaalsContact C-N 3.3Å; N1646-Q1650 VanDerWaalsContact O-CB 3.23Å; N1646-Q1650 WeakPolarHBondContact O-CB 3.28Å; N1646-Q1650 WeakPolarHBondContact O-CG 3.32Å; N1646-Q1650 PolarHBondContact O-N 2.9Å
1647	Y	32.9	Very low	32.4	Very low	156 Å²	156	128.4 Å²	128.4	61%	0.612	61%	0.613	S	S	*	*	H	α-helix	trans	-79.7	-36.8	177.5	-124.2	-93.4	0	0	0	112.4	I1645 W1651	I1645-Y1647 VanDerWaalsContact C-N 3.27Å; I1645-Y1647 PolarHBondContact O-N 2.91Å; Y1647-W1651 WeakPolarHBondContact O-CB 3.33Å; Y1647-W1651 PolarHBondContact O-N 2.95Å
1648	Y	34.3	Very low	33.1	Very low	181 Å²	181	126.2 Å²	126.2	71%	0.71	60%	0.602	S	S	*	*	H	α-helix	trans	-69.8	-37.7	169.7	-127.9	-91.4	0	0	0	110.9	I1645 W1651 L1652	I1645-Y1648 PolarHBondContact O-N 3.05Å; Y1648-W1651 PolarHBondContact O-N 2.98Å; Y1648-L1652 WeakPolarHBondContact O-CB 3.44Å; Y1648-L1652 PolarHBondContact O-N 2.84Å
1649	F	34.8	Very low	33.8	Very low	121 Å²	121	124 Å²	124	53%	0.531	59%	0.59	S	S	.	*	H	α-helix	trans	-69	-36.8	175.3	-143.9	-92.3	0	0	0	112.5	I1645 L1652 L1653	I1645-F1649 WeakPolarHBondContact O-CB 3.19Å; I1645-F1649 PolarHBondContact O-N 2.88Å; F1649-L1652 PolarHBondContact O-N 2.72Å; F1649-L1653 HydrophobicContact CD1-CB 4.48Å; F1649-L1653 WeakPolarHBondContact O-CA 3.41Å; F1649-L1653 WeakPolarHBondContact O-CB 3.5Å; F1649-L1653 PolarHBondContact O-N 3.49Å
1650	Q	33.3	Very low	34.1	Very low	125 Å²	125	125.6 Å²	125.6	58%	0.584	59%	0.587	S	S	*	*	H	α-helix	trans	-72.6	-26.1	171.5	-79.5	-173.2	-14.2	0	0	113.2	N1646 G1654	N1646-Q1650 VanDerWaalsContact O-CB 3.23Å; N1646-Q1650 WeakPolarHBondContact O-CB 3.28Å; N1646-Q1650 WeakPolarHBondContact O-CG 3.32Å; N1646-Q1650 PolarHBondContact O-N 2.9Å; Q1650-G1654 WeakPolarHBondContact O-CA 3.15Å; Q1650-G1654 PolarHBondContact O-N 3.31Å
1651	W	36.6	Very low	34.8	Very low	178 Å²	178	127.9 Å²	127.9	67%	0.674	58%	0.584	S	S	*	*	H	α-helix	trans	-73.6	-39	170.2	-149.7	75.2	0	0	0	111.4	Y1647 Y1648 L1655	Y1647-W1651 WeakPolarHBondContact O-CB 3.33Å; Y1647-W1651 PolarHBondContact O-N 2.95Å; Y1648-W1651 PolarHBondContact O-N 2.98Å; W1651-L1655 WeakPolarHBondContact O-CB 3.45Å; W1651-L1655 PolarHBondContact O-N 3.31Å
1652	L	37.9	Very low	35.5	Very low	92 Å²	92	121.5 Å²	121.5	48%	0.482	57%	0.565	S	S	.	*	H	α-helix	trans	-71.6	-43.6	175.8	-145.5	81.9	0	0	0	112.4	Y1648 F1649 L1655 L1656	Y1648-L1652 WeakPolarHBondContact O-CB 3.44Å; Y1648-L1652 PolarHBondContact O-N 2.84Å; F1649-L1652 PolarHBondContact O-N 2.72Å; L1652-L1655 PolarHBondContact O-N 2.95Å; L1652-L1656 WeakPolarHBondContact O-CB 3.38Å; L1652-L1656 WeakPolarHBondContact O-CG 3.32Å; L1652-L1656 PolarHBondContact O-N 2.92Å
1653	L	40.5	Very low	36	Very low	79 Å²	79	116.9 Å²	116.9	41%	0.414	55%	0.546	S	S	.	.	H	α-helix	trans	-72.5	-31.8	176.3	-162.2	73.1	0	0	0	111	F1649 L1656 F1657	F1649-L1653 HydrophobicContact CD1-CB 4.48Å; F1649-L1653 WeakPolarHBondContact O-CA 3.41Å; F1649-L1653 WeakPolarHBondContact O-CB 3.5Å; F1649-L1653 PolarHBondContact O-N 3.49Å; L1653-L1656 PolarHBondContact O-N 2.91Å; L1653-F1657 HydrophobicContact CG-CD2 4.35Å; L1653-F1657 WeakPolarHBondContact O-CB 3.46Å; L1653-F1657 WeakPolarHBondContact O-CD2 3.43Å; L1653-F1657 PolarHBondContact O-N 2.91Å
1654	G	41.9	Very low	36.3	Very low	37 Å²	37	118.1 Å²	118.1	38%	0.381	55%	0.552	S	S	.	*	H	α-helix	trans	-68.1	-39.8	169.6	0	0	0	0	0	112.3	Q1650 F1657 L1658	Q1650-G1654 WeakPolarHBondContact O-CA 3.15Å; Q1650-G1654 PolarHBondContact O-N 3.31Å; G1654-F1657 PolarHBondContact O-N 2.97Å; G1654-L1658 WeakPolarHBondContact O-CB 3.45Å; G1654-L1658 PolarHBondContact O-N 3.48Å
1655	L	41.6	Very low	36.7	Very low	78 Å²	78	112.2 Å²	112.2	41%	0.408	53%	0.533	S	S	.	.	H	α-helix	trans	-66.2	-40.6	171.4	-165.6	75.4	0	0	0	111.1	W1651 L1652 L1658 I1659	W1651-L1655 WeakPolarHBondContact O-CB 3.45Å; W1651-L1655 PolarHBondContact O-N 3.31Å; L1652-L1655 PolarHBondContact O-N 2.95Å; L1655-L1658 PolarHBondContact O-N 3.01Å; L1655-I1659 HydrophobicContact CG-CD1 4.1Å; L1655-I1659 WeakPolarHBondContact O-CB 3.35Å; L1655-I1659 WeakPolarHBondContact O-CD1 3.48Å; L1655-I1659 VanDerWaalsContact O-CG1 3.23Å; L1655-I1659 WeakPolarHBondContact O-CG1 3.33Å; L1655-I1659 PolarHBondContact O-N 2.86Å
1656	L	38.1	Very low	36.7	Very low	98 Å²	98	115.1 Å²	115.1	51%	0.513	54%	0.537	S	S	.	.	H	α-helix	trans	-64.5	-39.5	172.5	-80.6	162.3	0	0	0	112.2	L1652 L1653 I1659 K1660	L1652-L1656 WeakPolarHBondContact O-CB 3.38Å; L1652-L1656 WeakPolarHBondContact O-CG 3.32Å; L1652-L1656 PolarHBondContact O-N 2.92Å; L1653-L1656 PolarHBondContact O-N 2.91Å; L1656-I1659 PolarHBondContact O-N 2.92Å; L1656-K1660 WeakPolarHBondContact O-CB 3.41Å; L1656-K1660 PolarHBondContact O-N 3.34Å
1657	F	41.2	Very low	37	Very low	134 Å²	134	114.6 Å²	114.6	59%	0.588	53%	0.533	S	S	*	.	H	α-helix	trans	-68.6	-36.3	172.1	-101.1	-85.3	0	0	0	111.7	L1653 G1654 K1660 Y1661	L1653-F1657 HydrophobicContact CG-CD2 4.35Å; L1653-F1657 WeakPolarHBondContact O-CB 3.46Å; L1653-F1657 WeakPolarHBondContact O-CD2 3.43Å; L1653-F1657 PolarHBondContact O-N 2.91Å; G1654-F1657 PolarHBondContact O-N 2.97Å; F1657-K1660 PolarHBondContact O-N 3.43Å; F1657-Y1661 WeakPolarHBondContact O-CB 3.29Å; F1657-Y1661 PolarHBondContact O-N 2.67Å
1658	L	37.7	Very low	37.1	Very low	106 Å²	106	111.9 Å²	111.9	56%	0.555	53%	0.529	S	S	*	.	H	α-helix	trans	-63.9	-45.6	173.6	-146.2	79.9	0	0	0	110.6	G1654 L1655 I1662	G1654-L1658 WeakPolarHBondContact O-CB 3.45Å; G1654-L1658 PolarHBondContact O-N 3.48Å; L1655-L1658 PolarHBondContact O-N 3.01Å; L1658-I1662 HydrophobicContact CD2-CD1 4.11Å; L1658-I1662 HydrophobicContact CG-CD1 3.83Å; L1658-I1662 WeakPolarHBondContact O-CB 3.5Å; L1658-I1662 WeakPolarHBondContact O-CG1 3.36Å; L1658-I1662 PolarHBondContact O-N 3.45Å
1659	I	40.7	Very low	37.1	Very low	101 Å²	101	108 Å²	108	52%	0.518	52%	0.519	S	S	.	.	H	α-helix	trans	-64.7	-42	176.3	-70.5	164.9	0	0	0	111.1	L1655 L1656 S1663	L1655-I1659 HydrophobicContact CG-CD1 4.1Å; L1655-I1659 WeakPolarHBondContact O-CB 3.35Å; L1655-I1659 WeakPolarHBondContact O-CD1 3.48Å; L1655-I1659 VanDerWaalsContact O-CG1 3.23Å; L1655-I1659 WeakPolarHBondContact O-CG1 3.33Å; L1655-I1659 PolarHBondContact O-N 2.86Å; L1656-I1659 PolarHBondContact O-N 2.92Å; I1659-S1663 WeakPolarHBondContact O-CB 3.08Å; I1659-S1663 PolarHBondContact O-N 3.02Å; I1659-S1663 PolarHBondContact O-OG 3.03Å
1660	K	32.2	Very low	37.3	Very low	147 Å²	147	107.3 Å²	107.3	64%	0.639	52%	0.52	S	S	*	.	H	α-helix	trans	-71.9	-34.7	179.1	-163.3	169.3	-173.4	176.9	0	112.6	L1656 F1657 S1663 L1664	L1656-K1660 WeakPolarHBondContact O-CB 3.41Å; L1656-K1660 PolarHBondContact O-N 3.34Å; F1657-K1660 PolarHBondContact O-N 3.43Å; K1660-S1663 WeakPolarHBondContact CA-OG 3.3Å; K1660-S1663 PolarHBondContact O-OG 3Å; K1660-L1664 WeakPolarHBondContact O-CB 3.32Å; K1660-L1664 PolarHBondContact O-N 3.27Å; K1660-L1664 VanDerWaalsContact O-N 3.14Å
1661	Y	39.3	Very low	37.5	Very low	166 Å²	166	107.4 Å²	107.4	65%	0.651	52%	0.523	S	S	*	.	H	α-helix	trans	-80	-40.5	177.4	-157.3	-95.3	0	0	0	111.9	F1657 H1665	F1657-Y1661 WeakPolarHBondContact O-CB 3.29Å; F1657-Y1661 PolarHBondContact O-N 2.67Å; Y1661-H1665 WeakPolarHBondContact O-CB 3.48Å; Y1661-H1665 PolarHBondContact O-N 3.32Å
1662	I	37.9	Very low	37.2	Very low	89 Å²	89	107 Å²	107	46%	0.456	53%	0.526	S	S	.	.	H	α-helix	trans	-66.6	-43.6	174.6	-68.6	172.1	0	0	0	110.6	L1658 W1666	L1658-I1662 HydrophobicContact CD2-CD1 4.11Å; L1658-I1662 HydrophobicContact CG-CD1 3.83Å; L1658-I1662 WeakPolarHBondContact O-CB 3.5Å; L1658-I1662 WeakPolarHBondContact O-CG1 3.36Å; L1658-I1662 PolarHBondContact O-N 3.45Å; I1662-W1666 WeakPolarHBondContact O-CB 3.39Å; I1662-W1666 VanDerWaalsContact O-CD1 3.29Å; I1662-W1666 PolarHBondContact O-N 3.26Å
1663	S	35.6	Very low	36.8	Very low	50 Å²	50	112 Å²	112	35%	0.35	54%	0.54	S	S	.	.	H	α-helix	trans	-62.7	-51.6	176	54.7	0	0	0	0	112	I1659 K1660 H1665 W1666 I1667	I1659-S1663 WeakPolarHBondContact O-CB 3.08Å; I1659-S1663 PolarHBondContact O-N 3.02Å; I1659-S1663 PolarHBondContact O-OG 3.03Å; K1660-S1663 WeakPolarHBondContact CA-OG 3.3Å; K1660-S1663 PolarHBondContact O-OG 3Å; S1663-H1665 VanDerWaalsContact C-N 3.35Å; S1663-H1665 PolarHBondContact O-N 2.79Å; S1663-W1666 PolarHBondContact O-N 3.46Å; S1663-I1667 WeakPolarHBondContact O-CB 3.42Å; S1663-I1667 WeakPolarHBondContact O-CD1 3.22Å; S1663-I1667 WeakPolarHBondContact O-CG1 3.4Å; S1663-I1667 PolarHBondContact O-N 3.29Å
1664	L	36.7	Very low	36.6	Very low	108 Å²	108	111.7 Å²	111.7	57%	0.565	54%	0.542	S	S	*	.	H	α-helix	trans	-64.8	-37.7	-178.5	-143.9	79	0	0	0	112.5	K1660 I1667 L1668	K1660-L1664 WeakPolarHBondContact O-CB 3.32Å; K1660-L1664 PolarHBondContact O-N 3.27Å; K1660-L1664 VanDerWaalsContact O-N 3.14Å; L1664-I1667 PolarHBondContact O-N 2.81Å; L1664-L1668 HydrophobicContact CD2-CD1 4.49Å; L1664-L1668 HydrophobicContact CG-CD1 4.36Å; L1664-L1668 WeakPolarHBondContact O-CB 3.49Å; L1664-L1668 PolarHBondContact O-N 2.89Å
1665	H	34	Very low	36	Very low	98 Å²	98	120.9 Å²	120.9	45%	0.454	57%	0.567	S	S	.	*	H	α-helix	trans	-76	-27.4	179.6	-160.1	-44.3	0	0	0	113	Y1661 S1663 I1669	Y1661-H1665 WeakPolarHBondContact O-CB 3.48Å; Y1661-H1665 PolarHBondContact O-N 3.32Å; S1663-H1665 VanDerWaalsContact C-N 3.35Å; S1663-H1665 PolarHBondContact O-N 2.79Å; H1665-I1669 WeakPolarHBondContact ND1-CD1 3.35Å; H1665-I1669 WeakPolarHBondContact O-CB 3.43Å; H1665-I1669 VanDerWaalsContact O-CG1 3.3Å; H1665-I1669 WeakPolarHBondContact O-CG1 3.35Å; H1665-I1669 PolarHBondContact O-N 3.34Å
1666	W	32.1	Very low	35.2	Very low	176 Å²	176	127.2 Å²	127.2	67%	0.667	59%	0.592	S	S	*	*	H	α-helix	trans	-73.6	-43.9	167.8	-87.2	61.1	0	0	0	111.7	I1662 S1663 L1668 I1669 I1670	I1662-W1666 WeakPolarHBondContact O-CB 3.39Å; I1662-W1666 VanDerWaalsContact O-CD1 3.29Å; I1662-W1666 PolarHBondContact O-N 3.26Å; S1663-W1666 PolarHBondContact O-N 3.46Å; W1666-L1668 PolarHBondContact O-N 3.48Å; W1666-I1669 PolarHBondContact O-N 2.77Å; W1666-I1670 HydrophobicContact CE3-CD1 4.44Å; W1666-I1670 WeakPolarHBondContact O-CB 3.37Å; W1666-I1670 VanDerWaalsContact O-CG1 3.29Å; W1666-I1670 WeakPolarHBondContact O-CG1 3.27Å; W1666-I1670 PolarHBondContact O-N 3.41Å
1667	I	36.9	Very low	34.7	Very low	87 Å²	87	127.3 Å²	127.3	45%	0.446	60%	0.596	S	S	.	*	H	α-helix	trans	-61.9	-44.1	178.7	-71	166.8	0	0	0	110.8	S1663 L1664 I1669 I1670 I1671	S1663-I1667 WeakPolarHBondContact O-CB 3.42Å; S1663-I1667 WeakPolarHBondContact O-CD1 3.22Å; S1663-I1667 WeakPolarHBondContact O-CG1 3.4Å; S1663-I1667 PolarHBondContact O-N 3.29Å; L1664-I1667 PolarHBondContact O-N 2.81Å; I1667-I1669 PolarHBondContact O-N 3.25Å; I1667-I1670 PolarHBondContact O-N 2.95Å; I1667-I1671 HydrophobicContact CG2-CD1 3.59Å; I1667-I1671 HydrophobicContact CG2-CG1 4.38Å; I1667-I1671 WeakPolarHBondContact O-CB 3.49Å; I1667-I1671 VanDerWaalsContact O-CG1 3.31Å; I1667-I1671 WeakPolarHBondContact O-CG1 3.25Å; I1667-I1671 PolarHBondContact O-N 3.28Å
1668	L	35.3	Very low	34.1	Very low	99 Å²	99	126.2 Å²	126.2	52%	0.518	59%	0.594	S	S	.	*	H	α-helix	trans	-67.6	-30.8	176	-85.5	160	0	0	0	113.9	L1664 W1666 K1672	L1664-L1668 HydrophobicContact CD2-CD1 4.49Å; L1664-L1668 HydrophobicContact CG-CD1 4.36Å; L1664-L1668 WeakPolarHBondContact O-CB 3.49Å; L1664-L1668 PolarHBondContact O-N 2.89Å; W1666-L1668 PolarHBondContact O-N 3.48Å; L1668-K1672 PolarHBondContact O-N 2.9Å
1669	I	35.8	Very low	33.7	Very low	100 Å²	100	130.5 Å²	130.5	51%	0.513	61%	0.609	S	S	.	*	H	α-helix	trans	-69.4	-43.1	171.8	-77.3	174.6	0	0	0	110.9	H1665 W1666 I1667 Y1673	H1665-I1669 WeakPolarHBondContact ND1-CD1 3.35Å; H1665-I1669 WeakPolarHBondContact O-CB 3.43Å; H1665-I1669 VanDerWaalsContact O-CG1 3.3Å; H1665-I1669 WeakPolarHBondContact O-CG1 3.35Å; H1665-I1669 PolarHBondContact O-N 3.34Å; W1666-I1669 PolarHBondContact O-N 2.77Å; I1667-I1669 PolarHBondContact O-N 3.25Å; I1669-Y1673 PolarHBondContact O-N 3.37Å
1670	I	37.9	Very low	33.1	Very low	105 Å²	105	136 Å²	136	54%	0.538	62%	0.623	S	S	.	*	H	α-helix	trans	-66.8	-38.9	-179.7	-70.4	166.4	0	0	0	111.3	W1666 I1667	W1666-I1670 HydrophobicContact CE3-CD1 4.44Å; W1666-I1670 WeakPolarHBondContact O-CB 3.37Å; W1666-I1670 VanDerWaalsContact O-CG1 3.29Å; W1666-I1670 WeakPolarHBondContact O-CG1 3.27Å; W1666-I1670 PolarHBondContact O-N 3.41Å; I1667-I1670 PolarHBondContact O-N 2.95Å
1671	I	37.1	Very low	32.9	Very low	127 Å²	127	137.3 Å²	137.3	65%	0.651	63%	0.625	S	S	*	*	H	α-helix	trans	-76.6	-30.3	-178.3	-70	174.8	0	0	0	113	I1667	I1667-I1671 HydrophobicContact CG2-CD1 3.59Å; I1667-I1671 HydrophobicContact CG2-CG1 4.38Å; I1667-I1671 WeakPolarHBondContact O-CB 3.49Å; I1667-I1671 VanDerWaalsContact O-CG1 3.31Å; I1667-I1671 WeakPolarHBondContact O-CG1 3.25Å; I1667-I1671 PolarHBondContact O-N 3.28Å
1672	K	31	Very low	32.7	Very low	170 Å²	170	135.5 Å²	135.5	74%	0.739	63%	0.625	S	S	*	*	H	α-helix	trans	-98.4	-20.3	-175.2	-105.3	-178.2	176.4	-178.2	0	117.3	L1668	L1668-K1672 PolarHBondContact O-N 2.9Å
1673	Y	29.8	Very low	32.5	Very low	198 Å²	198	136.4 Å²	136.4	78%	0.776	63%	0.63	S	S	*	*			trans	-159	95.9	180	-104.4	-80.4	0	0	0	115.2	I1669	I1669-Y1673 PolarHBondContact O-N 3.37Å
1674	P	36.8	Very low	32.1	Very low	71 Å²	71	138 Å²	138	46%	0.461	64%	0.64	S	S	.	*			trans	-148.2	78.2	150.8	38.3	-19.9	0	0	0	116.1
1675	Y	27.6	Very low	31.7	Very low	231 Å²	231	139.8 Å²	139.8	91%	0.906	65%	0.649	S	S	*	*	S	Bend	trans	-131.2	-6.6	162.1	-125.7	-85.3	0	0	0	117.2
1676	K	26.5	Very low	31.6	Very low	211 Å²	211	137.9 Å²	137.9	92%	0.917	66%	0.656	S	S	*	*	S	Bend	trans	-119.7	-6.9	176.3	-114.6	169.4	-177.4	168.5	0	116.1
1677	T	26.7	Very low	31.4	Very low	100 Å²	100	135.4 Å²	135.4	61%	0.613	65%	0.65	S	S	*	*	S	Bend	trans	-119.3	-23.4	-170	-22.2	0	0	0	0	115	K1679	T1677-K1679 VanDerWaalsContact C-N 3.33Å; T1677-K1679 PolarHBondContact O-N 2.95Å
1678	M	29.3	Very low	31	Very low	110 Å²	110	136.1 Å²	136.1	54%	0.542	66%	0.662	S	S	.	*	G	3₁₀ helix	trans	-69.9	-27	-176.5	-123.7	-54.2	-172.1	0	0	113.5	R1680 Y1681 I1682	M1678-R1680 PolarHBondContact O-N 3.06Å; M1678-Y1681 PolarHBondContact O-N 3.42Å; M1678-Y1681 VanDerWaalsContact O-N 3.15Å; M1678-I1682 HydrophobicContact CE-CD1 4.24Å; M1678-I1682 HydrophobicContact CE-CG1 4.29Å; M1678-I1682 HydrophobicContact SD-CD1 3.75Å; M1678-I1682 HydrophobicContact SD-CG1 3.81Å
1679	K	29.2	Very low	30.6	Very low	197 Å²	197	139.8 Å²	139.8	86%	0.857	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-63.9	1.9	-179.5	-154.7	168.2	-174.6	171.7	0	114.6	T1677	T1677-K1679 VanDerWaalsContact C-N 3.33Å; T1677-K1679 PolarHBondContact O-N 2.95Å
1680	R	28	Very low	30.2	Very low	216 Å²	216	141.7 Å²	141.7	82%	0.815	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-116.5	-14.8	174.7	-75.5	-173.7	173.5	176.1	0.2	115.9	M1678	M1678-R1680 PolarHBondContact O-N 3.06Å
1681	Y	28	Very low	29.7	Very low	175 Å²	175	147.5 Å²	147.5	69%	0.686	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-34.9	-174.9	-109.9	-88.3	0	0	0	114.4	M1678 I1683 C1684	M1678-Y1681 PolarHBondContact O-N 3.42Å; M1678-Y1681 VanDerWaalsContact O-N 3.15Å; Y1681-I1683 PolarHBondContact O-N 3.13Å; Y1681-C1684 PolarHBondContact O-N 3.16Å; Y1681-C1684 VanDerWaalsContact O-N 3.15Å
1682	I	34.8	Very low	29	Very low	127 Å²	127	147.7 Å²	147.7	65%	0.651	70%	0.702	S	S	*	*	H	α-helix	trans	-64.6	-23.6	179.7	-70.4	169.1	0	0	0	112.5	M1678 C1684	M1678-I1682 HydrophobicContact CE-CD1 4.24Å; M1678-I1682 HydrophobicContact CE-CG1 4.29Å; M1678-I1682 HydrophobicContact SD-CD1 3.75Å; M1678-I1682 HydrophobicContact SD-CG1 3.81Å; I1682-C1684 PolarHBondContact O-N 3.11Å
1683	I	34.1	Very low	28.9	Very low	108 Å²	108	147 Å²	147	55%	0.554	71%	0.705	S	S	*	*	H	α-helix	trans	-71.9	-13.3	178.5	-65.7	173.9	0	0	0	113	Y1681 K1687	Y1681-I1683 PolarHBondContact O-N 3.13Å; I1683-K1687 PolarHBondContact O-NZ 2.96Å
1684	C	26.6	Very low	28.7	Very low	84 Å²	84	141.7 Å²	141.7	57%	0.568	70%	0.696	S	S	*	*	H	α-helix	trans	-102.9	-21.7	-174.7	-70.5	0	0	0	0	115.4	Y1681 I1682	Y1681-C1684 PolarHBondContact O-N 3.16Å; Y1681-C1684 VanDerWaalsContact O-N 3.15Å; I1682-C1684 PolarHBondContact O-N 3.11Å
1685	L	28.4	Very low	28.1	Very low	145 Å²	145	142.2 Å²	142.2	76%	0.759	70%	0.702	S	S	*	*	H	α-helix	trans	-88.8	-28.4	179.6	-88.2	160.3	0	0	0	113.5	K1687	L1685-K1687 PolarHBondContact O-N 2.91Å
1686	G	32.1	Very low	28.9	Very low	58 Å²	58	139 Å²	139	60%	0.598	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	33.3	172.7	0	0	0	0	0	115
1687	K	28.1	Very low	28.7	Very low	124 Å²	124	134.2 Å²	134.2	54%	0.539	68%	0.684	S	S	.	*	T	Hydrogen-bonded Turn	trans	-139.2	-1.8	179.2	-67	-164.4	-177	88.9	0	115.4	I1683 L1685	I1683-K1687 PolarHBondContact O-NZ 2.96Å; L1685-K1687 PolarHBondContact O-N 2.91Å
1688	C	27.9	Very low	28.7	Very low	103 Å²	103	136.4 Å²	136.4	70%	0.696	69%	0.691	S	S	*	*	S	Bend	trans	-107.4	1.1	178.4	-69.2	0	0	0	0	114.2
1689	K	26.2	Very low	28.5	Very low	175 Å²	175	138.1 Å²	138.1	76%	0.761	70%	0.701	S	S	*	*	S	Bend	trans	-94	-43.3	176.9	-159.8	175.2	-178.3	-176.1	0	112	W1691 L1692	K1689-W1691 PolarHBondContact O-N 3Å; K1689-L1692 PolarHBondContact O-N 3.45Å
1690	D	28.4	Very low	28.1	Very low	141 Å²	141	135 Å²	135	75%	0.754	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	20.9	-174.7	-43.4	-32.7	0	0	0	113.4
1691	W	26.4	Very low	27.9	Very low	226 Å²	226	134.9 Å²	134.9	86%	0.856	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.5	-3.8	174.1	-170.1	65.9	0	0	0	112.8	K1689	K1689-W1691 PolarHBondContact O-N 3Å
1692	L	23.5	Very low	27.8	Very low	131 Å²	131	128.8 Å²	128.8	69%	0.686	69%	0.685	S	S	*	*	S	Bend	trans	-129.2	11.5	-170.3	-118.5	174	0	0	0	115.9	K1689	K1689-L1692 PolarHBondContact O-N 3.45Å
1693	I	28.7	Very low	27.3	Very low	156 Å²	156	129.5 Å²	129.5	80%	0.8	68%	0.681	S	S	*	*	S	Bend	trans	-158.7	130.4	158.9	-96.9	138	0	0	0	107.6
1694	S	26.3	Very low	26.9	Very low	86 Å²	86	128 Å²	128	60%	0.601	67%	0.67	S	S	*	*			cis	-156.7	128.9	-16	-171.7	0	0	0	0	112
1695	S	23.1	Very low	26.8	Very low	82 Å²	82	130.5 Å²	130.5	57%	0.573	67%	0.673	S	S	*	*			trans	-128.2	127.6	137.1	63.6	0	0	0	0	105.7	N1697	S1695-N1697 WeakPolarHBondContact CB-OD1 3.41Å; S1695-N1697 PolarHBondContact O-OD1 3.28Å; S1695-N1697 PolarHBondContact OG-OD1 3.22Å
1696	L	43.9	Very low	26.6	Very low	165 Å²	165	127.9 Å²	127.9	86%	0.864	67%	0.667	S	S	*	*			cis	46.1	70.3	19.4	-92.9	162.3	0	0	0	110.6
1697	N	23.1	Very low	26.3	Very low	109 Å²	109	131.7 Å²	131.7	58%	0.583	67%	0.672	S	S	*	*			trans	-92.5	151.3	-149.7	-78.9	-30.5	0	0	0	114	S1695	S1695-N1697 WeakPolarHBondContact CB-OD1 3.41Å; S1695-N1697 PolarHBondContact O-OD1 3.28Å; S1695-N1697 PolarHBondContact OG-OD1 3.22Å
1698	L	26	Very low	26	Very low	146 Å²	146	136.2 Å²	136.2	76%	0.764	69%	0.685	S	S	*	*			trans	57.6	132.9	141.6	-83.5	68.6	0	0	0	119.1
1699	I	25.5	Very low	25.9	Very low	147 Å²	147	138.2 Å²	138.2	75%	0.754	69%	0.685	S	S	*	*				179.9	115	109.6	-88.3	155.9	0	0	0	111.5
1700	N	21.3	Very low	25.9	Very low	132 Å²	132	135.7 Å²	135.7	71%	0.706	69%	0.689	S	S	*	*			trans	53.9	156.1	145.5	-59.3	-9.2	0	0	0	125.7
1701	Y	24.4	Very low	25.7	Very low	212 Å²	212	134.7 Å²	134.7	83%	0.831	69%	0.693	S	S	*	*			trans	72.7	117.2	175.5	-53.6	-83.6	0	0	0	117
1702	G	24.1	Very low	25.7	Very low	48 Å²	48	129.2 Å²	129.2	50%	0.495	69%	0.689	S	S	.	*			cis	166.7	168.2	-16.4	0	0	0	0	0	114.2
1703	Y	25.5	Very low	25.7	Very low	141 Å²	141	129.5 Å²	129.5	55%	0.553	69%	0.691	S	S	*	*			trans	82.3	154.9	159.2	-37.6	-90.7	0	0	0	118.9	A1717 T1718	Y1703-A1717 HydrophobicContact CD1-CB 3.61Å; Y1703-A1717 HydrophobicContact CD2-CB 4.5Å; Y1703-A1717 HydrophobicContact CE1-CB 4.49Å; Y1703-A1717 HydrophobicContact CG-CB 3.69Å; Y1703-T1718 VanDerWaalsContact CA-OG1 3.23Å; Y1703-T1718 WeakPolarHBondContact CA-OG1 3.41Å; Y1703-T1718 WeakPolarHBondContact CB-OG1 3.31Å; Y1703-T1718 WeakPolarHBondContact CD1-OG1 3.37Å
1704	F	25.9	Very low	25.6	Very low	76 Å²	76	128.2 Å²	128.2	33%	0.333	69%	0.69	S	S	.	*			cis	-139.4	-105.6	15.6	-170.2	10.1	0	0	0	122	N1716 A1717 T1718	F1704-N1716 HydrophobicContact CB-CB 4.29Å; F1704-N1716 VanDerWaalsContact CD2-CA 3.46Å; F1704-N1716 WeakPolarHBondContact CD2-O 3.49Å; F1704-N1716 WeakPolarHBondContact CE2-O 3.49Å; F1704-A1717 WeakPolarHBondContact CD1-O 3.49Å; F1704-A1717 WeakPolarHBondContact CE1-O 3.39Å; F1704-A1717 VanDerWaalsContact CE2-N 3.25Å; F1704-A1717 VanDerWaalsContact CG-C 3.41Å; F1704-T1718 WeakPolarHBondContact O-CG2 3.31Å
1705	H	24	Very low	25.5	Very low	137 Å²	137	131.2 Å²	131.2	63%	0.634	70%	0.698	S	S	*	*			trans	-127.2	158.7	-145.7	-129.1	-16.9	0	0	0	117.6
1706	C	24.1	Very low	25.5	Very low	91 Å²	91	132.1 Å²	132.1	62%	0.615	70%	0.696	S	S	*	*			trans	40	145.7	136.8	-92.9	0	0	0	0	126.6
1707	I	25.3	Very low	24.7	Very low	138 Å²	138	126.9 Å²	126.9	71%	0.708	68%	0.677	S	S	*	*			trans	73.3	128.5	136.6	-72.9	168.3	0	0	0	121
1708	R	23.2	Very low	24.8	Very low	219 Å²	219	124.7 Å²	124.7	83%	0.826	67%	0.668	S	S	*	*	S	Bend	trans	62.9	-177.5	154	-95.8	-179.9	167.5	147.5	-2.3	120.3
1709	Q	25.6	Very low	24.9	Very low	145 Å²	145	123.6 Å²	123.6	68%	0.678	66%	0.663	S	S	*	*	S	Bend	trans	-44.1	163.2	157.9	-52.3	138	-87	0	0	112.8
1710	S	26.5	Very low	25	Very low	121 Å²	121	122.6 Å²	122.6	85%	0.846	66%	0.659	S	S	*	*	S	Bend	trans	63.2	167	167.9	65.1	0	0	0	0	115.9
1711	S	22.6	Very low	25.1	Very low	120 Å²	120	123.3 Å²	123.3	84%	0.839	66%	0.662	S	S	*	*			trans	-136.9	114.8	174.3	54.3	0	0	0	0	107.8
1712	S	26.4	Very low	25.4	Very low	111 Å²	111	117.9 Å²	117.9	78%	0.776	66%	0.656	S	S	*	*			trans	-93.9	-179.5	-167.2	62.2	0	0	0	0	113.7
1713	D	23.9	Very low	25.6	Very low	138 Å²	138	124.1 Å²	124.1	74%	0.738	67%	0.672	S	S	*	*	S	Bend	trans	-49.9	139.6	153.8	-53.9	-81.4	0	0	0	112.4
1714	V	27.3	Very low	25.6	Very low	128 Å²	128	122.6 Å²	122.6	78%	0.776	68%	0.682	S	S	*	*				33.4	113.8	121.7	-173.9	0	0	0	0	114.9
1715	I	23.5	Very low	25.4	Very low	150 Å²	150	124.8 Å²	124.8	77%	0.769	70%	0.702	S	S	*	*			cis	-156.1	178.8	49.7	-49	166.2	0	0	0	113.3
1716	N	23.4	Very low	25.4	Very low	100 Å²	100	123.6 Å²	123.6	54%	0.535	71%	0.706	S	S	.	*			trans	-90.2	177.5	-176.3	-64.2	-1.3	0	0	0	117.1	F1704	F1704-N1716 HydrophobicContact CB-CB 4.29Å; F1704-N1716 VanDerWaalsContact CD2-CA 3.46Å; F1704-N1716 WeakPolarHBondContact CD2-O 3.49Å; F1704-N1716 WeakPolarHBondContact CE2-O 3.49Å
1717	A	26	Very low	25.4	Very low	55 Å²	55	123.6 Å²	123.6	46%	0.455	71%	0.707	S	S	.	*			cis	-152.3	150.7	22.4	0	0	0	0	0	121.1	Y1703 F1704	Y1703-A1717 HydrophobicContact CD1-CB 3.61Å; Y1703-A1717 HydrophobicContact CD2-CB 4.5Å; Y1703-A1717 HydrophobicContact CE1-CB 4.49Å; Y1703-A1717 HydrophobicContact CG-CB 3.69Å; F1704-A1717 WeakPolarHBondContact CD1-O 3.49Å; F1704-A1717 WeakPolarHBondContact CE1-O 3.39Å; F1704-A1717 VanDerWaalsContact CE2-N 3.25Å; F1704-A1717 VanDerWaalsContact CG-C 3.41Å
1718	T	26.9	Very low	25.4	Very low	63 Å²	63	121.5 Å²	121.5	39%	0.387	71%	0.705	S	S	.	*			trans	-55.9	151.2	-155.6	15.9	0	0	0	0	125.9	Y1703 F1704	Y1703-T1718 VanDerWaalsContact CA-OG1 3.23Å; Y1703-T1718 WeakPolarHBondContact CA-OG1 3.41Å; Y1703-T1718 WeakPolarHBondContact CB-OG1 3.31Å; Y1703-T1718 WeakPolarHBondContact CD1-OG1 3.37Å; F1704-T1718 WeakPolarHBondContact O-CG2 3.31Å
1719	N	28.4	Very low	25.7	Very low	124 Å²	124	117.3 Å²	117.3	66%	0.663	70%	0.699	S	S	*	*			trans	59.3	152	139.3	-102.5	53.7	0	0	0	124.7
1720	D	25.6	Very low	25.8	Very low	125 Å²	125	115.5 Å²	115.5	67%	0.668	69%	0.694	S	S	*	*			trans	81.4	131.1	152.3	-76.6	12.5	0	0	0	123.2
1721	N	25.3	Very low	25.8	Very low	147 Å²	147	116.7 Å²	116.7	79%	0.786	70%	0.696	S	S	*	*			trans	75.3	157	147.1	-73.4	-46.4	0	0	0	123.4
1722	S	29	Very low	26.2	Very low	99 Å²	99	118.3 Å²	118.3	69%	0.692	69%	0.692	S	S	*	*			trans	86.9	118.3	163.7	75.5	0	0	0	0	121
1723	Q	28.6	Very low	26.3	Very low	178 Å²	178	119.7 Å²	119.7	83%	0.832	69%	0.689	S	S	*	*				59.5	145.9	125.2	-65	171	-34.7	0	0	123.5
1724	S	26.1	Very low	26.4	Very low	109 Å²	109	120.1 Å²	120.1	76%	0.762	69%	0.69	S	S	*	*			trans	64	112.5	150.8	45	0	0	0	0	121.5
1725	T	21.8	Very low	26.3	Very low	123 Å²	123	120.6 Å²	120.6	76%	0.755	69%	0.689	S	S	*	*			trans	-48.5	151.1	137.2	48.2	0	0	0	0	111.5
1726	P	24.8	Very low	26.5	Very low	111 Å²	111	121.4 Å²	121.4	72%	0.721	69%	0.686	S	S	*	*				-92.6	158.3	51.1	34.2	-39.3	0	0	0	113.8
1727	S	23.7	Very low	26.7	Very low	91 Å²	91	125.8 Å²	125.8	64%	0.636	70%	0.701	S	S	*	*			cis	78.9	149.2	26	87.5	0	0	0	0	116.2
1728	S	25.5	Very low	26.7	Very low	94 Å²	94	130.6 Å²	130.6	66%	0.657	72%	0.719	S	S	*	*			trans	59.2	134.1	153	49.3	0	0	0	0	120.4
1729	N	28.2	Very low	26.7	Very low	132 Å²	132	135.3 Å²	135.3	71%	0.706	74%	0.741	S	S	*	*			cis	-154.2	145.1	1.1	-106.9	19.2	0	0	0	112.8
1730	D	27.8	Very low	26.5	Very low	107 Å²	107	138.8 Å²	138.8	57%	0.572	75%	0.75	S	S	*	*			trans	53.3	104.4	134	-47.9	-23.5	0	0	0	123
1731	T	27.2	Very low	26.6	Very low	145 Å²	145	136.5 Å²	136.5	89%	0.89	76%	0.756	S	S	*	*				-176.4	69.5	121.9	20	0	0	0	0	107.9
1732	M	31.4	Very low	26.5	Very low	154 Å²	154	135.3 Å²	135.3	76%	0.759	75%	0.749	S	S	*	*				42	123.1	81.6	-102.7	-167.6	-179.8	0	0	114.2
1733	I	27.4	Very low	26.3	Very low	140 Å²	140	135.9 Å²	135.9	72%	0.718	75%	0.753	S	S	*	*			cis	-178.6	136.4	-25.1	-110.6	151.5	0	0	0	104.1
1734	I	25.8	Very low	26.1	Very low	147 Å²	147	135.9 Å²	135.9	75%	0.754	75%	0.751	S	S	*	*			cis	-144.6	150.8	-0	-101.8	157.7	0	0	0	109.1
1735	N	26.5	Very low	26	Very low	139 Å²	139	138.1 Å²	138.1	74%	0.743	75%	0.749	S	S	*	*			trans	-113.8	150.3	167.8	-88.5	-55.1	0	0	0	109
1736	K	28	Very low	26.1	Very low	167 Å²	167	136.9 Å²	136.9	73%	0.726	75%	0.746	S	S	*	*			cis	79.4	113.7	35.7	-171.3	-168.9	-177.1	175.4	0	114.3
1737	K	27.7	Very low	26	Very low	192 Å²	192	136.8 Å²	136.8	84%	0.835	75%	0.747	S	S	*	*			trans	171	170.6	130.4	-96.5	-173.2	176	-168.9	0	113.7
1738	N	25.7	Very low	26.2	Very low	155 Å²	155	136.2 Å²	136.2	83%	0.829	75%	0.748	S	S	*	*			trans	-99.9	-176.3	-163	-55	9.5	0	0	0	113.8
1739	L	27	Very low	26.3	Very low	163 Å²	163	137.6 Å²	137.6	85%	0.853	75%	0.748	S	S	*	*			trans	-60.5	157.8	177.1	-81.6	68.5	0	0	0	115.1
1740	F	23.7	Very low	26.1	Very low	196 Å²	196	137.9 Å²	137.9	86%	0.86	75%	0.745	S	S	*	*				-170	146.4	125	-110.3	-70.4	0	0	0	110.8
1741	G	27.7	Very low	26.2	Very low	77 Å²	77	138.9 Å²	138.9	79%	0.794	76%	0.755	S	S	*	*			trans	132	134.7	165.5	0	0	0	0	0	116.5
1742	L	23.5	Very low	26	Very low	123 Å²	123	140.6 Å²	140.6	64%	0.644	75%	0.75	S	S	*	*			trans	-104.7	149	-177.5	-73.7	138	0	0	0	112.7
1743	S	23.8	Very low	26	Very low	111 Å²	111	140.3 Å²	140.3	78%	0.776	75%	0.751	S	S	*	*				158.9	142.5	111.9	57.4	0	0	0	0	116.9
1744	K	25.3	Very low	26.4	Very low	178 Å²	178	143.2 Å²	143.2	77%	0.774	76%	0.762	S	S	*	*			trans	59.3	114.3	145.1	-73.3	-179.2	167.2	179.5	0	124.2
1745	Q	23.5	Very low	26.5	Very low	155 Å²	155	144.2 Å²	144.2	72%	0.724	76%	0.761	S	S	*	*				81.2	104.5	120	-69.6	178.1	-82.1	0	0	123.6
1746	S	23.7	Very low	26.5	Very low	98 Å²	98	141.9 Å²	141.9	69%	0.685	76%	0.761	S	S	*	*				70.4	117.2	121	69.4	0	0	0	0	124.7
1747	S	24.1	Very low	26.4	Very low	108 Å²	108	138.5 Å²	138.5	76%	0.755	76%	0.758	S	S	*	*				95.5	147.9	123.9	77.1	0	0	0	0	123.3
1748	A	27	Very low	26.2	Very low	79 Å²	79	136.2 Å²	136.2	65%	0.653	76%	0.755	S	S	*	*			trans	84.3	88.7	152.2	0	0	0	0	0	122
1749	D	26.9	Very low	26.1	Very low	124 Å²	124	136.8 Å²	136.8	66%	0.663	75%	0.75	S	S	*	*				77.7	136.8	115.6	-61.3	-1.5	0	0	0	125.7	K1269	K1269-D1749 IonicContact NZ-OD2 2.67Å; K1269-D1749 PolarHBondContact NZ-OD2 3.26Å
1750	E	25.1	Very low	26	Very low	138 Å²	138	131.4 Å²	131.4	65%	0.645	73%	0.725	S	S	*	*			trans	72.7	88.2	138.6	-73.5	-173.9	111.6	0	0	122.6	K1269	K1269-E1750 WeakPolarHBondContact CE-OE2 3.48Å; K1269-E1750 IonicContact NZ-OE2 3.41Å; K1269-E1750 PolarHBondContact NZ-OE2 3.07Å
1751	V	29.8	Very low	26.1	Very low	128 Å²	128	127.5 Å²	127.5	78%	0.776	71%	0.706	S	S	*	*				37.7	104.7	107.5	-174.5	0	0	0	0	118
1752	K	22.9	Very low	25.9	Very low	180 Å²	180	126.1 Å²	126.1	78%	0.783	68%	0.684	S	S	*	*				-175.9	123	128.9	-101.1	149.2	-170.4	159.9	0	112.2
1753	N	31.2	Very low	25.9	Very low	148 Å²	148	130 Å²	130	79%	0.791	69%	0.69	S	S	*	*				170.2	115.1	113.6	-94.5	-63.6	0	0	0	112.8	K1755	N1753-K1755 PolarHBondContact O-N 2.96Å
1754	Q	35.8	Very low	26.2	Very low	202 Å²	202	131.9 Å²	131.9	94%	0.944	69%	0.691	S	S	*	*			trans	-83.9	106.9	160.1	-72.6	-178.6	-11.4	0	0	110
1755	K	28.5	Very low	26.1	Very low	168 Å²	168	130.5 Å²	130.5	73%	0.73	69%	0.692	S	S	*	*			trans	-125.7	121.6	152.8	-80.4	179.4	179.5	170.9	0	107	N1753	N1753-K1755 PolarHBondContact O-N 2.96Å
1756	A	26.5	Very low	26.1	Very low	89 Å²	89	127.6 Å²	127.6	74%	0.736	69%	0.689	S	S	*	*				71.5	130.2	59.6	0	0	0	0	0	112.6
1757	S	25.1	Very low	26.5	Very low	97 Å²	97	132.4 Å²	132.4	68%	0.678	70%	0.697	S	S	*	*			cis	-174.3	155.3	-3.6	44.2	0	0	0	0	113.6
1758	L	23.5	Very low	26.7	Very low	144 Å²	144	133.9 Å²	133.9	75%	0.754	70%	0.696	S	S	*	*			trans	61.9	159.4	140.9	-92.6	69.4	0	0	0	121.5
1759	K	24.4	Very low	26.5	Very low	167 Å²	167	133.5 Å²	133.5	73%	0.726	69%	0.685	S	S	*	*			trans	34.9	139.7	144.7	-75.7	-167.1	175.6	-170.6	0	121.4	I2450	K1759-I2450 VanDerWaalsContact O-CD1 3.27Å; K1759-I2450 WeakPolarHBondContact O-CD1 3.22Å
1760	S	25.1	Very low	26.8	Very low	49 Å²	49	133.8 Å²	133.8	34%	0.343	69%	0.687	S	S	.	*			cis	-172.6	-172.5	-18.1	31.4	0	0	0	0	109.6	N2451	S1760-N2451 PolarHBondContact O-OD1 2.87Å
1761	Y	25.9	Very low	26.9	Very low	115 Å²	115	134.1 Å²	134.1	45%	0.451	69%	0.689	S	S	.	*			trans	62.2	173.6	172.5	-66.9	-110.9	0	0	0	116.8	I2450 N2451 V2453 D2454	Y1761-I2450 WeakPolarHBondContact O-CA 2.99Å; Y1761-N2451 VanDerWaalsContact C-C 3.49Å; Y1761-N2451 CarbonylContact C-O 3.59Å; Y1761-V2453 VanDerWaalsContact CD1-N 3.27Å; Y1761-D2454 VanDerWaalsContact CE1-OD1 3.28Å; Y1761-D2454 WeakPolarHBondContact CE1-OD1 3.49Å; Y1761-D2454 VanDerWaalsContact CZ-OD1 3.26Å; Y1761-D2454 PolarHBondContact OH-OD1 2.74Å
1762	S	23.5	Very low	26.9	Very low	47 Å²	47	133.2 Å²	133.2	33%	0.329	68%	0.684	S	S	.	*				-171.8	152.1	-63.6	61.2	0	0	0	0	111.1	N2451	S1762-N2451 PolarHBondContact N-O 2.86Å; S1762-N2451 VanDerWaalsContact O-O 3.05Å
1763	R	23.4	Very low	27.4	Very low	205 Å²	205	129.7 Å²	129.7	77%	0.774	68%	0.682	S	S	*	*			trans	59.9	86.8	164.9	-60.4	175.8	-180	147.4	-4.5	116.4
1764	N	29.3	Very low	27.3	Very low	150 Å²	150	127.6 Å²	127.6	80%	0.802	67%	0.67	S	S	*	*				-162.8	131.1	107.6	-85.8	-28.8	0	0	0	107.4
1765	L	22.9	Very low	27	Very low	149 Å²	149	126.8 Å²	126.8	78%	0.78	66%	0.664	S	S	*	*			cis	79.7	107.8	35.7	-156.8	91.2	0	0	0	112.8
1766	S	23.5	Very low	27	Very low	95 Å²	95	122.2 Å²	122.2	66%	0.664	66%	0.664	S	S	*	*			trans	31.2	94.6	158	63	0	0	0	0	118.9
1767	K	32	Very low	27.1	Very low	198 Å²	198	122.8 Å²	122.8	86%	0.861	66%	0.663	S	S	*	*			trans	175.7	141.9	141.3	-98.6	156.5	-178.4	-178.7	0	109.6
1768	L	29	Very low	27.3	Very low	139 Å²	139	122.2 Å²	122.2	73%	0.728	66%	0.655	S	S	*	*			cis	-157.5	156.7	-25.4	-156.6	68.1	0	0	0	107.5	N1770	L1768-N1770 PolarHBondContact O-N 3.34Å
1769	T	22.9	Very low	27.4	Very low	71 Å²	71	118.9 Å²	118.9	44%	0.436	64%	0.644	S	S	.	*			trans	-55.8	129.1	151.9	49.4	0	0	0	0	109.6	T1778	T1769-T1778 HydrophobicContact CG2-CG2 4.17Å
1770	N	33.4	Very low	27.5	Very low	131 Å²	131	115.7 Å²	115.7	70%	0.701	63%	0.628	S	S	*	*				-132.1	126.4	123.4	-89.9	-14.2	0	0	0	106	L1768	L1768-N1770 PolarHBondContact O-N 3.34Å
1771	Q	27.1	Very low	27.7	Very low	145 Å²	145	116.9 Å²	116.9	68%	0.678	63%	0.633	S	S	*	*				66.8	144.3	56.6	-61.8	-178.6	15.7	0	0	111.2
1772	T	29.7	Very low	27.7	Very low	109 Å²	109	116.5 Å²	116.5	67%	0.669	64%	0.638	S	S	*	*			cis	-145.2	176.1	11.7	-6.6	0	0	0	0	107.9	D1774	T1772-D1774 VanDerWaalsContact CG2-OD1 3.25Å; T1772-D1774 WeakPolarHBondContact CG2-OD1 3.34Å
1773	S	32.4	Very low	27.9	Very low	106 Å²	106	124.6 Å²	124.6	74%	0.741	66%	0.662	S	S	*	*	S	Bend	cis	-150.8	155.1	13.5	33.9	0	0	0	0	109.1
1774	D	29.3	Very low	28	Very low	104 Å²	104	124.9 Å²	124.9	56%	0.556	67%	0.668	S	S	*	*	S	Bend	cis	-160.5	142.9	-0.6	-107.1	4.5	0	0	0	106.2	T1772	T1772-D1774 VanDerWaalsContact CG2-OD1 3.25Å; T1772-D1774 WeakPolarHBondContact CG2-OD1 3.34Å
1775	K	29.5	Very low	28	Very low	185 Å²	185	127.1 Å²	127.1	80%	0.804	67%	0.671	S	S	*	*			cis	-150.3	146	0.9	-86.6	135.5	170.8	135.7	0	108.4
1776	G	29.1	Very low	28.2	Very low	72 Å²	72	129 Å²	129	74%	0.742	67%	0.673	S	S	*	*			trans	120.1	94.5	160.9	0	0	0	0	0	119.6
1777	S	28.4	Very low	28.3	Very low	101 Å²	101	129.5 Å²	129.5	71%	0.706	67%	0.672	S	S	*	*			trans	5.1	129.7	152.2	46.5	0	0	0	0	122
1778	T	28.5	Very low	27.9	Very low	84 Å²	84	128 Å²	128	52%	0.515	67%	0.67	S	S	.	*			cis	78.3	138.5	47.5	65.6	0	0	0	0	116.9	T1769 Y2441	T1769-T1778 HydrophobicContact CG2-CG2 4.17Å; T1778-Y2441 PolarHBondContact N-OH 3.09Å; T1778-Y2441 VanDerWaalsContact N-OH 3.16Å
1779	S	26.7	Very low	27.6	Very low	75 Å²	75	127.3 Å²	127.3	52%	0.524	67%	0.672	S	S	.	*			cis	-174.6	157.7	-4.1	48.5	0	0	0	0	113.6
1780	R	26.8	Very low	27.8	Very low	100 Å²	100	129.4 Å²	129.4	38%	0.377	69%	0.686	S	S	.	*			trans	-59.6	157.9	169.8	-82.3	-178.3	-161	130.5	-4.8	110.8	Y2441 I2442	R1780-Y2441 WeakPolarHBondContact CA-O 3.45Å; R1780-Y2441 WeakPolarHBondContact CG-O 3.31Å; R1780-Y2441 PolarHBondContact N-O 3.12Å; R1780-I2442 WeakPolarHBondContact CA-O 3.46Å; R1780-I2442 WeakPolarHBondContact CB-O 3.27Å; R1780-I2442 VanDerWaalsContact CG-O 3.24Å; R1780-I2442 WeakPolarHBondContact CG-O 3.2Å; R1780-I2442 PolarHBondContact N-O 3.29Å
1781	V	27.6	Very low	27.3	Very low	74 Å²	74	126.4 Å²	126.4	45%	0.448	67%	0.67	S	S	.	*				168.7	113.9	102.4	159.8	0	0	0	0	114.6	E2444	V1781-E2444 VanDerWaalsContact CG2-O 3.28Å; V1781-E2444 WeakPolarHBondContact CG2-O 3.41Å
1782	N	26.5	Very low	27.3	Very low	106 Å²	106	121.5 Å²	121.5	57%	0.567	65%	0.65	S	S	*	*			trans	36.1	128.3	137.4	-70.3	-62.4	0	0	0	124.5
1783	R	27.3	Very low	27	Very low	218 Å²	218	122.8 Å²	122.8	82%	0.823	65%	0.648	S	S	*	*				70.1	133.6	124	-65.9	172.7	179.5	-176.6	-3.6	120.9
1784	K	25.9	Very low	26.6	Very low	210 Å²	210	122 Å²	122	91%	0.913	64%	0.635	S	S	*	*				-150.6	146.5	103.2	-108	159.1	-172	168.2	0	113.2
1785	K	29.9	Very low	26.4	Very low	198 Å²	198	122.2 Å²	122.2	86%	0.861	64%	0.644	S	S	*	*			trans	-96.2	155.7	173.7	-73.1	-174.7	172.9	-173	0	110.7
1786	K	26.6	Very low	26.6	Very low	189 Å²	189	123 Å²	123	82%	0.822	65%	0.648	S	S	*	*				-160.7	112.9	128.5	-103	-166.8	175.7	-169	0	108.3
1787	T	25.7	Very low	26.6	Very low	104 Å²	104	125.2 Å²	125.2	64%	0.638	65%	0.649	S	S	*	*				63.4	128.7	97	60.9	0	0	0	0	113.5
1788	M	24	Very low	26.6	Very low	167 Å²	167	125.4 Å²	125.4	82%	0.823	65%	0.65	S	S	*	*			cis	-162.1	171.7	15.3	-151	166.8	74.7	0	0	113
1789	V	23.1	Very low	26.9	Very low	125 Å²	125	124.2 Å²	124.2	76%	0.758	65%	0.654	S	S	*	*			trans	77.3	140.3	167.8	-175.1	0	0	0	0	115.5
1790	P	27.3	Very low	27.2	Very low	115 Å²	115	129.3 Å²	129.3	75%	0.747	67%	0.667	S	S	*	*			trans	-122.5	179.3	-151.3	43.5	-30.6	0	0	0	116.1
1791	L	22.3	Very low	27.4	Very low	68 Å²	68	130 Å²	130	36%	0.356	68%	0.678	S	S	.	*			trans	-137.5	135.4	149.9	-141.6	91.9	0	0	0	109.3	L961	L961-L1791 HydrophobicContact CD2-CD2 4.1Å
1792	V	26.5	Very low	27.7	Very low	42 Å²	42	129.9 Å²	129.9	26%	0.255	69%	0.686	S	S	.	*			trans	50.7	122.7	146.3	174.2	0	0	0	0	120.6	T962 I2394	T962-V1792 HydrophobicContact CG2-CG1 4.09Å; T962-V1792 WeakPolarHBondContact OG1-CG1 3.34Å; V1792-I2394 HydrophobicContact CG2-CB 4.27Å; V1792-I2394 HydrophobicContact CG2-CG2 3.45Å; V1792-I2394 VanDerWaalsContact CG2-CG2 3.45Å
1793	E	23.7	Very low	28	Very low	136 Å²	136	131.1 Å²	131.1	64%	0.636	69%	0.692	S	S	*	*			trans	-40.4	166.8	152.1	-81.3	178.3	160.4	0	0	115.3
1794	I	24	Very low	28.3	Very low	89 Å²	89	125 Å²	125	46%	0.456	69%	0.688	S	S	.	*			cis	-149.2	147.8	9.5	-114.9	144	0	0	0	106.3
1795	S	24.1	Very low	28.6	Very low	109 Å²	109	119.3 Å²	119.3	76%	0.762	68%	0.675	S	S	*	*			trans	-177.7	125.6	137.2	28.5	0	0	0	0	112
1796	K	34.9	Very low	28.7	Very low	202 Å²	202	114 Å²	114	88%	0.878	66%	0.656	S	S	*	*			trans	-64.1	142.5	151.6	-57.2	169.6	-177.5	172.9	0	106.4
1797	P	29.3	Very low	28.9	Very low	118 Å²	118	111.1 Å²	111.1	77%	0.766	65%	0.65	S	S	*	*				-144	-168.1	90.3	41.4	-24	0	0	0	110.4
1798	S	27.8	Very low	29	Very low	105 Å²	105	113 Å²	113	73%	0.734	65%	0.651	S	S	*	*			cis	-169.5	171	26.2	48.6	0	0	0	0	110.6
1799	G	34.7	Very low	29.2	Very low	58 Å²	58	107.3 Å²	107.3	60%	0.598	63%	0.631	S	S	*	*			trans	142.8	132.7	158.6	0	0	0	0	0	111.9
1800	F	32.5	Very low	29.4	Very low	182 Å²	182	106.5 Å²	106.5	80%	0.798	62%	0.622	S	S	*	*			cis	-162.9	167.5	3	-80.6	-56.9	0	0	0	107.9
1801	N	31.9	Very low	29.4	Very low	114 Å²	114	106 Å²	106	61%	0.61	62%	0.616	S	S	*	*			cis	-151.6	147.2	-11.9	-101.9	-34.5	0	0	0	104.4
1802	A	34.5	Very low	29.6	Very low	73 Å²	73	107.2 Å²	107.2	60%	0.603	63%	0.631	S	S	*	*			cis	90.8	144.7	29.4	0	0	0	0	0	115.9
1803	N	32.6	Very low	29.5	Very low	131 Å²	131	112.7 Å²	112.7	70%	0.701	66%	0.659	S	S	*	*			trans	84.5	145.4	169.9	-47	-26.9	0	0	0	116.6
1804	A	33.6	Very low	29.5	Very low	89 Å²	89	117.2 Å²	117.2	74%	0.736	67%	0.67	S	S	*	*			cis	179.2	166.1	-15	0	0	0	0	0	108
1805	S	31.3	Very low	29.4	Very low	91 Å²	91	116.9 Å²	116.9	64%	0.636	68%	0.675	S	S	*	*			cis	-171.3	-163.6	-31.6	58.8	0	0	0	0	106.5
1806	D	32.3	Very low	29.6	Very low	86 Å²	86	122.2 Å²	122.2	46%	0.46	68%	0.679	S	S	.	*			cis	-164.7	-158.6	5.8	-126.4	-43.4	0	0	0	110
1807	D	30.2	Very low	29.1	Very low	129 Å²	129	121 Å²	121	69%	0.69	67%	0.674	S	S	*	*			trans	77.8	91.8	154.1	-72.6	2.2	0	0	0	123.7
1808	H	29.5	Very low	28.9	Very low	144 Å²	144	121.1 Å²	121.1	67%	0.667	67%	0.673	S	S	*	*				76.6	101.8	121.7	-74.9	-60.8	0	0	0	125.1
1809	A	27.3	Very low	28.8	Very low	48 Å²	48	124.2 Å²	124.2	40%	0.397	67%	0.673	S	S	.	*				85.4	116.1	103.5	0	0	0	0	0	124.5	N2431	A1809-N2431 VanDerWaalsContact N-CG 3.29Å; A1809-N2431 PolarHBondContact N-ND2 2.99Å; A1809-N2431 PolarHBondContact N-OD1 2.82Å
1810	N	27.9	Very low	28.4	Very low	107 Å²	107	127.7 Å²	127.7	57%	0.572	68%	0.676	S	S	*	*				97.9	100.8	129.5	-73.1	79.5	0	0	0	124.2	E2432	N1810-E2432 WeakPolarHBondContact CA-OE1 3.38Å; N1810-E2432 VanDerWaalsContact CG-OE2 3.24Å; N1810-E2432 PolarHBondContact N-OE1 2.9Å; N1810-E2432 PolarHBondContact ND2-OE2 3.19Å; N1810-E2432 PolarHBondContact OD1-OE2 2.91Å
1811	V	27.2	Very low	28.1	Very low	104 Å²	104	127.8 Å²	127.8	63%	0.63	68%	0.679	S	S	*	*				87.3	95	128.3	-180	0	0	0	0	121.9
1812	S	25.5	Very low	27.8	Very low	95 Å²	95	126.1 Å²	126.1	66%	0.664	68%	0.677	S	S	*	*			trans	80.3	133.7	135.6	82	0	0	0	0	123.3
1813	N	24.9	Very low	27.4	Very low	157 Å²	157	128.9 Å²	128.9	84%	0.84	69%	0.686	S	S	*	*			trans	57.2	116.6	153.1	-68.6	-35	0	0	0	120.3
1814	R	23.2	Very low	27.2	Very low	231 Å²	231	127.9 Å²	127.9	87%	0.872	69%	0.689	S	S	*	*				164.5	110.7	98.5	-173.8	175.3	-167	-177.4	6	115.9
1815	S	23.4	Very low	26.9	Very low	81 Å²	81	129.5 Å²	129.5	57%	0.566	69%	0.692	S	S	*	*			trans	76.8	154.9	144.3	80	0	0	0	0	122.9
1816	R	27.5	Very low	26.5	Very low	221 Å²	221	132.3 Å²	132.3	83%	0.834	70%	0.699	S	S	*	*			trans	85.6	150	158.3	-61	169.3	-149.2	-147	5.7	119.3
1817	F	23.4	Very low	27	Very low	177 Å²	177	133 Å²	133	78%	0.776	71%	0.708	S	S	*	*			cis	177.4	145.4	-41.1	-116.6	-63.7	0	0	0	108.4
1818	T	25.7	Very low	26.8	Very low	121 Å²	121	132.5 Å²	132.5	74%	0.742	71%	0.712	S	S	*	*			trans	64.5	150.4	160.1	56.1	0	0	0	0	118
1819	K	26.7	Very low	26.5	Very low	170 Å²	170	129.9 Å²	129.9	74%	0.739	72%	0.715	S	S	*	*			cis	-160.9	144	1.7	-128.9	-176.2	176.9	-171.2	0	110.5
1820	I	25.8	Very low	26.3	Very low	130 Å²	130	131.8 Å²	131.8	67%	0.667	73%	0.731	S	S	*	*			trans	49.1	139.3	139.4	-66.4	170.2	0	0	0	118.2
1821	E	26.5	Very low	26.2	Very low	185 Å²	185	132.9 Å²	132.9	86%	0.864	74%	0.741	S	S	*	*	S	Bend	cis	-82.2	132.1	17.3	-68.3	171.4	150.7	0	0	113
1822	S	25.5	Very low	26.5	Very low	79 Å²	79	133.1 Å²	133.1	55%	0.552	75%	0.745	S	S	*	*				77.4	78.4	52.5	74.1	0	0	0	0	113.1
1823	V	26.3	Very low	26.3	Very low	131 Å²	131	134.6 Å²	134.6	79%	0.794	75%	0.751	S	S	*	*				79.6	120.8	62.1	178.7	0	0	0	0	113.9
1824	S	27.1	Very low	26.2	Very low	110 Å²	110	133.3 Å²	133.3	77%	0.769	75%	0.748	S	S	*	*			trans	-136.3	154.2	158.5	-72.8	0	0	0	0	108.1
1825	P	27	Very low	26.8	Very low	122 Å²	122	127.4 Å²	127.4	79%	0.792	74%	0.74	S	S	*	*			trans	-73.8	147.1	-157.8	28.4	-35.7	0	0	0	114
1826	L	23.7	Very low	26.7	Very low	150 Å²	150	129.5 Å²	129.5	79%	0.785	75%	0.75	S	S	*	*			cis	87.8	127.3	29.8	-158.3	151.8	0	0	0	112.8
1827	P	41.7	Very low	26.6	Very low	101 Å²	101	127.2 Å²	127.2	66%	0.656	75%	0.749	S	S	*	*			trans	-93.5	-171.1	-169.4	40.7	-38.7	0	0	0	113.4
1828	P	26.2	Very low	26.6	Very low	118 Å²	118	123.1 Å²	123.1	77%	0.766	75%	0.747	S	S	*	*				-137.7	164.6	98.2	21.9	0.1	0	0	0	112.3
1829	A	24.1	Very low	26.5	Very low	89 Å²	89	123.1 Å²	123.1	74%	0.736	75%	0.747	S	S	*	*			cis	77.3	141.1	38.8	0	0	0	0	0	115.2
1830	A	23	Very low	26.4	Very low	88 Å²	88	122 Å²	122	73%	0.727	75%	0.749	S	S	*	*			trans	65.6	127	-175.3	0	0	0	0	0	115.2
1831	T	25.1	Very low	26.5	Very low	130 Å²	130	123.7 Å²	123.7	80%	0.798	75%	0.752	S	S	*	*				64	138.7	50.1	71.9	0	0	0	0	115.1
1832	P	33.2	Very low	26.5	Very low	110 Å²	110	120.8 Å²	120.8	71%	0.714	74%	0.742	S	S	*	*			cis	-137.4	-134.4	-22.6	35.2	-11.9	0	0	0	111.1
1833	T	22	Very low	26.6	Very low	126 Å²	126	121.6 Å²	121.6	77%	0.773	75%	0.753	S	S	*	*			trans	75.3	112.8	163.9	46.4	0	0	0	0	121.7
1834	T	23.4	Very low	26.8	Very low	129 Å²	129	120.9 Å²	120.9	79%	0.791	75%	0.754	S	S	*	*			trans	-49.6	-178.1	144	46.6	0	0	0	0	114.7
1835	P	34.8	Very low	26.9	Very low	108 Å²	108	121.6 Å²	121.6	70%	0.701	76%	0.756	S	S	*	*			cis	-136.8	176.7	-48.4	38.9	-23.9	0	0	0	112.5
1836	T	22.5	Very low	26.9	Very low	125 Å²	125	120.5 Å²	120.5	77%	0.767	75%	0.749	S	S	*	*			trans	-175.8	152.3	140.2	14.7	0	0	0	0	116.1
1837	Q	25.3	Very low	27.1	Very low	173 Å²	173	125 Å²	125	81%	0.808	76%	0.755	S	S	*	*			trans	49.5	94.9	142.4	-66.5	170.4	4	0	0	122.1
1838	A	22.2	Very low	26.2	Very low	91 Å²	91	126.6 Å²	126.6	75%	0.752	76%	0.756	S	S	*	*				56.3	155.7	94.3	0	0	0	0	0	122.8
1839	V	24.2	Very low	26.1	Very low	121 Å²	121	124.1 Å²	124.1	73%	0.733	75%	0.745	S	S	*	*			trans	81.5	98.7	162.2	-176.5	0	0	0	0	117.3
1840	N	25.1	Very low	26.1	Very low	146 Å²	146	126 Å²	126	78%	0.781	74%	0.739	S	S	*	*			trans	70.6	141.7	144.4	-67.6	-4.9	0	0	0	118.5
1841	K	28.6	Very low	26.2	Very low	166 Å²	166	126 Å²	126	72%	0.722	74%	0.739	S	S	*	*			cis	-157.9	156.4	23.4	-136.2	-173.5	175.3	-150.8	0	114.1
1842	D	25.8	Very low	26.2	Very low	123 Å²	123	126.6 Å²	126.6	66%	0.658	74%	0.737	S	S	*	*			trans	46.9	105.5	149.8	-56.1	-21.1	0	0	0	122.1
1843	A	26.7	Very low	25.9	Very low	96 Å²	96	129.5 Å²	129.5	79%	0.793	75%	0.745	S	S	*	*				80.4	156.4	126.7	0	0	0	0	0	122.9
1844	S	31.5	Very low	26	Very low	116 Å²	116	130.5 Å²	130.5	81%	0.811	75%	0.751	S	S	*	*			trans	95.9	146	169.7	-45.6	0	0	0	0	117.2
1845	P	28.3	Very low	26	Very low	125 Å²	125	128 Å²	128	81%	0.812	74%	0.743	S	S	*	*			trans	-122.8	-130.5	-161.8	33.2	-7.6	0	0	0	112.6
1846	P	28.6	Very low	25.7	Very low	99 Å²	99	126 Å²	126	64%	0.643	74%	0.736	S	S	*	*				-115.1	151.6	-124.1	36.1	-18.7	0	0	0	116.4
1847	R	27.5	Very low	25.8	Very low	244 Å²	244	127.1 Å²	127.1	92%	0.921	74%	0.742	S	S	*	*			trans	-158.1	129.4	149.2	-88.5	129.3	-166.5	-130.4	6.7	106.4
1848	M	22.8	Very low	25.8	Very low	135 Å²	135	128.1 Å²	128.1	67%	0.665	75%	0.747	S	S	*	*			cis	70.8	109.4	17.1	-157.8	-167.6	-70.2	0	0	115.3	K688	K688-M1848 PolarHBondContact NZ-SD 3.46Å
1849	A	24.6	Very low	25.9	Very low	66 Å²	66	127.8 Å²	127.8	55%	0.545	74%	0.744	S	S	.	*			trans	81.3	141.9	155.7	0	0	0	0	0	120.5
1850	E	23.1	Very low	26	Very low	128 Å²	128	126.7 Å²	126.7	60%	0.598	74%	0.742	S	S	*	*			trans	61.9	104.8	143.4	-66.3	157.8	132.6	0	0	120.3	T690	T690-E1850 PolarHBondContact OG1-OE1 2.93Å
1851	A	25.7	Very low	25.9	Very low	88 Å²	88	127 Å²	127	73%	0.727	74%	0.742	S	S	*	*			trans	-161.1	150.7	135.5	0	0	0	0	0	112.5
1852	D	25.4	Very low	25.6	Very low	143 Å²	143	129.5 Å²	129.5	77%	0.765	75%	0.747	S	S	*	*			trans	57.9	94.9	151.7	-53.4	-20.2	0	0	0	122
1853	I	25.7	Very low	25.5	Very low	172 Å²	172	131.1 Å²	131.1	88%	0.882	76%	0.755	S	S	*	*	S	Bend	trans	-132	81.5	145.8	-54	178.4	0	0	0	109.1
1854	V	23.5	Very low	25.5	Very low	147 Å²	147	132 Å²	132	89%	0.891	75%	0.75	S	S	*	*	S	Bend	trans	-167.5	76.2	130.8	179	0	0	0	0	105.7
1855	A	24.3	Very low	25.4	Very low	76 Å²	76	135.6 Å²	135.6	63%	0.628	75%	0.754	S	S	*	*	S	Bend	trans	-153.3	121.4	172.2	0	0	0	0	0	111.6	V1857	A1855-V1857 PolarHBondContact O-N 3.18Å
1856	A	28.9	Very low	25.3	Very low	67 Å²	67	135.6 Å²	135.6	55%	0.554	75%	0.747	S	S	*	*			trans	54.7	42.5	150.7	0	0	0	0	0	120.4	Q1858 A1859	A1856-Q1858 PolarHBondContact O-N 3.48Å; A1856-A1859 HydrophobicContact CB-CB 4.26Å
1857	V	25.1	Very low	25.4	Very low	148 Å²	148	136.7 Å²	136.7	90%	0.897	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	52.3	149.5	-167.8	0	0	0	0	110.6	A1855	A1855-V1857 PolarHBondContact O-N 3.18Å
1858	Q	24.1	Very low	25.5	Very low	194 Å²	194	131.5 Å²	131.5	91%	0.907	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171.2	41.9	144.7	-162.8	136.8	-3	0	0	112.1	A1856	A1856-Q1858 PolarHBondContact O-N 3.48Å
1859	A	24.7	Very low	25.9	Very low	83 Å²	83	129 Å²	129	69%	0.686	74%	0.739	S	S	*	*	S	Bend	trans	-140.4	28.5	-178.8	0	0	0	0	0	114.4	A1856	A1856-A1859 HydrophobicContact CB-CB 4.26Å
1860	S	25.5	Very low	26.2	Very low	99 Å²	99	132.4 Å²	132.4	69%	0.692	75%	0.747	S	S	*	*			trans	-150.3	32.9	-178.5	51.5	0	0	0	0	114.3	R1862	S1860-R1862 PolarHBondContact O-N 2.81Å
1861	I	23.8	Very low	26.6	Very low	153 Å²	153	133.2 Å²	133.2	79%	0.785	75%	0.751	S	S	*	*	S	Bend	trans	-73.7	109.8	154.8	-71.6	-178	0	0	0	107.8
1862	R	22.6	Very low	26.8	Very low	218 Å²	218	136.6 Å²	136.6	82%	0.823	75%	0.751	S	S	*	*			trans	69.8	164	166.4	-63	171.3	175.5	166.9	-1.5	117.4	S1860	S1860-R1862 PolarHBondContact O-N 2.81Å
1863	L	23.3	Very low	26.8	Very low	157 Å²	157	137.3 Å²	137.3	82%	0.822	75%	0.75	S	S	*	*			trans	75	112	174.6	-48.2	-174.8	0	0	0	114.1
1864	T	26.1	Very low	26.8	Very low	113 Å²	113	136.6 Å²	136.6	69%	0.693	74%	0.742	S	S	*	*			cis	-143.9	133.6	1.3	-1.2	0	0	0	0	113
1865	E	29.5	Very low	26.9	Very low	192 Å²	192	136.7 Å²	136.7	90%	0.897	73%	0.733	S	S	*	*			trans	-66	130.1	141.2	-62.7	168.4	116.1	0	0	108.1
1866	D	27.1	Very low	27.1	Very low	126 Å²	126	138.1 Å²	138.1	67%	0.674	73%	0.729	S	S	*	*			trans	-134.7	137.1	147	-101.8	-55.8	0	0	0	104.6
1867	V	30.4	Very low	27.2	Very low	122 Å²	122	145 Å²	145	74%	0.739	74%	0.74	S	S	*	*			cis	-134.1	117.1	46.2	179.1	0	0	0	0	112.1
1868	N	29.1	Very low	27.1	Very low	134 Å²	134	148.3 Å²	148.3	72%	0.717	74%	0.737	S	S	*	*				-173.2	117.7	113.5	-106.9	-60	0	0	0	116.2
1869	S	30.6	Very low	27.1	Very low	84 Å²	84	147.3 Å²	147.3	59%	0.587	73%	0.73	S	S	*	*			trans	74.1	103.9	131.9	73	0	0	0	0	121.7
1870	N	31.3	Very low	27.2	Very low	136 Å²	136	150.8 Å²	150.8	73%	0.727	73%	0.732	S	S	*	*				102.3	120.3	116	-81.2	-30.1	0	0	0	122.2
1871	H	32.1	Very low	27.2	Very low	145 Å²	145	148.8 Å²	148.8	67%	0.671	72%	0.721	S	S	*	*			trans	99.3	109.2	134.4	-79.3	40.4	0	0	0	121
1872	H	30.1	Very low	28	Very low	159 Å²	159	149.8 Å²	149.8	74%	0.736	72%	0.723	S	S	*	*			trans	62.8	87	135.9	-63.4	-17.1	0	0	0	120
1873	H	24.8	Very low	28.1	Very low	158 Å²	158	150.1 Å²	150.1	73%	0.731	72%	0.724	S	S	*	*				23.7	142.2	92.2	-119.8	-78.9	0	0	0	118.6
1874	H	25.4	Very low	28.5	Very low	157 Å²	157	149.6 Å²	149.6	73%	0.727	72%	0.72	S	S	*	*			trans	73	147.8	164.4	-69.3	-62.8	0	0	0	116.3
1875	E	26.1	Very low	28.7	Very low	149 Å²	149	148.7 Å²	148.7	70%	0.696	72%	0.718	S	S	*	*			cis	-158.5	171.3	12.3	-140.1	-169.5	152.5	0	0	114.4
1876	I	27.8	Very low	28.6	Very low	107 Å²	107	144.3 Å²	144.3	55%	0.549	71%	0.709	S	S	.	*			trans	83.8	143.3	140	-91.2	166.7	0	0	0	122.2
1877	R	31.8	Very low	28.5	Very low	210 Å²	210	148.3 Å²	148.3	79%	0.792	72%	0.715	S	S	*	*			trans	73.8	86.4	161.7	-83.4	153.6	-151.4	170.8	7.5	120.6
1878	R	23.6	Very low	28.4	Very low	219 Å²	219	150.2 Å²	150.2	83%	0.826	71%	0.713	S	S	*	*				41	127.4	106.9	-71.2	-179	173.1	175.4	-0.9	118.7
1879	K	23.3	Very low	28.3	Very low	173 Å²	173	152.7 Å²	152.7	75%	0.752	72%	0.718	S	S	*	*			trans	69.5	156.7	139.3	-70	-173.4	174.6	-167.7	0	115.2
1880	Q	26.2	Very low	28.3	Very low	156 Å²	156	153.1 Å²	153.1	73%	0.729	72%	0.72	S	S	*	*			cis	-151.3	179.4	12.2	-140.8	156.9	-62.7	0	0	112.7
1881	A	25.2	Very low	28.4	Very low	57 Å²	57	156 Å²	156	47%	0.471	72%	0.722	S	S	.	*			trans	4.8	121.8	137	0	0	0	0	0	116.4
1882	Q	40.5	Very low	28.6	Very low	174 Å²	174	156 Å²	156	81%	0.813	73%	0.727	S	S	*	*				63.4	140.6	85.3	-58.7	157.2	-30.2	0	0	114.4
1883	R	25.5	Very low	29.1	Very low	224 Å²	224	153.1 Å²	153.1	85%	0.845	72%	0.724	S	S	*	*			trans	73.9	155.5	169.6	-56.8	174.3	165.5	165.8	-5.5	116.7
1884	I	30.8	Very low	29.8	Very low	146 Å²	146	150.1 Å²	150.1	75%	0.749	72%	0.721	S	S	*	*			trans	53.8	86	149.7	-64.5	156.5	0	0	0	114.5
1885	S	31.2	Very low	30	Very low	94 Å²	94	146.3 Å²	146.3	66%	0.657	71%	0.712	S	S	*	*				81.2	135.1	58.4	81.6	0	0	0	0	115.3
1886	S	26.7	Very low	30.7	Very low	101 Å²	101	144.3 Å²	144.3	71%	0.706	71%	0.712	S	S	*	*			trans	72.4	149.5	165.4	104.1	0	0	0	0	113.8
1887	R	25.8	Very low	31.3	Very low	210 Å²	210	143.8 Å²	143.8	79%	0.792	72%	0.718	S	S	*	*			cis	-163.8	165.6	-1.5	-110.7	158	-177.5	169.3	-2.5	104.9
1888	K	28.3	Very low	31.2	Very low	162 Å²	162	138 Å²	138	70%	0.704	71%	0.709	S	S	*	*			cis	-173.2	152.1	30.1	-134.8	162.4	-174	175	0	108.7
1889	K	27.9	Very low	31.3	Very low	186 Å²	186	132 Å²	132	81%	0.809	71%	0.707	S	S	*	*			trans	69.6	143.6	161.4	-61.5	-176.9	176.3	-172.7	0	116.7
1890	C	29.9	Very low	31.4	Very low	93 Å²	93	128.4 Å²	128.4	63%	0.628	70%	0.704	S	S	*	*			cis	-154.9	145.4	-2.1	-116.8	0	0	0	0	112.2
1891	Y	34.2	Very low	31.3	Very low	197 Å²	197	124.7 Å²	124.7	77%	0.773	71%	0.707	S	S	*	*			trans	54.6	126	157.8	-68	-65.3	0	0	0	121.8
1892	N	35.9	Very low	31.5	Very low	145 Å²	145	127 Å²	127	78%	0.775	72%	0.717	S	S	*	*			trans	68	144.3	134.1	-62.9	5.8	0	0	0	119.4
1893	S	39.7	Very low	30.7	Very low	97 Å²	97	126.5 Å²	126.5	68%	0.678	72%	0.72	S	S	*	*			cis	-161.5	167	-1.5	44.3	0	0	0	0	111.6
1894	S	39.9	Very low	31.1	Very low	95 Å²	95	121 Å²	121	66%	0.664	71%	0.711	S	S	*	*			trans	56	115.2	149	54.1	0	0	0	0	117.8
1895	S	30.5	Very low	31.2	Very low	78 Å²	78	120.4 Å²	120.4	55%	0.545	71%	0.709	S	S	.	*			cis	60.1	142.4	29	-41.3	0	0	0	0	114.5	S1897	S1895-S1897 VanDerWaalsContact CA-OG 3.29Å; S1895-S1897 WeakPolarHBondContact CA-OG 3.46Å; S1895-S1897 PolarHBondContact N-OG 3.01Å
1896	P	40.6	Very low	31.4	Very low	107 Å²	107	123 Å²	123	70%	0.695	72%	0.716	S	S	*	*	S	Bend	cis	-120.2	123.6	-3.3	34.9	-18.7	0	0	0	113
1897	S	40.4	Very low	31.7	Very low	95 Å²	95	124.8 Å²	124.8	66%	0.664	72%	0.717	S	S	*	*			cis	60.4	172.6	2.8	-6.1	0	0	0	0	115.6	S1895	S1895-S1897 VanDerWaalsContact CA-OG 3.29Å; S1895-S1897 WeakPolarHBondContact CA-OG 3.46Å; S1895-S1897 PolarHBondContact N-OG 3.01Å
1898	S	28.2	Very low	32.1	Very low	88 Å²	88	120.4 Å²	120.4	62%	0.615	71%	0.71	S	S	*	*			trans	61.2	112.6	176.4	37.9	0	0	0	0	117
1899	A	26.2	Very low	32.4	Very low	94 Å²	94	117.6 Å²	117.6	78%	0.777	70%	0.702	S	S	*	*				23.6	147.9	103.6	0	0	0	0	0	118.6
1900	S	26	Very low	32.7	Very low	98 Å²	98	116.8 Å²	116.8	69%	0.685	70%	0.699	S	S	*	*			cis	-173.1	150.4	-8	41.9	0	0	0	0	109.9
1901	G	23.9	Very low	32.7	Very low	77 Å²	77	117.1 Å²	117.1	79%	0.794	70%	0.703	S	S	*	*	S	Bend	trans	-68.7	144.3	156.7	0	0	0	0	0	110.1
1902	P	29.3	Very low	32.5	Very low	106 Å²	106	117.2 Å²	117.2	69%	0.688	71%	0.707	S	S	*	*			trans	-126.2	133.8	-131.3	35.2	-20	0	0	0	115.8
1903	D	24.8	Very low	32	Very low	163 Å²	163	117.7 Å²	117.7	87%	0.872	71%	0.709	S	S	*	*	S	Bend	trans	-86.4	102.2	134.3	-90.8	-42	0	0	0	108
1904	V	33.5	Very low	31.4	Very low	109 Å²	109	119.9 Å²	119.9	66%	0.661	71%	0.713	S	S	*	*	S	Bend	trans	69.8	98.4	151.9	-168.8	0	0	0	0	118.6
1905	D	32.9	Very low	30.8	Very low	133 Å²	133	126 Å²	126	71%	0.711	72%	0.721	S	S	*	*			trans	84.3	119.1	138.1	-53.7	-5.2	0	0	0	123.4
1906	D	34.8	Very low	30.6	Very low	149 Å²	149	127.7 Å²	127.7	80%	0.797	73%	0.728	S	S	*	*			trans	78.9	103.4	140.8	-64.3	-1.9	0	0	0	124.7
1907	D	32.8	Very low	29.7	Very low	138 Å²	138	130.5 Å²	130.5	74%	0.738	73%	0.734	S	S	*	*				95.3	97.3	123.8	-102.5	27.8	0	0	0	125.3
1908	N	35	Very low	28.9	Very low	119 Å²	119	132.9 Å²	132.9	64%	0.636	74%	0.739	S	S	*	*				90.9	110.6	119.4	-89	-43.8	0	0	0	125.4
1909	N	34.6	Very low	28.7	Very low	102 Å²	102	133 Å²	133	55%	0.545	74%	0.736	S	S	.	*			trans	85.9	105.4	136.9	-74.2	-65.3	0	0	0	125.2
1910	K	32.8	Very low	28.6	Very low	169 Å²	169	137.8 Å²	137.8	74%	0.735	74%	0.74	S	S	*	*				69.7	152.3	122.7	-70.4	173.9	-176.6	139.4	0	122.5
1911	S	31.8	Very low	28.6	Very low	101 Å²	101	143.3 Å²	143.3	71%	0.706	75%	0.747	S	S	*	*			cis	-180	135.6	-25	54.8	0	0	0	0	113.3
1912	K	28.3	Very low	28.6	Very low	199 Å²	199	148 Å²	148	87%	0.865	75%	0.748	S	S	*	*			trans	-177.1	125.6	146.8	-104.4	174.9	178.9	-175.5	0	108.6
1913	L	27.2	Very low	28.5	Very low	154 Å²	154	149.5 Å²	149.5	81%	0.806	75%	0.751	S	S	*	*				51.5	124.9	93.7	-107.6	68.6	0	0	0	113.1
1914	D	25.9	Very low	28.5	Very low	143 Å²	143	147.4 Å²	147.4	77%	0.765	74%	0.739	S	S	*	*			cis	-147.6	170.5	49.1	-125.5	-29.2	0	0	0	117.3
1915	R	27.6	Very low	28	Very low	225 Å²	225	148.8 Å²	148.8	85%	0.849	74%	0.743	S	S	*	*			trans	67.3	99.5	165.1	-73.8	-173.2	172.2	-167.4	-4.3	122.2
1916	V	25.1	Very low	27.9	Very low	113 Å²	113	144.5 Å²	144.5	69%	0.685	72%	0.723	S	S	*	*				51.4	97.2	120.8	-176	0	0	0	0	118.3	N1918	V1916-N1918 HydrophobicContact CG1-CB 3.91Å
1917	M	22.3	Very low	27.5	Very low	166 Å²	166	141 Å²	141	82%	0.818	71%	0.708	S	S	*	*				-72.5	137.6	123.9	-99.5	-102.5	-90.9	0	0	108	V1919	M1917-V1919 HydrophobicContact CE-CG2 3.71Å; M1917-V1919 HydrophobicContact SD-CG2 4.18Å
1918	N	24.7	Very low	27.2	Very low	145 Å²	145	138.4 Å²	138.4	78%	0.775	71%	0.706	S	S	*	*			trans	-121.1	93.1	159	-103.3	15	0	0	0	108	V1916	V1916-N1918 HydrophobicContact CG1-CB 3.91Å
1919	V	24.1	Very low	26.8	Very low	91 Å²	91	141.9 Å²	141.9	55%	0.552	72%	0.718	S	S	*	*			trans	-66	146.3	159.7	170.9	0	0	0	0	108.1	M1917	M1917-V1919 HydrophobicContact CE-CG2 3.71Å; M1917-V1919 HydrophobicContact SD-CG2 4.18Å
1920	F	24.3	Very low	26.4	Very low	194 Å²	194	143.2 Å²	143.2	85%	0.851	73%	0.725	S	S	*	*			trans	-28.9	137.1	171.4	-62.1	-98.8	0	0	0	115.4
1921	Y	25	Very low	26.1	Very low	213 Å²	213	141.5 Å²	141.5	84%	0.835	72%	0.724	S	S	*	*			trans	-135.9	117.3	147	-80	-83.1	0	0	0	109.7
1922	Q	24.1	Very low	25.8	Very low	175 Å²	175	141.7 Å²	141.7	82%	0.818	72%	0.724	S	S	*	*			trans	-133.4	134.7	149.4	-98.2	-169.5	-22	0	0	107.1
1923	N	26.2	Very low	25.7	Very low	139 Å²	139	141.8 Å²	141.8	74%	0.743	73%	0.725	S	S	*	*			trans	43.2	78.7	161.5	-58	3.7	0	0	0	115.1
1924	D	26.1	Very low	25.6	Very low	119 Å²	119	139.6 Å²	139.6	64%	0.636	72%	0.722	S	S	*	*				68	113.2	71	-72.8	-66.5	0	0	0	115.1
1925	N	23.7	Very low	25.5	Very low	138 Å²	138	140.1 Å²	140.1	74%	0.738	73%	0.725	S	S	*	*			trans	60.5	126.7	141.5	-56.4	-51.1	0	0	0	119.8
1926	S	29.1	Very low	25.3	Very low	42 Å²	42	133.7 Å²	133.7	29%	0.294	71%	0.714	S	S	.	*				174.8	168.1	119.4	46.5	0	0	0	0	111.9	D2090 S2091	S1926-D2090 WeakPolarHBondContact CB-OD1 3.31Å; S1926-D2090 WeakPolarHBondContact OG-CB 3.44Å; S1926-D2090 PolarHBondContact OG-OD1 2.8Å; S1926-S2091 PolarHBondContact OG-N 3.37Å
1927	P	26.9	Very low	25.3	Very low	75 Å²	75	135.5 Å²	135.5	49%	0.487	72%	0.718	S	S	.	*			cis	-122.3	-172	-41.3	44.7	-31.7	0	0	0	112	H1929 D2090 S2091	P1927-H1929 PolarHBondContact O-N 2.98Å; P1927-D2090 HydrophobicContact CB-CB 4.02Å; P1927-D2090 WeakPolarHBondContact CB-OD2 3.38Å; P1927-D2090 HydrophobicContact CG-CB 3.54Å; P1927-S2091 VanDerWaalsContact CD-O 3.25Å; P1927-S2091 WeakPolarHBondContact CD-O 3.5Å
1928	A	27.6	Very low	25.5	Very low	84 Å²	84	133 Å²	133	69%	0.694	71%	0.709	S	S	*	*			trans	7.8	89.2	149	0	0	0	0	0	120.2
1929	H	24.7	Very low	25.7	Very low	192 Å²	192	134.5 Å²	134.5	89%	0.889	71%	0.708	S	S	*	*				-88.6	109.7	127.5	-123.9	-59	0	0	0	108.7	P1927	P1927-H1929 PolarHBondContact O-N 2.98Å
1930	L	27.4	Very low	25.7	Very low	130 Å²	130	138 Å²	138	68%	0.681	72%	0.722	S	S	*	*			trans	-89.3	145.9	161.5	-67.8	170.6	0	0	0	107.7
1931	N	27.2	Very low	25.8	Very low	134 Å²	134	134 Å²	134	72%	0.717	72%	0.718	S	S	*	*			cis	-146.2	148.9	12	-123.5	-37.2	0	0	0	113
1932	C	24.8	Very low	25.9	Very low	105 Å²	105	128.9 Å²	128.9	71%	0.709	71%	0.713	S	S	*	*			trans	17.8	106	166	-67	0	0	0	0	122.8
1933	K	26.2	Very low	26.1	Very low	201 Å²	201	125.8 Å²	125.8	87%	0.874	71%	0.712	S	S	*	*				52	114.4	125	-64.2	176.3	177.8	172.2	0	120.8
1934	S	24	Very low	26.1	Very low	108 Å²	108	124.9 Å²	124.9	76%	0.755	72%	0.716	S	S	*	*				-165.8	161	109.7	43.6	0	0	0	0	111.3
1935	D	24.5	Very low	26	Very low	153 Å²	153	124.4 Å²	124.4	82%	0.818	72%	0.722	S	S	*	*			trans	11.3	147.5	152.2	-46.6	-20.6	0	0	0	120.1
1936	S	24	Very low	26.1	Very low	90 Å²	90	122.6 Å²	122.6	63%	0.629	73%	0.726	S	S	*	*			cis	176.9	170.8	-12.3	59.8	0	0	0	0	108.4
1937	I	24	Very low	26.1	Very low	151 Å²	151	127.7 Å²	127.7	77%	0.774	75%	0.75	S	S	*	*			trans	76.9	143.5	155.4	-67.3	165.4	0	0	0	119.3
1938	D	27.2	Very low	26.1	Very low	114 Å²	114	131.3 Å²	131.3	61%	0.61	77%	0.765	S	S	*	*			trans	86.1	101	156.4	-88.9	5	0	0	0	124.9
1939	K	28.5	Very low	26.2	Very low	176 Å²	176	136.1 Å²	136.1	77%	0.765	77%	0.773	S	S	*	*				94.8	159.4	118.7	-79.6	179.6	-178.6	75.7	0	121.5
1940	I	24.7	Very low	26.4	Very low	164 Å²	164	138.3 Å²	138.3	84%	0.841	77%	0.774	S	S	*	*			trans	-116.2	160.7	-162.3	-69.6	170.5	0	0	0	110
1941	S	27	Very low	26.4	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	78%	0.776	S	S	*	*			trans	-58.6	164.7	-176.3	54.7	0	0	0	0	116.9
1942	S	25.9	Very low	26.3	Very low	105 Å²	105	137.2 Å²	137.2	73%	0.734	78%	0.777	S	S	*	*			trans	-157.4	142.9	158.2	60.6	0	0	0	0	114.3
1943	S	28.7	Very low	26.4	Very low	111 Å²	111	139 Å²	139	78%	0.776	78%	0.779	S	S	*	*			trans	66.8	151.3	153	71.6	0	0	0	0	121
1944	S	26.7	Very low	26.4	Very low	120 Å²	120	136.3 Å²	136.3	84%	0.839	77%	0.77	S	S	*	*			cis	-168.8	167.5	-27.1	51.7	0	0	0	0	111
1945	S	23.9	Very low	26.5	Very low	109 Å²	109	138.3 Å²	138.3	76%	0.762	77%	0.767	S	S	*	*			trans	-93.6	153	-176	55	0	0	0	0	116.1
1946	A	24.9	Very low	26.5	Very low	99 Å²	99	137.7 Å²	137.7	82%	0.818	76%	0.764	S	S	*	*			trans	51.3	127.4	143.9	0	0	0	0	0	121.8
1947	D	28.6	Very low	26.6	Very low	150 Å²	150	141.9 Å²	141.9	80%	0.802	77%	0.771	S	S	*	*				-161	-172.5	114	-141.2	-39	0	0	0	111.6
1948	N	28.6	Very low	26.6	Very low	150 Å²	150	142.1 Å²	142.1	80%	0.802	77%	0.766	S	S	*	*			trans	-90.3	167.3	-156	-79.5	-87.3	0	0	0	117.8
1949	Q	28.8	Very low	26.4	Very low	186 Å²	186	141.9 Å²	141.9	87%	0.869	76%	0.761	S	S	*	*			trans	-78.3	148.5	-163.3	-57.1	171.9	-14.8	0	0	116.2
1950	R	27.9	Very low	26.3	Very low	237 Å²	237	136.3 Å²	136.3	89%	0.894	74%	0.742	S	S	*	*			trans	-161.1	128.7	135.6	-115.8	-173.2	177.4	-169.1	-0.9	114.9
1951	V	27.8	Very low	26.5	Very low	120 Å²	120	131.6 Å²	131.6	73%	0.727	72%	0.724	S	S	*	*			trans	50.3	110.4	141.8	177.8	0	0	0	0	119.4
1952	V	25.9	Very low	26.6	Very low	122 Å²	122	132.1 Å²	132.1	74%	0.739	71%	0.712	S	S	*	*			trans	31.8	107	131.9	-170.3	0	0	0	0	117.3
1953	N	27.8	Very low	26.7	Very low	142 Å²	142	131.1 Å²	131.1	76%	0.759	71%	0.705	S	S	*	*				-157.5	162.7	106.9	-125.3	-41	0	0	0	116.4
1954	H	26.2	Very low	26.5	Very low	144 Å²	144	130.3 Å²	130.3	67%	0.667	70%	0.696	S	S	*	*			trans	-43.4	148	173.6	-84.1	-63.3	0	0	0	118.2
1955	Q	25.3	Very low	26.6	Very low	150 Å²	150	130.4 Å²	130.4	70%	0.701	69%	0.69	S	S	*	*			trans	69.8	121.3	131.2	-68.7	176.1	4.3	0	0	118.2
1956	N	23.8	Very low	27.3	Very low	140 Å²	140	130.2 Å²	130.2	75%	0.749	69%	0.687	S	S	*	*				90.3	143.1	55.4	-91.7	-28.7	0	0	0	113.6
1957	K	25.7	Very low	27.2	Very low	178 Å²	178	137.9 Å²	137.9	77%	0.774	69%	0.694	S	S	*	*			trans	75.1	144.4	161.1	-70.7	174	175.4	-173.5	0	118.2
1958	K	24	Very low	27	Very low	157 Å²	157	136.5 Å²	136.5	68%	0.683	69%	0.687	S	S	*	*			cis	167.5	169.7	-33.7	-109.3	168	143.7	-141.9	0	109
1959	E	24.9	Very low	26.9	Very low	109 Å²	109	131.8 Å²	131.8	51%	0.509	66%	0.664	S	S	.	*			trans	74	136.2	139.4	-81.3	147.3	-173.1	0	0	121.1	L1974	E1959-L1974 HydrophobicContact CB-CD1 3.89Å; E1959-L1974 HydrophobicContact CG-CD1 3.69Å
1960	T	25.6	Very low	26.6	Very low	59 Å²	59	129.1 Å²	129.1	36%	0.362	65%	0.651	S	S	.	*			cis	-168.2	146.9	-16.6	3.8	0	0	0	0	116.3	L1974	T1960-L1974 WeakPolarHBondContact OG1-CD1 3.44Å; T1960-L1974 WeakPolarHBondContact OG1-CG 3.48Å
1961	S	28.2	Very low	26.4	Very low	65 Å²	65	122.2 Å²	122.2	46%	0.455	64%	0.635	S	S	.	*			trans	32.1	150	132.8	68.4	0	0	0	0	126.1	K1972 Q1973	S1961-K1972 VanDerWaalsContact C-N 3.34Å; S1961-K1972 CarbonylContact O-C 3.58Å; S1961-K1972 WeakPolarHBondContact O-CA 3.48Å; S1961-K1972 PolarHBondContact O-N 3.01Å; S1961-Q1973 VanDerWaalsContact O-CA 3.26Å; S1961-Q1973 WeakPolarHBondContact O-CA 3.34Å; S1961-Q1973 PolarHBondContact O-N 3.37Å; S1961-Q1973 VanDerWaalsContact O-N 3.08Å
1962	K	29.9	Very low	26.3	Very low	122 Å²	122	123.4 Å²	123.4	53%	0.53	63%	0.631	S	S	.	*			trans	121.7	120.2	142.8	-65.1	-178.9	-168.8	159.8	0	121	H1970 T1971 K1972 Q1973	K1962-H1970 CarbonylContact C-O 3.59Å; K1962-H1970 CarbonylContact O-C 3.6Å; K1962-H1970 VanDerWaalsContact O-C 3.31Å; K1962-T1971 CarbonylContact O-C 3.4Å; K1962-T1971 PolarHBondContact O-N 3.24Å; K1962-K1972 WeakPolarHBondContact CB-O 3.19Å; K1962-Q1973 VanDerWaalsContact CD-O 3.29Å; K1962-Q1973 WeakPolarHBondContact CD-O 3.49Å; K1962-Q1973 WeakPolarHBondContact CE-O 3.45Å; K1962-Q1973 PolarHBondContact NZ-O 2.86Å
1963	S	28.2	Very low	26.3	Very low	83 Å²	83	121.3 Å²	121.3	58%	0.58	61%	0.613	S	S	*	*			trans	109.3	105	134.6	-123.2	0	0	0	0	124.5	P1969 H1970	S1963-P1969 CarbonylContact C-O 3.55Å; S1963-H1970 PolarHBondContact N-O 2.9Å; S1963-H1970 VanDerWaalsContact N-O 3.14Å
1964	T	24.4	Very low	26.3	Very low	95 Å²	95	119 Å²	119	58%	0.583	60%	0.6	S	S	*	*			trans	85.5	83	144	-39.8	0	0	0	0	122.7	L1968 P1969	T1964-L1968 CarbonylContact C-O 3.59Å; T1964-L1968 CarbonylContact O-C 3.58Å; T1964-P1969 WeakPolarHBondContact O-CD 3.16Å; T1964-P1969 VanDerWaalsContact O-N 3.11Å
1965	V	28	Very low	26.2	Very low	121 Å²	121	118.1 Å²	118.1	73%	0.733	60%	0.599	S	S	*	*			trans	28.4	137.4	131.1	-174	0	0	0	0	120.1	L1968	V1965-L1968 CarbonylContact C-O 3.59Å; V1965-L1968 VanDerWaalsContact CA-O 3.24Å; V1965-L1968 WeakPolarHBondContact CA-O 3.27Å; V1965-L1968 PolarHBondContact N-O 2.93Å
1966	P	39.6	Very low	26.2	Very low	105 Å²	105	116.9 Å²	116.9	68%	0.682	60%	0.597	S	S	*	*	S	Bend	cis	-127.9	139.4	-18.3	36.6	-19.7	0	0	0	113.7	L1968	P1966-L1968 WeakPolarHBondContact CA-O 3.4Å; P1966-L1968 PolarHBondContact O-N 3.18Å
1967	R	22	Very low	26.4	Very low	260 Å²	260	119 Å²	119	98%	0.981	60%	0.602	S	S	*	*	S	Bend	trans	50.4	18.3	-158.3	-158.8	-140.1	-178.1	159.3	2.5	112.5
1968	L	25.1	Very low	26.2	Very low	122 Å²	122	120.2 Å²	120.2	64%	0.639	60%	0.604	S	S	*	*			trans	-156.8	153.9	175.1	-129.1	71.5	0	0	0	103.8	T1964 V1965 P1966	T1964-L1968 CarbonylContact C-O 3.59Å; T1964-L1968 CarbonylContact O-C 3.58Å; V1965-L1968 CarbonylContact C-O 3.59Å; V1965-L1968 VanDerWaalsContact CA-O 3.24Å; V1965-L1968 WeakPolarHBondContact CA-O 3.27Å; V1965-L1968 PolarHBondContact N-O 2.93Å; P1966-L1968 WeakPolarHBondContact CA-O 3.4Å; P1966-L1968 PolarHBondContact O-N 3.18Å
1969	P	26.1	Very low	26.7	Very low	50 Å²	50	120.1 Å²	120.1	33%	0.325	61%	0.611	S	S	.	*				-131.2	-161.2	-66.9	39.9	-30	0	0	0	112.1	S1963 T1964	S1963-P1969 CarbonylContact C-O 3.55Å; T1964-P1969 WeakPolarHBondContact O-CD 3.16Å; T1964-P1969 VanDerWaalsContact O-N 3.11Å
1970	H	23.5	Very low	26.7	Very low	131 Å²	131	122.7 Å²	122.7	61%	0.606	62%	0.623	S	S	*	*			trans	66.4	133.7	145.6	-63	-30.8	0	0	0	118.2	K1962 S1963	K1962-H1970 CarbonylContact C-O 3.59Å; K1962-H1970 CarbonylContact O-C 3.6Å; K1962-H1970 VanDerWaalsContact O-C 3.31Å; S1963-H1970 PolarHBondContact N-O 2.9Å; S1963-H1970 VanDerWaalsContact N-O 3.14Å
1971	T	23.3	Very low	26.8	Very low	91 Å²	91	127.9 Å²	127.9	56%	0.558	64%	0.641	S	S	*	*			cis	69.7	117.6	35	81.1	0	0	0	0	115.9	K1962	K1962-T1971 CarbonylContact O-C 3.4Å; K1962-T1971 PolarHBondContact O-N 3.24Å
1972	K	25	Very low	26.9	Very low	145 Å²	145	131.5 Å²	131.5	63%	0.63	65%	0.654	S	S	*	*			trans	79.3	129.3	160.2	-56.4	-179.9	154	-157.3	0	117.5	S1961 K1962	S1961-K1972 VanDerWaalsContact C-N 3.34Å; S1961-K1972 CarbonylContact O-C 3.58Å; S1961-K1972 WeakPolarHBondContact O-CA 3.48Å; S1961-K1972 PolarHBondContact O-N 3.01Å; K1962-K1972 WeakPolarHBondContact CB-O 3.19Å
1973	Q	26.7	Very low	26.9	Very low	79 Å²	79	129.8 Å²	129.8	37%	0.369	66%	0.662	S	S	.	*			cis	-156.9	-169.5	-7	-125.3	162.4	-70.6	0	0	111.1	S1961 K1962	S1961-Q1973 VanDerWaalsContact O-CA 3.26Å; S1961-Q1973 WeakPolarHBondContact O-CA 3.34Å; S1961-Q1973 PolarHBondContact O-N 3.37Å; S1961-Q1973 VanDerWaalsContact O-N 3.08Å; K1962-Q1973 VanDerWaalsContact CD-O 3.29Å; K1962-Q1973 WeakPolarHBondContact CD-O 3.49Å; K1962-Q1973 WeakPolarHBondContact CE-O 3.45Å; K1962-Q1973 PolarHBondContact NZ-O 2.86Å
1974	L	27.3	Very low	26.7	Very low	94 Å²	94	134.1 Å²	134.1	49%	0.492	67%	0.673	S	S	.	*			trans	-61.7	-155.8	145.5	-82.6	167.1	0	0	0	110.1	E1959 T1960	E1959-L1974 HydrophobicContact CB-CD1 3.89Å; E1959-L1974 HydrophobicContact CG-CD1 3.69Å; T1960-L1974 WeakPolarHBondContact OG1-CD1 3.44Å; T1960-L1974 WeakPolarHBondContact OG1-CG 3.48Å
1975	I	24.7	Very low	26.5	Very low	124 Å²	124	137.8 Å²	137.8	64%	0.636	68%	0.683	S	S	*	*			trans	76.8	128.7	173.7	-56.9	174.9	0	0	0	113.1
1976	D	23.9	Very low	26.3	Very low	125 Å²	125	137.2 Å²	137.2	67%	0.668	68%	0.683	S	S	*	*			cis	-155.9	-145.9	-23.9	-103.2	-26	0	0	0	106.7
1977	E	27.6	Very low	25.5	Very low	183 Å²	183	137.4 Å²	137.4	86%	0.855	68%	0.682	S	S	*	*			trans	61.2	77.5	164.5	-73.8	148.7	-150.7	0	0	113.4
1978	Y	23	Very low	25.7	Very low	204 Å²	204	131.2 Å²	131.2	80%	0.8	67%	0.674	S	S	*	*			cis	65.9	95.2	39.8	-138.3	-74.5	0	0	0	111.8	E1980	Y1978-E1980 PolarHBondContact O-N 3.2Å; Y1978-E1980 VanDerWaalsContact O-N 3.17Å
1979	N	34.1	Very low	26.1	Very low	155 Å²	155	129.6 Å²	129.6	83%	0.829	67%	0.673	S	S	*	*			trans	20.4	75.5	154.5	-59.7	-3.4	0	0	0	118.6
1980	E	25.8	Very low	26.8	Very low	164 Å²	164	135 Å²	135	77%	0.766	69%	0.694	S	S	*	*			trans	-130.2	143.8	140.7	-85.5	-167.3	172.9	0	0	108.8	Y1978	Y1978-E1980 PolarHBondContact O-N 3.2Å; Y1978-E1980 VanDerWaalsContact O-N 3.17Å
1981	F	27.3	Very low	27.2	Very low	168 Å²	168	136.2 Å²	136.2	74%	0.737	70%	0.7	S	S	*	*			cis	-129.6	155.2	3	-132.2	-75.6	0	0	0	111.9	A1983	F1981-A1983 PolarHBondContact O-N 3.13Å
1982	I	30	Very low	27.6	Very low	141 Å²	141	138.9 Å²	138.9	72%	0.723	71%	0.71	S	S	*	*			trans	-69.6	110.5	166.9	-66.5	172.8	0	0	0	109.7	E1984	I1982-E1984 HydrophobicContact CG2-CB 3.82Å; I1982-E1984 HydrophobicContact CG2-CG 4.02Å
1983	A	29.3	Very low	27.9	Very low	85 Å²	85	138.4 Å²	138.4	70%	0.702	71%	0.713	S	S	*	*				-125.3	134.9	124.2	0	0	0	0	0	104.9	F1981	F1981-A1983 PolarHBondContact O-N 3.13Å
1984	E	25	Very low	28.2	Very low	174 Å²	174	142 Å²	142	81%	0.813	73%	0.73	S	S	*	*			cis	45.7	57.2	19.3	-71.8	-147.7	143.2	0	0	114	I1982	I1982-E1984 HydrophobicContact CG2-CB 3.82Å; I1982-E1984 HydrophobicContact CG2-CG 4.02Å
1985	E	20.3	Very low	28.6	Very low	172 Å²	172	143.8 Å²	143.8	80%	0.804	75%	0.745	S	S	*	*				-149.1	124.5	120.2	-108.1	166.5	178.9	0	0	106.6
1986	C	22.2	Very low	29.1	Very low	109 Å²	109	142 Å²	142	74%	0.736	75%	0.749	S	S	*	*			cis	63.7	148.3	30.2	-146.5	0	0	0	0	112.7
1987	V	22.7	Very low	29.4	Very low	109 Å²	109	142.8 Å²	142.8	66%	0.661	75%	0.753	S	S	*	*			trans	43.1	85.1	171.5	-161.6	0	0	0	0	116.8
1988	T	26.7	Very low	29.7	Very low	131 Å²	131	141.2 Å²	141.2	80%	0.804	75%	0.746	S	S	*	*				-166	78.2	118.4	16.6	0	0	0	0	107.6
1989	S	34.2	Very low	30.1	Very low	88 Å²	88	140.3 Å²	140.3	62%	0.615	75%	0.746	S	S	*	*				65.2	122.6	87.3	74.1	0	0	0	0	112.9
1990	Q	39.8	Very low	29.8	Very low	164 Å²	164	137.6 Å²	137.6	77%	0.766	74%	0.739	S	S	*	*			trans	102.9	118.5	174.5	-56.1	-170.2	-79.3	0	0	114.1
1991	E	33	Very low	30	Very low	155 Å²	155	137.6 Å²	137.6	72%	0.724	74%	0.743	S	S	*	*			cis	-153.8	173.5	-4.9	-138.7	147.1	-136.5	0	0	114.9
1992	L	30.8	Very low	29.9	Very low	147 Å²	147	134.6 Å²	134.6	77%	0.77	74%	0.743	S	S	*	*			trans	-50.4	159.6	-177	-70.9	146.2	0	0	0	117.2
1993	L	31.2	Very low	30	Very low	135 Å²	135	133.4 Å²	133.4	71%	0.707	75%	0.747	S	S	*	*			trans	94.2	137.3	140	-117.4	69.7	0	0	0	121.9
1994	E	34.1	Very low	29.9	Very low	156 Å²	156	134.6 Å²	134.6	73%	0.729	75%	0.75	S	S	*	*			trans	74.1	99.6	146.4	-86.1	160.3	-155.7	0	0	123.9
1995	T	35.8	Very low	29.9	Very low	130 Å²	130	133.5 Å²	133.5	80%	0.798	75%	0.749	S	S	*	*			trans	58.3	118.7	130.1	54.7	0	0	0	0	122.4
1996	A	33.7	Very low	30.1	Very low	88 Å²	88	132.7 Å²	132.7	73%	0.727	75%	0.748	S	S	*	*				176.9	156.9	106.7	0	0	0	0	0	115.7
1997	N	31.1	Very low	30.7	Very low	141 Å²	141	133.1 Å²	133.1	75%	0.754	75%	0.75	S	S	*	*			trans	74.8	110.7	148.8	-68.4	-12	0	0	0	125.5
1998	H	33.3	Very low	30.8	Very low	150 Å²	150	133.1 Å²	133.1	69%	0.694	75%	0.754	S	S	*	*				89.1	123.5	120.7	-80.1	-37.2	0	0	0	126.2
1999	K	31.1	Very low	31.1	Very low	184 Å²	184	132 Å²	132	80%	0.8	75%	0.752	S	S	*	*			trans	74.3	149.6	135.9	-78.3	179.8	178.5	179.4	0	119.1
2000	S	29.3	Very low	30.8	Very low	99 Å²	99	137.5 Å²	137.5	69%	0.692	77%	0.768	S	S	*	*			cis	-165.1	173.4	1.1	39.1	0	0	0	0	114
2001	I	28.4	Very low	30	Very low	164 Å²	164	137 Å²	137	84%	0.841	77%	0.77	S	S	*	*			trans	93.2	156.2	161.5	-71.7	167.2	0	0	0	118
2002	S	27	Very low	29.6	Very low	105 Å²	105	135 Å²	135	73%	0.734	76%	0.764	S	S	*	*			trans	-173	168.9	-151.9	52.1	0	0	0	0	109.1
2003	S	31.2	Very low	29.3	Very low	116 Å²	116	135.6 Å²	135.6	81%	0.811	76%	0.761	S	S	*	*			cis	-175.8	167.3	-8.2	42	0	0	0	0	108.9
2004	S	26.9	Very low	28.9	Very low	109 Å²	109	134 Å²	134	76%	0.762	76%	0.76	S	S	*	*			trans	-144.7	135.9	-178.9	62.1	0	0	0	0	117.3
2005	L	25.7	Very low	28.7	Very low	152 Å²	152	133.1 Å²	133.1	80%	0.796	76%	0.76	S	S	*	*			trans	56.8	118.7	145.6	-80.9	166.9	0	0	0	123.3
2006	I	23.5	Very low	28.3	Very low	155 Å²	155	135.6 Å²	135.6	80%	0.795	76%	0.759	S	S	*	*			trans	56.4	167	151.1	29.2	172.6	0	0	0	120.4
2007	P	34.8	Very low	27.9	Very low	118 Å²	118	142 Å²	142	77%	0.766	77%	0.766	S	S	*	*			cis	-131.6	-168.2	-11.6	33.9	-11.4	0	0	0	116
2008	S	25	Very low	27.8	Very low	108 Å²	108	140.1 Å²	140.1	76%	0.755	76%	0.762	S	S	*	*			trans	-80.1	175.1	173.5	52.3	0	0	0	0	115.4
2009	S	34	Very low	27.6	Very low	109 Å²	109	140 Å²	140	76%	0.762	76%	0.761	S	S	*	*			cis	179.1	129.2	-34.9	60.8	0	0	0	0	109.6
2010	E	26.5	Very low	27.4	Very low	203 Å²	203	139 Å²	139	95%	0.949	76%	0.759	S	S	*	*			trans	-156.6	-178.8	164.6	-140.4	172.3	-153.8	0	0	112.4
2011	L	24.2	Very low	27.1	Very low	153 Å²	153	138 Å²	138	80%	0.801	75%	0.752	S	S	*	*			trans	-134.1	154.2	-147.6	-158.6	80.5	0	0	0	115.2
2012	D	23.7	Very low	26.8	Very low	114 Å²	114	136.4 Å²	136.4	61%	0.61	75%	0.745	S	S	*	*				113	153.7	127.6	-146.8	8	0	0	0	120.8
2013	K	25.2	Very low	26.7	Very low	159 Å²	159	138.1 Å²	138.1	69%	0.691	75%	0.746	S	S	*	*			trans	76.3	91.8	158.9	-76	167.8	-175.5	83.9	0	121.5
2014	S	23.2	Very low	26.4	Very low	100 Å²	100	137.1 Å²	137.1	70%	0.699	74%	0.735	S	S	*	*				113	164	92.1	74	0	0	0	0	120.9
2015	I	29.8	Very low	26.3	Very low	139 Å²	139	138 Å²	138	71%	0.713	74%	0.735	S	S	*	*			trans	96.6	97.1	159.8	-63.3	166.1	0	0	0	118.4
2016	K	27.5	Very low	26.2	Very low	182 Å²	182	134 Å²	134	79%	0.791	72%	0.72	S	S	*	*			trans	68.2	104.6	137.5	-65.7	-179.7	-172.2	176.1	0	121.4
2017	Y	25.3	Very low	26.3	Very low	221 Å²	221	130 Å²	130	87%	0.867	70%	0.7	S	S	*	*				0	148.1	111.9	-63.3	-74.8	0	0	0	117.1
2018	P	27.6	Very low	25.8	Very low	102 Å²	102	126.2 Å²	126.2	66%	0.662	68%	0.677	S	S	*	*			cis	-150.1	-156.3	47.1	41.9	-19.5	0	0	0	115.7
2019	H	29.1	Very low	25.7	Very low	148 Å²	148	127.7 Å²	127.7	69%	0.685	67%	0.672	S	S	*	*			trans	78.9	107.2	-174.5	-55.2	-69.7	0	0	0	113.7
2020	Q	27.3	Very low	25.2	Very low	162 Å²	162	128 Å²	128	76%	0.757	66%	0.664	S	S	*	*				81.7	141.7	54.2	-76.6	-176.9	-44.6	0	0	112.9
2021	S	23	Very low	25	Very low	78 Å²	78	126.4 Å²	126.4	55%	0.545	66%	0.655	S	S	.	*			cis	178	153	-20.4	48.8	0	0	0	0	108.8
2022	L	23.5	Very low	25	Very low	132 Å²	132	125.5 Å²	125.5	69%	0.691	65%	0.65	S	S	*	*			trans	63.4	162.9	155.9	-92.4	58.5	0	0	0	114.8	T2024	L2022-T2024 HydrophobicContact CD1-CG2 4.49Å; L2022-T2024 HydrophobicContact CG-CG2 4.33Å
2023	D	23.8	Very low	25	Very low	140 Å²	140	129.8 Å²	129.8	75%	0.749	66%	0.658	S	S	*	*			cis	-103.8	145.8	-7	-65.9	-76.1	0	0	0	109.7
2024	T	25.1	Very low	25.1	Very low	95 Å²	95	127.5 Å²	127.5	58%	0.583	66%	0.66	S	S	*	*			cis	74.1	120.5	44.9	45	0	0	0	0	118	L2022	L2022-T2024 HydrophobicContact CD1-CG2 4.49Å; L2022-T2024 HydrophobicContact CG-CG2 4.33Å
2025	V	24.7	Very low	25.3	Very low	127 Å²	127	130 Å²	130	77%	0.77	66%	0.66	S	S	*	*			trans	93.6	155.5	140.8	167.6	0	0	0	0	118.8
2026	S	24.4	Very low	25.2	Very low	68 Å²	68	128.4 Å²	128.4	48%	0.476	66%	0.657	S	S	.	*			trans	-79.7	-178.7	-176.4	48.3	0	0	0	0	111.1	D2310	S2026-D2310 CarbonylContact O-C 3.52Å; S2026-D2310 PolarHBondContact O-N 3.46Å
2027	N	25.5	Very low	25.1	Very low	72 Å²	72	126 Å²	126	39%	0.385	65%	0.652	S	S	.	*			cis	-158.3	-168.6	44.7	-75.5	-67.5	0	0	0	112.8	D2308 D2309 D2310 N2311	N2027-D2308 PolarHBondContact ND2-O 3.26Å; N2027-D2309 PolarHBondContact ND2-O 3.1Å; N2027-D2310 VanDerWaalsContact N-C 3.28Å; N2027-N2311 PolarHBondContact O-N 3.25Å
2028	S	23.1	Very low	25.2	Very low	39 Å²	39	123 Å²	123	27%	0.273	65%	0.645	S	S	.	*			trans	68.9	119.4	133.5	40.7	0	0	0	0	122.8	D2309 D2310	S2028-D2309 WeakPolarHBondContact OG-CA 3.35Å; S2028-D2310 WeakPolarHBondContact OG-CA 3.19Å; S2028-D2310 PolarHBondContact OG-OD1 3.28Å
2029	E	23.2	Very low	25.1	Very low	139 Å²	139	123.4 Å²	123.4	65%	0.65	65%	0.646	S	S	*	*				81.7	138.9	118.4	-67	-158.8	174.4	0	0	125
2030	L	23.3	Very low	24.9	Very low	116 Å²	116	122.1 Å²	122.1	61%	0.607	65%	0.652	S	S	*	*			trans	67.9	105.4	142.8	-94.7	57.6	0	0	0	122
2031	F	22.8	Very low	25.1	Very low	169 Å²	169	119.3 Å²	119.3	74%	0.741	65%	0.648	S	S	*	*				76.2	154.8	126.2	-75	-157	0	0	0	117.5
2032	D	24.2	Very low	25	Very low	133 Å²	133	121.8 Å²	121.8	71%	0.711	66%	0.655	S	S	*	*			cis	-131.9	161.6	9.2	-135.8	-34.5	0	0	0	113.8
2033	W	23.8	Very low	25	Very low	205 Å²	205	124.7 Å²	124.7	78%	0.777	67%	0.665	S	S	*	*			trans	-84.6	179	172.5	-72.8	36.9	0	0	0	109.9
2034	P	28.1	Very low	25.1	Very low	111 Å²	111	125.1 Å²	125.1	72%	0.721	67%	0.666	S	S	*	*				-126.2	129.8	76.9	2.1	21.8	0	0	0	112.4
2035	E	26.1	Very low	24.8	Very low	153 Å²	153	124.7 Å²	124.7	72%	0.715	67%	0.672	S	S	*	*				91	142	100.2	-75.2	176.8	168.1	0	0	113.1
2036	T	27.2	Very low	24.7	Very low	104 Å²	104	129.5 Å²	129.5	64%	0.638	68%	0.676	S	S	*	*			cis	-148.4	146.1	10.3	-2.1	0	0	0	0	111.6
2037	I	26.4	Very low	24.5	Very low	133 Å²	133	133.9 Å²	133.9	68%	0.682	69%	0.692	S	S	*	*				39.6	131.3	127.9	-68.7	175	0	0	0	118.5
2038	Q	26.4	Very low	24.3	Very low	156 Å²	156	137.5 Å²	137.5	73%	0.729	71%	0.706	S	S	*	*			cis	-165.6	-164.5	-1.8	-114	173.1	13.7	0	0	107.4
2039	T	26.6	Very low	24.3	Very low	112 Å²	112	141.6 Å²	141.6	69%	0.687	72%	0.72	S	S	*	*			cis	-156.8	128	16.9	-22.5	0	0	0	0	112.4
2040	C	23.8	Very low	24.4	Very low	120 Å²	120	144.4 Å²	144.4	81%	0.811	73%	0.726	S	S	*	*			trans	53.9	160.5	144	-67.6	0	0	0	0	125.6
2041	P	31.4	Very low	24.4	Very low	104 Å²	104	144.2 Å²	144.2	68%	0.675	73%	0.73	S	S	*	*			trans	-131.9	-160.2	-169.7	41.8	-20.6	0	0	0	114.5
2042	N	21.8	Very low	24.6	Very low	130 Å²	130	140.3 Å²	140.3	70%	0.695	72%	0.72	S	S	*	*			trans	64.6	105.3	157.5	-65.6	-12.3	0	0	0	120.2
2043	Q	23.7	Very low	24.7	Very low	193 Å²	193	138.8 Å²	138.8	90%	0.902	71%	0.712	S	S	*	*			trans	-131.6	133.8	133.3	-68	-171.3	-13.1	0	0	107.8
2044	I	24.6	Very low	25	Very low	148 Å²	148	134 Å²	134	76%	0.759	70%	0.701	S	S	*	*			cis	81.1	136	29.9	-53	176.3	0	0	0	112.9
2045	A	20.6	Very low	24.9	Very low	86 Å²	86	135.7 Å²	135.7	71%	0.711	70%	0.7	S	S	*	*			trans	-76.5	178.9	-172	0	0	0	0	0	114.4
2046	R	21.9	Very low	24.9	Very low	228 Å²	228	138.1 Å²	138.1	86%	0.86	70%	0.704	S	S	*	*			trans	88.4	109.2	-167.1	-60	173.2	-179.2	172.6	1	111
2047	M	20.1	Very low	24.8	Very low	161 Å²	161	138.4 Å²	138.4	79%	0.793	71%	0.707	S	S	*	*			cis	61.3	137.9	20.5	-152.1	-173.2	-163	0	0	113.6
2048	H	21.8	Very low	24.5	Very low	148 Å²	148	139.5 Å²	139.5	69%	0.685	71%	0.714	S	S	*	*			trans	91.4	134	-177	-54.8	-38.1	0	0	0	115.3
2049	H	22.8	Very low	24.3	Very low	125 Å²	125	138.2 Å²	138.2	58%	0.579	72%	0.717	S	S	*	*	S	Bend	cis	-147.8	163.9	4.8	-131.6	69.7	0	0	0	112.7
2050	Y	25.8	Very low	24	Very low	198 Å²	198	139.5 Å²	139.5	78%	0.776	72%	0.718	S	S	*	*			trans	71.3	101.2	-175.2	-57.9	-73.6	0	0	0	115.1
2051	V	22.9	Very low	24.1	Very low	111 Å²	111	144.2 Å²	144.2	67%	0.673	72%	0.72	S	S	*	*			cis	74.6	121.7	31.1	-164.8	0	0	0	0	110.4
2052	T	26.9	Very low	23.8	Very low	88 Å²	88	145.4 Å²	145.4	54%	0.54	73%	0.728	S	S	.	*				-141.3	147.7	50.2	50	0	0	0	0	116.8
2053	N	26.5	Very low	23.7	Very low	101 Å²	101	146.5 Å²	146.5	54%	0.54	73%	0.733	S	S	.	*			trans	44.9	148.1	130.2	-61	56.8	0	0	0	121.2
2054	D	28.6	Very low	23.7	Very low	103 Å²	103	148.7 Å²	148.7	55%	0.551	73%	0.733	S	S	*	*			cis	-171.7	161.2	-0.8	-91.6	-22.4	0	0	0	107.4
2055	Q	27.3	Very low	23.6	Very low	148 Å²	148	147 Å²	147	69%	0.692	74%	0.735	S	S	*	*			cis	-160.4	175.8	-10.9	-114.1	177.8	57.7	0	0	114.2
2056	Y	25.2	Very low	23.7	Very low	203 Å²	203	146.5 Å²	146.5	80%	0.796	74%	0.738	S	S	*	*			trans	-47.1	179.1	173.7	-69.6	-63.6	0	0	0	122.7
2057	P	26.3	Very low	23.9	Very low	110 Å²	110	140.3 Å²	140.3	71%	0.714	74%	0.735	S	S	*	*			cis	-135	169.1	-21.9	29.1	-9.4	0	0	0	115.7
2058	L	19.7	Very low	24.2	Very low	157 Å²	157	138.2 Å²	138.2	82%	0.822	73%	0.731	S	S	*	*			trans	-132.3	126.8	158.2	-164.6	163.6	0	0	0	108.6	I2060	L2058-I2060 HydrophobicContact CD2-CG1 4.38Å
2059	T	22.5	Very low	24.4	Very low	128 Å²	128	137.5 Å²	137.5	79%	0.785	74%	0.738	S	S	*	*			trans	-100.5	133.9	-170.2	-27.4	0	0	0	0	112.8
2060	I	19.9	Very low	24.4	Very low	140 Å²	140	139.6 Å²	139.6	72%	0.718	75%	0.748	S	S	*	*			trans	-124.9	145.3	170.1	-69.9	179.9	0	0	0	109.5	L2058	L2058-I2060 HydrophobicContact CD2-CG1 4.38Å
2061	Y	26.1	Very low	24.4	Very low	218 Å²	218	137.9 Å²	137.9	86%	0.855	75%	0.751	S	S	*	*			trans	-29.7	157.3	175.3	-67	-95.7	0	0	0	118.6
2062	P	23.8	Very low	24.5	Very low	129 Å²	129	136.4 Å²	136.4	84%	0.838	75%	0.75	S	S	*	*			trans	-120.2	145.1	131	36.2	-30	0	0	0	113.5
2063	L	21.4	Very low	24.3	Very low	154 Å²	154	137.8 Å²	137.8	81%	0.806	76%	0.759	S	S	*	*			trans	-106.1	160.8	161.4	-172.4	93.6	0	0	0	107.1
2064	W	23	Very low	24.1	Very low	238 Å²	238	142.1 Å²	142.1	90%	0.902	77%	0.769	S	S	*	*			trans	178.7	166.6	133.1	-100	34.2	0	0	0	114.1
2065	S	21.6	Very low	23.9	Very low	113 Å²	113	149.1 Å²	149.1	79%	0.79	79%	0.788	S	S	*	*			trans	-81	171	-174.8	48.9	0	0	0	0	114.3
2066	G	24.6	Very low	23.6	Very low	76 Å²	76	148.1 Å²	148.1	78%	0.784	79%	0.787	S	S	*	*			cis	-172.8	-154.7	5.3	0	0	0	0	0	108.5
2067	A	25	Very low	23.4	Very low	97 Å²	97	146.5 Å²	146.5	80%	0.802	79%	0.787	S	S	*	*			cis	-164.5	-163.9	-10.5	0	0	0	0	0	105.7
2068	V	25.7	Very low	23.2	Very low	117 Å²	117	148 Å²	148	71%	0.709	79%	0.794	S	S	*	*			cis	-151.9	144.3	9.2	-172.4	0	0	0	0	108.4
2069	T	26.1	Very low	23.3	Very low	134 Å²	134	146.8 Å²	146.8	82%	0.822	79%	0.788	S	S	*	*			trans	148	152	134.3	46.8	0	0	0	0	111.6
2070	E	23.8	Very low	23.2	Very low	168 Å²	168	147.1 Å²	147.1	79%	0.785	78%	0.784	S	S	*	*			cis	-166.5	166.6	-43.7	-168.8	159.7	-128.5	0	0	106.6
2071	L	24.8	Very low	23.4	Very low	163 Å²	163	148.2 Å²	148.2	85%	0.853	79%	0.786	S	S	*	*			trans	91.6	111.9	-175.3	-59.3	165.2	0	0	0	113.7
2072	A	25.7	Very low	23.2	Very low	79 Å²	79	141.8 Å²	141.8	65%	0.653	77%	0.773	S	S	*	*				98.2	140.6	50.3	0	0	0	0	0	111.7
2073	T	22.3	Very low	23.3	Very low	118 Å²	118	142.7 Å²	142.7	72%	0.724	77%	0.771	S	S	*	*			cis	-179	156.9	-32.9	16.9	0	0	0	0	106.7
2074	Y	22.6	Very low	23.4	Very low	191 Å²	191	142.8 Å²	142.8	75%	0.749	77%	0.767	S	S	*	*			trans	59.3	120.9	151.7	-95.6	-91.5	0	0	0	119.8
2075	W	23.7	Very low	23.5	Very low	251 Å²	251	138.1 Å²	138.1	95%	0.951	76%	0.757	S	S	*	*				-163.5	160.2	109.8	-109.5	41.7	0	0	0	110.9
2076	D	21.9	Very low	23.7	Very low	126 Å²	126	139.7 Å²	139.7	67%	0.674	76%	0.756	S	S	*	*			trans	-102.2	176.9	-156.6	-82.5	-69.7	0	0	0	115.9
2077	Q	20.4	Very low	23.7	Very low	169 Å²	169	146.3 Å²	146.3	79%	0.79	76%	0.759	S	S	*	*			trans	-54.4	154.1	168.9	-59.4	173	-21	0	0	112.9
2078	T	23	Very low	23.5	Very low	142 Å²	142	146.3 Å²	146.3	87%	0.871	75%	0.752	S	S	*	*			trans	-145.9	140.4	146.1	-7.2	0	0	0	0	110.4
2079	L	21.3	Very low	23.4	Very low	131 Å²	131	144.8 Å²	144.8	69%	0.686	75%	0.747	S	S	*	*			trans	-88.7	153.8	172.4	-86.3	64.7	0	0	0	109.8
2080	L	21.6	Very low	23.3	Very low	136 Å²	136	143 Å²	143	71%	0.712	73%	0.732	S	S	*	*			trans	37.3	140.6	133.9	-54.5	172.4	0	0	0	118.9
2081	H	23.2	Very low	23.5	Very low	163 Å²	163	138 Å²	138	76%	0.755	72%	0.717	S	S	*	*			cis	-165.4	-158.7	21.7	-139.6	-20.1	0	0	0	112.5
2082	S	21.9	Very low	23.6	Very low	82 Å²	82	135.2 Å²	135.2	57%	0.573	71%	0.708	S	S	*	*			trans	73.3	109.3	161.1	31	0	0	0	0	119.1
2083	D	25	Very low	23.4	Very low	148 Å²	148	138.4 Å²	138.4	79%	0.791	71%	0.714	S	S	*	*				78.5	137.1	125.9	-47.9	-21	0	0	0	118.8
2084	E	24.4	Very low	23.6	Very low	157 Å²	157	142.1 Å²	142.1	73%	0.734	72%	0.723	S	S	*	*			cis	-157.5	-179.6	4.9	-137.6	178.9	-170.8	0	0	112.9
2085	M	25.2	Very low	23.6	Very low	139 Å²	139	137.2 Å²	137.2	69%	0.685	72%	0.722	S	S	*	*			trans	84.8	112.2	163.9	-60.2	-58	173.2	0	0	121.7
2086	L	25.9	Very low	23.6	Very low	146 Å²	146	133.2 Å²	133.2	76%	0.764	72%	0.716	S	S	*	*			trans	59	97.7	130.6	-57.3	169.9	0	0	0	117.8
2087	Y	25	Very low	23.6	Very low	216 Å²	216	132.5 Å²	132.5	85%	0.847	71%	0.712	S	S	*	*				62.5	143.2	63.2	-87.9	-87.9	0	0	0	117.6
2088	S	20.8	Very low	23.7	Very low	96 Å²	96	133.8 Å²	133.8	67%	0.671	71%	0.71	S	S	*	*			trans	-25.7	141.5	166.4	51.2	0	0	0	0	116.8
2089	S	23.1	Very low	23.9	Very low	86 Å²	86	134 Å²	134	60%	0.601	71%	0.705	S	S	*	*			cis	-169.8	-173.5	4.5	35.2	0	0	0	0	111.7
2090	D	24.1	Very low	24	Very low	95 Å²	95	130.9 Å²	130.9	51%	0.508	69%	0.694	S	S	.	*			trans	97.2	160.6	143.2	-56	-39.4	0	0	0	120.9	S1926 P1927	S1926-D2090 WeakPolarHBondContact CB-OD1 3.31Å; S1926-D2090 WeakPolarHBondContact OG-CB 3.44Å; S1926-D2090 PolarHBondContact OG-OD1 2.8Å; P1927-D2090 HydrophobicContact CB-CB 4.02Å; P1927-D2090 WeakPolarHBondContact CB-OD2 3.38Å; P1927-D2090 HydrophobicContact CG-CB 3.54Å
2091	S	27	Very low	24.2	Very low	65 Å²	65	133.7 Å²	133.7	46%	0.455	70%	0.703	S	S	.	*			trans	-106	178.8	-176.2	76.8	0	0	0	0	111.6	S1926 P1927	S1926-S2091 PolarHBondContact OG-N 3.37Å; P1927-S2091 VanDerWaalsContact CD-O 3.25Å; P1927-S2091 WeakPolarHBondContact CD-O 3.5Å
2092	P	27.2	Very low	24.2	Very low	103 Å²	103	133.3 Å²	133.3	67%	0.669	70%	0.702	S	S	*	*				-137.5	154	50.2	38.8	-19.8	0	0	0	118.1
2093	D	23.1	Very low	24.5	Very low	146 Å²	146	135.5 Å²	135.5	78%	0.781	71%	0.712	S	S	*	*			trans	41.8	93.4	138.9	-54.2	-6.5	0	0	0	121
2094	E	24.9	Very low	24.7	Very low	197 Å²	197	136.6 Å²	136.6	92%	0.921	71%	0.712	S	S	*	*				21.9	99.6	123.5	-170.5	169.5	-127.8	0	0	119
2095	A	23.4	Very low	24.6	Very low	87 Å²	87	134.9 Å²	134.9	72%	0.719	71%	0.712	S	S	*	*			trans	-153.2	96.6	144.2	0	0	0	0	0	113.1
2096	M	22.8	Very low	24.8	Very low	167 Å²	167	138.5 Å²	138.5	82%	0.823	73%	0.725	S	S	*	*			trans	64	145.2	151.2	-66.9	-161.3	-63.3	0	0	121.7
2097	N	22.4	Very low	24.9	Very low	112 Å²	112	136.1 Å²	136.1	60%	0.599	73%	0.726	S	S	*	*				3.6	134.5	120.1	-67.1	-70	0	0	0	115.4
2098	R	23.1	Very low	24.8	Very low	196 Å²	196	134.3 Å²	134.3	74%	0.74	73%	0.725	S	S	*	*			cis	-178.6	171	23.1	-130.4	169.3	-142.9	170.8	1.6	112.2
2099	L	25.6	Very low	25	Very low	146 Å²	146	134.7 Å²	134.7	76%	0.764	73%	0.727	S	S	*	*			trans	67.9	153.3	151.9	-67	161.2	0	0	0	115.5
2100	S	23.6	Very low	24.9	Very low	65 Å²	65	138.6 Å²	138.6	46%	0.455	73%	0.734	S	S	.	*			cis	-179.7	161.9	-25.5	48.3	0	0	0	0	108.6
2101	E	26.7	Very low	24.8	Very low	196 Å²	196	141.1 Å²	141.1	92%	0.916	75%	0.745	S	S	*	*			trans	-153	94.5	142.1	-110.1	156.9	-153	0	0	106.2
2102	E	23.6	Very low	24.8	Very low	155 Å²	155	143.7 Å²	143.7	72%	0.724	76%	0.758	S	S	*	*				59.6	73.3	69.3	-63.1	-150.2	148	0	0	114.5
2103	T	28.4	Very low	24.7	Very low	127 Å²	127	146 Å²	146	78%	0.779	76%	0.759	S	S	*	*			trans	-151.8	143.2	138.2	50.5	0	0	0	0	109
2104	H	28.2	Very low	25	Very low	171 Å²	171	145.2 Å²	145.2	79%	0.792	76%	0.762	S	S	*	*			cis	-146.9	147	-25.4	-124.2	-51.4	0	0	0	110.1
2105	T	23.1	Very low	25.1	Very low	121 Å²	121	140.3 Å²	140.3	74%	0.742	75%	0.746	S	S	*	*			trans	-68.7	135.9	170.9	37	0	0	0	0	112.5
2106	F	28.3	Very low	25	Very low	216 Å²	216	143.4 Å²	143.4	95%	0.947	75%	0.751	S	S	*	*			trans	-153.9	159.2	155.5	-134.3	-93.4	0	0	0	111.3
2107	A	28.1	Very low	25.3	Very low	95 Å²	95	140.9 Å²	140.9	79%	0.785	75%	0.747	S	S	*	*			trans	76.2	86.2	-170.1	0	0	0	0	0	115.4
2108	Q	22.3	Very low	25.4	Very low	179 Å²	179	139.9 Å²	139.9	84%	0.836	75%	0.748	S	S	*	*			trans	-125.7	99.1	174.5	179	-171.2	14	0	0	109.4
2109	S	25.7	Very low	25.4	Very low	103 Å²	103	135 Å²	135	72%	0.72	74%	0.744	S	S	*	*			trans	-159.5	103.2	174.1	51.5	0	0	0	0	109
2110	F	22.3	Very low	25.4	Very low	169 Å²	169	137 Å²	137	74%	0.741	75%	0.747	S	S	*	*				59.7	106.5	91.8	-83	-101	0	0	0	112.5
2111	M	21.5	Very low	25.3	Very low	148 Å²	148	142.9 Å²	142.9	73%	0.729	77%	0.767	S	S	*	*				91.5	164.9	65.2	-75.9	-103	-73.4	0	0	112
2112	T	26.8	Very low	25.1	Very low	119 Å²	119	138.3 Å²	138.3	73%	0.73	76%	0.757	S	S	*	*			trans	68.1	114.3	-170.3	65.6	0	0	0	0	113.1
2113	E	25.4	Very low	25	Very low	151 Å²	151	138.6 Å²	138.6	71%	0.706	76%	0.758	S	S	*	*			cis	72.6	130.4	46.6	-56.8	179.1	125.6	0	0	113.6	T2115	E2113-T2115 HydrophobicContact CB-CG2 4.39Å
2114	P	29.4	Very low	24.7	Very low	129 Å²	129	140.8 Å²	140.8	84%	0.838	76%	0.757	S	S	*	*				-106	112.7	109.9	-13.5	30.6	0	0	0	109.9
2115	T	26.2	Very low	24.5	Very low	94 Å²	94	139.1 Å²	139.1	58%	0.577	75%	0.753	S	S	*	*				64.4	105.6	74.4	68	0	0	0	0	114.8	E2113	E2113-T2115 HydrophobicContact CB-CG2 4.39Å
2116	D	22.5	Very low	24.3	Very low	153 Å²	153	138.3 Å²	138.3	82%	0.818	75%	0.752	S	S	*	*				57.4	159	123.3	-71.5	-12.4	0	0	0	121.8
2117	P	27.6	Very low	24	Very low	114 Å²	114	132.2 Å²	132.2	74%	0.74	74%	0.736	S	S	*	*			cis	-117.6	-177.2	7	44.4	-32.7	0	0	0	112.5
2118	S	25.7	Very low	23.7	Very low	91 Å²	91	134.9 Å²	134.9	64%	0.636	73%	0.732	S	S	*	*			cis	-159	132	5.8	5.4	0	0	0	0	106.6
2119	S	23.3	Very low	23.8	Very low	93 Å²	93	134 Å²	134	65%	0.65	73%	0.726	S	S	*	*				67.4	132.8	76.1	84.7	0	0	0	0	117
2120	F	24.6	Very low	23.6	Very low	189 Å²	189	136.1 Å²	136.1	83%	0.829	73%	0.725	S	S	*	*			trans	79.8	88.3	162.2	-63.5	-70.1	0	0	0	122.1
2121	H	21	Very low	23.7	Very low	187 Å²	187	133 Å²	133	87%	0.866	72%	0.719	S	S	*	*				9.2	105.1	114.1	-128.1	-51.5	0	0	0	119.4
2122	S	23.2	Very low	23.7	Very low	101 Å²	101	131.4 Å²	131.4	71%	0.706	72%	0.718	S	S	*	*			trans	-169	111	142.2	59.5	0	0	0	0	109.4
2123	Q	21.1	Very low	23.5	Very low	161 Å²	161	133.8 Å²	133.8	75%	0.752	72%	0.72	S	S	*	*				63.1	138	99.2	-75.4	-165.9	-17.3	0	0	117.5
2124	F	22.6	Very low	23.6	Very low	173 Å²	173	136.7 Å²	136.7	76%	0.759	73%	0.731	S	S	*	*			trans	90.1	122	160.2	-68.1	-67.5	0	0	0	122
2125	I	23	Very low	23.3	Very low	136 Å²	136	137.6 Å²	137.6	70%	0.697	73%	0.728	S	S	*	*			trans	75	102.9	131.2	-72.5	164.2	0	0	0	119.6
2126	S	20.6	Very low	23.1	Very low	104 Å²	104	141.6 Å²	141.6	73%	0.727	74%	0.74	S	S	*	*			trans	68.6	166.6	135.4	81.4	0	0	0	0	119.3
2127	S	21.7	Very low	23.6	Very low	88 Å²	88	140.2 Å²	140.2	62%	0.615	74%	0.739	S	S	*	*			cis	-174.6	161.9	-37	60.2	0	0	0	0	110
2128	Q	21.5	Very low	23.7	Very low	151 Å²	151	141.5 Å²	141.5	71%	0.706	75%	0.745	S	S	*	*			trans	71	152.3	160.6	-59.1	177.6	-38	0	0	118.9
2129	F	24.5	Very low	23.8	Very low	160 Å²	160	140.9 Å²	140.9	70%	0.702	75%	0.753	S	S	*	*			trans	64.3	137.1	155.8	-60.9	-50.6	0	0	0	119.6
2130	E	22.1	Very low	23.9	Very low	148 Å²	148	143.6 Å²	143.6	69%	0.692	76%	0.759	S	S	*	*			cis	-164.3	178.3	-20.6	-143.9	172.2	-155	0	0	111.7
2131	T	23.3	Very low	24.2	Very low	103 Å²	103	144.4 Å²	144.4	63%	0.632	76%	0.757	S	S	*	*			trans	59	108.6	149.8	51.8	0	0	0	0	122.3
2132	T	22.4	Very low	24.5	Very low	114 Å²	114	142.3 Å²	142.3	70%	0.699	75%	0.748	S	S	*	*				69.8	134.3	123.8	62.3	0	0	0	0	123.7
2133	H	22.8	Very low	24.7	Very low	169 Å²	169	144.4 Å²	144.4	78%	0.782	75%	0.752	S	S	*	*			trans	50.7	131	143.7	-65.3	-62.5	0	0	0	120.7
2134	F	26	Very low	25.1	Very low	212 Å²	212	140.6 Å²	140.6	93%	0.93	76%	0.755	S	S	*	*				-160.1	174.3	116	-110	-69.4	0	0	0	112.1
2135	I	24.4	Very low	25.3	Very low	149 Å²	149	139.9 Å²	139.9	76%	0.764	76%	0.758	S	S	*	*			trans	-112.2	167.5	-177.5	-71.5	170.2	0	0	0	109
2136	Q	22.1	Very low	25.5	Very low	177 Å²	177	141 Å²	141	83%	0.827	76%	0.758	S	S	*	*			trans	-34.3	166.4	163.7	-70.8	176.8	-29	0	0	116.5
2137	P	33.1	Very low	25.7	Very low	124 Å²	124	141 Å²	141	81%	0.805	75%	0.75	S	S	*	*			cis	-132.7	-163.7	-1.1	25.9	-0.4	0	0	0	114.4
2138	T	29.5	Very low	25.9	Very low	142 Å²	142	148.4 Å²	148.4	87%	0.871	77%	0.766	S	S	*	*			trans	-73	156.6	-179.4	46.8	0	0	0	0	116.5
2139	G	26.4	Very low	26.2	Very low	77 Å²	77	149.7 Å²	149.7	79%	0.794	77%	0.77	S	S	*	*			trans	-140.2	157.6	164.7	0	0	0	0	0	111.7
2140	I	26.5	Very low	26.3	Very low	151 Å²	151	146.2 Å²	146.2	77%	0.774	77%	0.765	S	S	*	*			trans	-114.3	154.4	-166.9	-65.9	163.3	0	0	0	110.9
2141	Y	30.4	Very low	26.5	Very low	205 Å²	205	147.5 Å²	147.5	80%	0.804	77%	0.771	S	S	*	*			trans	159.3	144.9	145.5	-87.3	-54.2	0	0	0	110.2
2142	E	28.2	Very low	26.5	Very low	143 Å²	143	148.4 Å²	148.4	67%	0.668	77%	0.772	S	S	*	*			cis	-160.4	148.6	-3.2	-169.7	155.4	-141.5	0	0	113.6
2143	N	26.8	Very low	26.6	Very low	146 Å²	146	152.3 Å²	152.3	78%	0.781	78%	0.78	S	S	*	*			trans	26.3	140.3	156.9	-58.1	-32.4	0	0	0	124.5
2144	G	28.8	Very low	26.9	Very low	80 Å²	80	153.4 Å²	153.4	83%	0.825	78%	0.782	S	S	*	*			trans	-164.5	23.5	177.5	0	0	0	0	0	120.8
2145	L	27.9	Very low	26.9	Very low	159 Å²	159	149.8 Å²	149.8	83%	0.832	77%	0.771	S	S	*	*			trans	38.4	101.5	157.6	-75	164	0	0	0	123.1
2146	K	26	Very low	27.1	Very low	159 Å²	159	150 Å²	150	69%	0.691	77%	0.773	S	S	*	*				59.4	130.1	115.7	-82.7	-170.7	145.4	-72.6	0	125
2147	D	25.8	Very low	27.3	Very low	103 Å²	103	148.5 Å²	148.5	55%	0.551	77%	0.771	S	S	*	*			trans	71.7	107.5	134.5	-54.1	-8.6	0	0	0	122.1
2148	Y	25.5	Very low	26.8	Very low	244 Å²	244	149.2 Å²	149.2	96%	0.957	77%	0.768	S	S	*	*				-146.3	151.7	129.6	-112.7	-81.7	0	0	0	109.4
2149	F	27.7	Very low	26.7	Very low	179 Å²	179	148.4 Å²	148.4	79%	0.785	76%	0.758	S	S	*	*			trans	-124.6	153.6	-159	-124.7	-92.7	0	0	0	114.6
2150	S	26	Very low	26.8	Very low	86 Å²	86	152.9 Å²	152.9	60%	0.601	76%	0.762	S	S	*	*			trans	49.7	114.2	156.6	56.3	0	0	0	0	119.9
2151	Q	26.7	Very low	26.7	Very low	176 Å²	176	155.4 Å²	155.4	82%	0.822	76%	0.763	S	S	*	*				-176.2	161.3	88	-78.3	-150	-85.2	0	0	110.6
2152	D	24.1	Very low	26.4	Very low	122 Å²	122	151.5 Å²	151.5	65%	0.652	77%	0.766	S	S	*	*			cis	-165.2	134.8	-40.2	-94.9	-18.5	0	0	0	109.1
2153	K	24.7	Very low	26.3	Very low	196 Å²	196	148 Å²	148	85%	0.852	77%	0.768	S	S	*	*			trans	-169.6	151.1	162.5	-121.9	172.2	-176.1	175.3	0	111.8
2154	F	28	Very low	26.3	Very low	192 Å²	192	148.7 Å²	148.7	84%	0.842	77%	0.77	S	S	*	*			trans	61.5	136.8	-166.2	-72.2	-88.4	0	0	0	114.5
2155	I	26.9	Very low	26	Very low	136 Å²	136	155 Å²	155	70%	0.697	77%	0.769	S	S	*	*			cis	173.5	127.3	-37.3	-98.1	162.2	0	0	0	103.9
2156	L	27.2	Very low	25.8	Very low	152 Å²	152	153.7 Å²	153.7	80%	0.796	76%	0.763	S	S	*	*			trans	62.7	111	174.3	-94.6	72.7	0	0	0	120.5
2157	N	26.2	Very low	25.9	Very low	147 Å²	147	151.9 Å²	151.9	79%	0.786	77%	0.766	S	S	*	*			trans	67	78.8	140.7	-65.2	18.5	0	0	0	121.1
2158	N	24.1	Very low	25.8	Very low	138 Å²	138	154.6 Å²	154.6	74%	0.738	78%	0.777	S	S	*	*				-52.7	141.6	127.8	-83.7	-50.7	0	0	0	110.8
2159	N	27.4	Very low	25.7	Very low	126 Å²	126	150.8 Å²	150.8	67%	0.674	77%	0.766	S	S	*	*				68.2	119.6	63.7	-66	-47.4	0	0	0	114.6
2160	I	27.6	Very low	25.7	Very low	171 Å²	171	148.7 Å²	148.7	88%	0.877	76%	0.758	S	S	*	*			trans	172	148.9	150	-94.4	152.2	0	0	0	109.6
2161	Y	24.9	Very low	25.7	Very low	204 Å²	204	150.7 Å²	150.7	80%	0.8	76%	0.762	S	S	*	*			cis	-168.9	158.2	-46.3	-137.7	-84.5	0	0	0	109.1
2162	S	23.7	Very low	25.7	Very low	122 Å²	122	147.8 Å²	147.8	85%	0.853	75%	0.752	S	S	*	*			trans	66.6	154	169	77.1	0	0	0	0	117.6
2163	G	27.1	Very low	25.8	Very low	70 Å²	70	147.9 Å²	147.9	72%	0.722	75%	0.753	S	S	*	*			cis	-142.6	174.6	-12.4	0	0	0	0	0	108.1
2164	I	25.5	Very low	25.8	Very low	161 Å²	161	145.1 Å²	145.1	83%	0.826	75%	0.747	S	S	*	*			cis	-163	159.5	37.6	-80.3	170.2	0	0	0	105.8
2165	W	23.4	Very low	25.8	Very low	212 Å²	212	144.3 Å²	144.3	80%	0.803	75%	0.746	S	S	*	*			cis	178.7	135.3	-25.2	-164.8	-2.7	0	0	0	106.5
2166	N	23.2	Very low	25.6	Very low	131 Å²	131	141.9 Å²	141.9	70%	0.701	74%	0.741	S	S	*	*			trans	35.3	129.4	159.8	-69.8	0.8	0	0	0	122.9
2167	T	27.4	Very low	25.7	Very low	122 Å²	122	144.7 Å²	144.7	75%	0.748	74%	0.743	S	S	*	*				162.4	150.2	113.3	40.3	0	0	0	0	109.3
2168	M	25.2	Very low	25.6	Very low	159 Å²	159	144.5 Å²	144.5	78%	0.783	74%	0.741	S	S	*	*			cis	-151.6	153.1	-13.7	-112.7	170.6	-171.8	0	0	107.1
2169	K	23	Very low	25.5	Very low	165 Å²	165	142.1 Å²	142.1	72%	0.717	74%	0.735	S	S	*	*				40.1	137.4	102.1	-76.5	-175.2	150	-143.5	0	115.2
2170	E	26.4	Very low	25.3	Very low	135 Å²	135	141.7 Å²	141.7	63%	0.631	74%	0.737	S	S	*	*			cis	-167.2	160.6	22.8	-119.1	157.7	-168.3	0	0	111.6
2171	N	26.6	Very low	25.1	Very low	127 Å²	127	141.3 Å²	141.3	68%	0.679	73%	0.732	S	S	*	*			trans	62.8	160	150.1	-67.6	24.1	0	0	0	119.7
2172	D	26.9	Very low	25	Very low	115 Å²	115	138.3 Å²	138.3	62%	0.615	73%	0.73	S	S	*	*			cis	-161.8	166.6	-13.6	-114.1	-31.4	0	0	0	111.1
2173	N	27.3	Very low	25.1	Very low	125 Å²	125	137.8 Å²	137.8	67%	0.668	73%	0.726	S	S	*	*			trans	25.4	144.2	143	-66.5	-57.5	0	0	0	121.2
2174	N	24	Very low	25.1	Very low	137 Å²	137	139.8 Å²	139.8	73%	0.733	73%	0.726	S	S	*	*			cis	167.2	-178.7	-4.4	-125.8	-52.6	0	0	0	105.8
2175	Q	28.1	Very low	25	Very low	176 Å²	176	139.9 Å²	139.9	82%	0.822	72%	0.723	S	S	*	*			trans	70.7	117.9	167.9	-67.1	174.3	6.6	0	0	117
2176	S	23.4	Very low	25	Very low	85 Å²	85	139.2 Å²	139.2	59%	0.594	72%	0.722	S	S	*	*				72.8	123.2	63.6	74.3	0	0	0	0	113.9
2177	Y	28.3	Very low	25.1	Very low	210 Å²	210	140.1 Å²	140.1	82%	0.824	73%	0.726	S	S	*	*				-162.4	175.9	67	-110.8	-91.9	0	0	0	115.7
2178	L	25.1	Very low	24.8	Very low	143 Å²	143	139 Å²	139	75%	0.749	72%	0.723	S	S	*	*			trans	-40.1	157.3	178.6	-81.3	149	0	0	0	121.6
2179	S	21.8	Very low	24.7	Very low	88 Å²	88	135.9 Å²	135.9	62%	0.615	72%	0.717	S	S	*	*			trans	-17.9	152	152	58.7	0	0	0	0	118.6
2180	T	23.3	Very low	24.9	Very low	117 Å²	117	134.4 Å²	134.4	72%	0.718	72%	0.717	S	S	*	*				-166.7	153.4	60.2	44.4	0	0	0	0	115.3
2181	E	21.7	Very low	25	Very low	164 Å²	164	135.6 Å²	135.6	77%	0.766	72%	0.722	S	S	*	*			trans	62.1	148.3	143.1	-72.3	-172.6	-178	0	0	124.3
2182	N	23.3	Very low	24.8	Very low	141 Å²	141	137 Å²	137	75%	0.754	73%	0.729	S	S	*	*			trans	75.6	111.9	155.1	-58.4	-38	0	0	0	121.3
2183	S	25.7	Very low	24.7	Very low	111 Å²	111	138.6 Å²	138.6	78%	0.776	74%	0.742	S	S	*	*			trans	-65.5	156	150.8	55.2	0	0	0	0	111.6
2184	P	28.2	Very low	24.8	Very low	112 Å²	112	136.3 Å²	136.3	73%	0.727	75%	0.748	S	S	*	*				-152.9	149.4	94	39.9	-22.3	0	0	0	118
2185	E	22.4	Very low	24.9	Very low	163 Å²	163	139.5 Å²	139.5	76%	0.762	76%	0.759	S	S	*	*			trans	50.7	127	131.2	-65	-167	147.8	0	0	126.1
2186	Y	24.6	Very low	24.9	Very low	198 Å²	198	134 Å²	134	78%	0.776	75%	0.749	S	S	*	*			trans	85.7	137.6	130.1	-86.7	-57.8	0	0	0	125
2187	L	23.7	Very low	25	Very low	149 Å²	149	139.5 Å²	139.5	78%	0.78	76%	0.763	S	S	*	*			trans	83.9	108.2	152.9	-68	160.3	0	0	0	121.1
2188	S	22.7	Very low	24.9	Very low	99 Å²	99	136 Å²	136	69%	0.692	76%	0.757	S	S	*	*				11.7	149.1	126.4	64.2	0	0	0	0	120.1
2189	S	22.6	Very low	24.8	Very low	93 Å²	93	136.6 Å²	136.6	65%	0.65	76%	0.757	S	S	*	*			cis	-159.9	-179.1	32	43.3	0	0	0	0	114.7
2190	D	27	Very low	25	Very low	134 Å²	134	138.1 Å²	138.1	72%	0.717	77%	0.767	S	S	*	*			trans	102	125.2	144.9	-61.9	-48.9	0	0	0	123.6
2191	H	27.5	Very low	25.1	Very low	161 Å²	161	139.8 Å²	139.8	75%	0.745	77%	0.771	S	S	*	*			trans	54.8	98.2	143.6	-78.3	-82.9	0	0	0	123.2
2192	L	23.5	Very low	25.2	Very low	156 Å²	156	140.1 Å²	140.1	82%	0.817	77%	0.773	S	S	*	*				20.7	140.9	117.9	-76.2	166.4	0	0	0	121.1
2193	V	25.3	Very low	25.1	Very low	149 Å²	149	142.2 Å²	142.2	90%	0.903	78%	0.776	S	S	*	*			trans	82.9	111.9	166.9	-167.5	0	0	0	0	116.2
2194	G	28	Very low	24.9	Very low	77 Å²	77	141.8 Å²	141.8	79%	0.794	77%	0.771	S	S	*	*			trans	172.4	85.1	172.8	0	0	0	0	0	113.5
2195	Q	27.8	Very low	24.6	Very low	203 Å²	203	143.1 Å²	143.1	95%	0.949	77%	0.772	S	S	*	*			trans	-62.7	150.6	-173.1	-59.9	162.9	-52.5	0	0	115.2
2196	G	27.4	Very low	24.7	Very low	60 Å²	60	144.8 Å²	144.8	62%	0.619	77%	0.773	S	S	*	*			trans	144	103.5	138.4	0	0	0	0	0	118.4
2197	F	25.1	Very low	24.5	Very low	202 Å²	202	142.2 Å²	142.2	89%	0.886	77%	0.768	S	S	*	*			trans	68.3	139	161.2	-63.7	-75.5	0	0	0	116.7
2198	L	25.9	Very low	24.4	Very low	135 Å²	135	141.8 Å²	141.8	71%	0.707	77%	0.765	S	S	*	*			cis	-145.5	158.8	10.8	-110.6	155.3	0	0	0	112.3
2199	Q	24.1	Very low	24.4	Very low	157 Å²	157	143.7 Å²	143.7	73%	0.734	77%	0.767	S	S	*	*			trans	59.6	114.3	153.8	-78.6	161.3	-53.1	0	0	122.1
2200	S	25.8	Very low	24.3	Very low	119 Å²	119	146.2 Å²	146.2	83%	0.832	77%	0.766	S	S	*	*			trans	-168.3	132.9	131	18.3	0	0	0	0	109.9
2201	D	25	Very low	24.1	Very low	152 Å²	152	146.6 Å²	146.6	81%	0.813	77%	0.767	S	S	*	*			trans	-102.9	-178.3	-173.8	-70.1	-64.2	0	0	0	113.3
2202	H	23.5	Very low	23.9	Very low	172 Å²	172	144.5 Å²	144.5	80%	0.796	77%	0.766	S	S	*	*			trans	-144.1	155.6	-173.3	-110	39.8	0	0	0	114.1
2203	F	21.6	Very low	24	Very low	185 Å²	185	142.8 Å²	142.8	81%	0.811	76%	0.762	S	S	*	*			trans	89.8	131.2	164.7	-74.8	-72.9	0	0	0	122.4
2204	C	21	Very low	23.7	Very low	102 Å²	102	143.3 Å²	143.3	69%	0.689	75%	0.754	S	S	*	*			trans	74.4	97.7	150.7	-62.5	0	0	0	0	121.7
2205	D	21.1	Very low	23.4	Very low	139 Å²	139	144.6 Å²	144.6	74%	0.743	74%	0.743	S	S	*	*				37.5	123.6	126.6	-48.3	-15	0	0	0	121.4
2206	Y	24.4	Very low	23.1	Very low	199 Å²	199	138.8 Å²	138.8	78%	0.78	73%	0.73	S	S	*	*				-173	130.3	97.5	-118.5	-106.3	0	0	0	114.5
2207	H	21.8	Very low	22.9	Very low	144 Å²	144	141.7 Å²	141.7	67%	0.667	73%	0.725	S	S	*	*			trans	63.1	130.4	144.7	-89.6	-130.4	0	0	0	125.1
2208	I	21.6	Very low	22.7	Very low	139 Å²	139	136.2 Å²	136.2	71%	0.713	71%	0.705	S	S	*	*			trans	94.8	118.7	134.7	-73	170	0	0	0	121.7
2209	N	21.9	Very low	22.6	Very low	139 Å²	139	134.2 Å²	134.2	74%	0.743	70%	0.699	S	S	*	*			trans	73.6	99.2	150	-77.9	-11.9	0	0	0	124.4
2210	K	21.6	Very low	22.6	Very low	146 Å²	146	132.1 Å²	132.1	64%	0.635	70%	0.697	S	S	*	*				87.9	147.5	109.1	-153.1	-171.9	-179.6	-177.9	0	119.1
2211	I	22.1	Very low	22.5	Very low	142 Å²	142	133.5 Å²	133.5	73%	0.728	69%	0.694	S	S	*	*			trans	72.4	134.4	173.7	-28.5	179.8	0	0	0	111.2
2212	T	23.6	Very low	22.8	Very low	118 Å²	118	130.8 Å²	130.8	72%	0.724	69%	0.685	S	S	*	*			cis	-156.9	166.4	24.3	-21.5	0	0	0	0	111.3
2213	V	24.5	Very low	22.8	Very low	120 Å²	120	129.7 Å²	129.7	73%	0.727	68%	0.683	S	S	*	*			trans	51.6	109.3	159.7	-178.4	0	0	0	0	117
2214	E	20	Very low	22.9	Very low	159 Å²	159	127.6 Å²	127.6	74%	0.743	68%	0.679	S	S	*	*				82.6	139.7	57.9	-168.6	-179.2	-102.9	0	0	114.8
2215	N	21.5	Very low	22.9	Very low	105 Å²	105	132.4 Å²	132.4	56%	0.561	68%	0.684	S	S	*	*			trans	3.9	141.3	167.2	-57.3	-50.5	0	0	0	119.5	Q549	Q549-N2215 PolarHBondContact NE2-OD1 2.93Å
2216	A	22.2	Very low	23	Very low	81 Å²	81	129.7 Å²	129.7	67%	0.669	68%	0.676	S	S	*	*			cis	-172.3	149.5	46	0	0	0	0	0	115.4
2217	F	21.9	Very low	22.9	Very low	121 Å²	121	126.2 Å²	126.2	53%	0.531	67%	0.67	S	S	.	*			trans	57.5	108.6	137.3	-84.7	-101.2	0	0	0	123.7
2218	N	21.5	Very low	23.1	Very low	87 Å²	87	126.5 Å²	126.5	47%	0.465	68%	0.675	S	S	.	*				77.1	123.5	113.3	-96.8	49.3	0	0	0	124.3
2219	T	24.3	Very low	23.3	Very low	93 Å²	93	126.6 Å²	126.6	57%	0.571	67%	0.673	S	S	*	*				50.8	139.5	126.1	61.2	0	0	0	0	121
2220	T	23.7	Very low	23.4	Very low	112 Å²	112	124.3 Å²	124.3	69%	0.687	67%	0.666	S	S	*	*			cis	-154.8	140.8	15.6	15.5	0	0	0	0	108.2
2221	L	24.1	Very low	23.7	Very low	149 Å²	149	125 Å²	125	78%	0.78	68%	0.677	S	S	*	*				54.4	151.1	84.7	-87	86.9	0	0	0	115.8
2222	P	31.3	Very low	23.8	Very low	94 Å²	94	125.6 Å²	125.6	61%	0.61	68%	0.681	S	S	*	*			cis	-148	-159.5	-29.9	40	-19.5	0	0	0	113.6
2223	I	23.9	Very low	23.9	Very low	149 Å²	149	125.7 Å²	125.7	76%	0.764	68%	0.678	S	S	*	*			trans	72.7	140.8	149	-80.1	177.7	0	0	0	115.7
2224	I	23.1	Very low	24	Very low	141 Å²	141	129.2 Å²	129.2	72%	0.723	68%	0.678	S	S	*	*			cis	-164.3	160.7	2.6	-114.3	-174.7	0	0	0	106.7
2225	Y	21.8	Very low	24.3	Very low	204 Å²	204	129.7 Å²	129.7	80%	0.8	68%	0.678	S	S	*	*			cis	-171.8	-161.1	-15.2	-152.9	-138.1	0	0	0	109.9
2226	S	21.8	Very low	24.6	Very low	82 Å²	82	131.6 Å²	131.6	57%	0.573	69%	0.688	S	S	*	*			trans	0.7	147.7	148.7	62.5	0	0	0	0	120.7
2227	L	22.5	Very low	24.8	Very low	125 Å²	125	132.7 Å²	132.7	65%	0.654	69%	0.691	S	S	*	*			cis	-169.4	162.6	22.5	-126.3	159.3	0	0	0	110.6	Q2229	L2227-Q2229 HydrophobicContact CD2-CG 3.81Å
2228	I	27	Very low	25	Very low	151 Å²	151	131.2 Å²	131.2	77%	0.774	70%	0.695	S	S	*	*			trans	169.9	112.5	134.2	-88.3	156.3	0	0	0	105.8
2229	Q	24.2	Very low	25.3	Very low	141 Å²	141	133.6 Å²	133.6	66%	0.659	71%	0.713	S	S	*	*				63.6	145.1	67.5	-77.4	174.8	-54.5	0	0	113.7	L2227	L2227-Q2229 HydrophobicContact CD2-CG 3.81Å
2230	C	23.9	Very low	25.4	Very low	90 Å²	90	133.1 Å²	133.1	61%	0.608	72%	0.718	S	S	*	*			cis	-150.1	165.6	9.2	-127.9	0	0	0	0	110.6
2231	N	28	Very low	25.4	Very low	160 Å²	160	135 Å²	135	86%	0.856	72%	0.724	S	S	*	*				176.2	115.2	122.3	-89.3	-10.1	0	0	0	112.6
2232	D	25	Very low	25.4	Very low	155 Å²	155	134.9 Å²	134.9	83%	0.829	72%	0.719	S	S	*	*			trans	-89.8	159.6	156.9	-75.9	-67	0	0	0	110.8
2233	D	25.3	Very low	24.9	Very low	121 Å²	121	135 Å²	135	65%	0.647	72%	0.722	S	S	*	*				145.8	152.3	115.7	-161	16.6	0	0	0	114.3
2234	R	26.8	Very low	24.8	Very low	194 Å²	194	133 Å²	133	73%	0.732	72%	0.722	S	S	*	*			trans	80.6	90.7	158.9	-77.3	157.2	-159.2	-133.4	0.1	123.7
2235	K	26.8	Very low	24.7	Very low	169 Å²	169	131.1 Å²	131.1	74%	0.735	72%	0.72	S	S	*	*				79	135.6	101.4	-83.2	-174.2	-177.9	178.9	0	123.6
2236	N	26.8	Very low	24.7	Very low	144 Å²	144	128.4 Å²	128.4	77%	0.77	72%	0.718	S	S	*	*			trans	73.8	141.2	151.4	-59.6	0.1	0	0	0	117.9
2237	S	26.2	Very low	24.6	Very low	105 Å²	105	131.8 Å²	131.8	73%	0.734	73%	0.73	S	S	*	*			cis	-169.6	-175.9	-17.5	65	0	0	0	0	107.7
2238	S	27.5	Very low	24.6	Very low	89 Å²	89	135.2 Å²	135.2	62%	0.622	74%	0.74	S	S	*	*			cis	-170.9	162.4	2.8	18.1	0	0	0	0	109.8
2239	T	26.9	Very low	24.6	Very low	137 Å²	137	132.9 Å²	132.9	84%	0.84	74%	0.735	S	S	*	*			trans	64.1	148.5	154.9	46.8	0	0	0	0	119.7
2240	A	27.5	Very low	24.5	Very low	83 Å²	83	131.3 Å²	131.3	69%	0.686	74%	0.735	S	S	*	*			cis	-162.6	128.9	-7.4	0	0	0	0	0	107.7
2241	L	23.4	Very low	24.4	Very low	152 Å²	152	133.7 Å²	133.7	80%	0.796	74%	0.742	S	S	*	*				87.3	125.9	76.6	-90.7	167.8	0	0	0	117.3
2242	Q	23.3	Very low	24.1	Very low	147 Å²	147	131 Å²	131	69%	0.687	73%	0.731	S	S	*	*			trans	82.3	103.2	143	-92.4	171.1	-3.2	0	0	124.6
2243	S	21.7	Very low	24.1	Very low	96 Å²	96	130.4 Å²	130.4	67%	0.671	73%	0.728	S	S	*	*				69.7	113.9	118.1	66.3	0	0	0	0	124
2244	S	21.8	Very low	24.1	Very low	108 Å²	108	132.4 Å²	132.4	76%	0.755	73%	0.734	S	S	*	*				92.7	152.4	125.2	79	0	0	0	0	121.7
2245	S	20.5	Very low	23.9	Very low	100 Å²	100	129.4 Å²	129.4	70%	0.699	73%	0.731	S	S	*	*			trans	82.2	112.9	167.3	74.5	0	0	0	0	120
2246	I	20.8	Very low	23.6	Very low	148 Å²	148	127.7 Å²	127.7	76%	0.759	73%	0.73	S	S	*	*				75.8	140.2	124.4	-66.4	172.4	0	0	0	119.7
2247	N	21	Very low	23.5	Very low	153 Å²	153	131.2 Å²	131.2	82%	0.818	73%	0.733	S	S	*	*			trans	74.8	109	165.3	-71.3	-5.7	0	0	0	121.2
2248	F	22.6	Very low	23.6	Very low	196 Å²	196	132.6 Å²	132.6	86%	0.86	73%	0.73	S	S	*	*				-60.6	161.7	128.9	-71.9	-85.6	0	0	0	109.5
2249	P	27	Very low	23.5	Very low	103 Å²	103	135.1 Å²	135.1	67%	0.669	74%	0.737	S	S	*	*			cis	-150.5	-179.8	33.9	40	-17.1	0	0	0	118.8
2250	T	21.2	Very low	23.3	Very low	108 Å²	108	134.4 Å²	134.4	66%	0.663	73%	0.733	S	S	*	*			trans	49.1	128.9	144.2	51.9	0	0	0	0	123.5
2251	N	22	Very low	23.5	Very low	139 Å²	139	135.6 Å²	135.6	74%	0.743	73%	0.733	S	S	*	*			trans	70.7	152.1	131.4	-63	22.9	0	0	0	118.4
2252	T	22.8	Very low	23.5	Very low	103 Å²	103	135.6 Å²	135.6	63%	0.632	73%	0.733	S	S	*	*			cis	-160.3	153.6	-3	7.6	0	0	0	0	109.4
2253	D	23.4	Very low	23.6	Very low	144 Å²	144	134.2 Å²	134.2	77%	0.77	73%	0.729	S	S	*	*			trans	61.2	162.6	153.9	-47.3	-29.7	0	0	0	118.1
2254	E	25.3	Very low	23.8	Very low	163 Å²	163	136.5 Å²	136.5	76%	0.762	74%	0.739	S	S	*	*			cis	-151.7	159.6	3.9	-148.9	-173.2	-158.4	0	0	112
2255	L	22.7	Very low	23.9	Very low	130 Å²	130	138.3 Å²	138.3	68%	0.681	74%	0.736	S	S	*	*			trans	57.9	117.3	146.7	-119	63.4	0	0	0	124.5
2256	D	21.8	Very low	24.3	Very low	134 Å²	134	141.1 Å²	141.1	72%	0.717	74%	0.741	S	S	*	*			trans	30.3	133.7	134.2	-52.6	-7.6	0	0	0	123
2257	R	24.9	Very low	24.5	Very low	218 Å²	218	143.6 Å²	143.6	82%	0.823	75%	0.747	S	S	*	*				176.2	148.5	93.1	-98.8	-172.7	165	-178.2	-5.6	115.3
2258	I	28.1	Very low	24.5	Very low	133 Å²	133	144.5 Å²	144.5	68%	0.682	75%	0.751	S	S	*	*			trans	68	126.7	145.7	-70.7	168.7	0	0	0	116.1
2259	D	25.1	Very low	24.6	Very low	143 Å²	143	140.8 Å²	140.8	77%	0.765	74%	0.74	S	S	*	*			cis	-150.2	169.7	7.3	-120.7	-11.8	0	0	0	114.1
2260	T	23.1	Very low	24.6	Very low	122 Å²	122	140.2 Å²	140.2	75%	0.748	74%	0.744	S	S	*	*			trans	-116.1	-176.1	179.7	52.8	0	0	0	0	110.8
2261	P	31.7	Very low	24.8	Very low	107 Å²	107	143.3 Å²	143.3	70%	0.695	76%	0.755	S	S	*	*				-128.3	-130.5	-53	35.9	-16.3	0	0	0	109.5
2262	L	23.7	Very low	24.7	Very low	152 Å²	152	147.5 Å²	147.5	80%	0.796	76%	0.761	S	S	*	*			trans	71.9	148.8	166	-106.6	73	0	0	0	115.9
2263	I	23.8	Very low	24.8	Very low	119 Å²	119	148.4 Å²	148.4	61%	0.61	77%	0.767	S	S	*	*			cis	-127.2	140.9	-2	-72.7	176.1	0	0	0	110.5	Q2265	I2263-Q2265 VanDerWaalsContact C-N 3.28Å; I2263-Q2265 PolarHBondContact O-N 3.36Å
2264	T	25.9	Very low	24.8	Very low	143 Å²	143	145.7 Å²	145.7	88%	0.877	76%	0.764	S	S	*	*			trans	-5.9	53	137.9	-29.7	0	0	0	0	120.3
2265	Q	25.3	Very low	24.7	Very low	147 Å²	147	145.7 Å²	145.7	69%	0.687	76%	0.764	S	S	*	*			trans	-150.8	96.1	177.3	-132.6	175.8	10.6	0	0	113.3	I2263	I2263-Q2265 VanDerWaalsContact C-N 3.28Å; I2263-Q2265 PolarHBondContact O-N 3.36Å
2266	I	28.1	Very low	24.7	Very low	158 Å²	158	148.8 Å²	148.8	81%	0.81	77%	0.766	S	S	*	*	S	Bend	trans	-178.3	-28.9	151.6	-103.9	158.8	0	0	0	112.7
2267	F	25.2	Very low	24.8	Very low	200 Å²	200	148.9 Å²	148.9	88%	0.877	76%	0.762	S	S	*	*	S	Bend	trans	-110.2	10	-176.2	-117.6	-84.3	0	0	0	116.3
2268	L	21.5	Very low	24.9	Very low	172 Å²	172	146.5 Å²	146.5	90%	0.901	76%	0.764	S	S	*	*	S	Bend	trans	-147.3	44.5	172.1	-105.2	-178	0	0	0	112.7
2269	D	24.6	Very low	24.7	Very low	119 Å²	119	144.5 Å²	144.5	64%	0.636	76%	0.758	S	S	*	*			trans	-146.2	37	164.7	-143	7.7	0	0	0	113.7
2270	A	26.6	Very low	24.8	Very low	91 Å²	91	144.4 Å²	144.4	75%	0.752	76%	0.758	S	S	*	*	S	Bend	trans	-117.4	109.3	163.7	0	0	0	0	0	108.1
2271	L	25.5	Very low	24.9	Very low	172 Å²	172	146.6 Å²	146.6	90%	0.901	76%	0.759	S	S	*	*			trans	72.2	64.2	179.5	-57.8	174.8	0	0	0	117.2
2272	R	20.5	Very low	24.8	Very low	228 Å²	228	148 Å²	148	86%	0.86	76%	0.76	S	S	*	*			trans	-110.8	45.1	156.4	-158	-154.9	-174.6	164.2	4.7	114.2
2273	T	24.8	Very low	24.9	Very low	122 Å²	122	147.8 Å²	147.8	75%	0.748	76%	0.759	S	S	*	*			trans	-165.2	119.9	157.5	28.2	0	0	0	0	106.9
2274	A	22.2	Very low	25.4	Very low	87 Å²	87	146.7 Å²	146.7	72%	0.719	76%	0.76	S	S	*	*			cis	87	132.3	27.5	0	0	0	0	0	115.7
2275	H	23.1	Very low	25.3	Very low	163 Å²	163	143.9 Å²	143.9	76%	0.755	75%	0.746	S	S	*	*			trans	70.5	114.1	164.4	-79	-57.7	0	0	0	122
2276	R	22.9	Very low	25.4	Very low	194 Å²	194	146.3 Å²	146.3	73%	0.732	75%	0.75	S	S	*	*				90.7	125.6	120.7	-83.6	172.9	164.6	-166.1	0.5	120.8
2277	Q	23.9	Very low	25.3	Very low	136 Å²	136	146.4 Å²	146.4	64%	0.636	75%	0.747	S	S	*	*				63.8	124.6	126.7	-69.4	173.6	-69.8	0	0	120.6	V2279	Q2277-V2279 HydrophobicContact CB-CG2 4.09Å
2278	I	27.2	Very low	25.4	Very low	168 Å²	168	145.8 Å²	145.8	86%	0.862	74%	0.74	S	S	*	*			trans	-132.1	112.1	134.9	-64.2	-178.6	0	0	0	103.3
2279	V	24.4	Very low	25.6	Very low	91 Å²	91	142.2 Å²	142.2	55%	0.552	73%	0.726	S	S	*	*				70	121.8	51.6	-177.4	0	0	0	0	108.8	Q2277	Q2277-V2279 HydrophobicContact CB-CG2 4.09Å
2280	D	26.2	Very low	25.8	Very low	142 Å²	142	143.2 Å²	143.2	76%	0.759	73%	0.731	S	S	*	*			cis	-126.1	-177.1	35.1	-92.2	-63	0	0	0	112.8
2281	E	26.7	Very low	25.9	Very low	167 Å²	167	143.4 Å²	143.4	78%	0.78	73%	0.727	S	S	*	*			cis	-153.9	163.3	19.2	-149.6	173.5	-157.4	0	0	113.5
2282	I	28.7	Very low	25.9	Very low	137 Å²	137	142.7 Å²	142.7	70%	0.703	72%	0.722	S	S	*	*			trans	70.8	86.2	163.6	-41	-174.5	0	0	0	120.1
2283	N	24.9	Very low	26.2	Very low	147 Å²	147	137.7 Å²	137.7	79%	0.786	72%	0.717	S	S	*	*				42.3	158.1	105.8	-79.2	-22	0	0	0	123.4
2284	P	34.2	Very low	26.2	Very low	96 Å²	96	138.4 Å²	138.4	62%	0.623	72%	0.716	S	S	*	*			cis	-150.1	159.3	-27.4	40.6	-21.2	0	0	0	119
2285	S	24.7	Very low	26.4	Very low	84 Å²	84	138.7 Å²	138.7	59%	0.587	71%	0.713	S	S	*	*				80.3	154.7	127.8	67.2	0	0	0	0	127.1
2286	Y	28.1	Very low	26.5	Very low	199 Å²	199	135.6 Å²	135.6	78%	0.78	71%	0.71	S	S	*	*			trans	81.4	119	164.1	-57.5	-71	0	0	0	119.5
2287	H	25.1	Very low	26.6	Very low	160 Å²	160	131.4 Å²	131.4	74%	0.741	71%	0.71	S	S	*	*			cis	100	153.1	19.4	-83.4	-82.6	0	0	0	118.2
2288	Y	28.7	Very low	26.6	Very low	186 Å²	186	132.9 Å²	132.9	73%	0.729	72%	0.717	S	S	*	*			trans	78.8	103.5	176.2	-67.3	-82.7	0	0	0	115.7
2289	T	24.2	Very low	26.5	Very low	97 Å²	97	131.1 Å²	131.1	60%	0.595	71%	0.709	S	S	*	*			cis	93.7	159.4	25.8	82.2	0	0	0	0	116.5
2290	N	29.4	Very low	26.5	Very low	140 Å²	140	133.2 Å²	133.2	75%	0.749	72%	0.722	S	S	*	*			trans	87.7	143.3	169.4	-53.3	-5.3	0	0	0	115.4
2291	S	27.8	Very low	26.6	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	72%	0.724	S	S	*	*			cis	-167.8	130.2	-12	39.3	0	0	0	0	107.9
2292	I	25.7	Very low	26.7	Very low	158 Å²	158	129.7 Å²	129.7	81%	0.81	72%	0.719	S	S	*	*				56.7	125.3	87.2	-65.2	169.5	0	0	0	112.6
2293	V	26.8	Very low	26.5	Very low	123 Å²	123	128.9 Å²	128.9	75%	0.745	72%	0.717	S	S	*	*			cis	-171.1	-178.3	-13.5	86	0	0	0	0	109.7
2294	N	26.2	Very low	26.5	Very low	137 Å²	137	129.9 Å²	129.9	73%	0.733	71%	0.71	S	S	*	*			trans	113.7	131.4	145.5	-106.9	-8.3	0	0	0	122.7
2295	S	25.4	Very low	26.2	Very low	92 Å²	92	134 Å²	134	64%	0.643	72%	0.715	S	S	*	*			trans	61.7	113.1	141.9	63.3	0	0	0	0	124
2296	S	25	Very low	26.3	Very low	99 Å²	99	135.9 Å²	135.9	69%	0.692	72%	0.723	S	S	*	*				70.1	112.5	126.5	66.6	0	0	0	0	123
2297	S	25.8	Very low	26.3	Very low	105 Å²	105	131.6 Å²	131.6	73%	0.734	71%	0.714	S	S	*	*				68.3	131.3	128.4	63.4	0	0	0	0	123
2298	E	24.3	Very low	26.6	Very low	168 Å²	168	129.3 Å²	129.3	79%	0.785	71%	0.707	S	S	*	*			trans	80.3	111.3	149.5	-74.6	-165.9	-160.8	0	0	122.2
2299	N	23.8	Very low	26.8	Very low	130 Å²	130	124.4 Å²	124.4	70%	0.695	69%	0.693	S	S	*	*				80	160	129.2	-66.3	-34.9	0	0	0	121.4
2300	T	26	Very low	27.2	Very low	135 Å²	135	123.8 Å²	123.8	83%	0.828	69%	0.686	S	S	*	*			trans	65.6	97	172.5	43.6	0	0	0	0	118.9
2301	T	28.3	Very low	27.3	Very low	129 Å²	129	120.8 Å²	120.8	79%	0.791	67%	0.67	S	S	*	*			trans	-36.6	154.8	130.3	37.7	0	0	0	0	112.6
2302	P	28.7	Very low	27.4	Very low	106 Å²	106	122.1 Å²	122.1	69%	0.688	67%	0.67	S	S	*	*				-156	174.9	52.5	45.7	-24.8	0	0	0	120.2
2303	D	23.9	Very low	27.5	Very low	121 Å²	121	120.4 Å²	120.4	65%	0.647	67%	0.667	S	S	*	*			trans	70	124.1	134.3	-74.6	7.2	0	0	0	125.9
2304	Y	24.9	Very low	27.4	Very low	167 Å²	167	121.1 Å²	121.1	66%	0.655	66%	0.664	S	S	*	*				100.3	124.3	126.2	-81.1	-45.2	0	0	0	124.3
2305	Y	27.1	Very low	27.4	Very low	184 Å²	184	124.2 Å²	124.2	72%	0.722	67%	0.665	S	S	*	*			trans	65.5	152.9	147.1	-63.2	-47.1	0	0	0	118.2
2306	T	28.2	Very low	27.3	Very low	123 Å²	123	126.4 Å²	126.4	76%	0.755	67%	0.668	S	S	*	*			cis	-167.3	161.4	2.3	19.5	0	0	0	0	107.8
2307	N	27.9	Very low	27.3	Very low	109 Å²	109	129.4 Å²	129.4	58%	0.583	68%	0.677	S	S	*	*			cis	-175	-159.5	-24.6	-159.9	71.1	0	0	0	108.7
2308	D	31.4	Very low	27.3	Very low	111 Å²	111	130 Å²	130	59%	0.594	68%	0.68	S	S	*	*			trans	90.6	111.5	149.3	-54.9	-14.6	0	0	0	122.6	N2027	N2027-D2308 PolarHBondContact ND2-O 3.26Å
2309	D	32.6	Very low	27.5	Very low	84 Å²	84	129.4 Å²	129.4	45%	0.449	68%	0.681	S	S	.	*				70.6	138.9	110.2	-59.1	6.9	0	0	0	122.1	N2027 S2028	N2027-D2309 PolarHBondContact ND2-O 3.1Å; S2028-D2309 WeakPolarHBondContact OG-CA 3.35Å
2310	D	32.6	Very low	27.8	Very low	83 Å²	83	128.6 Å²	128.6	44%	0.444	68%	0.684	S	S	.	*			cis	-168	142.6	-4.3	-133.1	16.2	0	0	0	117.7	S2026 N2027 S2028	S2026-D2310 CarbonylContact O-C 3.52Å; S2026-D2310 PolarHBondContact O-N 3.46Å; N2027-D2310 VanDerWaalsContact N-C 3.28Å; S2028-D2310 WeakPolarHBondContact OG-CA 3.19Å; S2028-D2310 PolarHBondContact OG-OD1 3.28Å
2311	N	31.8	Very low	27.8	Very low	78 Å²	78	129.9 Å²	129.9	42%	0.417	68%	0.68	S	S	.	*				69.5	122.5	129.2	-90.6	-37.5	0	0	0	128.5	N2027	N2027-N2311 PolarHBondContact O-N 3.25Å
2312	N	29.4	Very low	27.8	Very low	122 Å²	122	130.1 Å²	130.1	65%	0.652	68%	0.676	S	S	*	*				70.2	123.8	119.5	-83.4	-21.4	0	0	0	128.3
2313	T	27.9	Very low	27.7	Very low	122 Å²	122	130.5 Å²	130.5	75%	0.748	68%	0.682	S	S	*	*			trans	62.1	168.1	132.5	72.5	0	0	0	0	120
2314	M	24.7	Very low	27.8	Very low	139 Å²	139	130.2 Å²	130.2	69%	0.685	69%	0.687	S	S	*	*			cis	-164.7	166.1	22.6	-149.9	-160.2	-161.6	0	0	112.3
2315	R	25.5	Very low	27.7	Very low	202 Å²	202	132.8 Å²	132.8	76%	0.762	70%	0.696	S	S	*	*			trans	69.6	134.2	163.3	-69.3	176.6	-178.9	164.1	3.4	116.9
2316	I	23.6	Very low	27.5	Very low	138 Å²	138	130.7 Å²	130.7	71%	0.708	70%	0.703	S	S	*	*			cis	73.5	99.8	41.6	-54	161.3	0	0	0	112.6
2317	D	25.7	Very low	27.3	Very low	162 Å²	162	129 Å²	129	87%	0.866	70%	0.696	S	S	*	*				-154.4	167.1	123.5	-110.8	-33.2	0	0	0	110.1
2318	C	24.3	Very low	26.9	Very low	118 Å²	118	132.9 Å²	132.9	80%	0.797	71%	0.708	S	S	*	*			trans	-107.9	164.6	-164.6	-62.9	0	0	0	0	115.6
2319	N	29.5	Very low	26.5	Very low	154 Å²	154	132.4 Å²	132.4	82%	0.824	71%	0.712	S	S	*	*			trans	-36	156.2	156.7	-57	-25.1	0	0	0	113.2
2320	P	30.5	Very low	26.1	Very low	114 Å²	114	136.9 Å²	136.9	74%	0.74	73%	0.731	S	S	*	*			cis	-152.3	176.4	34.1	43	-21.9	0	0	0	119.5
2321	H	25.5	Very low	25.6	Very low	162 Å²	162	139.4 Å²	139.4	75%	0.75	74%	0.743	S	S	*	*			trans	24.2	124.4	146.7	-76	-87.8	0	0	0	123.9
2322	D	27.8	Very low	25.1	Very low	133 Å²	133	140 Å²	140	71%	0.711	75%	0.754	S	S	*	*				73.6	122.6	123.7	-60.3	-16.6	0	0	0	125.5
2323	S	26.2	Very low	24.7	Very low	115 Å²	115	145 Å²	145	80%	0.804	76%	0.763	S	S	*	*				108.6	138.3	125.7	78.3	0	0	0	0	121.6
2324	C	26	Very low	24.5	Very low	114 Å²	114	146.3 Å²	146.3	77%	0.77	76%	0.764	S	S	*	*			trans	-127.6	118.7	145.7	-92.1	0	0	0	0	106.4
2325	R	24.4	Very low	24.4	Very low	221 Å²	221	145 Å²	145	83%	0.834	76%	0.764	S	S	*	*				64.8	125.8	96.6	-77.6	-179.8	153.6	-167.6	-6.4	113.1
2326	T	22	Very low	24.2	Very low	140 Å²	140	143.2 Å²	143.2	86%	0.859	76%	0.764	S	S	*	*	S	Bend	cis	-59.7	151.4	5	43.1	0	0	0	0	115.2
2327	S	23.2	Very low	24.1	Very low	89 Å²	89	140.3 Å²	140.3	62%	0.622	76%	0.756	S	S	*	*			cis	-158.2	158.1	1.2	44.1	0	0	0	0	111.1
2328	F	21	Very low	23.8	Very low	190 Å²	190	141.4 Å²	141.4	83%	0.833	75%	0.748	S	S	*	*			trans	27	147.8	142.3	-73.4	-107.8	0	0	0	121.1
2329	C	22.7	Very low	23.7	Very low	101 Å²	101	145.5 Å²	145.5	68%	0.682	75%	0.747	S	S	*	*			cis	175.2	171.8	-15.8	-108.6	0	0	0	0	107.2
2330	E	23.1	Very low	23.4	Very low	178 Å²	178	145.4 Å²	145.4	83%	0.832	75%	0.745	S	S	*	*			trans	70.5	160.4	160.9	-69.8	-157.4	156.7	0	0	121.7
2331	L	23.6	Very low	22.9	Very low	135 Å²	135	144 Å²	144	71%	0.707	74%	0.738	S	S	*	*			trans	2.4	126.7	168.4	-77.3	70.9	0	0	0	118.1
2332	S	20.7	Very low	22.7	Very low	91 Å²	91	142.3 Å²	142.3	64%	0.636	74%	0.739	S	S	*	*			cis	64.1	112.5	28	121.8	0	0	0	0	115.4
2333	R	20.6	Very low	22.5	Very low	228 Å²	228	143 Å²	143	86%	0.86	74%	0.742	S	S	*	*			trans	63.4	120.7	163.5	-51.7	173.7	168.8	173.3	-2.9	118.2
2334	I	23.3	Very low	22.2	Very low	148 Å²	148	143.1 Å²	143.1	76%	0.759	73%	0.734	S	S	*	*				169.2	146.1	110.5	-89.8	159.2	0	0	0	110.6
2335	T	23.3	Very low	22.1	Very low	111 Å²	111	146.6 Å²	146.6	68%	0.681	73%	0.732	S	S	*	*			trans	60.5	127.5	175.4	42.5	0	0	0	0	116.1
2336	E	20.8	Very low	21.9	Very low	166 Å²	166	142.5 Å²	142.5	78%	0.776	72%	0.722	S	S	*	*				65.4	142	65.2	-68.6	-161	142.8	0	0	114.6
2337	S	21.1	Very low	22	Very low	76 Å²	76	139.7 Å²	139.7	53%	0.531	71%	0.713	S	S	.	*			cis	-169.3	170.6	-19.4	61.2	0	0	0	0	111
2338	R	20.6	Very low	21.9	Very low	185 Å²	185	141.1 Å²	141.1	70%	0.698	71%	0.71	S	S	*	*			trans	55	122.7	141.2	-78.9	168.6	166.8	166.3	-2.2	120.5
2339	R	21	Very low	21.9	Very low	205 Å²	205	138.9 Å²	138.9	77%	0.774	70%	0.704	S	S	*	*			trans	68.6	168.3	142.3	-54.9	163.1	168	168.3	-9.6	115
2340	L	23.3	Very low	21.8	Very low	151 Å²	151	140.3 Å²	140.3	79%	0.791	70%	0.704	S	S	*	*			cis	-109.4	140.6	-17.8	-81.8	87.7	0	0	0	106.4
2341	S	20.8	Very low	21.7	Very low	85 Å²	85	136.3 Å²	136.3	59%	0.594	70%	0.696	S	S	*	*			cis	74.9	130.2	42	85.8	0	0	0	0	115.5
2342	V	21.3	Very low	21.6	Very low	126 Å²	126	134.4 Å²	134.4	76%	0.764	69%	0.694	S	S	*	*			trans	83.7	132.5	153	173.5	0	0	0	0	118.2
2343	L	23.5	Very low	21.7	Very low	147 Å²	147	136.4 Å²	136.4	77%	0.77	70%	0.696	S	S	*	*			trans	98.5	133.2	177.6	-59.2	171.8	0	0	0	114.5
2344	N	20.1	Very low	21.8	Very low	118 Å²	118	131.8 Å²	131.8	63%	0.631	68%	0.684	S	S	*	*			cis	148.8	159.9	-14.1	-99.8	25.9	0	0	0	105.4
2345	Y	23.7	Very low	22	Very low	188 Å²	188	128.2 Å²	128.2	74%	0.737	69%	0.685	S	S	*	*			trans	73.8	113.3	-179.5	-60.1	-80.4	0	0	0	113.4
2346	E	20.6	Very low	22	Very low	135 Å²	135	130.6 Å²	130.6	63%	0.631	69%	0.686	S	S	*	*			cis	85.7	159.5	49.3	-71.6	-174.3	161.1	0	0	113.7	L1214	L1214-E2346 HydrophobicContact CD1-CB 4.17Å; L1214-E2346 HydrophobicContact CD1-CG 4.34Å; L1214-E2346 HydrophobicContact CD2-CG 4.11Å; L1214-E2346 HydrophobicContact CG-CG 4.33Å
2347	A	23.3	Very low	22.3	Very low	80 Å²	80	130.1 Å²	130.1	66%	0.661	69%	0.685	S	S	*	*			trans	75.9	84.7	170.3	0	0	0	0	0	116.9	L1214	L1214-A2347 VanDerWaalsContact CD1-N 3.34Å
2348	E	21.1	Very low	22.6	Very low	120 Å²	120	133.6 Å²	133.6	56%	0.561	69%	0.693	S	S	*	*				17.7	147.7	94.8	-151.6	-173.5	-158.2	0	0	118.8	L1214	L1214-E2348 HydrophobicContact CD1-CB 4.27Å
2349	M	20.5	Very low	22.9	Very low	143 Å²	143	131.6 Å²	131.6	70%	0.704	70%	0.695	S	S	*	*			trans	83.7	143.1	160.9	-68.1	-146.8	178.8	0	0	121.3
2350	N	21.6	Very low	23.1	Very low	130 Å²	130	129.5 Å²	129.5	70%	0.695	69%	0.691	S	S	*	*			trans	68.7	85.8	148.2	-62.7	-25.8	0	0	0	120.3
2351	S	21.5	Very low	23.2	Very low	95 Å²	95	129.8 Å²	129.8	66%	0.664	69%	0.688	S	S	*	*				41.2	136.1	105.9	66.2	0	0	0	0	121.1
2352	S	21.3	Very low	23.4	Very low	94 Å²	94	132.2 Å²	132.2	66%	0.657	69%	0.69	S	S	*	*			trans	85.8	112.1	135.8	69.9	0	0	0	0	121.5
2353	I	22.5	Very low	23.5	Very low	133 Å²	133	136.6 Å²	136.6	68%	0.682	70%	0.695	S	S	*	*				94.7	135.7	118.4	-73.5	174.3	0	0	0	120.5
2354	E	22.9	Very low	23.5	Very low	131 Å²	131	138.3 Å²	138.3	61%	0.612	70%	0.696	S	S	*	*			trans	71.2	140.1	162.7	-84.8	173.6	122.1	0	0	121.1	K2356	E2354-K2356 IonicContact OE1-NZ 3.76Å
2355	G	27.4	Very low	23.5	Very low	74 Å²	74	139.2 Å²	139.2	76%	0.763	70%	0.701	S	S	*	*			trans	-179.1	-19.7	-178.3	0	0	0	0	0	118.3
2356	K	24	Very low	23.4	Very low	161 Å²	161	137.3 Å²	137.3	70%	0.7	70%	0.703	S	S	*	*			trans	34.5	117	166.6	-66.5	176.3	-177.7	164.7	0	119.7	E2354	E2354-K2356 IonicContact OE1-NZ 3.76Å
2357	M	27.1	Very low	23.8	Very low	156 Å²	156	136.1 Å²	136.1	77%	0.768	70%	0.704	S	S	*	*				-161.5	125.4	116.9	-153.4	91.9	-179.6	0	0	112.6
2358	E	26.2	Very low	23.9	Very low	148 Å²	148	138.2 Å²	138.2	69%	0.692	71%	0.712	S	S	*	*			trans	59	120.2	148.7	-76.9	170	169.5	0	0	124.5
2359	I	27.5	Very low	24	Very low	143 Å²	143	139 Å²	139	73%	0.733	72%	0.719	S	S	*	*			trans	72.9	108.5	141.7	-58.6	167	0	0	0	115.6
2360	K	24.7	Very low	24.4	Very low	161 Å²	161	137 Å²	137	70%	0.7	72%	0.717	S	S	*	*			cis	-149.4	130.3	9.3	-102.7	174.6	172	-178	0	109.9
2361	E	26.6	Very low	24.4	Very low	157 Å²	157	138.3 Å²	138.3	73%	0.734	72%	0.724	S	S	*	*				69	130.6	91.1	-69.1	176.5	173.4	0	0	115.1
2362	E	24.5	Very low	24.6	Very low	136 Å²	136	141.3 Å²	141.3	64%	0.636	72%	0.724	S	S	*	*			cis	-165.9	172.7	-24.8	-147.2	164.4	-144.9	0	0	110.6
2363	Y	23	Very low	24.9	Very low	219 Å²	219	144.6 Å²	144.6	86%	0.859	74%	0.735	S	S	*	*			trans	-55.2	154.4	150.4	-92.5	-115.2	0	0	0	109.4
2364	F	24.3	Very low	25.2	Very low	182 Å²	182	141.9 Å²	141.9	80%	0.798	74%	0.739	S	S	*	*			trans	-170.6	142.4	131.8	-109.3	-66.6	0	0	0	114.2
2365	D	19.8	Very low	25.5	Very low	138 Å²	138	141.8 Å²	141.8	74%	0.738	75%	0.747	S	S	*	*			trans	-69.4	157	156.6	-109.9	-51.6	0	0	0	111.6
2366	L	20.8	Very low	25.4	Very low	147 Å²	147	142.7 Å²	142.7	77%	0.77	74%	0.742	S	S	*	*			trans	60.7	99.2	156.7	-66.3	165.1	0	0	0	119.8
2367	V	29.2	Very low	25.6	Very low	110 Å²	110	141.2 Å²	141.2	67%	0.667	74%	0.742	S	S	*	*				42.2	120.1	120.6	-179.3	0	0	0	0	119.4
2368	P	24.5	Very low	25.6	Very low	125 Å²	125	140 Å²	140	81%	0.812	74%	0.738	S	S	*	*			trans	-113.7	99.5	149	34.8	-25.7	0	0	0	113.3
2369	N	23.7	Very low	25.5	Very low	135 Å²	135	140.7 Å²	140.7	72%	0.722	74%	0.742	S	S	*	*			trans	-43.9	147.9	140.7	-82.5	-58.1	0	0	0	109.6
2370	P	28.9	Very low	25.5	Very low	101 Å²	101	140.8 Å²	140.8	66%	0.656	74%	0.742	S	S	*	*				-161.2	142	63.8	38.4	-15.1	0	0	0	119.9
2371	L	21.5	Very low	25.4	Very low	159 Å²	159	137.6 Å²	137.6	83%	0.832	74%	0.74	S	S	*	*	S	Bend		-108.7	89.3	116.8	-81.7	174.6	0	0	0	106.8
2372	K	26.3	Very low	25.2	Very low	157 Å²	157	134 Å²	134	68%	0.683	73%	0.733	S	S	*	*				81.3	104.3	95.1	-84	-171.5	179.8	176.9	0	112.2
2373	N	26.5	Very low	25.3	Very low	164 Å²	164	135.4 Å²	135.4	88%	0.877	74%	0.739	S	S	*	*			trans	69.7	113.2	175.9	-42.7	-20.2	0	0	0	111.5
2374	G	29.4	Very low	25.4	Very low	75 Å²	75	132.3 Å²	132.3	77%	0.773	73%	0.732	S	S	*	*			cis	109.4	140.8	37	0	0	0	0	0	107.3
2375	V	29.1	Very low	25.3	Very low	129 Å²	129	130.2 Å²	130.2	78%	0.782	73%	0.729	S	S	*	*			cis	-151.8	111.7	23.8	156.1	0	0	0	0	105.1
2376	S	24.9	Very low	25.5	Very low	93 Å²	93	129.2 Å²	129.2	65%	0.65	73%	0.731	S	S	*	*				52.2	141.3	92.8	85	0	0	0	0	116.6
2377	N	29.7	Very low	25.6	Very low	131 Å²	131	124.9 Å²	124.9	70%	0.701	72%	0.722	S	S	*	*			trans	101	100.1	172	-54.8	28	0	0	0	113.9
2378	D	27	Very low	25.3	Very low	129 Å²	129	130.9 Å²	130.9	69%	0.69	73%	0.734	S	S	*	*				72.8	138.8	67.2	-68.9	-36.6	0	0	0	112.6
2379	Q	23.6	Very low	25.3	Very low	163 Å²	163	130.2 Å²	130.2	76%	0.762	73%	0.732	S	S	*	*			cis	171.4	-165.3	-12.6	-114.8	-170.8	19.4	0	0	102.5
2380	I	27.1	Very low	25.2	Very low	145 Å²	145	128.4 Å²	128.4	74%	0.744	73%	0.731	S	S	*	*			trans	66.5	76	166.7	-47	-176.1	0	0	0	112.6
2381	S	22.6	Very low	24.8	Very low	95 Å²	95	135.2 Å²	135.2	66%	0.664	74%	0.743	S	S	*	*				76.6	161.9	64.3	82.6	0	0	0	0	114.2
2382	S	23.5	Very low	25	Very low	82 Å²	82	135.4 Å²	135.4	57%	0.573	74%	0.738	S	S	*	*			trans	60.4	136.9	159.4	46.1	0	0	0	0	117.2
2383	E	26.3	Very low	24.8	Very low	164 Å²	164	133.4 Å²	133.4	77%	0.766	74%	0.742	S	S	*	*			cis	-174.2	157.4	0.8	-107.4	141.1	-140.6	0	0	104.3
2384	E	25.2	Very low	24.5	Very low	154 Å²	154	128.4 Å²	128.4	72%	0.72	71%	0.714	S	S	*	*			cis	-164.4	-178.8	-11.3	-125.7	-172.8	163.6	0	0	109.4
2385	L	22.6	Very low	24.2	Very low	139 Å²	139	128.7 Å²	128.7	73%	0.728	70%	0.701	S	S	*	*			trans	6.1	141.9	148.7	-54.1	164.4	0	0	0	118.6
2386	C	22.4	Very low	23.9	Very low	117 Å²	117	125.3 Å²	125.3	79%	0.791	68%	0.679	S	S	*	*			cis	-164	169.3	0.9	-118.3	0	0	0	0	107.8
2387	G	24.4	Very low	24.1	Very low	55 Å²	55	126.4 Å²	126.4	57%	0.567	68%	0.676	S	S	*	*			cis	166.4	160.3	-1.2	0	0	0	0	0	109.9
2388	Y	22.9	Very low	23.9	Very low	236 Å²	236	123.2 Å²	123.2	93%	0.925	66%	0.662	S	S	*	*			trans	58.6	148.3	173.1	-60.6	-92	0	0	0	117.7
2389	S	23	Very low	23.6	Very low	111 Å²	111	124.3 Å²	124.3	78%	0.776	66%	0.663	S	S	*	*			cis	-136.5	-179.3	8.7	58	0	0	0	0	112.9
2390	S	21.5	Very low	23.6	Very low	98 Å²	98	121.8 Å²	121.8	69%	0.685	66%	0.664	S	S	*	*			trans	-66.7	144.3	-178.7	47.9	0	0	0	0	113.2
2391	W	21.2	Very low	23.5	Very low	244 Å²	244	123.4 Å²	123.4	92%	0.924	67%	0.668	S	S	*	*				-165.3	171.2	84.3	-107.8	58.2	0	0	0	112.7
2392	K	25	Very low	23.5	Very low	163 Å²	163	126.7 Å²	126.7	71%	0.709	68%	0.678	S	S	*	*			trans	86	95	156.4	-148.1	167	-168.3	168.4	0	118.5
2393	C	22.2	Very low	23.4	Very low	114 Å²	114	129.8 Å²	129.8	77%	0.77	68%	0.681	S	S	*	*			trans	-85	147.8	170.2	-50.6	0	0	0	0	113.3	V2395	C2393-V2395 HydrophobicContact CB-CG2 4.24Å
2394	I	20.4	Very low	23.4	Very low	59 Å²	59	129.7 Å²	129.7	30%	0.303	68%	0.681	S	S	.	*			trans	-149.6	105.7	154.2	-66.6	-166.7	0	0	0	104.3	H963 R964 V1792	H963-I2394 HydrophobicContact CB-CG2 3.88Å; R964-I2394 HydrophobicContact CG-CD1 4.48Å; V1792-I2394 HydrophobicContact CG2-CB 4.27Å; V1792-I2394 HydrophobicContact CG2-CG2 3.45Å; V1792-I2394 VanDerWaalsContact CG2-CG2 3.45Å
2395	V	23.6	Very low	23.5	Very low	81 Å²	81	130.7 Å²	130.7	49%	0.491	69%	0.685	S	S	.	*			cis	58.9	92.5	44.8	-176.8	0	0	0	0	109.7	C2393	C2393-V2395 HydrophobicContact CB-CG2 4.24Å
2396	D	22.7	Very low	23.5	Very low	58 Å²	58	130 Å²	130	31%	0.31	68%	0.681	S	S	.	*			cis	-162.1	154	43.9	-104.7	-33	0	0	0	114.8
2397	I	30	Very low	23.6	Very low	116 Å²	116	127.3 Å²	127.3	60%	0.595	67%	0.674	S	S	*	*				14.7	132.2	117.7	-50.1	171.4	0	0	0	116.6
2398	P	25.1	Very low	23.6	Very low	64 Å²	64	132.3 Å²	132.3	42%	0.416	69%	0.687	S	S	.	*			trans	-129.9	117.1	137.6	9.6	12.2	0	0	0	115.3
2399	Q	20.9	Very low	23.6	Very low	152 Å²	152	124.7 Å²	124.7	71%	0.71	67%	0.668	S	S	*	*				58.5	100.1	127.7	-60.9	170.1	51	0	0	119.6
2400	S	23.7	Very low	23.7	Very low	110 Å²	110	127.1 Å²	127.1	77%	0.769	67%	0.667	S	S	*	*			trans	-150.3	153.3	134.3	-60	0	0	0	0	108.7
2401	E	24.8	Very low	23.8	Very low	179 Å²	179	128 Å²	128	84%	0.836	67%	0.668	S	S	*	*			trans	35.4	90.6	157.3	-73.7	139.6	-139.5	0	0	119.2
2402	L	21.6	Very low	23.9	Very low	165 Å²	165	122.7 Å²	122.7	86%	0.864	66%	0.663	S	S	*	*			trans	-128.3	77.3	135.5	-167.3	147.1	0	0	0	108
2403	F	21.4	Very low	23.8	Very low	147 Å²	147	117.8 Å²	117.8	65%	0.645	65%	0.649	S	S	*	*			trans	-172.7	138	166	-104.3	-67.7	0	0	0	107.8	L2406	F2403-L2406 HydrophobicContact CD1-CD1 3.65Å; F2403-L2406 HydrophobicContact CD1-CG 4.04Å; F2403-L2406 HydrophobicContact CE1-CD1 3.92Å; F2403-L2406 HydrophobicContact CE1-CG 4.29Å
2404	Q	27.6	Very low	23.8	Very low	162 Å²	162	122 Å²	122	76%	0.757	66%	0.658	S	S	*	*			trans	67.1	102.2	-171.1	-70.8	177.9	-57.7	0	0	112.7	L2406	Q2404-L2406 HydrophobicContact CG-CB 4.03Å; Q2404-L2406 HydrophobicContact CG-CD1 4.35Å
2405	E	26.2	Very low	23.9	Very low	174 Å²	174	127.2 Å²	127.2	81%	0.813	68%	0.681	S	S	*	*			cis	-57.4	155.2	-1	-52	81.7	-99.8	0	0	113.8
2406	L	23.4	Very low	23.9	Very low	124 Å²	124	128.4 Å²	128.4	65%	0.649	69%	0.692	S	S	*	*			cis	44.2	116.6	-33.8	-62.3	-179.9	0	0	0	121.7	F2403 Q2404	F2403-L2406 HydrophobicContact CD1-CD1 3.65Å; F2403-L2406 HydrophobicContact CD1-CG 4.04Å; F2403-L2406 HydrophobicContact CE1-CD1 3.92Å; F2403-L2406 HydrophobicContact CE1-CG 4.29Å; Q2404-L2406 HydrophobicContact CG-CB 4.03Å; Q2404-L2406 HydrophobicContact CG-CD1 4.35Å
2407	G	24	Very low	24	Very low	61 Å²	61	132.1 Å²	132.1	63%	0.629	71%	0.712	S	S	*	*			trans	131.6	123.4	167.9	0	0	0	0	0	109.9
2408	L	23.8	Very low	23.5	Very low	161 Å²	161	135.9 Å²	135.9	84%	0.843	73%	0.725	S	S	*	*			cis	-130.2	143.5	-0.6	-60.2	167.1	0	0	0	107.2
2409	S	23.8	Very low	23.6	Very low	75 Å²	75	139.8 Å²	139.8	52%	0.524	75%	0.747	S	S	.	*			cis	78.3	130	33.3	83.6	0	0	0	0	115.4
2410	E	24.1	Very low	23.6	Very low	163 Å²	163	136.8 Å²	136.8	76%	0.762	74%	0.743	S	S	*	*			trans	66.3	162.7	164.4	-57.3	131.4	151.9	0	0	114.7
2411	T	24	Very low	23.7	Very low	115 Å²	115	138.1 Å²	138.1	71%	0.706	75%	0.746	S	S	*	*			cis	-142.7	160.5	26.4	49.1	0	0	0	0	109.5
2412	T	23.1	Very low	23.7	Very low	133 Å²	133	132.7 Å²	132.7	82%	0.816	74%	0.739	S	S	*	*			cis	-108.1	125.3	34.6	54.6	0	0	0	0	113.6
2413	S	24.1	Very low	23.7	Very low	61 Å²	61	134 Å²	134	43%	0.427	74%	0.738	S	S	.	*			cis	67.2	102.2	41.8	89.3	0	0	0	0	115.1
2414	E	22.6	Very low	23.8	Very low	202 Å²	202	133.8 Å²	133.8	94%	0.944	74%	0.741	S	S	*	*			trans	-99.4	140.5	131.7	-71.5	-164.6	139	0	0	107.9
2415	Q	22.6	Very low	23.6	Very low	169 Å²	169	131.7 Å²	131.7	79%	0.79	74%	0.735	S	S	*	*			trans	-102.3	149.5	-177.2	-61.4	171.1	-22	0	0	109.8
2416	S	23.2	Very low	23.4	Very low	105 Å²	105	133 Å²	133	73%	0.734	73%	0.734	S	S	*	*				179.7	127.5	114.6	41.4	0	0	0	0	115.3
2417	N	23.2	Very low	23.5	Very low	137 Å²	137	134.9 Å²	134.9	73%	0.733	74%	0.739	S	S	*	*			trans	59.2	117.1	131.6	-57.5	-20.8	0	0	0	122.8
2418	F	20.7	Very low	23.6	Very low	194 Å²	194	137 Å²	137	85%	0.851	74%	0.736	S	S	*	*				42.5	121	125.5	-72.2	-89.6	0	0	0	120.5
2419	V	26.5	Very low	23.7	Very low	146 Å²	146	135.1 Å²	135.1	89%	0.885	73%	0.726	S	S	*	*				-156.6	155.8	101.6	140.3	0	0	0	0	109.7
2420	S	21.6	Very low	23.7	Very low	90 Å²	90	138.7 Å²	138.7	63%	0.629	73%	0.732	S	S	*	*			trans	-105.2	179.7	-171.6	55.1	0	0	0	0	114.1
2421	T	26.2	Very low	23.8	Very low	137 Å²	137	135 Å²	135	84%	0.84	72%	0.718	S	S	*	*			trans	75.4	135.8	177	74.8	0	0	0	0	115.2
2422	G	24	Very low	23.9	Very low	66 Å²	66	134 Å²	134	68%	0.68	71%	0.705	S	S	*	*			cis	90.6	147.6	-2.8	0	0	0	0	0	115
2423	F	22.4	Very low	24.2	Very low	191 Å²	191	132.1 Å²	132.1	84%	0.838	70%	0.697	S	S	*	*			cis	-171.2	164.9	-14	-140.4	-76.7	0	0	0	107.3
2424	M	22.1	Very low	24.3	Very low	144 Å²	144	133.4 Å²	133.4	71%	0.709	71%	0.706	S	S	*	*			trans	68.6	160.2	170.8	-53.8	-56.6	-117.1	0	0	115.8
2425	N	24.3	Very low	24.4	Very low	118 Å²	118	127.2 Å²	127.2	63%	0.631	69%	0.689	S	S	*	*			cis	-146.3	130.6	-6.2	-117.6	-3.4	0	0	0	107.1
2426	Y	22.1	Very low	24.6	Very low	200 Å²	200	125.8 Å²	125.8	78%	0.784	69%	0.686	S	S	*	*				79.7	154.6	91.6	-103.9	-88.1	0	0	0	117.1
2427	E	25	Very low	24.6	Very low	164 Å²	164	124.4 Å²	124.4	77%	0.766	68%	0.68	S	S	*	*			trans	77.6	135.2	-180	-57.6	-145.1	100.8	0	0	118.6
2428	N	26.4	Very low	24.9	Very low	106 Å²	106	122.4 Å²	122.4	57%	0.567	68%	0.675	S	S	*	*			cis	-161.4	145.4	-26.9	-115.3	-18.4	0	0	0	112.1
2429	I	25.9	Very low	24.9	Very low	122 Å²	122	124.2 Å²	124.2	63%	0.626	68%	0.676	S	S	*	*			trans	5.2	163.5	149.3	18.2	172.6	0	0	0	121.1
2430	F	24	Very low	24.8	Very low	150 Å²	150	122.2 Å²	122.2	66%	0.658	67%	0.665	S	S	*	*			cis	-140.1	175.9	15.4	-92.8	-70.6	0	0	0	109.5
2431	N	25.4	Very low	24.9	Very low	86 Å²	86	123.9 Å²	123.9	46%	0.46	66%	0.658	S	S	.	*			cis	-156.5	167.2	37.1	-100.9	-57	0	0	0	107.5	A1809	A1809-N2431 VanDerWaalsContact N-CG 3.29Å; A1809-N2431 PolarHBondContact N-ND2 2.99Å; A1809-N2431 PolarHBondContact N-OD1 2.82Å
2432	E	27.4	Very low	24.8	Very low	93 Å²	93	122.4 Å²	122.4	44%	0.435	64%	0.644	S	S	.	*	S	Bend	cis	-138.7	174.1	10.6	-88.5	121.2	-113.1	0	0	107.7	N1810	N1810-E2432 WeakPolarHBondContact CA-OE1 3.38Å; N1810-E2432 VanDerWaalsContact CG-OE2 3.24Å; N1810-E2432 PolarHBondContact N-OE1 2.9Å; N1810-E2432 PolarHBondContact ND2-OE2 3.19Å; N1810-E2432 PolarHBondContact OD1-OE2 2.91Å
2433	S	27.7	Very low	24.7	Very low	93 Å²	93	126 Å²	126	65%	0.65	64%	0.641	S	S	*	*			cis	-158.3	117.1	-28.9	48	0	0	0	0	105.1
2434	S	26.6	Very low	24.8	Very low	89 Å²	89	122.1 Å²	122.1	62%	0.622	63%	0.625	S	S	*	*				78.2	138.2	58.3	76.1	0	0	0	0	114.8
2435	A	25.6	Very low	24.9	Very low	71 Å²	71	122.4 Å²	122.4	59%	0.587	62%	0.623	S	S	*	*			cis	-170.9	173.4	-22.9	0	0	0	0	0	110.3
2436	I	26.2	Very low	24.9	Very low	140 Å²	140	122 Å²	122	72%	0.718	63%	0.625	S	S	*	*			trans	63	157.3	134.1	-81.5	162.2	0	0	0	120.6
2437	A	23.9	Very low	24.9	Very low	75 Å²	75	119.5 Å²	119.5	62%	0.62	62%	0.623	S	S	*	*			cis	-156.7	-133.6	-43.7	0	0	0	0	0	109.7
2438	P	28.9	Very low	24.9	Very low	95 Å²	95	122.9 Å²	122.9	62%	0.617	63%	0.629	S	S	*	*			trans	-116.7	-136.2	-140.4	34.1	-9.4	0	0	0	115.3
2439	W	21	Very low	24.9	Very low	232 Å²	232	128.1 Å²	128.1	88%	0.879	64%	0.641	S	S	*	*			trans	-86.8	131	-145	-96.7	47.5	0	0	0	118.8
2440	T	24.5	Very low	24.9	Very low	105 Å²	105	126.3 Å²	126.3	64%	0.644	63%	0.631	S	S	*	*			trans	80.4	133.3	139.5	59.5	0	0	0	0	123.3
2441	Y	23.4	Very low	24.9	Very low	124 Å²	124	124 Å²	124	49%	0.486	63%	0.626	S	S	.	*			trans	-138.5	105.1	158.8	-176.2	-82.5	0	0	0	112.9	T1778 R1780	T1778-Y2441 PolarHBondContact N-OH 3.09Å; T1778-Y2441 VanDerWaalsContact N-OH 3.16Å; R1780-Y2441 WeakPolarHBondContact CA-O 3.45Å; R1780-Y2441 WeakPolarHBondContact CG-O 3.31Å; R1780-Y2441 PolarHBondContact N-O 3.12Å
2442	I	23.4	Very low	25	Very low	106 Å²	106	121.3 Å²	121.3	54%	0.544	62%	0.618	S	S	.	*			trans	42.1	129.9	147.8	-52.3	175.4	0	0	0	123.6	R1780	R1780-I2442 WeakPolarHBondContact CA-O 3.46Å; R1780-I2442 WeakPolarHBondContact CB-O 3.27Å; R1780-I2442 VanDerWaalsContact CG-O 3.24Å; R1780-I2442 WeakPolarHBondContact CG-O 3.2Å; R1780-I2442 PolarHBondContact N-O 3.29Å
2443	F	22.8	Very low	25.1	Very low	141 Å²	141	121.5 Å²	121.5	62%	0.618	63%	0.625	S	S	*	*			trans	-48.4	149.5	-173.3	-91.4	160.7	0	0	0	118.1
2444	E	23.7	Very low	25.1	Very low	110 Å²	110	121.4 Å²	121.4	51%	0.514	62%	0.618	S	S	.	*				-149.7	107.9	127.6	-91.5	-113.9	86	0	0	112.5	V1781	V1781-E2444 VanDerWaalsContact CG2-O 3.28Å; V1781-E2444 WeakPolarHBondContact CG2-O 3.41Å
2445	K	24.6	Very low	25.2	Very low	151 Å²	151	123.8 Å²	123.8	66%	0.657	62%	0.624	S	S	*	*			trans	53.2	146.2	155.2	-63.7	151.6	-172.9	153.4	0	120.1
2446	V	24.6	Very low	25.3	Very low	110 Å²	110	127 Å²	127	67%	0.667	63%	0.631	S	S	*	*			cis	89.8	96.1	13.2	-170.2	0	0	0	0	116.5
2447	I	22.6	Very low	25.5	Very low	146 Å²	146	128.4 Å²	128.4	75%	0.749	64%	0.635	S	S	*	*			trans	73	145.1	147.3	-69.2	172.6	0	0	0	120.1
2448	R	24.7	Very low	25.7	Very low	235 Å²	235	132 Å²	132	89%	0.887	64%	0.643	S	S	*	*			trans	69.3	156.9	177.4	-73.3	165.2	-177.9	-179.4	0.3	116.5
2449	R	25.2	Very low	25.6	Very low	217 Å²	217	133 Å²	133	82%	0.819	65%	0.653	S	S	*	*			cis	-170.1	156.2	-43.1	-124.3	-170.5	-173.7	-165	4.2	109.1
2450	I	26.4	Very low	25.8	Very low	83 Å²	83	127.4 Å²	127.4	43%	0.426	65%	0.649	S	S	.	*			trans	10.4	134	150.8	-57.3	163.2	0	0	0	117.1	K1759 Y1761	K1759-I2450 VanDerWaalsContact O-CD1 3.27Å; K1759-I2450 WeakPolarHBondContact O-CD1 3.22Å; Y1761-I2450 WeakPolarHBondContact O-CA 2.99Å
2451	N	25	Very low	26	Very low	102 Å²	102	130.9 Å²	130.9	55%	0.545	66%	0.662	S	S	.	*			cis	-136.9	-160.5	22.3	-143.9	8.2	0	0	0	110.2	S1760 Y1761 S1762	S1760-N2451 PolarHBondContact O-OD1 2.87Å; Y1761-N2451 VanDerWaalsContact C-C 3.49Å; Y1761-N2451 CarbonylContact C-O 3.59Å; S1762-N2451 PolarHBondContact N-O 2.86Å; S1762-N2451 VanDerWaalsContact O-O 3.05Å
2452	G	27	Very low	26.1	Very low	29 Å²	29	131.9 Å²	131.9	30%	0.299	68%	0.676	S	S	.	*			cis	-174.8	159	-0.2	0	0	0	0	0	115.4
2453	V	28.7	Very low	26.1	Very low	97 Å²	97	131.8 Å²	131.8	59%	0.588	68%	0.684	S	S	*	*			trans	61.9	97	146.2	-168.5	0	0	0	0	122.5	Y1761	Y1761-V2453 VanDerWaalsContact CD1-N 3.27Å
2454	D	27.8	Very low	26.2	Very low	91 Å²	91	132.4 Å²	132.4	49%	0.487	69%	0.689	S	S	.	*				57.8	178.5	113.3	-44.8	-32.5	0	0	0	125.5	Y1761	Y1761-D2454 VanDerWaalsContact CE1-OD1 3.28Å; Y1761-D2454 WeakPolarHBondContact CE1-OD1 3.49Å; Y1761-D2454 VanDerWaalsContact CZ-OD1 3.26Å; Y1761-D2454 PolarHBondContact OH-OD1 2.74Å
2455	N	29.4	Very low	26.5	Very low	140 Å²	140	132.9 Å²	132.9	75%	0.749	70%	0.695	S	S	*	*			trans	78.8	142.2	-173.8	-64.5	-22.6	0	0	0	117.9
2456	N	27.6	Very low	26.6	Very low	138 Å²	138	134.5 Å²	134.5	74%	0.738	70%	0.701	S	S	*	*			cis	-169.4	177.1	-28.9	-118.5	-3.7	0	0	0	111
2457	Q	31	Very low	26.6	Very low	170 Å²	170	135.8 Å²	135.8	79%	0.794	70%	0.704	S	S	*	*			trans	75.1	133	169.3	-70.3	173.2	-40.1	0	0	116.8
2458	D	26.6	Very low	26.8	Very low	151 Å²	151	135.3 Å²	135.3	81%	0.807	70%	0.703	S	S	*	*			cis	89	141.6	41.3	-66.1	-40.4	0	0	0	112.5
2459	S	27.7	Very low	26.7	Very low	116 Å²	116	130.9 Å²	130.9	81%	0.811	69%	0.69	S	S	*	*			cis	-158.4	167.8	1.4	45.4	0	0	0	0	112.3
2460	S	24.4	Very low	27.2	Very low	113 Å²	113	125.4 Å²	125.4	79%	0.79	68%	0.683	S	S	*	*			trans	-87	158.5	178.7	55.6	0	0	0	0	115.8
2461	L	29.6	Very low	27.1	Very low	179 Å²	179	126.6 Å²	126.6	94%	0.937	70%	0.698	S	S	*	*			trans	-149.5	170.7	157.6	-112.6	163.6	0	0	0	111.4
2462	N	24.7	Very low	27	Very low	144 Å²	144	127 Å²	127	77%	0.77	71%	0.709	S	S	*	*			trans	-146.4	168.5	-150.7	-156.4	6.4	0	0	0	114.3
2463	C	24.9	Very low	26.9	Very low	104 Å²	104	130.6 Å²	130.6	70%	0.703	73%	0.73	S	S	*	*			trans	71.8	149.7	178.5	-52.3	0	0	0	0	115.3
2464	E	25	Very low	26.7	Very low	155 Å²	155	133.1 Å²	133.1	72%	0.724	74%	0.739	S	S	*	*			cis	-157	163.9	2.9	-141.7	176.7	-117.4	0	0	112.8
2465	N	28.5	Very low	26.4	Very low	120 Å²	120	132.9 Å²	132.9	64%	0.642	75%	0.745	S	S	*	*			trans	69.7	119	160.9	-62.5	-53.7	0	0	0	123.2
2466	K	27	Very low	26.1	Very low	184 Å²	184	135.2 Å²	135.2	80%	0.8	75%	0.749	S	S	*	*			trans	19.8	141.2	131.5	-61.3	176.8	-178.6	174.5	0	119.5
2467	L	25.3	Very low	25.9	Very low	137 Å²	137	132.9 Å²	132.9	72%	0.717	74%	0.743	S	S	*	*			cis	-162.8	155	15.9	-149.9	77.9	0	0	0	112.9
2468	N	25.9	Very low	25.7	Very low	136 Å²	136	130.4 Å²	130.4	73%	0.727	74%	0.74	S	S	*	*			trans	60.1	111.2	156.4	-69.1	-3.1	0	0	0	124.3
2469	K	22.7	Very low	25.6	Very low	142 Å²	142	129.4 Å²	129.4	62%	0.617	74%	0.739	S	S	*	*				25.5	159.7	123	-85.9	-172.4	171.9	-174.2	0	123.3	I1608 S1609	I1608-K2469 PolarHBondContact O-NZ 3.25Å; S1609-K2469 WeakPolarHBondContact O-CE 3.13Å; S1609-K2469 PolarHBondContact O-NZ 3.36Å
2470	P	37	Very low	25.4	Very low	102 Å²	102	130.7 Å²	130.7	66%	0.662	74%	0.736	S	S	*	*			cis	-139.2	-173.4	-15.9	38.5	-18.7	0	0	0	116.3
2471	S	23.4	Very low	25.5	Very low	108 Å²	108	130.7 Å²	130.7	76%	0.755	73%	0.731	S	S	*	*			trans	103.1	129.8	151.5	81.3	0	0	0	0	122.3
2472	S	23.7	Very low	25.4	Very low	110 Å²	110	128.3 Å²	128.3	77%	0.769	72%	0.718	S	S	*	*			trans	76.3	132	151.3	78	0	0	0	0	123.8
2473	S	23.1	Very low	25.3	Very low	105 Å²	105	124.7 Å²	124.7	73%	0.734	70%	0.702	S	S	*	*			trans	91.2	147.9	142.9	83.7	0	0	0	0	123.3
2474	L	24.8	Very low	25.3	Very low	150 Å²	150	126.7 Å²	126.7	79%	0.785	71%	0.705	S	S	*	*			trans	76.4	76.1	150.1	-70.5	160.3	0	0	0	123.9
2475	S	22.7	Very low	25.1	Very low	87 Å²	87	127.4 Å²	127.4	61%	0.608	71%	0.711	S	S	*	*				75.8	146.4	108.8	72.9	0	0	0	0	125.5
2476	F	22.3	Very low	24.9	Very low	188 Å²	188	129.4 Å²	129.4	83%	0.825	72%	0.72	S	S	*	*			trans	84.6	93.5	157	-75	-70.9	0	0	0	122.8
2477	S	23.7	Very low	24.9	Very low	90 Å²	90	130.8 Å²	130.8	63%	0.629	73%	0.729	S	S	*	*				50.1	136.4	123	63.8	0	0	0	0	122.4
2478	T	25.9	Very low	24.9	Very low	117 Å²	117	130.5 Å²	130.5	72%	0.718	73%	0.73	S	S	*	*			cis	-168.4	134.6	-0.6	16.1	0	0	0	0	111.3
2479	T	25.4	Very low	24.8	Very low	130 Å²	130	130.2 Å²	130.2	80%	0.798	73%	0.73	S	S	*	*			trans	56.9	152.4	149.4	65.7	0	0	0	0	119.5
2480	I	23.6	Very low	24.9	Very low	143 Å²	143	129.6 Å²	129.6	73%	0.733	74%	0.736	S	S	*	*			cis	-131.6	155.5	19.7	-65.2	169.2	0	0	0	110.8
2481	T	26.9	Very low	24.2	Very low	114 Å²	114	131.2 Å²	131.2	70%	0.699	74%	0.741	S	S	*	*			trans	-86.7	162.8	-171.9	49	0	0	0	0	116
2482	L	26.3	Very low	24.3	Very low	128 Å²	128	132.6 Å²	132.6	67%	0.67	74%	0.74	S	S	*	*				145.2	101.4	100.2	-160.7	143.2	0	0	0	114.3
2483	T	23.5	Very low	24.3	Very low	69 Å²	69	134.1 Å²	134.1	42%	0.423	74%	0.738	S	S	.	*			trans	-173.7	153.6	141.6	5.6	0	0	0	0	111.6	T1615	T1615-T2483 WeakPolarHBondContact CG2-O 3.28Å; T1615-T2483 PolarHBondContact OG1-O 2.85Å
2484	D	24.6	Very low	24.4	Very low	145 Å²	145	136.2 Å²	136.2	78%	0.775	74%	0.738	S	S	*	*			trans	56	65.7	152.5	-51.3	-14	0	0	0	119.9
2485	M	21.6	Very low	24.4	Very low	171 Å²	171	135.2 Å²	135.2	84%	0.842	73%	0.734	S	S	*	*				-148.7	144.5	120.3	-114.1	-178.2	-178.9	0	0	110
2486	I	24.5	Very low	24.5	Very low	161 Å²	161	139.2 Å²	139.2	83%	0.826	75%	0.745	S	S	*	*			trans	-66.1	150.4	176.9	-64.1	162.6	0	0	0	109
2487	E	25.7	Very low	24.7	Very low	214 Å²	214	134.7 Å²	134.7	100%	1	74%	0.738	S	S	*	*			cis	-75.5	0	7.1	-65.1	174.6	137.8	0	0	115.2	T972	T972-E2487 PolarHBondContact OG1-OE1 3.45Å

Retrieved 2,487 of 2,487 residues in 460.3 ms (Link to these results)

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