A0A3Q0KMG0_SCHMA Loading...

Putative thymidylate synthase

AlphaFold DB (A0A5K4EN42), UniProt , Accession A0A3Q0KMG0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,656 aa.

						>A0A3Q0KMG0_SCHMA|A0A3Q0KMG0
MLNVYDKNPSYRTSFRAADFYSLLSAYDETVSRNLGISHSSQDDVKKSFAFQGKVKYPRKNKDEGSFSKEISSSDHHKPKTLQHLLVNNGVKEYSKPNPIIFNDLCQQSLTGFSCSLPQALEKINSDIHNPKFWADFQTNNSLSMNKDSPKVSNKYHLEGTRGSNMVVRQVDATAETMTIGLPNCRALPTVQKTPRIIRTRIFFNQIKTGLKEHIEWHTTQLQQAELDQDVMSANKALENVNQLQHRLNTIRCLEHEYMKHWKLYREIRARSQGELYCDHVNSGSSGSGKSGEEIIQLSQCSTNMNNSSLLSKNKLSKSTLALTGFNGSDHIQPSTTIVNATNPYQNHSHNNNNSIYDTTNYLPTIIEKRPKYSSLLNLIRHKSKKTTNNYLLQNENRPRAATTASPVTTTAVDQKHSFLHLNRQSNLDLTATHIPLKKSATLLVHNNNSHYNKGLSKSRSSARDLITNDASLKQQQEVLLKRLCQIEAQTEYLSGTLICEVIGVSGSVSSLSKDVFRISLKYNTPALSSIYELQSDKELPDVKPLYTSTVPLNQKGGSNDKWTITGRLFSSSFSASSSAPISNSSKSLAHLQATYLNDVNLKLPEQRWDQTKHIFSPTIGDVLTIKVVVMRRFGKPETLIQQACDILKLITFKGHHISVGLKNFTDLQFHFILKWCPLADTKDDRMLFYNLSTIQLNNFLDEQRQKASSIKMILNEEEINDYSSPKMDYSNIKRYHTDLISSEFDNRYNEPQQFRHHDHHQQLTNLIKTETSSSEFIIPQDNSDSSDLENKGSVTILTVRSNKRTPSRYGEQNKCHSKLPKWISLPDLETHELSEPELMSPEIKIITVRTHRNHESKGYQNNYVDIADTNSINTTSNHNNYYDNVSEQKNFNVSFLSKVTQLISTDNRTNISESSTPEKELVQERQIEQQVPINDRTSVKINTLQTAESRLLTSKPTNNQLFEHISKLKDKIDIKTRIHDDPEGLLKNLDKTITNLIAQLENNSYWFNQLYVSNKSQNPKSIISSPVKTIEKNIDEKNTLKSLWESLAFLDEPEKSFDGYIEDGSTSSISGSSHSIRVVEKTDIYTCDSDQVIKTTGWRQLDLALIWHLNYTIRLLDQVYPDHLYVSSSQILLSPQSSVSDVSDKTINNYTPNGSSSSVRNSVHSAWSTLPLLEQIEFFNEVESLCQGIIDDLQTVESNYLLKVCGDGKPYSTLRFTCFLSKLIWPVQNNNNITISEEISSPQIIFDRDAFRETLLRFYEKDVVPRWSKDMANGVIDHFIEDVLDLQVNGSELSTIPLTHLNLRLKLSERMESTVLSNRLSDQHNRDQLKQFNVYFIQLLSYLAGQLYIQWNLENAYSSRTLSTLPYFTRALQPIFGLNVLLSDVGVDPNYLEQIEYGLDMRSTELAACHSTQTWLRVAELVGNHDEEINKKAIMLLKSMNEKIYKVFQHLTNSKQKLHLSSDVQMLQGTNNHINNYHQLIKKNSRNTVPRPIFYLMGPPIHIQYCLNKNCIKQNLSSLSPIWISMICGLEQKSSIKRIAALKALTILIESQISGTIKTTQNNNTNNKNCRLYGNTTDGITNSTILQLLNDIHSNDSDPLVKNLARQIIDRITTRFNTESHNEQITKPTRLLKTIWTKFSTAENLPSKPSYIFQR
					

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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	23.2	Very low	26.2	Very low	220 Å²	220	154.6 Å²	154.6	100%	1.084	78%	0.778	S	S	*	*				0	147	0	-74.8	153.4	54.3	0	0	108.7
2	L	21.8	Very low	26.2	Very low	171 Å²	171	161.6 Å²	161.6	90%	0.895	79%	0.788	S	S	*	*			trans	-152.7	118.8	157.6	-110.5	166.9	0	0	0	105.1	V4	L2-V4 PolarHBondContact O-N 2.93Å
3	N	22.5	Very low	26.5	Very low	118 Å²	118	156.5 Å²	156.5	63%	0.631	77%	0.772	S	S	*	*			trans	-82.2	103.5	-171.7	-72.2	-18	0	0	0	110	Y5	N3-Y5 HydrophobicContact CB-CD2 4.18Å; N3-Y5 HydrophobicContact CB-CE2 4.31Å; N3-Y5 PolarHBondContact O-N 2.91Å
4	V	27.1	Very low	26.5	Very low	130 Å²	130	151.9 Å²	151.9	79%	0.788	76%	0.764	S	S	*	*			trans	-88.1	97.3	159.3	-177.6	0	0	0	0	106.9	L2 D6	L2-V4 PolarHBondContact O-N 2.93Å; V4-D6 PolarHBondContact O-N 3.26Å; V4-D6 VanDerWaalsContact O-N 3.16Å
5	Y	23.5	Very low	26.5	Very low	203 Å²	203	156.2 Å²	156.2	80%	0.796	78%	0.776	S	S	*	*			trans	-71.7	97.5	167.6	-90.8	-88.3	0	0	0	108.5	N3	N3-Y5 HydrophobicContact CB-CD2 4.18Å; N3-Y5 HydrophobicContact CB-CE2 4.31Å; N3-Y5 PolarHBondContact O-N 2.91Å
6	D	25.1	Very low	26.5	Very low	141 Å²	141	159.8 Å²	159.8	75%	0.754	78%	0.778	S	S	*	*			trans	-97.3	119.7	171.4	-142.4	-29.5	0	0	0	110	V4 N8	V4-D6 PolarHBondContact O-N 3.26Å; V4-D6 VanDerWaalsContact O-N 3.16Å; D6-N8 VanDerWaalsContact C-N 3.32Å; D6-N8 PolarHBondContact O-N 3.34Å
7	K	32.1	Very low	26.7	Very low	198 Å²	198	154.9 Å²	154.9	86%	0.861	77%	0.77	S	S	*	*			trans	-88.6	16.7	-159.2	-103.9	-172.9	178.7	-176.9	0	114.8
8	N	24.8	Very low	26.9	Very low	122 Å²	122	151.6 Å²	151.6	65%	0.652	77%	0.771	S	S	*	*			trans	-113.6	109.8	-175.6	-111.2	-34	0	0	0	113.1	D6 S10	D6-N8 VanDerWaalsContact C-N 3.32Å; D6-N8 PolarHBondContact O-N 3.34Å; N8-S10 PolarHBondContact O-N 2.98Å
9	P	32.3	Very low	27.5	Very low	115 Å²	115	148.5 Å²	148.5	75%	0.747	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-75.3	-2.7	-177.8	30.6	-35	0	0	0	114.4	Y11	P9-Y11 VanDerWaalsContact C-N 3.27Å; P9-Y11 PolarHBondContact O-N 3.24Å
10	S	29.5	Very low	27.9	Very low	79 Å²	79	147.1 Å²	147.1	55%	0.552	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-70.2	-12.1	-175.2	43.9	0	0	0	0	115.3	N8	N8-S10 PolarHBondContact O-N 2.98Å
11	Y	26	Very low	28.2	Very low	204 Å²	204	148.3 Å²	148.3	80%	0.8	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-94.8	15.5	-177.9	-110.7	-84.2	0	0	0	115.8	P9	P9-Y11 VanDerWaalsContact C-N 3.27Å; P9-Y11 PolarHBondContact O-N 3.24Å
12	R	26.8	Very low	28.8	Very low	238 Å²	238	141.7 Å²	141.7	90%	0.898	72%	0.717	S	S	*	*	S	Bend	trans	-91.1	3.3	-178.8	-93.5	-166.6	178.2	-155.4	1.2	116.6
13	T	30.1	Very low	29.3	Very low	95 Å²	95	139.7 Å²	139.7	58%	0.583	71%	0.706	S	S	*	*	S	Bend	trans	-118.7	1.8	-165	40.3	0	0	0	0	117.3
14	S	26.6	Very low	29.8	Very low	93 Å²	93	136.4 Å²	136.4	65%	0.65	69%	0.688	S	S	*	*	S	Bend	trans	-95.9	-8.3	-175.5	56.5	0	0	0	0	116.8	R16	S14-R16 VanDerWaalsContact C-N 3.29Å; S14-R16 PolarHBondContact O-N 3.23Å
15	F	26	Very low	30.3	Very low	216 Å²	216	133.6 Å²	133.6	95%	0.947	68%	0.675	S	S	*	*	S	Bend	trans	-93.5	56.4	164.3	-96.6	-85.7	0	0	0	110.8
16	R	26.3	Very low	31.1	Very low	213 Å²	213	126.4 Å²	126.4	80%	0.804	66%	0.657	S	S	*	*			trans	-79.8	130.5	168.2	-86.4	-174.9	173.2	-168.7	-1.3	109.9	S14 A18	S14-R16 VanDerWaalsContact C-N 3.29Å; S14-R16 PolarHBondContact O-N 3.23Å; R16-A18 PolarHBondContact O-N 3.38Å
17	A	29.7	Very low	31.7	Very low	78 Å²	78	124.9 Å²	124.9	65%	0.645	64%	0.642	S	S	*	*			trans	15.4	87.1	154.3	0	0	0	0	0	116.3	D19	A17-D19 PolarHBondContact O-N 3.49Å
18	A	30.4	Very low	32	Very low	95 Å²	95	117.6 Å²	117.6	79%	0.785	61%	0.612	S	S	*	*			trans	-69.6	105.9	147.1	0	0	0	0	0	105.9	R16	R16-A18 PolarHBondContact O-N 3.38Å
19	D	39.3	Very low	32.6	Very low	92 Å²	92	116.1 Å²	116.1	49%	0.492	60%	0.601	S	S	.	*			trans	-54.8	139	-160.1	-74.3	-56	0	0	0	114.4	A17 Y21 S22	A17-D19 PolarHBondContact O-N 3.49Å; D19-Y21 PolarHBondContact O-N 3.1Å; D19-Y21 VanDerWaalsContact O-N 3.13Å; D19-S22 WeakPolarHBondContact O-CB 3.41Å; D19-S22 PolarHBondContact O-N 2.9Å
20	F	35.3	Very low	32.9	Very low	120 Å²	120	114.1 Å²	114.1	53%	0.526	59%	0.587	S	S	.	*	H	α-helix	trans	-50.8	-35	171.5	173.7	-98.5	0	0	0	112	S22 L23 L24	F20-S22 VanDerWaalsContact C-N 3.29Å; F20-S22 PolarHBondContact O-N 3.26Å; F20-L23 PolarHBondContact O-N 3.05Å; F20-L24 HydrophobicContact CE1-CD1 4.43Å; F20-L24 HydrophobicContact CE1-CD2 4.15Å; F20-L24 HydrophobicContact CZ-CD1 4.15Å; F20-L24 WeakPolarHBondContact O-CB 3.36Å; F20-L24 PolarHBondContact O-N 3.16Å
21	Y	33.4	Very low	33.3	Very low	174 Å²	174	112.8 Å²	112.8	68%	0.682	58%	0.575	S	S	*	*	H	α-helix	trans	-57.1	-36.1	173.1	-67.4	-74.1	0	0	0	113.7	D19 S25	D19-Y21 PolarHBondContact O-N 3.1Å; D19-Y21 VanDerWaalsContact O-N 3.13Å; Y21-S25 VanDerWaalsContact O-CB 3.28Å; Y21-S25 WeakPolarHBondContact O-CB 3.24Å; Y21-S25 PolarHBondContact O-N 2.91Å; Y21-S25 PolarHBondContact O-OG 3.1Å; Y21-S25 VanDerWaalsContact O-OG 3.12Å
22	S	36.2	Very low	33.7	Very low	81 Å²	81	104.5 Å²	104.5	57%	0.566	55%	0.547	S	S	*	.	H	α-helix	trans	-69.5	-40.2	177.2	-60.2	0	0	0	0	111.9	D19 F20 A26	D19-S22 WeakPolarHBondContact O-CB 3.41Å; D19-S22 PolarHBondContact O-N 2.9Å; F20-S22 VanDerWaalsContact C-N 3.29Å; F20-S22 PolarHBondContact O-N 3.26Å; S22-A26 WeakPolarHBondContact O-CB 3.33Å; S22-A26 PolarHBondContact O-N 3.16Å
23	L	33.5	Very low	34.1	Very low	129 Å²	129	99.8 Å²	99.8	68%	0.675	53%	0.529	S	S	*	.	H	α-helix	trans	-69.5	-38.1	175.2	-89.2	157.9	0	0	0	112	F20 A26 Y27	F20-L23 PolarHBondContact O-N 3.05Å; L23-A26 PolarHBondContact O-N 2.96Å; L23-Y27 WeakPolarHBondContact O-CB 3.46Å; L23-Y27 PolarHBondContact O-N 3.42Å
24	L	33	Very low	34.4	Very low	48 Å²	48	102 Å²	102	25%	0.251	54%	0.538	S	S	.	.	H	α-helix	trans	-71.4	-41.6	178.1	-155.4	76	0	0	0	111.7	F20 Y27 D28	F20-L24 HydrophobicContact CE1-CD1 4.43Å; F20-L24 HydrophobicContact CE1-CD2 4.15Å; F20-L24 HydrophobicContact CZ-CD1 4.15Å; F20-L24 WeakPolarHBondContact O-CB 3.36Å; F20-L24 PolarHBondContact O-N 3.16Å; L24-Y27 CarbonylContact O-C 3.57Å; L24-Y27 WeakPolarHBondContact O-CB 3.37Å; L24-Y27 PolarHBondContact O-N 3Å; L24-D28 PolarHBondContact O-N 3.29Å
25	S	37.3	Very low	34.8	Very low	72 Å²	72	103.3 Å²	103.3	50%	0.503	54%	0.537	S	S	.	.	H	α-helix	trans	-62.9	-38.5	171.9	-71.9	0	0	0	0	112.5	Y21 Y27 D28 E29	Y21-S25 VanDerWaalsContact O-CB 3.28Å; Y21-S25 WeakPolarHBondContact O-CB 3.24Å; Y21-S25 PolarHBondContact O-N 2.91Å; Y21-S25 PolarHBondContact O-OG 3.1Å; Y21-S25 VanDerWaalsContact O-OG 3.12Å; S25-Y27 VanDerWaalsContact C-N 3.33Å; S25-D28 PolarHBondContact O-N 3.33Å; S25-E29 PolarHBondContact O-N 3.07Å
26	A	39.3	Very low	35	Very low	51 Å²	51	96.1 Å²	96.1	42%	0.421	52%	0.524	S	S	.	.	H	α-helix	trans	-66	-36	174	0	0	0	0	0	112.4	S22 L23 T30	S22-A26 WeakPolarHBondContact O-CB 3.33Å; S22-A26 PolarHBondContact O-N 3.16Å; L23-A26 PolarHBondContact O-N 2.96Å; A26-T30 PolarHBondContact O-N 2.93Å; A26-T30 VanDerWaalsContact O-N 3.16Å; A26-T30 PolarHBondContact O-OG1 2.85Å
27	Y	37.5	Very low	35.1	Very low	110 Å²	110	91.6 Å²	91.6	43%	0.431	51%	0.514	S	S	.	.	H	α-helix	trans	-69	-40.4	172.7	-173.6	-100.5	0	0	0	111.9	L23 L24 S25 T30 V31	L23-Y27 WeakPolarHBondContact O-CB 3.46Å; L23-Y27 PolarHBondContact O-N 3.42Å; L24-Y27 CarbonylContact O-C 3.57Å; L24-Y27 WeakPolarHBondContact O-CB 3.37Å; L24-Y27 PolarHBondContact O-N 3Å; S25-Y27 VanDerWaalsContact C-N 3.33Å; Y27-T30 WeakPolarHBondContact CA-OG1 3.27Å; Y27-T30 PolarHBondContact O-N 2.93Å; Y27-T30 PolarHBondContact O-OG1 3.06Å; Y27-V31 HydrophobicContact CD1-CG2 4.23Å; Y27-V31 HydrophobicContact CE1-CG2 3.85Å; Y27-V31 HydrophobicContact CE2-CG2 4.38Å; Y27-V31 WeakPolarHBondContact O-CG2 3.25Å; Y27-V31 PolarHBondContact O-N 3.07Å
28	D	38.3	Very low	35	Very low	44 Å²	44	92.9 Å²	92.9	24%	0.235	52%	0.519	C	S	.	.	H	α-helix	trans	-62.8	-49.6	173.8	-84.3	-47.1	0	0	0	112.6	L24 S25 T30 V31 S32 R1361	L24-D28 PolarHBondContact O-N 3.29Å; S25-D28 PolarHBondContact O-N 3.33Å; D28-T30 PolarHBondContact O-N 2.86Å; D28-V31 PolarHBondContact O-N 2.99Å; D28-S32 WeakPolarHBondContact O-CB 3.45Å; D28-S32 PolarHBondContact O-N 2.94Å; D28-S32 PolarHBondContact O-OG 2.81Å; D28-R1361 VanDerWaalsContact CG-NH1 3.33Å; D28-R1361 IonicContact OD1-CZ 3.95Å; D28-R1361 IonicContact OD1-NE 3.3Å; D28-R1361 PolarHBondContact OD1-NE 2.74Å; D28-R1361 VanDerWaalsContact OD1-NE 3.16Å; D28-R1361 IonicContact OD1-NH1 3.98Å; D28-R1361 PolarHBondContact OD1-NH1 2.96Å; D28-R1361 IonicContact OD1-NH2 2.75Å; D28-R1361 PolarHBondContact OD1-NH2 3.05Å; D28-R1361 IonicContact OD2-CZ 3.93Å; D28-R1361 IonicContact OD2-NH1 3.51Å; D28-R1361 PolarHBondContact OD2-NH1 2.88Å; D28-R1361 IonicContact OD2-NH2 3.9Å; D28-R1361 PolarHBondContact OD2-NH2 2.84Å
29	E	38.8	Very low	34.9	Very low	91 Å²	91	96.1 Å²	96.1	43%	0.425	52%	0.517	S	S	.	.	H	α-helix	trans	-58.6	-38.4	177.2	-80	-144.9	105.8	0	0	111.9	S25 R33	S25-E29 PolarHBondContact O-N 3.07Å; E29-R33 VanDerWaalsContact O-CB 3.26Å; E29-R33 WeakPolarHBondContact O-CB 3.45Å; E29-R33 WeakPolarHBondContact O-CG 3.3Å; E29-R33 PolarHBondContact O-N 2.85Å; E29-R33 IonicContact OE1-CZ 2.7Å; E29-R33 IonicContact OE1-NE 3.62Å; E29-R33 IonicContact OE1-NH2 2.81Å; E29-R33 PolarHBondContact OE1-NH2 3.16Å; E29-R33 IonicContact OE2-CZ 3.02Å; E29-R33 IonicContact OE2-NH2 3.75Å; E29-R33 PolarHBondContact OE2-NH2 2.82Å
30	T	38.7	Very low	34.4	Very low	73 Å²	73	96.8 Å²	96.8	45%	0.448	53%	0.529	S	S	.	.	H	α-helix	trans	-72.8	-35.2	177.9	43.2	0	0	0	0	112.8	A26 Y27 D28 N34	A26-T30 PolarHBondContact O-N 2.93Å; A26-T30 VanDerWaalsContact O-N 3.16Å; A26-T30 PolarHBondContact O-OG1 2.85Å; Y27-T30 WeakPolarHBondContact CA-OG1 3.27Å; Y27-T30 PolarHBondContact O-N 2.93Å; Y27-T30 PolarHBondContact O-OG1 3.06Å; D28-T30 PolarHBondContact O-N 2.86Å; T30-N34 WeakPolarHBondContact O-CB 3.29Å; T30-N34 PolarHBondContact O-N 2.68Å; T30-N34 PolarHBondContact O-ND2 3.13Å
31	V	37.7	Very low	34.1	Very low	51 Å²	51	96.8 Å²	96.8	31%	0.309	54%	0.544	S	S	.	.	H	α-helix	trans	-70.2	-47.4	173.5	171.9	0	0	0	0	111.4	Y27 D28 R33 N34 L35	Y27-V31 HydrophobicContact CD1-CG2 4.23Å; Y27-V31 HydrophobicContact CE1-CG2 3.85Å; Y27-V31 HydrophobicContact CE2-CG2 4.38Å; Y27-V31 WeakPolarHBondContact O-CG2 3.25Å; Y27-V31 PolarHBondContact O-N 3.07Å; D28-V31 PolarHBondContact O-N 2.99Å; V31-R33 PolarHBondContact O-N 3.41Å; V31-N34 PolarHBondContact O-N 3.38Å; V31-L35 HydrophobicContact CG1-CD1 3.85Å; V31-L35 PolarHBondContact O-N 2.74Å
32	S	33.6	Very low	33.7	Very low	31 Å²	31	97 Å²	97	22%	0.217	55%	0.551	C	S	.	*	H	α-helix	trans	-62.5	-40.4	179.1	-65.6	0	0	0	0	112.6	D28 L35 G36	D28-S32 WeakPolarHBondContact O-CB 3.45Å; D28-S32 PolarHBondContact O-N 2.94Å; D28-S32 PolarHBondContact O-OG 2.81Å; S32-L35 PolarHBondContact O-N 3.07Å; S32-G36 PolarHBondContact O-N 3.39Å; S32-G36 VanDerWaalsContact O-N 3.11Å
33	R	35.5	Very low	33.3	Very low	138 Å²	138	100.6 Å²	100.6	52%	0.521	56%	0.564	S	S	.	*	H	α-helix	trans	-65.9	-37.3	174.1	-73.4	176.1	-164.4	170.6	13	112.7	E29 V31 L35	E29-R33 VanDerWaalsContact O-CB 3.26Å; E29-R33 WeakPolarHBondContact O-CB 3.45Å; E29-R33 WeakPolarHBondContact O-CG 3.3Å; E29-R33 PolarHBondContact O-N 2.85Å; E29-R33 IonicContact OE1-CZ 2.7Å; E29-R33 IonicContact OE1-NE 3.62Å; E29-R33 IonicContact OE1-NH2 2.81Å; E29-R33 PolarHBondContact OE1-NH2 3.16Å; E29-R33 IonicContact OE2-CZ 3.02Å; E29-R33 IonicContact OE2-NH2 3.75Å; E29-R33 PolarHBondContact OE2-NH2 2.82Å; V31-R33 PolarHBondContact O-N 3.41Å; R33-L35 VanDerWaalsContact C-N 3.33Å
34	N	36.5	Very low	33	Very low	141 Å²	141	101.8 Å²	101.8	75%	0.754	57%	0.571	S	S	*	*	H	α-helix	trans	-74.6	-21.1	178.3	-74.1	-25.8	0	0	0	113.5	T30 V31	T30-N34 WeakPolarHBondContact O-CB 3.29Å; T30-N34 PolarHBondContact O-N 2.68Å; T30-N34 PolarHBondContact O-ND2 3.13Å; V31-N34 PolarHBondContact O-N 3.38Å
35	L	34.5	Very low	32.7	Very low	122 Å²	122	106.2 Å²	106.2	64%	0.639	60%	0.6	S	S	*	*	H	α-helix	trans	-103.7	2	179.5	-67.6	175.9	0	0	0	114.2	V31 S32 R33 I37	V31-L35 HydrophobicContact CG1-CD1 3.85Å; V31-L35 PolarHBondContact O-N 2.74Å; S32-L35 PolarHBondContact O-N 3.07Å; R33-L35 VanDerWaalsContact C-N 3.33Å; L35-I37 HydrophobicContact CB-CD1 4.49Å; L35-I37 HydrophobicContact CB-CG1 4.36Å; L35-I37 PolarHBondContact O-N 3.4Å; L35-I37 VanDerWaalsContact O-N 3.16Å
36	G	29.8	Very low	32.2	Very low	65 Å²	65	112.2 Å²	112.2	67%	0.67	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.5	13.2	171.8	0	0	0	0	0	115.3	S32 S38	S32-G36 PolarHBondContact O-N 3.39Å; S32-G36 VanDerWaalsContact O-N 3.11Å; G36-S38 PolarHBondContact O-N 3.41Å
37	I	28.1	Very low	31.6	Very low	117 Å²	117	119.4 Å²	119.4	60%	0.6	64%	0.639	S	S	*	*			trans	-79	95.3	-179.9	-53.8	178.3	0	0	0	108.2	L35 H39	L35-I37 HydrophobicContact CB-CD1 4.49Å; L35-I37 HydrophobicContact CB-CG1 4.36Å; L35-I37 PolarHBondContact O-N 3.4Å; L35-I37 VanDerWaalsContact O-N 3.16Å; I37-H39 PolarHBondContact O-N 3.11Å
38	S	29	Very low	30.9	Very low	106 Å²	106	118.8 Å²	118.8	74%	0.741	65%	0.651	S	S	*	*			trans	-65.8	121.4	174.8	57.7	0	0	0	0	110.4	G36 S40	G36-S38 PolarHBondContact O-N 3.41Å; S38-S40 PolarHBondContact O-N 3.44Å
39	H	28.1	Very low	30.2	Very low	162 Å²	162	127.1 Å²	127.1	75%	0.75	69%	0.685	S	S	*	*			trans	-60.3	99.2	172.3	-71	-80.6	0	0	0	111	I37 S41	I37-H39 PolarHBondContact O-N 3.11Å; H39-S41 PolarHBondContact O-N 3.3Å; H39-S41 VanDerWaalsContact O-N 3.11Å
40	S	28.3	Very low	29.5	Very low	106 Å²	106	127.1 Å²	127.1	74%	0.741	70%	0.701	S	S	*	*			trans	-70.6	98.8	159.2	54.4	0	0	0	0	107.8	S38 Q42	S38-S40 PolarHBondContact O-N 3.44Å; S40-Q42 PolarHBondContact O-N 3.03Å; S40-Q42 VanDerWaalsContact O-N 3.11Å
41	S	29.2	Very low	28.8	Very low	120 Å²	120	134 Å²	134	84%	0.839	73%	0.725	S	S	*	*			trans	-55	113.1	178.7	53.2	0	0	0	0	111	H39	H39-S41 PolarHBondContact O-N 3.3Å; H39-S41 VanDerWaalsContact O-N 3.11Å
42	Q	24.9	Very low	28	Very low	180 Å²	180	140.6 Å²	140.6	84%	0.841	75%	0.752	S	S	*	*			trans	-136.9	45.6	178.7	-152.4	176.9	10.6	0	0	112.2	S40	S40-Q42 PolarHBondContact O-N 3.03Å; S40-Q42 VanDerWaalsContact O-N 3.11Å
43	D	27	Very low	27.4	Very low	155 Å²	155	142.4 Å²	142.4	83%	0.829	78%	0.776	S	S	*	*			trans	-113.6	104.4	167.6	-85.4	-47.8	0	0	0	109.8
44	D	27.1	Very low	27	Very low	154 Å²	154	146 Å²	146	82%	0.824	80%	0.796	S	S	*	*			trans	-158.4	49.8	159.2	-116.2	-21.1	0	0	0	110.3	K46	D44-K46 VanDerWaalsContact C-N 3.33Å; D44-K46 PolarHBondContact O-N 3.42Å
45	V	27.8	Very low	26.4	Very low	142 Å²	142	145 Å²	145	86%	0.861	79%	0.794	S	S	*	*			trans	-76.7	88.4	173.9	-177.7	0	0	0	0	109.5	K47	V45-K47 PolarHBondContact O-N 3.18Å
46	K	27.4	Very low	26.1	Very low	197 Å²	197	149 Å²	149	86%	0.857	81%	0.806	S	S	*	*			trans	-38.6	120.4	-179.9	-63.7	166	-178.8	170.8	0	114.9	D44	D44-K46 VanDerWaalsContact C-N 3.33Å; D44-K46 PolarHBondContact O-N 3.42Å
47	K	25.1	Very low	25.9	Very low	202 Å²	202	155.5 Å²	155.5	88%	0.878	81%	0.812	S	S	*	*			trans	-94.4	105.1	149.4	-85.9	-177.2	176.1	175.5	0	110.3	V45	V45-K47 PolarHBondContact O-N 3.18Å
48	S	23.5	Very low	26	Very low	98 Å²	98	155.3 Å²	155.3	69%	0.685	82%	0.818	S	S	*	*			trans	14.5	110.2	145.9	56.4	0	0	0	0	118.9
49	F	24.4	Very low	26	Very low	218 Å²	218	162.5 Å²	162.5	96%	0.956	83%	0.829	S	S	*	*			trans	-146.6	139.9	131.7	-95	-71.8	0	0	0	109.5
50	A	23.5	Very low	25.9	Very low	92 Å²	92	163.4 Å²	163.4	76%	0.76	83%	0.831	S	S	*	*			trans	-88.7	133.1	-174	0	0	0	0	0	111.7
51	F	23.8	Very low	25.7	Very low	217 Å²	217	165 Å²	165	95%	0.952	83%	0.831	S	S	*	*			trans	-148.8	142.7	146.1	-119.7	-82.5	0	0	0	110.1
52	Q	20.9	Very low	25.5	Very low	190 Å²	190	167.7 Å²	167.7	89%	0.888	83%	0.828	S	S	*	*			trans	-81.8	143.5	-165.6	-67.8	172.3	-17.8	0	0	113.7
53	G	21.8	Very low	25.7	Very low	69 Å²	69	165.2 Å²	165.2	71%	0.711	82%	0.82	S	S	*	*			trans	80.2	103.7	135.2	0	0	0	0	0	119
54	K	26.3	Very low	25.5	Very low	214 Å²	214	167.4 Å²	167.4	93%	0.93	83%	0.826	S	S	*	*				-168.7	121.9	108.4	-100.9	159.6	-172.5	175.7	0	112
55	V	23.6	Very low	25.6	Very low	120 Å²	120	163.3 Å²	163.3	73%	0.727	82%	0.819	S	S	*	*			trans	-74.7	135.9	173.5	174.3	0	0	0	0	110.1	Y57	V55-Y57 HydrophobicContact CG1-CD2 4.29Å; V55-Y57 HydrophobicContact CG1-CE2 3.96Å
56	K	28.4	Very low	25.4	Very low	204 Å²	204	161.9 Å²	161.9	89%	0.887	82%	0.816	S	S	*	*			trans	-156.4	148	148	-109.8	167.5	-172.1	-175.9	0	110.8
57	Y	26.8	Very low	25.4	Very low	202 Å²	202	162.1 Å²	162.1	79%	0.792	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-86.9	157.5	-152.9	-78.6	-98.4	0	0	0	115.6	V55	V55-Y57 HydrophobicContact CG1-CD2 4.29Å; V55-Y57 HydrophobicContact CG1-CE2 3.96Å
58	P	29.6	Very low	25.3	Very low	113 Å²	113	157.9 Å²	157.9	73%	0.734	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-77.9	144.3	175.9	32.9	-35.2	0	0	0	112.5
59	R	28.9	Very low	25.5	Very low	257 Å²	257	162.5 Å²	162.5	97%	0.97	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-91.8	136.8	166.2	-89.1	-177.6	170	164.3	-3.5	110.7
60	K	25.1	Very low	25.4	Very low	182 Å²	182	161.2 Å²	161.2	79%	0.791	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-94.7	144.9	-175.4	-74	-179.4	175.2	-179.5	0	112.1
61	N	24.4	Very low	25.6	Very low	140 Å²	140	164.8 Å²	164.8	75%	0.749	82%	0.823	S	S	*	*			trans	60.4	160.1	137.8	-56.8	8.7	0	0	0	121.3
62	K	25.5	Very low	25.6	Very low	175 Å²	175	159.7 Å²	159.7	76%	0.761	81%	0.814	S	S	*	*			trans	86.9	135.6	160.2	-59.9	-173.6	148.8	-89.5	0	116.5
63	D	29.1	Very low	25.7	Very low	128 Å²	128	156.3 Å²	156.3	68%	0.684	81%	0.811	S	S	*	*			cis	-152.9	163.1	-12.7	-96.2	-30.6	0	0	0	108.4
64	E	23.1	Very low	25.7	Very low	202 Å²	202	158.2 Å²	158.2	94%	0.944	81%	0.813	S	S	*	*			trans	-68.2	142.2	171	-65.8	172.8	144.1	0	0	111
65	G	27.8	Very low	25.5	Very low	67 Å²	67	155.5 Å²	155.5	69%	0.691	81%	0.809	S	S	*	*			trans	-156	83.8	-174.5	0	0	0	0	0	112.2
66	S	24.8	Very low	25.5	Very low	113 Å²	113	158.5 Å²	158.5	79%	0.79	82%	0.815	S	S	*	*			trans	-48.5	128.7	177	46.6	0	0	0	0	114.8
67	F	27.5	Very low	25.4	Very low	202 Å²	202	157.7 Å²	157.7	89%	0.886	81%	0.814	S	S	*	*			trans	-120	90.3	159.2	-98.6	-85.4	0	0	0	110.4
68	S	22.8	Very low	25.3	Very low	113 Å²	113	157.5 Å²	157.5	79%	0.79	82%	0.817	S	S	*	*			trans	-83.9	123.8	162	-53.8	0	0	0	0	108.4
69	K	27.3	Very low	25	Very low	195 Å²	195	157.7 Å²	157.7	85%	0.848	82%	0.818	S	S	*	*			trans	-149.3	124.1	158.3	-126.2	174.6	-175.5	179.9	0	111
70	E	23	Very low	24.9	Very low	190 Å²	190	155.4 Å²	155.4	89%	0.888	82%	0.815	S	S	*	*			trans	-67.6	139.7	-176.9	-60.8	143.3	130.6	0	0	110.5
71	I	26.2	Very low	24.9	Very low	168 Å²	168	152.9 Å²	152.9	86%	0.862	82%	0.816	S	S	*	*			trans	-119.5	112	157.6	-63	-179.6	0	0	0	106.2	S73	I71-S73 PolarHBondContact O-N 3.05Å
72	S	24.1	Very low	24.9	Very low	109 Å²	109	154.1 Å²	154.1	76%	0.762	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-59.5	128.1	-176.3	48.3	0	0	0	0	112.2
73	S	22.7	Very low	24.8	Very low	120 Å²	120	153.9 Å²	153.9	84%	0.839	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-63	128.1	170.5	51.4	0	0	0	0	112.1	I71	I71-S73 PolarHBondContact O-N 3.05Å
74	S	22.6	Very low	24.5	Very low	108 Å²	108	157.2 Å²	157.2	76%	0.755	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-100	135.5	168.4	57.2	0	0	0	0	111.3	H76	S74-H76 PolarHBondContact O-N 2.91Å
75	D	22.5	Very low	24.5	Very low	157 Å²	157	154.3 Å²	154.3	84%	0.84	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-64.7	125.7	-174	-64.6	-77	0	0	0	114.7
76	H	24.2	Very low	24.3	Very low	184 Å²	184	158.5 Å²	158.5	85%	0.852	83%	0.83	S	S	*	*			trans	-126.3	110.7	157.1	-91	23.5	0	0	0	110.8	S74	S74-H76 PolarHBondContact O-N 2.91Å
77	H	25	Very low	24.3	Very low	186 Å²	186	158.5 Å²	158.5	86%	0.861	83%	0.825	S	S	*	*			trans	-7.4	115.9	176.5	-67.3	-76.6	0	0	0	120.1
78	K	25.7	Very low	24.3	Very low	199 Å²	199	156.5 Å²	156.5	87%	0.865	82%	0.823	S	S	*	*			trans	-61.1	130.4	161.2	-67.8	172.2	177.8	171.1	0	111.1
79	P	22.7	Very low	24.4	Very low	116 Å²	116	158.4 Å²	158.4	75%	0.753	82%	0.824	S	S	*	*			trans	-69.6	139	167.2	29.1	-32.7	0	0	0	110.4	T81	P79-T81 PolarHBondContact O-N 2.86Å; P79-T81 VanDerWaalsContact O-N 3.1Å
80	K	25.8	Very low	24.2	Very low	209 Å²	209	152.8 Å²	152.8	91%	0.909	82%	0.822	S	S	*	*			trans	-64.9	108.8	-176.7	-71.4	177.4	177.5	176.2	0	111.2	L82	K80-L82 PolarHBondContact O-N 2.83Å
81	T	25.8	Very low	24.4	Very low	130 Å²	130	150.6 Å²	150.6	80%	0.798	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-69.3	119.1	169	-38	0	0	0	0	109.2	P79 Q83	P79-T81 PolarHBondContact O-N 2.86Å; P79-T81 VanDerWaalsContact O-N 3.1Å; T81-Q83 PolarHBondContact O-N 3.48Å
82	L	23.5	Very low	24.3	Very low	166 Å²	166	151.7 Å²	151.7	87%	0.869	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-61.3	122.3	171.5	-80.5	162	0	0	0	109.2	K80 H84	K80-L82 PolarHBondContact O-N 2.83Å; L82-H84 PolarHBondContact O-N 3.19Å
83	Q	24.9	Very low	24.3	Very low	169 Å²	169	155.8 Å²	155.8	79%	0.79	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-69.3	118.3	-176.4	-75.7	177.1	-30.5	0	0	110.7	T81 L85	T81-Q83 PolarHBondContact O-N 3.48Å; Q83-L85 VanDerWaalsContact C-N 3.34Å; Q83-L85 PolarHBondContact O-N 2.98Å
84	H	23.1	Very low	24.4	Very low	198 Å²	198	160.1 Å²	160.1	92%	0.917	83%	0.826	S	S	*	*			trans	-78.5	83	175.7	-143.2	-79.8	0	0	0	109.5	L82	L82-H84 PolarHBondContact O-N 3.19Å
85	L	21.8	Very low	24.4	Very low	142 Å²	142	160.7 Å²	160.7	74%	0.743	83%	0.831	S	S	*	*			trans	-102.3	87.8	-174.7	-122.8	171.4	0	0	0	111	Q83	Q83-L85 VanDerWaalsContact C-N 3.34Å; Q83-L85 PolarHBondContact O-N 2.98Å
86	L	25.1	Very low	24.5	Very low	155 Å²	155	162.3 Å²	162.3	81%	0.812	83%	0.83	S	S	*	*			trans	-178.2	112.6	139.8	-102.1	154.1	0	0	0	110.5
87	V	24.6	Very low	24.5	Very low	112 Å²	112	159.2 Å²	159.2	68%	0.679	83%	0.826	S	S	*	*			trans	-80.3	125.5	171.8	173	0	0	0	0	108.3	N89	V87-N89 WeakPolarHBondContact CG1-OD1 3.28Å
88	N	25.9	Very low	24.4	Very low	160 Å²	160	157.5 Å²	157.5	86%	0.856	82%	0.824	S	S	*	*			trans	-127.5	121.7	157.7	-101.7	-25.2	0	0	0	108.6
89	N	25.3	Very low	24.4	Very low	153 Å²	153	153.6 Å²	153.6	82%	0.818	82%	0.819	S	S	*	*			trans	-77.4	150.6	-166.5	-66.3	-44.3	0	0	0	112.5	V87	V87-N89 WeakPolarHBondContact CG1-OD1 3.28Å
90	G	24.3	Very low	24.6	Very low	77 Å²	77	155.7 Å²	155.7	79%	0.794	82%	0.822	S	S	*	*			trans	122.7	32.4	152.5	0	0	0	0	0	119.3
91	V	25.7	Very low	24.8	Very low	145 Å²	145	152 Å²	152	88%	0.879	81%	0.811	S	S	*	*			trans	-122.9	123	163.8	-175.3	0	0	0	0	110.2
92	K	25.1	Very low	24.9	Very low	190 Å²	190	154.3 Å²	154.3	83%	0.826	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-62.8	132.5	-173.4	-68.8	174.4	176.2	175.9	0	111.8	Y94	K92-Y94 PolarHBondContact O-N 3.16Å
93	E	24.5	Very low	25.1	Very low	195 Å²	195	152.7 Å²	152.7	91%	0.911	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-63.7	117.9	173.9	-66.2	178.5	120.6	0	0	111.1
94	Y	24	Very low	25.4	Very low	211 Å²	211	151.3 Å²	151.3	83%	0.827	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-80.5	123.6	156.8	-78.7	-88.5	0	0	0	108.2	K92 K96	K92-Y94 PolarHBondContact O-N 3.16Å; Y94-K96 PolarHBondContact O-N 2.94Å
95	S	22.7	Very low	25.6	Very low	121 Å²	121	149.1 Å²	149.1	85%	0.846	79%	0.794	S	S	*	*			trans	-55.5	100.2	177.4	53.7	0	0	0	0	111.4
96	K	25.4	Very low	25.8	Very low	191 Å²	191	147.1 Å²	147.1	83%	0.83	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-70.2	140.8	170	-77.9	177	176	173	0	109.4	Y94	Y94-K96 PolarHBondContact O-N 2.94Å
97	P	23.3	Very low	26	Very low	118 Å²	118	148.3 Å²	148.3	77%	0.766	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-66.7	142.8	175.9	28.8	-34.2	0	0	0	110.6
98	N	23.4	Very low	26.1	Very low	151 Å²	151	152 Å²	152	81%	0.807	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-54.3	124.8	-178.7	-77.1	-19.9	0	0	0	111.6	I100	N98-I100 PolarHBondContact O-N 3.11Å
99	P	26.4	Very low	26.1	Very low	117 Å²	117	149.1 Å²	149.1	76%	0.76	80%	0.795	S	S	*	*			trans	-73	108.7	170.4	29.9	-31.1	0	0	0	108.5	I101	P99-I101 PolarHBondContact O-N 3.29Å
100	I	26.3	Very low	26	Very low	160 Å²	160	149.6 Å²	149.6	82%	0.821	80%	0.797	S	S	*	*			trans	-63.2	130.7	171.3	-63.9	175.6	0	0	0	108	N98 F102	N98-I100 PolarHBondContact O-N 3.11Å; I100-F102 PolarHBondContact O-N 3.43Å
101	I	28.9	Very low	26	Very low	132 Å²	132	152.6 Å²	152.6	68%	0.677	80%	0.799	S	S	*	*			trans	-60.3	118.8	-164.4	-65.9	161.2	0	0	0	111	P99 N103	P99-I101 PolarHBondContact O-N 3.29Å; I101-N103 VanDerWaalsContact C-N 3.26Å; I101-N103 HydrophobicContact CG2-CB 3.96Å; I101-N103 PolarHBondContact O-N 3Å
102	F	27.8	Very low	25.8	Very low	178 Å²	178	148.8 Å²	148.8	78%	0.781	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	2.6	-176.6	-145.6	-92.6	0	0	0	113.8	I100	I100-F102 PolarHBondContact O-N 3.43Å
103	N	29.4	Very low	25.8	Very low	131 Å²	131	150 Å²	150	70%	0.701	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-25	-170.3	-85.7	6.2	0	0	0	115.3	I101 L105	I101-N103 VanDerWaalsContact C-N 3.26Å; I101-N103 HydrophobicContact CG2-CB 3.96Å; I101-N103 PolarHBondContact O-N 3Å; N103-L105 VanDerWaalsContact C-N 3.26Å; N103-L105 PolarHBondContact O-N 2.82Å
104	D	30.5	Very low	25.5	Very low	140 Å²	140	146.1 Å²	146.1	75%	0.749	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-16.8	-173.1	-75.9	-7.4	0	0	0	113.8
105	L	27	Very low	25.4	Very low	153 Å²	153	142.3 Å²	142.3	80%	0.801	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-11.9	-175.3	-135.8	80.1	0	0	0	114.8	N103	N103-L105 VanDerWaalsContact C-N 3.26Å; N103-L105 PolarHBondContact O-N 2.82Å
106	C	26.8	Very low	25.3	Very low	99 Å²	99	141.9 Å²	141.9	67%	0.669	79%	0.79	S	S	*	*	S	Bend	trans	-103.4	-4.7	-172.2	-76.6	0	0	0	0	115.9
107	Q	28.6	Very low	25.3	Very low	181 Å²	181	139 Å²	139	85%	0.846	78%	0.783	S	S	*	*	S	Bend	trans	-99.8	-5	-176.4	-75.9	-165	-13.5	0	0	116.1
108	Q	26.8	Very low	25.4	Very low	188 Å²	188	139.6 Å²	139.6	88%	0.879	79%	0.787	S	S	*	*	S	Bend	trans	-95.3	0.3	-178.8	-68.9	-168.9	-0.8	0	0	115.5
109	S	26.3	Very low	25.4	Very low	101 Å²	101	139.9 Å²	139.9	71%	0.706	78%	0.783	S	S	*	*	S	Bend	trans	-109	40.5	-176.3	68.1	0	0	0	0	114.1
110	L	23	Very low	25.4	Very low	163 Å²	163	138.8 Å²	138.8	85%	0.853	78%	0.784	S	S	*	*			trans	-155.1	52.3	-179	-114.8	166.9	0	0	0	115.3
111	T	24.6	Very low	25.2	Very low	139 Å²	139	137.7 Å²	137.7	85%	0.853	78%	0.779	S	S	*	*			trans	-130.9	111.1	159.3	53.8	0	0	0	0	108.7
112	G	21.4	Very low	25	Very low	66 Å²	66	139.6 Å²	139.6	68%	0.68	79%	0.785	S	S	*	*			trans	-82	178.2	-170	0	0	0	0	0	114.2
113	F	23.9	Very low	24.8	Very low	214 Å²	214	140.2 Å²	140.2	94%	0.939	79%	0.788	S	S	*	*			trans	-161.3	109.5	134.8	-98.4	-65.5	0	0	0	109.4
114	S	19.8	Very low	24.7	Very low	114 Å²	114	141.7 Å²	141.7	80%	0.797	79%	0.794	S	S	*	*			trans	-89.6	118.9	169.6	51.8	0	0	0	0	109.8
115	C	21.6	Very low	24.4	Very low	131 Å²	131	141.7 Å²	141.7	89%	0.885	79%	0.794	S	S	*	*			trans	-140	143.8	161	-87.1	0	0	0	0	110.4
116	S	21	Very low	24.2	Very low	112 Å²	112	139.1 Å²	139.1	78%	0.783	79%	0.789	S	S	*	*			trans	-94.5	152.5	-163.3	49.8	0	0	0	0	114.5
117	L	25.3	Very low	24.2	Very low	131 Å²	131	141.6 Å²	141.6	69%	0.686	80%	0.795	S	S	*	*			trans	36.6	130.9	143.5	-138.8	78.6	0	0	0	119.2	Q119	L117-Q119 HydrophobicContact CD1-CG 4.33Å; L117-Q119 HydrophobicContact CD2-CG 3.98Å; L117-Q119 HydrophobicContact CG-CG 4.2Å
118	P	23.6	Very low	23.9	Very low	131 Å²	131	139.3 Å²	139.3	85%	0.851	79%	0.788	S	S	*	*				-133.9	136.1	110.4	34.3	-24.9	0	0	0	113.8
119	Q	24.1	Very low	23.8	Very low	156 Å²	156	138 Å²	138	73%	0.729	78%	0.781	S	S	*	*			trans	-81.9	127.4	168.8	-75.1	165.9	-36.1	0	0	110.4	L117	L117-Q119 HydrophobicContact CD1-CG 4.33Å; L117-Q119 HydrophobicContact CD2-CG 3.98Å; L117-Q119 HydrophobicContact CG-CG 4.2Å
120	A	27.7	Very low	23.8	Very low	95 Å²	95	140.5 Å²	140.5	79%	0.785	79%	0.786	S	S	*	*			trans	-134.2	79.8	148.3	0	0	0	0	0	106
121	L	21.6	Very low	24.4	Very low	137 Å²	137	137.8 Å²	137.8	72%	0.717	78%	0.779	S	S	*	*				41.1	95.6	106.9	-80.6	164.5	0	0	0	110.9	K123	L121-K123 VanDerWaalsContact C-N 3.28Å; L121-K123 PolarHBondContact O-N 2.83Å
122	E	23.2	Very low	24.4	Very low	171 Å²	171	140.2 Å²	140.2	80%	0.799	78%	0.777	S	S	*	*				42.3	56.1	81	-65.8	-167.1	123.7	0	0	113.3
123	K	24.6	Very low	24.5	Very low	191 Å²	191	146 Å²	146	83%	0.83	78%	0.784	S	S	*	*			trans	-158.8	106.1	148.2	-96.4	169.4	-173.6	-179.2	0	103.9	L121	L121-K123 VanDerWaalsContact C-N 3.28Å; L121-K123 PolarHBondContact O-N 2.83Å
124	I	27.6	Very low	24.3	Very low	162 Å²	162	147.2 Å²	147.2	83%	0.831	78%	0.783	S	S	*	*			cis	-132.6	116.9	40.1	-66.9	110	0	0	0	110.7
125	N	22.9	Very low	24.4	Very low	141 Å²	141	145.9 Å²	145.9	75%	0.754	78%	0.778	S	S	*	*			trans	-82.5	160.2	152.6	-122.6	-27.5	0	0	0	108.1
126	S	24.6	Very low	24.3	Very low	99 Å²	99	146.2 Å²	146.2	69%	0.692	77%	0.771	S	S	*	*			trans	57.8	102.3	170.5	63.4	0	0	0	0	118.7
127	D	25.3	Very low	24.2	Very low	150 Å²	150	148.8 Å²	148.8	80%	0.802	77%	0.769	S	S	*	*				-161.8	139.1	123.1	-91.8	-20.2	0	0	0	107.1
128	I	23.4	Very low	24	Very low	134 Å²	134	150 Å²	150	69%	0.687	77%	0.771	S	S	*	*			cis	-168.9	150	-16.4	-113.3	168.5	0	0	0	104.1
129	H	24.3	Very low	23.9	Very low	159 Å²	159	149.2 Å²	149.2	74%	0.736	76%	0.764	S	S	*	*			trans	-2	138.6	163.5	-59.6	-90.1	0	0	0	119.9
130	N	26.1	Very low	23.7	Very low	154 Å²	154	148.2 Å²	148.2	82%	0.824	76%	0.764	S	S	*	*				-170.3	146	68.3	-121.8	-26.9	0	0	0	114
131	P	36.8	Very low	23.4	Very low	106 Å²	106	150.3 Å²	150.3	69%	0.688	76%	0.762	S	S	*	*			trans	-104	137.2	173.5	36.2	-28.6	0	0	0	113.3
132	K	23.8	Very low	23.4	Very low	191 Å²	191	148.4 Å²	148.4	83%	0.83	76%	0.759	S	S	*	*			trans	-169.2	147.1	151.6	-116.1	164.6	-171.8	176.7	0	115.7
133	F	23.1	Very low	23.3	Very low	188 Å²	188	148.2 Å²	148.2	83%	0.825	76%	0.763	S	S	*	*			trans	73.3	113.5	165	-83.1	-81.8	0	0	0	121.3
134	W	19.9	Very low	23.3	Very low	239 Å²	239	144.5 Å²	144.5	91%	0.905	76%	0.761	S	S	*	*			trans	-76.7	152.1	152.5	-60.8	17	0	0	0	109.8
135	A	21.3	Very low	22.9	Very low	85 Å²	85	144.6 Å²	144.6	70%	0.702	76%	0.76	S	S	*	*				173.4	106.8	128.7	0	0	0	0	0	112.1
136	D	20.7	Very low	23	Very low	138 Å²	138	145.9 Å²	145.9	74%	0.738	77%	0.767	S	S	*	*			trans	62	152.4	131.5	-51.6	-24	0	0	0	125.5
137	F	19.1	Very low	22.9	Very low	167 Å²	167	148.7 Å²	148.7	73%	0.732	77%	0.767	S	S	*	*			trans	72.7	98.8	160.9	-71.8	-73	0	0	0	121.6
138	Q	20.3	Very low	22.8	Very low	155 Å²	155	147.8 Å²	147.8	72%	0.724	76%	0.762	S	S	*	*				36.4	120.8	121.5	-55.2	176.8	-2.9	0	0	117.1
139	T	20.9	Very low	23.1	Very low	115 Å²	115	146.8 Å²	146.8	71%	0.706	77%	0.767	S	S	*	*				-179.9	149.9	79.4	30.6	0	0	0	0	112
140	N	20.7	Very low	23.5	Very low	136 Å²	136	144.9 Å²	144.9	73%	0.727	77%	0.769	S	S	*	*			trans	54.6	128.8	143.8	-58.2	-13.6	0	0	0	123.2
141	N	21.1	Very low	23.3	Very low	139 Å²	139	147.4 Å²	147.4	74%	0.743	77%	0.773	S	S	*	*			trans	76.1	97.1	138.6	-66.5	-5.4	0	0	0	121.6
142	S	21.7	Very low	22.7	Very low	96 Å²	96	148.4 Å²	148.4	67%	0.671	78%	0.776	S	S	*	*				83	142.7	115.8	72.9	0	0	0	0	121.1
143	L	22	Very low	22.6	Very low	167 Å²	167	144.6 Å²	144.6	87%	0.874	77%	0.774	S	S	*	*			trans	70.3	143.8	172.1	-60	129.1	0	0	0	114.4
144	S	22.7	Very low	22.7	Very low	114 Å²	114	140.9 Å²	140.9	80%	0.797	76%	0.762	S	S	*	*			cis	-146.3	175.9	17	62.4	0	0	0	0	113.6
145	M	19.2	Very low	22.9	Very low	163 Å²	163	139.3 Å²	139.3	80%	0.803	76%	0.762	S	S	*	*			trans	-63.2	148.4	-178.3	-64.9	-90.5	-165.1	0	0	114.1
146	N	26.9	Very low	23.1	Very low	169 Å²	169	144.4 Å²	144.4	90%	0.904	76%	0.764	S	S	*	*			trans	-147.4	152.1	130.2	-133.9	-18.6	0	0	0	111.8
147	K	21.3	Very low	23.3	Very low	157 Å²	157	146.9 Å²	146.9	68%	0.683	77%	0.771	S	S	*	*			trans	-109.4	169.7	-162.4	-60.1	179.2	170.7	178.6	0	114.6
148	D	23.4	Very low	23.5	Very low	132 Å²	132	144.4 Å²	144.4	71%	0.706	77%	0.765	S	S	*	*			trans	78.8	72.7	145.3	-57.9	-32.8	0	0	0	121.6
149	S	29.1	Very low	23.6	Very low	113 Å²	113	145.6 Å²	145.6	79%	0.79	77%	0.771	S	S	*	*				70.4	171.4	126.1	83.2	0	0	0	0	119.3
150	P	34	Very low	23.8	Very low	119 Å²	119	142.5 Å²	142.5	77%	0.773	76%	0.761	S	S	*	*			cis	-128.3	175.3	1.2	40.9	-24.2	0	0	0	116.4
151	K	21.3	Very low	24	Very low	207 Å²	207	142.4 Å²	142.4	90%	0.9	77%	0.766	S	S	*	*			trans	-73.9	130.2	-177	-63.5	167	176.4	174.4	0	112.7
152	V	24.5	Very low	24.3	Very low	126 Å²	126	146 Å²	146	76%	0.764	77%	0.769	S	S	*	*			trans	-110.3	118.1	153.2	174.5	0	0	0	0	108.4	N154	V152-N154 VanDerWaalsContact C-N 3.34Å; V152-N154 PolarHBondContact O-N 3.42Å
153	S	21.5	Very low	24.6	Very low	111 Å²	111	143.8 Å²	143.8	78%	0.776	76%	0.761	S	S	*	*			trans	-80.2	76.7	-177.7	57.6	0	0	0	0	111.8	K155	S153-K155 PolarHBondContact O-N 3.22Å
154	N	24.9	Very low	25.5	Very low	110 Å²	110	137 Å²	137	59%	0.588	73%	0.728	S	S	*	*			trans	-68.5	101.4	160	-78.4	-20.9	0	0	0	108.5	V152 Y156	V152-N154 VanDerWaalsContact C-N 3.34Å; V152-N154 PolarHBondContact O-N 3.42Å; N154-Y156 HydrophobicContact CB-CD2 3.6Å; N154-Y156 HydrophobicContact CB-CE2 3.58Å; N154-Y156 PolarHBondContact O-N 2.74Å
155	K	24.4	Very low	26.9	Very low	206 Å²	206	136.9 Å²	136.9	90%	0.896	72%	0.719	S	S	*	*			trans	-68.9	70.6	163	-79.8	-175.6	174.7	178.2	0	109.1	S153 H157	S153-K155 PolarHBondContact O-N 3.22Å; K155-H157 PolarHBondContact O-N 3.36Å
156	Y	24.8	Very low	28.6	Very low	193 Å²	193	131 Å²	131	76%	0.757	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-63.4	125.4	162.6	-81	-71.9	0	0	0	108.2	N154	N154-Y156 HydrophobicContact CB-CD2 3.6Å; N154-Y156 HydrophobicContact CB-CE2 3.58Å; N154-Y156 PolarHBondContact O-N 2.74Å
157	H	24.8	Very low	30.2	Very low	189 Å²	189	125.9 Å²	125.9	88%	0.875	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-65.3	134.9	-178.1	-134.3	13.2	0	0	0	109.1	K155 E159	K155-H157 PolarHBondContact O-N 3.36Å; H157-E159 PolarHBondContact O-N 3.44Å
158	L	23.1	Very low	32.1	Very low	116 Å²	116	121.5 Å²	121.5	61%	0.607	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-58.9	118.8	-175.2	-103.1	82	0	0	0	112.2	G160	L158-G160 PolarHBondContact O-N 3.15Å
159	E	24.1	Very low	34	Very low	180 Å²	180	121 Å²	121	84%	0.841	64%	0.639	S	S	*	*			trans	-73.7	68.5	156.8	-69.3	-173.4	149.7	0	0	110	H157 T161	H157-E159 PolarHBondContact O-N 3.44Å; E159-T161 PolarHBondContact O-N 2.68Å
160	G	24.8	Very low	35.6	Very low	50 Å²	50	121 Å²	121	52%	0.515	63%	0.626	S	S	.	*			trans	-66	116.7	165.3	0	0	0	0	0	109	L158 R162	L158-G160 PolarHBondContact O-N 3.15Å; G160-R162 PolarHBondContact O-N 3.4Å
161	T	24.9	Very low	37	Very low	134 Å²	134	116.6 Å²	116.6	82%	0.822	60%	0.598	S	S	*	*			trans	-53.8	99.1	-170.4	-12.8	0	0	0	0	111.8	E159 G163	E159-T161 PolarHBondContact O-N 2.68Å; T161-G163 PolarHBondContact O-N 2.79Å
162	R	27.4	Very low	38.7	Very low	213 Å²	213	112 Å²	112	80%	0.804	58%	0.583	S	S	*	*			trans	-63.2	110.9	175.4	-89.8	-176.5	170.7	173.7	-1	109.2	G160	G160-R162 PolarHBondContact O-N 3.4Å
163	G	28.4	Very low	39.9	Very low	50 Å²	50	106.7 Å²	106.7	52%	0.515	55%	0.552	S	S	.	*			trans	-53.8	149.2	166	0	0	0	0	0	111.1	T161 N165	T161-G163 PolarHBondContact O-N 2.79Å; G163-N165 PolarHBondContact O-N 3.05Å
164	S	39.5	Very low	41.3	Very low	26 Å²	26	104.9 Å²	104.9	18%	0.182	54%	0.537	C	S	.	.			trans	-66.4	70.5	-176.6	55.2	0	0	0	0	112.7	Q643 G661	S164-Q643 PolarHBondContact O-NE2 3.4Å; S164-G661 WeakPolarHBondContact CB-O 3.47Å
165	N	51.9	Low	42.5	Very low	110 Å²	110	100.3 Å²	100.3	59%	0.588	51%	0.514	S	S	*	.			trans	-75.9	140.1	-176.4	-70	-14.1	0	0	0	111.4	G163 G661	G163-N165 PolarHBondContact O-N 3.05Å; N165-G661 PolarHBondContact O-N 2.75Å
166	M	55.8	Low	43.5	Very low	40 Å²	40	96.5 Å²	96.5	20%	0.197	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	121.8	166.2	174.5	167.4	149.7	0	0	108.7	V168 T550 I626 C645 I658 S659 V660	M166-V168 HydrophobicContact CE-CG2 3.68Å; M166-V168 HydrophobicContact CG-CG2 4.45Å; M166-T550 HydrophobicContact CB-CG2 4.06Å; M166-I626 HydrophobicContact SD-CD1 4.27Å; M166-C645 HydrophobicContact CE-CB 3.64Å; M166-C645 HydrophobicContact SD-CB 4.23Å; M166-I658 HydrophobicContact CE-CD1 4.11Å; M166-I658 HydrophobicContact CE-CG2 3.58Å; M166-I658 HydrophobicContact CG-CG2 3.87Å; M166-I658 HydrophobicContact SD-CG2 3.98Å; M166-S659 CarbonylContact C-O 3.52Å; M166-S659 WeakPolarHBondContact CA-O 3.12Å; M166-V660 HydrophobicContact CB-CG2 4.4Å; M166-V660 HydrophobicContact CG-CG2 4.1Å; M166-V660 HydrophobicContact SD-CG2 4.34Å
167	V	60.1	Low	44.8	Very low	61 Å²	61	90.8 Å²	90.8	37%	0.37	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	118.4	179.7	-178.8	0	0	0	0	108.3	R169 S659	V167-R169 HydrophobicContact CG1-CG 4.27Å; V167-S659 PolarHBondContact N-O 3.33Å; V167-S659 PolarHBondContact O-N 2.93Å
168	V	60.8	Low	46.3	Very low	66 Å²	66	81.8 Å²	81.8	40%	0.4	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	129.1	174.7	-176.1	0	0	0	0	108.5	M166 L650 H656 H657 I658	M166-V168 HydrophobicContact CE-CG2 3.68Å; M166-V168 HydrophobicContact CG-CG2 4.45Å; V168-L650 HydrophobicContact CG1-CD2 4.35Å; V168-H656 HydrophobicContact CG1-CB 4.15Å; V168-H657 WeakPolarHBondContact CA-O 3.38Å; V168-I658 HydrophobicContact CG1-CG1 4.21Å; V168-I658 HydrophobicContact CG2-CD1 4.41Å; V168-I658 HydrophobicContact CG2-CG1 4.12Å; V168-I658 HydrophobicContact CG2-CG2 4.43Å
169	R	65.1	Low	47.7	Very low	120 Å²	120	76.3 Å²	76.3	45%	0.453	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.1	173.5	-62	-177.4	-179.4	-171.3	-0.5	108.7	V167 H656 H657	V167-R169 HydrophobicContact CG1-CG 4.27Å; R169-H656 CarbonylContact O-C 3.6Å; R169-H656 WeakPolarHBondContact O-CA 3.41Å; R169-H657 PolarHBondContact N-O 3.01Å; R169-H657 PolarHBondContact O-N 3.12Å
170	Q	62.1	Low	49.2	Very low	113 Å²	113	72.3 Å²	72.3	53%	0.528	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	140.9	166.3	-74.1	179	-22.1	0	0	109	K654 G655	Q170-K654 HydrophobicContact CB-CB 4.15Å; Q170-K654 HydrophobicContact CB-CD 4.03Å; Q170-K654 HydrophobicContact CG-CB 4.12Å; Q170-K654 HydrophobicContact CG-CD 4.47Å; Q170-G655 CarbonylContact C-O 3.56Å; Q170-G655 WeakPolarHBondContact CA-O 3.27Å
171	V	62.1	Low	50.6	Low	28 Å²	28	70.3 Å²	70.3	17%	0.17	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.7	176.8	-172.2	0	0	0	0	108.1	A173 Y596 G655 H657	V171-A173 PolarHBondContact O-N 2.97Å; V171-Y596 HydrophobicContact CG1-CD1 3.87Å; V171-G655 PolarHBondContact N-O 2.78Å; V171-G655 PolarHBondContact O-N 3.36Å; V171-H657 HydrophobicContact CG2-CB 3.43Å; V171-H657 VanDerWaalsContact CG2-CB 3.43Å
172	D	57.3	Low	51.9	Low	110 Å²	110	69 Å²	69	59%	0.588	36%	0.364	S	S	*	.			trans	-74	109.7	173.8	-63.5	-33	0	0	0	108.1	K654	D172-K654 WeakPolarHBondContact OD1-CD 3.46Å; D172-K654 VanDerWaalsContact OD1-CE 3.28Å; D172-K654 WeakPolarHBondContact OD1-CE 3.4Å; D172-K654 IonicContact OD1-NZ 2.7Å; D172-K654 PolarHBondContact OD1-NZ 3.01Å; D172-K654 IonicContact OD2-NZ 3.67Å
173	A	50.6	Low	53	Low	15 Å²	15	63.6 Å²	63.6	12%	0.124	36%	0.357	C	S	.	.			trans	-96.2	155.9	-179	0	0	0	0	0	110.9	V171 A175 M178 Y596	V171-A173 PolarHBondContact O-N 2.97Å; A173-A175 PolarHBondContact O-N 3.13Å; A173-M178 HydrophobicContact CB-CE 3.66Å; A173-M178 HydrophobicContact CB-CG 4.25Å; A173-M178 HydrophobicContact CB-SD 3.71Å; A173-Y596 HydrophobicContact CB-CE1 3.53Å
174	T	51.3	Low	54.1	Low	73 Å²	73	68.7 Å²	68.7	45%	0.448	37%	0.372	S	S	.	.			trans	-60.1	99.2	171.7	46.4	0	0	0	0	110.7	E176 T177 T595 Y596	T174-E176 VanDerWaalsContact C-N 3.35Å; T174-E176 PolarHBondContact O-N 2.64Å; T174-T177 PolarHBondContact O-N 2.96Å; T174-T177 PolarHBondContact O-OG1 2.99Å; T174-T595 HydrophobicContact CG2-CG2 3.51Å; T174-Y596 PolarHBondContact OG1-OH 3.37Å
175	A	48.6	Very low	54.5	Low	13 Å²	13	70.1 Å²	70.1	11%	0.107	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.2	-153.2	0	0	0	0	0	115.9	A173 T177 M178 W217 F653	A173-A175 PolarHBondContact O-N 3.13Å; A175-T177 PolarHBondContact O-N 3.25Å; A175-M178 HydrophobicContact CB-SD 4.26Å; A175-M178 WeakPolarHBondContact O-CB 3.45Å; A175-M178 PolarHBondContact O-N 3.17Å; A175-W217 HydrophobicContact CB-CD2 4.42Å; A175-W217 HydrophobicContact CB-CE3 4.35Å; A175-W217 HydrophobicContact CB-CH2 3.15Å; A175-W217 HydrophobicContact CB-CZ2 3.2Å; A175-W217 HydrophobicContact CB-CZ3 3.76Å; A175-F653 HydrophobicContact CB-CZ 4.15Å
176	E	47.2	Very low	54.6	Low	127 Å²	127	66.5 Å²	66.5	59%	0.593	36%	0.359	S	S	*	.	H	α-helix	trans	-53.1	-39.6	171.7	-63.3	-153.7	111.6	0	0	112.2	T174 M178 K236	T174-E176 VanDerWaalsContact C-N 3.35Å; T174-E176 PolarHBondContact O-N 2.64Å; E176-M178 VanDerWaalsContact C-N 3.27Å; E176-M178 PolarHBondContact O-N 3.44Å; E176-K236 IonicContact OE1-NZ 2.65Å; E176-K236 PolarHBondContact OE1-NZ 3.48Å; E176-K236 IonicContact OE2-NZ 3.58Å
177	T	51.9	Low	54.7	Low	72 Å²	72	67.5 Å²	67.5	44%	0.442	37%	0.374	S	S	.	.	H	α-helix	trans	-76.6	-9.3	179.7	63	0	0	0	0	114	T174 A175	T174-T177 PolarHBondContact O-N 2.96Å; T174-T177 PolarHBondContact O-OG1 2.99Å; A175-T177 PolarHBondContact O-N 3.25Å
178	M	55.6	Low	54.7	Low	1 Å²	1	69.2 Å²	69.2	1%	0.005	38%	0.381	C	S	.	.	H	α-helix	trans	-85.6	-37.1	-176.9	-59.7	-177.8	101.5	0	0	112	A173 A175 E176 F653 G655 W676 C677	A173-M178 HydrophobicContact CB-CE 3.66Å; A173-M178 HydrophobicContact CB-CG 4.25Å; A173-M178 HydrophobicContact CB-SD 3.71Å; A175-M178 HydrophobicContact CB-SD 4.26Å; A175-M178 WeakPolarHBondContact O-CB 3.45Å; A175-M178 PolarHBondContact O-N 3.17Å; E176-M178 VanDerWaalsContact C-N 3.27Å; E176-M178 PolarHBondContact O-N 3.44Å; M178-F653 WeakPolarHBondContact CE-O 3.43Å; M178-F653 HydrophobicContact SD-CE2 4.47Å; M178-F653 HydrophobicContact SD-CZ 4.37Å; M178-G655 VanDerWaalsContact CE-N 3.35Å; M178-W676 VanDerWaalsContact O-O 3.07Å; M178-C677 VanDerWaalsContact O-CA 3.22Å; M178-C677 WeakPolarHBondContact O-CA 3.49Å; M178-C677 PolarHBondContact O-SG 3.15Å
179	T	53	Low	54.7	Low	1 Å²	1	66.9 Å²	66.9	1%	0.006	37%	0.367	C	S	.	.	H	α-helix	trans	-73.2	-41.6	-176.9	-8.8	0	0	0	0	112.9	H218 L244 L679	T179-H218 VanDerWaalsContact CG2-NE2 3.26Å; T179-H218 WeakPolarHBondContact CG2-NE2 3.37Å; T179-H218 PolarHBondContact OG1-CE1 3.48Å; T179-H218 VanDerWaalsContact OG1-CE1 3.29Å; T179-H218 PolarHBondContact OG1-NE2 2.87Å; T179-L244 HydrophobicContact CG2-CD1 4.1Å; T179-L244 HydrophobicContact CG2-CD2 4.29Å; T179-L244 HydrophobicContact CG2-CG 4.47Å; T179-L679 HydrophobicContact CG2-CD1 3.84Å; T179-L679 HydrophobicContact CG2-CG 4.29Å; T179-L679 WeakPolarHBondContact O-CB 3.35Å; T179-L679 PolarHBondContact O-N 2.73Å
180	I	55.9	Low	54.6	Low	96 Å²	96	66.9 Å²	66.9	49%	0.492	38%	0.381	S	S	.	.			trans	-111.2	108.6	-170	-51	175.7	0	0	0	109.1
181	G	53.3	Low	54.7	Low	7 Å²	7	64.4 Å²	64.4	7%	0.072	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-85.4	173.4	170.7	0	0	0	0	0	112.6
182	L	53.3	Low	55.1	Low	107 Å²	107	66 Å²	66	56%	0.56	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-62.4	135.9	-178.8	-71	-179.3	0	0	0	112.6	I615 D681	L182-I615 HydrophobicContact CB-CD1 3.79Å; L182-I615 HydrophobicContact CD1-CD1 3.68Å; L182-I615 HydrophobicContact CG-CD1 3.79Å; L182-D681 VanDerWaalsContact O-OD1 3.08Å
183	P	50	Low	55.5	Low	100 Å²	100	70.4 Å²	70.4	65%	0.649	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	143.8	172.7	-28.4	36.5	0	0	0	114.9	C185 D681	P183-C185 VanDerWaalsContact C-N 3.3Å; P183-C185 PolarHBondContact O-N 2.85Å; P183-C185 PolarHBondContact O-SG 2.92Å; P183-C185 VanDerWaalsContact O-SG 3.32Å; P183-D681 WeakPolarHBondContact CA-OD1 3.35Å
184	N	50	Low	56.3	Low	156 Å²	156	74.1 Å²	74.1	83%	0.834	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	26.6	169	-77.7	-27.3	0	0	0	116.3	D681	N184-D681 VanDerWaalsContact N-CG 3.32Å; N184-D681 PolarHBondContact N-OD1 3.41Å
185	C	48.2	Very low	57.4	Low	57 Å²	57	71.9 Å²	71.9	39%	0.385	40%	0.4	S	S	.	.			trans	-94.5	0.2	-175.9	-67.8	0	0	0	0	114.8	P183 I615 D681	P183-C185 VanDerWaalsContact C-N 3.3Å; P183-C185 PolarHBondContact O-N 2.85Å; P183-C185 PolarHBondContact O-SG 2.92Å; P183-C185 VanDerWaalsContact O-SG 3.32Å; C185-I615 HydrophobicContact CB-CB 4.48Å; C185-I615 HydrophobicContact CB-CG2 4.33Å; C185-D681 PolarHBondContact N-OD2 3.42Å
186	R	55.2	Low	58.7	Low	33 Å²	33	73.2 Å²	73.2	13%	0.125	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-88.1	130.4	-172.4	-70.8	171.7	-175.3	-150.5	-5.1	114.3	Y493 G496 T497 S617 A680 D681	R186-Y493 PolarHBondContact NH1-O 3.37Å; R186-G496 PolarHBondContact NH2-O 3.33Å; R186-T497 HydrophobicContact CG-CG2 3.59Å; R186-S617 WeakPolarHBondContact CG-OG 3.46Å; R186-A680 PolarHBondContact NH2-O 3.44Å; R186-D681 VanDerWaalsContact CD-OD2 3.32Å; R186-D681 WeakPolarHBondContact CD-OD2 3.36Å; R186-D681 WeakPolarHBondContact CG-OD2 3.34Å; R186-D681 IonicContact NE-OD2 2.62Å
187	A	57	Low	59.8	Low	62 Å²	62	69.1 Å²	69.1	51%	0.512	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-65.3	136.6	152.8	0	0	0	0	0	109.9
188	L	61.1	Low	60.6	Low	97 Å²	97	70.1 Å²	70.1	51%	0.508	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-70.1	134.7	175.7	-63.6	176.4	0	0	0	110.1	T190 M687	L188-T190 PolarHBondContact O-N 3.46Å; L188-M687 HydrophobicContact CD1-CE 4.02Å; L188-M687 HydrophobicContact CD2-CE 3.73Å; L188-M687 HydrophobicContact CD2-SD 3.5Å; L188-M687 VanDerWaalsContact CD2-SD 3.5Å
189	P	60.1	Low	61.4	Low	17 Å²	17	72.1 Å²	72.1	11%	0.11	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-66.3	130.9	179.9	24.8	-32.1	0	0	0	111.5	V191 A489 E492 F689	P189-V191 PolarHBondContact O-N 2.83Å; P189-A489 WeakPolarHBondContact CG-O 3.17Å; P189-E492 HydrophobicContact CB-CB 4.04Å; P189-F689 HydrophobicContact CG-CD2 4.48Å; P189-F689 HydrophobicContact CG-CE1 4.39Å; P189-F689 HydrophobicContact CG-CE2 3.75Å; P189-F689 HydrophobicContact CG-CZ 3.7Å
190	T	64	Low	62.4	Low	120 Å²	120	72 Å²	72	74%	0.736	39%	0.393	S	S	*	.			trans	-78.6	115.3	177	-57.4	0	0	0	0	110.2	L188 Q192	L188-T190 PolarHBondContact O-N 3.46Å; T190-Q192 PolarHBondContact O-N 2.9Å
191	V	64.2	Low	63.3	Low	61 Å²	61	74 Å²	74	37%	0.37	40%	0.395	S	S	.	.			trans	-59.7	111	176.3	-174.3	0	0	0	0	109.9	P189 C485 A489 F689	P189-V191 PolarHBondContact O-N 2.83Å; V191-C485 HydrophobicContact CG1-CB 3.89Å; V191-A489 HydrophobicContact CB-CB 4.47Å; V191-A489 HydrophobicContact CG2-CB 3.79Å; V191-F689 HydrophobicContact CG2-CD1 3.8Å; V191-F689 HydrophobicContact CG2-CE1 4.34Å
192	Q	68.8	Low	64.2	Low	61 Å²	61	74.9 Å²	74.9	29%	0.285	40%	0.397	S	S	.	.			trans	-69.6	155.5	179.5	-61.6	-152.2	-8.5	0	0	112	T190 T194 R196 C485	T190-Q192 PolarHBondContact O-N 2.9Å; Q192-T194 VanDerWaalsContact C-N 3.33Å; Q192-R196 VanDerWaalsContact OE1-CD 3.27Å; Q192-C485 WeakPolarHBondContact O-CB 3.44Å; Q192-C485 PolarHBondContact O-SG 3.39Å
193	K	67.4	Low	65.6	Low	203 Å²	203	69.8 Å²	69.8	88%	0.883	37%	0.371	S	S	*	.	S	Bend	trans	-78.9	-16.1	176.5	-64.8	-174.4	179.7	-178	0	113.5
194	T	67	Low	67.2	Low	93 Å²	93	65.1 Å²	65.1	57%	0.571	34%	0.34	S	S	*	.	S	Bend	trans	-136.2	128	-173.8	50.7	0	0	0	0	110.6	Q192	Q192-T194 VanDerWaalsContact C-N 3.33Å
195	P	73.2	Confident	68.7	Low	25 Å²	25	60.8 Å²	60.8	16%	0.162	32%	0.317	C	S	.	.			trans	-75.3	143	-177.1	30.4	-35.5	0	0	0	112.5	I197 L481 L484 E488	P195-I197 HydrophobicContact CB-CG1 4.39Å; P195-I197 HydrophobicContact CG-CD1 4.32Å; P195-I197 PolarHBondContact O-N 3.46Å; P195-L481 HydrophobicContact CG-CD2 3.86Å; P195-L484 HydrophobicContact CB-CB 3.85Å; P195-L484 HydrophobicContact CG-CB 4.25Å; P195-L484 HydrophobicContact CG-CD1 4.24Å; P195-E488 WeakPolarHBondContact CA-OE1 3.45Å; P195-E488 WeakPolarHBondContact CB-OE1 3.41Å
196	R	76.3	Confident	70.3	Confident	41 Å²	41	60.8 Å²	60.8	16%	0.155	31%	0.311	C	S	.	.			trans	-101.2	41.6	-173.8	-67.2	162.8	-70.3	173.6	0.7	112.7	Q192 I198 R199 T200 E488 E492 I620	Q192-R196 VanDerWaalsContact OE1-CD 3.27Å; R196-I198 VanDerWaalsContact C-N 3.35Å; R196-I198 PolarHBondContact O-N 2.78Å; R196-R199 PolarHBondContact O-N 3.2Å; R196-T200 VanDerWaalsContact C-OG1 3.31Å; R196-T200 PolarHBondContact O-N 3.26Å; R196-T200 PolarHBondContact O-OG1 3.18Å; R196-T200 VanDerWaalsContact O-OG1 3.12Å; R196-E488 IonicContact CZ-OE2 2.8Å; R196-E488 PolarHBondContact N-OE1 2.9Å; R196-E488 PolarHBondContact N-OE2 3.07Å; R196-E488 IonicContact NE-OE2 3.54Å; R196-E488 PolarHBondContact NE-OE2 3.24Å; R196-E488 IonicContact NH2-OE2 3.16Å; R196-E488 PolarHBondContact NH2-OE2 2.88Å; R196-E492 IonicContact CZ-OE1 2.77Å; R196-E492 IonicContact NH1-OE1 3.38Å; R196-E492 PolarHBondContact NH1-OE1 2.86Å; R196-E492 IonicContact NH2-OE1 3.19Å; R196-E492 PolarHBondContact NH2-OE1 2.74Å; R196-E492 IonicContact NH2-OE2 2.7Å; R196-I620 HydrophobicContact CB-CG2 4.1Å
197	I	70.7	Confident	71.6	Confident	42 Å²	42	59.3 Å²	59.3	22%	0.215	31%	0.306	C	S	.	.	H	α-helix	trans	-30	-54.3	-167.2	-57.8	127.6	0	0	0	116.3	P195 R201 Y258 W262	P195-I197 HydrophobicContact CB-CG1 4.39Å; P195-I197 HydrophobicContact CG-CD1 4.32Å; P195-I197 PolarHBondContact O-N 3.46Å; I197-R201 WeakPolarHBondContact O-CB 3.25Å; I197-R201 PolarHBondContact O-N 3.14Å; I197-Y258 VanDerWaalsContact CA-OH 3.3Å; I197-Y258 WeakPolarHBondContact CA-OH 3.48Å; I197-Y258 HydrophobicContact CG2-CE1 4.47Å; I197-W262 HydrophobicContact CD1-CD2 4.48Å; I197-W262 HydrophobicContact CD1-CE3 3.9Å; I197-W262 HydrophobicContact CD1-CH2 3.55Å; I197-W262 HydrophobicContact CD1-CZ2 4.14Å; I197-W262 HydrophobicContact CD1-CZ3 3.39Å; I197-W262 HydrophobicContact CG1-CD2 4.3Å; I197-W262 HydrophobicContact CG1-CE3 4.03Å; I197-W262 HydrophobicContact CG1-CH2 4.34Å; I197-W262 HydrophobicContact CG1-CZ3 4.05Å; I197-W262 HydrophobicContact CG2-CD2 4.29Å; I197-W262 HydrophobicContact CG2-CZ2 4.29Å
198	I	67.7	Low	73.1	Confident	93 Å²	93	57.9 Å²	57.9	48%	0.477	29%	0.288	S	S	.	.	H	α-helix	trans	-65.4	-48.6	-177.9	-59.6	176.2	0	0	0	110.8	R196 R201 I202	R196-I198 VanDerWaalsContact C-N 3.35Å; R196-I198 PolarHBondContact O-N 2.78Å; I198-R201 PolarHBondContact O-N 3.12Å; I198-I202 HydrophobicContact CG2-CD1 4.28Å; I198-I202 WeakPolarHBondContact O-CG1 3.39Å; I198-I202 PolarHBondContact O-N 3.49Å; I198-I202 VanDerWaalsContact O-N 3.12Å
199	R	72.5	Confident	74.1	Confident	42 Å²	42	56.4 Å²	56.4	16%	0.158	28%	0.283	C	S	.	.	H	α-helix	trans	-69.5	-36.4	-178.5	-156.5	168.2	166.4	98.3	9.8	110.6	R196 R201 I202 F203 I620 D622 D646 L648	R196-R199 PolarHBondContact O-N 3.2Å; R199-R201 PolarHBondContact O-N 3.35Å; R199-I202 PolarHBondContact O-N 3.09Å; R199-F203 WeakPolarHBondContact O-CB 3.45Å; R199-F203 PolarHBondContact O-N 3.41Å; R199-I620 HydrophobicContact CB-CG2 3.86Å; R199-I620 WeakPolarHBondContact CD-O 3.42Å; R199-I620 HydrophobicContact CG-CG2 3.96Å; R199-I620 VanDerWaalsContact CG-O 3.28Å; R199-I620 WeakPolarHBondContact CG-O 3.42Å; R199-I620 PolarHBondContact NE-O 2.97Å; R199-D622 PolarHBondContact NH2-O 3.44Å; R199-D646 IonicContact CZ-OD1 3.42Å; R199-D646 IonicContact CZ-OD2 3.67Å; R199-D646 IonicContact NH1-OD2 2.63Å; R199-D646 PolarHBondContact NH1-OD2 3.19Å; R199-D646 VanDerWaalsContact NH2-CG 3.27Å; R199-D646 IonicContact NH2-OD1 2.82Å; R199-D646 PolarHBondContact NH2-OD1 3.44Å; R199-D646 IonicContact NH2-OD2 2.82Å; R199-D646 PolarHBondContact NH2-OD2 3.42Å; R199-L648 HydrophobicContact CG-CD1 3.9Å
200	T	75.5	Confident	75.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59	-44.3	171.2	-50.7	0	0	0	0	112.1	R196 F203 F204 Y258 E488 I620	R196-T200 VanDerWaalsContact C-OG1 3.31Å; R196-T200 PolarHBondContact O-N 3.26Å; R196-T200 PolarHBondContact O-OG1 3.18Å; R196-T200 VanDerWaalsContact O-OG1 3.12Å; T200-F203 WeakPolarHBondContact O-CB 3.13Å; T200-F203 PolarHBondContact O-N 2.9Å; T200-F204 HydrophobicContact CG2-CD2 3.97Å; T200-F204 HydrophobicContact CG2-CE2 3.67Å; T200-F204 VanDerWaalsContact O-CD2 3.27Å; T200-F204 WeakPolarHBondContact O-CD2 3.41Å; T200-F204 PolarHBondContact O-N 2.91Å; T200-Y258 HydrophobicContact CG2-CD2 4.49Å; T200-Y258 HydrophobicContact CG2-CE1 4.09Å; T200-Y258 HydrophobicContact CG2-CE2 3.98Å; T200-E488 HydrophobicContact CG2-CG 3.73Å; T200-E488 PolarHBondContact OG1-OE1 3.1Å; T200-I620 HydrophobicContact CG2-CD1 3.94Å
201	R	75	Confident	76.2	Confident	137 Å²	137	50 Å²	50	52%	0.517	24%	0.244	S	C	.	.	H	α-helix	trans	-66.1	-38.2	177.2	-170.3	178.5	-178.2	-161.4	-1.3	112.6	I197 I198 R199 N205	I197-R201 WeakPolarHBondContact O-CB 3.25Å; I197-R201 PolarHBondContact O-N 3.14Å; I198-R201 PolarHBondContact O-N 3.12Å; R199-R201 PolarHBondContact O-N 3.35Å; R201-N205 PolarHBondContact O-N 3.12Å; R201-N205 VanDerWaalsContact O-N 3.15Å
202	I	72.1	Confident	77.3	Confident	26 Å²	26	52.5 Å²	52.5	13%	0.133	25%	0.25	C	C	.	.	H	α-helix	trans	-65.2	-44.8	173.7	-64	167.5	0	0	0	110	I198 R199 F204 N205 Q206 V543 L648	I198-I202 HydrophobicContact CG2-CD1 4.28Å; I198-I202 WeakPolarHBondContact O-CG1 3.39Å; I198-I202 PolarHBondContact O-N 3.49Å; I198-I202 VanDerWaalsContact O-N 3.12Å; R199-I202 PolarHBondContact O-N 3.09Å; I202-F204 PolarHBondContact O-N 2.82Å; I202-N205 PolarHBondContact O-N 2.93Å; I202-N205 VanDerWaalsContact O-N 3.11Å; I202-Q206 HydrophobicContact CG2-CG 4.22Å; I202-Q206 WeakPolarHBondContact O-CG 3.49Å; I202-Q206 PolarHBondContact O-N 3.36Å; I202-V543 HydrophobicContact CD1-CG1 4.3Å; I202-V543 HydrophobicContact CD1-CG2 4.34Å; I202-L648 HydrophobicContact CG2-CD1 4.08Å
203	F	81.2	Confident	77.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-59	-46.4	177.2	-170.1	-123.5	0	0	0	112.4	R199 T200 N205 Q206 I207 T491 E492 S495 P618 I620 L648 I651	R199-F203 WeakPolarHBondContact O-CB 3.45Å; R199-F203 PolarHBondContact O-N 3.41Å; T200-F203 WeakPolarHBondContact O-CB 3.13Å; T200-F203 PolarHBondContact O-N 2.9Å; F203-N205 VanDerWaalsContact C-N 3.31Å; F203-N205 PolarHBondContact O-N 3.4Å; F203-Q206 PolarHBondContact O-N 2.97Å; F203-I207 HydrophobicContact CD1-CD1 3.55Å; F203-I207 HydrophobicContact CD2-CD1 3.87Å; F203-I207 HydrophobicContact CD2-CG1 4.33Å; F203-I207 HydrophobicContact CE1-CD1 3.45Å; F203-I207 VanDerWaalsContact CE1-CD1 3.45Å; F203-I207 HydrophobicContact CE2-CD1 3.79Å; F203-I207 HydrophobicContact CE2-CG1 4.38Å; F203-I207 HydrophobicContact CG-CD1 3.82Å; F203-I207 HydrophobicContact CZ-CD1 3.61Å; F203-I207 WeakPolarHBondContact O-CG1 3.48Å; F203-I207 PolarHBondContact O-N 2.93Å; F203-T491 HydrophobicContact CD1-CG2 3.91Å; F203-T491 HydrophobicContact CE1-CG2 4.04Å; F203-E492 HydrophobicContact CE1-CG 4.05Å; F203-E492 HydrophobicContact CZ-CG 4.47Å; F203-S495 VanDerWaalsContact CZ-CB 3.46Å; F203-P618 HydrophobicContact CE2-CB 4.13Å; F203-P618 HydrophobicContact CZ-CB 4.27Å; F203-I620 HydrophobicContact CB-CG1 4.06Å; F203-I620 HydrophobicContact CD1-CB 4.43Å; F203-I620 HydrophobicContact CD1-CD1 4.11Å; F203-I620 HydrophobicContact CD1-CG1 3.24Å; F203-I620 HydrophobicContact CE1-CD1 4.42Å; F203-I620 HydrophobicContact CE1-CG1 3.59Å; F203-I620 HydrophobicContact CG-CG1 3.75Å; F203-I620 HydrophobicContact CZ-CG1 4.35Å; F203-L648 HydrophobicContact CB-CD2 4.08Å; F203-L648 HydrophobicContact CD2-CD2 3.46Å; F203-L648 VanDerWaalsContact CD2-CD2 3.46Å; F203-L648 HydrophobicContact CE2-CD2 4.29Å; F203-L648 HydrophobicContact CG-CD2 4.23Å; F203-I651 HydrophobicContact CD2-CD1 4.19Å; F203-I651 HydrophobicContact CE2-CD1 3.96Å
204	F	85	Confident	78.7	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.009	21%	0.208	C	C	.	.	H	α-helix	trans	-54.4	-46.8	171.7	-83.2	-57.6	0	0	0	111.8	T200 I202 K208 I251 L254 E255 Y258 I487 T491	T200-F204 HydrophobicContact CG2-CD2 3.97Å; T200-F204 HydrophobicContact CG2-CE2 3.67Å; T200-F204 VanDerWaalsContact O-CD2 3.27Å; T200-F204 WeakPolarHBondContact O-CD2 3.41Å; T200-F204 PolarHBondContact O-N 2.91Å; I202-F204 PolarHBondContact O-N 2.82Å; F204-K208 VanDerWaalsContact O-CB 3.3Å; F204-K208 WeakPolarHBondContact O-CB 3.35Å; F204-K208 WeakPolarHBondContact O-CE 3.35Å; F204-K208 WeakPolarHBondContact O-CG 3.41Å; F204-K208 PolarHBondContact O-N 3.33Å; F204-I251 HydrophobicContact CD1-CG2 3.78Å; F204-I251 HydrophobicContact CE1-CG2 4.13Å; F204-L254 HydrophobicContact CE1-CB 4.2Å; F204-L254 HydrophobicContact CZ-CB 4.3Å; F204-E255 HydrophobicContact CB-CG 4.48Å; F204-E255 HydrophobicContact CD1-CB 3.93Å; F204-E255 HydrophobicContact CD2-CB 4.24Å; F204-E255 HydrophobicContact CD2-CG 4.18Å; F204-E255 HydrophobicContact CE1-CB 3.99Å; F204-E255 HydrophobicContact CE2-CB 4.29Å; F204-E255 HydrophobicContact CG-CB 4.08Å; F204-E255 HydrophobicContact CG-CG 4.18Å; F204-E255 HydrophobicContact CZ-CB 4.18Å; F204-Y258 HydrophobicContact CE2-CD1 4.4Å; F204-Y258 HydrophobicContact CE2-CG 4.17Å; F204-I487 HydrophobicContact CZ-CG2 4.28Å; F204-T491 HydrophobicContact CD1-CG2 3.83Å; F204-T491 HydrophobicContact CE1-CG2 3.43Å; F204-T491 VanDerWaalsContact CE1-CG2 3.43Å; F204-T491 WeakPolarHBondContact CE1-OG1 3.48Å; F204-T491 HydrophobicContact CZ-CG2 3.94Å; F204-T491 WeakPolarHBondContact CZ-OG1 3.47Å
205	N	81.3	Confident	79.5	Confident	64 Å²	64	39.4 Å²	39.4	34%	0.342	19%	0.186	S	C	.	.	H	α-helix	trans	-65	-43.9	179.6	-76.6	-14.9	0	0	0	112.6	R201 I202 F203 K208 T209	R201-N205 PolarHBondContact O-N 3.12Å; R201-N205 VanDerWaalsContact O-N 3.15Å; I202-N205 PolarHBondContact O-N 2.93Å; I202-N205 VanDerWaalsContact O-N 3.11Å; F203-N205 VanDerWaalsContact C-N 3.31Å; F203-N205 PolarHBondContact O-N 3.4Å; N205-K208 PolarHBondContact O-N 2.66Å; N205-K208 WeakPolarHBondContact OD1-CE 3.33Å; N205-K208 PolarHBondContact OD1-NZ 3.38Å; N205-T209 WeakPolarHBondContact O-CB 3.24Å; N205-T209 PolarHBondContact O-N 3.2Å; N205-T209 PolarHBondContact O-OG1 3Å
206	Q	80.6	Confident	80	Confident	58 Å²	58	44.8 Å²	44.8	27%	0.271	21%	0.209	S	C	.	.	H	α-helix	trans	-65.1	-47.4	178.9	-64.8	-64.5	-6.6	0	0	111.6	I202 F203 K208 T209 G210 L648	I202-Q206 HydrophobicContact CG2-CG 4.22Å; I202-Q206 WeakPolarHBondContact O-CG 3.49Å; I202-Q206 PolarHBondContact O-N 3.36Å; F203-Q206 PolarHBondContact O-N 2.97Å; Q206-K208 PolarHBondContact O-N 3.22Å; Q206-T209 PolarHBondContact O-N 3.16Å; Q206-T209 VanDerWaalsContact O-N 3.16Å; Q206-G210 PolarHBondContact O-N 3.31Å; Q206-L648 VanDerWaalsContact CG-O 3.28Å; Q206-L648 WeakPolarHBondContact CG-O 3.16Å
207	I	84.1	Confident	80.3	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-43.2	177.4	-63.1	164.2	0	0	0	111.3	F203 T209 G210 L211 I251 T491 I651 W676	F203-I207 HydrophobicContact CD1-CD1 3.55Å; F203-I207 HydrophobicContact CD2-CD1 3.87Å; F203-I207 HydrophobicContact CD2-CG1 4.33Å; F203-I207 HydrophobicContact CE1-CD1 3.45Å; F203-I207 VanDerWaalsContact CE1-CD1 3.45Å; F203-I207 HydrophobicContact CE2-CD1 3.79Å; F203-I207 HydrophobicContact CE2-CG1 4.38Å; F203-I207 HydrophobicContact CG-CD1 3.82Å; F203-I207 HydrophobicContact CZ-CD1 3.61Å; F203-I207 WeakPolarHBondContact O-CG1 3.48Å; F203-I207 PolarHBondContact O-N 2.93Å; I207-T209 VanDerWaalsContact C-N 3.27Å; I207-T209 PolarHBondContact O-N 3.32Å; I207-G210 PolarHBondContact O-N 3.36Å; I207-L211 HydrophobicContact CG2-CD1 3.78Å; I207-L211 HydrophobicContact CG2-CG 4.06Å; I207-L211 VanDerWaalsContact O-CB 3.27Å; I207-L211 WeakPolarHBondContact O-CB 3.42Å; I207-L211 VanDerWaalsContact O-CG 3.28Å; I207-L211 WeakPolarHBondContact O-CG 3.4Å; I207-L211 PolarHBondContact O-N 3.04Å; I207-I251 HydrophobicContact CG2-CD1 3.74Å; I207-T491 HydrophobicContact CD1-CG2 4.42Å; I207-I651 HydrophobicContact CG1-CG2 4.42Å; I207-W676 HydrophobicContact CG2-CH2 4.4Å; I207-W676 HydrophobicContact CG2-CZ2 4.25Å
208	K	87.8	Confident	80.9	Confident	32 Å²	32	44.2 Å²	44.2	14%	0.139	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-36	175.9	-76.6	177.5	-59	178.3	0	112.4	F204 N205 Q206 K212 L248 I251 R252 E255	F204-K208 VanDerWaalsContact O-CB 3.3Å; F204-K208 WeakPolarHBondContact O-CB 3.35Å; F204-K208 WeakPolarHBondContact O-CE 3.35Å; F204-K208 WeakPolarHBondContact O-CG 3.41Å; F204-K208 PolarHBondContact O-N 3.33Å; N205-K208 PolarHBondContact O-N 2.66Å; N205-K208 WeakPolarHBondContact OD1-CE 3.33Å; N205-K208 PolarHBondContact OD1-NZ 3.38Å; Q206-K208 PolarHBondContact O-N 3.22Å; K208-K212 VanDerWaalsContact O-CG 3.31Å; K208-K212 WeakPolarHBondContact O-CG 3.42Å; K208-K212 PolarHBondContact O-N 2.95Å; K208-L248 HydrophobicContact CB-CD1 4.18Å; K208-L248 HydrophobicContact CG-CD1 3.99Å; K208-I251 HydrophobicContact CG-CG2 4.27Å; K208-R252 HydrophobicContact CD-CG 4.39Å; K208-E255 WeakPolarHBondContact CD-OE2 3.47Å; K208-E255 WeakPolarHBondContact CE-OE2 3.41Å; K208-E255 IonicContact NZ-OE1 3.8Å; K208-E255 PolarHBondContact NZ-OE1 3.5Å; K208-E255 IonicContact NZ-OE2 3.78Å; K208-E255 PolarHBondContact NZ-OE2 2.93Å
209	T	82.4	Confident	81.7	Confident	67 Å²	67	42 Å²	42	41%	0.411	20%	0.195	S	C	.	.	H	α-helix	trans	-72	-53	178.2	-58.3	0	0	0	0	110.3	N205 Q206 I207 L211 K212 E213	N205-T209 WeakPolarHBondContact O-CB 3.24Å; N205-T209 PolarHBondContact O-N 3.2Å; N205-T209 PolarHBondContact O-OG1 3Å; Q206-T209 PolarHBondContact O-N 3.16Å; Q206-T209 VanDerWaalsContact O-N 3.16Å; I207-T209 VanDerWaalsContact C-N 3.27Å; I207-T209 PolarHBondContact O-N 3.32Å; T209-L211 VanDerWaalsContact C-N 3.31Å; T209-L211 PolarHBondContact O-N 3.13Å; T209-K212 WeakPolarHBondContact O-CB 3.32Å; T209-K212 PolarHBondContact O-N 3.37Å; T209-E213 PolarHBondContact O-N 3.05Å
210	G	82.9	Confident	82.2	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-59.5	-37.6	176.9	0	0	0	0	0	113.4	Q206 I207 K212 E213 H214	Q206-G210 PolarHBondContact O-N 3.31Å; I207-G210 PolarHBondContact O-N 3.36Å; G210-K212 VanDerWaalsContact C-N 3.34Å; G210-K212 PolarHBondContact O-N 2.86Å; G210-E213 PolarHBondContact O-N 2.92Å; G210-H214 PolarHBondContact O-CD2 3.38Å; G210-H214 PolarHBondContact O-N 3.23Å
211	L	85.4	Confident	82.4	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-36.2	173.8	-76.9	177.3	0	0	0	112.5	I207 T209 H214 I215 L244 R247 L248 I251 W676 P678	I207-L211 HydrophobicContact CG2-CD1 3.78Å; I207-L211 HydrophobicContact CG2-CG 4.06Å; I207-L211 VanDerWaalsContact O-CB 3.27Å; I207-L211 WeakPolarHBondContact O-CB 3.42Å; I207-L211 VanDerWaalsContact O-CG 3.28Å; I207-L211 WeakPolarHBondContact O-CG 3.4Å; I207-L211 PolarHBondContact O-N 3.04Å; T209-L211 VanDerWaalsContact C-N 3.31Å; T209-L211 PolarHBondContact O-N 3.13Å; L211-H214 PolarHBondContact O-N 3.3Å; L211-I215 WeakPolarHBondContact O-CD1 3.07Å; L211-I215 WeakPolarHBondContact O-CG1 3.45Å; L211-I215 PolarHBondContact O-N 2.79Å; L211-L244 HydrophobicContact CD2-CD2 3.75Å; L211-R247 HydrophobicContact CD1-CG 4.14Å; L211-L248 HydrophobicContact CB-CD1 4.29Å; L211-L248 HydrophobicContact CD1-CB 4.22Å; L211-L248 HydrophobicContact CD1-CD1 4.36Å; L211-I251 HydrophobicContact CD1-CD1 3.68Å; L211-W676 HydrophobicContact CD2-CH2 4.2Å; L211-W676 HydrophobicContact CG-CH2 4.08Å; L211-P678 HydrophobicContact CD2-CB 3.66Å; L211-P678 HydrophobicContact CD2-CG 4.26Å
212	K	85.9	Confident	82.7	Confident	113 Å²	113	41.6 Å²	41.6	49%	0.491	21%	0.206	S	C	.	.	H	α-helix	trans	-64.6	-44.4	172.9	-75.4	172.3	175	-170.4	0	111.3	K208 T209 G210 H214 I215 E216 L248	K208-K212 VanDerWaalsContact O-CG 3.31Å; K208-K212 WeakPolarHBondContact O-CG 3.42Å; K208-K212 PolarHBondContact O-N 2.95Å; T209-K212 WeakPolarHBondContact O-CB 3.32Å; T209-K212 PolarHBondContact O-N 3.37Å; G210-K212 VanDerWaalsContact C-N 3.34Å; G210-K212 PolarHBondContact O-N 2.86Å; K212-H214 VanDerWaalsContact C-N 3.33Å; K212-H214 PolarHBondContact O-N 2.84Å; K212-I215 PolarHBondContact O-N 3Å; K212-I215 VanDerWaalsContact O-N 3.13Å; K212-E216 WeakPolarHBondContact O-CB 2.95Å; K212-E216 PolarHBondContact O-N 3.23Å; K212-L248 HydrophobicContact CG-CD2 4.25Å
213	E	82.7	Confident	83.3	Confident	63 Å²	63	45.5 Å²	45.5	29%	0.294	22%	0.224	S	C	.	.	H	α-helix	trans	-58.2	-44.9	176.4	-64.3	169.8	-175.8	0	0	111.2	T209 G210 W217 T652 F653	T209-E213 PolarHBondContact O-N 3.05Å; G210-E213 PolarHBondContact O-N 2.92Å; E213-W217 WeakPolarHBondContact O-CB 3.29Å; E213-W217 PolarHBondContact O-N 3.34Å; E213-T652 WeakPolarHBondContact OE2-CA 3.35Å; E213-T652 WeakPolarHBondContact OE2-CB 3.36Å; E213-F653 HydrophobicContact CB-CB 3.62Å; E213-F653 PolarHBondContact OE2-N 2.96Å
214	H	82.5	Confident	83.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.1	-41.2	173.7	-87.5	-85.3	0	0	0	112.8	G210 L211 K212 H218 L244 F653 W676	G210-H214 PolarHBondContact O-CD2 3.38Å; G210-H214 PolarHBondContact O-N 3.23Å; L211-H214 PolarHBondContact O-N 3.3Å; K212-H214 VanDerWaalsContact C-N 3.33Å; K212-H214 PolarHBondContact O-N 2.84Å; H214-H218 WeakPolarHBondContact O-CB 3.23Å; H214-H218 PolarHBondContact O-CD2 3.18Å; H214-H218 VanDerWaalsContact O-CD2 3.29Å; H214-H218 PolarHBondContact O-N 3.47Å; H214-L244 HydrophobicContact CB-CD1 3.86Å; H214-L244 HydrophobicContact CB-CD2 4.13Å; H214-F653 AromaticContact CE1-CD2 3.7Å; H214-F653 AromaticContact CG-CD2 3.81Å; H214-F653 AromaticContact ND1-CD2 3.55Å; H214-W676 AromaticContact CD2-CE3 3.88Å; H214-W676 AromaticContact CD2-CZ3 3.64Å; H214-W676 AromaticContact NE2-CE3 3.64Å; H214-W676 AromaticContact NE2-CZ3 3.91Å
215	I	84.1	Confident	83.3	Confident	20 Å²	20	50 Å²	50	10%	0.103	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-46.6	178.5	-70.9	162.3	0	0	0	110.8	L211 K212 W217 H218 T219 L244 Q245 L248	L211-I215 WeakPolarHBondContact O-CD1 3.07Å; L211-I215 WeakPolarHBondContact O-CG1 3.45Å; L211-I215 PolarHBondContact O-N 2.79Å; K212-I215 PolarHBondContact O-N 3Å; K212-I215 VanDerWaalsContact O-N 3.13Å; I215-W217 VanDerWaalsContact C-N 3.34Å; I215-W217 PolarHBondContact O-N 2.81Å; I215-H218 PolarHBondContact O-N 3.14Å; I215-T219 VanDerWaalsContact O-CB 3.29Å; I215-T219 WeakPolarHBondContact O-CB 3.5Å; I215-T219 PolarHBondContact O-N 2.81Å; I215-T219 PolarHBondContact O-OG1 3.44Å; I215-L244 HydrophobicContact CD1-CB 4.11Å; I215-L244 HydrophobicContact CG1-CB 3.54Å; I215-L244 HydrophobicContact CG1-CD1 4.26Å; I215-Q245 HydrophobicContact CD1-CB 4.47Å; I215-L248 HydrophobicContact CD1-CB 4.31Å; I215-L248 HydrophobicContact CD1-CD2 3.72Å
216	E	85.3	Confident	83.5	Confident	138 Å²	138	52.5 Å²	52.5	65%	0.645	26%	0.256	S	S	*	.	H	α-helix	trans	-60.1	-43.9	178.4	-176.2	173.6	-176.4	0	0	111.3	K212 T219 T220	K212-E216 WeakPolarHBondContact O-CB 2.95Å; K212-E216 PolarHBondContact O-N 3.23Å; E216-T219 PolarHBondContact O-N 2.96Å; E216-T220 PolarHBondContact O-N 2.99Å; E216-T220 PolarHBondContact O-OG1 3Å
217	W	82.1	Confident	83.6	Confident	64 Å²	64	56 Å²	56	24%	0.242	28%	0.276	C	S	.	.	H	α-helix	trans	-65.3	-49.2	175.9	-175.3	84	0	0	0	112.7	A175 E213 I215 T219 T220 Q221 F653	A175-W217 HydrophobicContact CB-CD2 4.42Å; A175-W217 HydrophobicContact CB-CE3 4.35Å; A175-W217 HydrophobicContact CB-CH2 3.15Å; A175-W217 HydrophobicContact CB-CZ2 3.2Å; A175-W217 HydrophobicContact CB-CZ3 3.76Å; E213-W217 WeakPolarHBondContact O-CB 3.29Å; E213-W217 PolarHBondContact O-N 3.34Å; I215-W217 VanDerWaalsContact C-N 3.34Å; I215-W217 PolarHBondContact O-N 2.81Å; W217-T219 VanDerWaalsContact C-N 3.28Å; W217-T219 PolarHBondContact O-N 3.1Å; W217-T220 WeakPolarHBondContact O-CB 3.47Å; W217-T220 PolarHBondContact O-N 3.31Å; W217-T220 VanDerWaalsContact O-N 3.09Å; W217-Q221 HydrophobicContact CD2-CG 4.03Å; W217-Q221 HydrophobicContact CE3-CG 3.95Å; W217-Q221 HydrophobicContact CH2-CG 3.28Å; W217-Q221 HydrophobicContact CZ2-CG 3.35Å; W217-Q221 HydrophobicContact CZ3-CG 3.61Å; W217-Q221 PolarHBondContact O-N 3.12Å; W217-F653 HydrophobicContact CB-CD2 4.26Å; W217-F653 HydrophobicContact CB-CE1 4.35Å; W217-F653 HydrophobicContact CB-CE2 3.88Å; W217-F653 HydrophobicContact CB-CZ 3.94Å; W217-F653 AromaticContact CD1-CE1 3.71Å; W217-F653 AromaticContact CD1-CZ 3.48Å; W217-F653 VanDerWaalsContact CD1-CZ 3.48Å; W217-F653 HydrophobicContact CD2-CE1 4.35Å; W217-F653 AromaticContact CD2-CE2 3.6Å; W217-F653 HydrophobicContact CD2-CE2 3.6Å; W217-F653 AromaticContact CD2-CZ 3.37Å; W217-F653 HydrophobicContact CD2-CZ 3.37Å; W217-F653 AromaticContact CE2-CZ 3.7Å; W217-F653 AromaticContact CE3-CE2 3.79Å; W217-F653 HydrophobicContact CE3-CE2 3.79Å; W217-F653 AromaticContact CE3-CZ 4Å; W217-F653 HydrophobicContact CE3-CZ 4Å; W217-F653 HydrophobicContact CG-CD2 4.42Å; W217-F653 AromaticContact CG-CE1 3.86Å; W217-F653 HydrophobicContact CG-CE1 3.86Å; W217-F653 AromaticContact CG-CE2 3.61Å; W217-F653 HydrophobicContact CG-CE2 3.61Å; W217-F653 AromaticContact CG-CZ 3.28Å; W217-F653 HydrophobicContact CG-CZ 3.28Å; W217-F653 AromaticContact NE1-CZ 3.69Å
218	H	81.9	Confident	83.6	Confident	7 Å²	7	61 Å²	61	3%	0.032	30%	0.303	C	S	.	.	H	α-helix	trans	-65.5	-30.1	177.7	-86	-81.9	0	0	0	112.7	T179 H214 I215 Q221 L222 N240 V241	T179-H218 VanDerWaalsContact CG2-NE2 3.26Å; T179-H218 WeakPolarHBondContact CG2-NE2 3.37Å; T179-H218 PolarHBondContact OG1-CE1 3.48Å; T179-H218 VanDerWaalsContact OG1-CE1 3.29Å; T179-H218 PolarHBondContact OG1-NE2 2.87Å; H214-H218 WeakPolarHBondContact O-CB 3.23Å; H214-H218 PolarHBondContact O-CD2 3.18Å; H214-H218 VanDerWaalsContact O-CD2 3.29Å; H214-H218 PolarHBondContact O-N 3.47Å; I215-H218 PolarHBondContact O-N 3.14Å; H218-Q221 PolarHBondContact O-N 2.83Å; H218-L222 WeakPolarHBondContact O-CB 3.34Å; H218-L222 PolarHBondContact O-N 2.93Å; H218-N240 PolarHBondContact CE1-ND2 3.03Å; H218-V241 HydrophobicContact CB-CG2 3.58Å
219	T	84.7	Confident	83.4	Confident	46 Å²	46	67.5 Å²	67.5	28%	0.282	33%	0.334	S	S	.	.	H	α-helix	trans	-67.1	-38.1	171.8	-55.1	0	0	0	0	111.1	I215 E216 W217 L222 Q223	I215-T219 VanDerWaalsContact O-CB 3.29Å; I215-T219 WeakPolarHBondContact O-CB 3.5Å; I215-T219 PolarHBondContact O-N 2.81Å; I215-T219 PolarHBondContact O-OG1 3.44Å; E216-T219 PolarHBondContact O-N 2.96Å; W217-T219 VanDerWaalsContact C-N 3.28Å; W217-T219 PolarHBondContact O-N 3.1Å; T219-L222 WeakPolarHBondContact O-CB 3.39Å; T219-L222 PolarHBondContact O-N 3.29Å; T219-Q223 WeakPolarHBondContact O-CG 3.22Å; T219-Q223 PolarHBondContact O-N 3.26Å
220	T	83.8	Confident	83.5	Confident	72 Å²	72	67.6 Å²	67.6	44%	0.442	33%	0.332	S	S	.	.	H	α-helix	trans	-66.4	-39.1	174.5	-51.4	0	0	0	0	111.3	E216 W217 Q223 Q224	E216-T220 PolarHBondContact O-N 2.99Å; E216-T220 PolarHBondContact O-OG1 3Å; W217-T220 WeakPolarHBondContact O-CB 3.47Å; W217-T220 PolarHBondContact O-N 3.31Å; W217-T220 VanDerWaalsContact O-N 3.09Å; T220-Q223 PolarHBondContact O-N 2.87Å; T220-Q224 WeakPolarHBondContact O-CB 3.3Å; T220-Q224 PolarHBondContact O-N 3.2Å
221	Q	78.7	Confident	83.5	Confident	78 Å²	78	72.1 Å²	72.1	36%	0.364	36%	0.359	S	S	.	.	H	α-helix	trans	-66.5	-38.4	172.8	-66.1	-58.4	-70	0	0	113	W217 H218 Q224 A225 A237	W217-Q221 HydrophobicContact CD2-CG 4.03Å; W217-Q221 HydrophobicContact CE3-CG 3.95Å; W217-Q221 HydrophobicContact CH2-CG 3.28Å; W217-Q221 HydrophobicContact CZ2-CG 3.35Å; W217-Q221 HydrophobicContact CZ3-CG 3.61Å; W217-Q221 PolarHBondContact O-N 3.12Å; H218-Q221 PolarHBondContact O-N 2.83Å; Q221-Q224 PolarHBondContact O-N 3.23Å; Q221-A225 WeakPolarHBondContact O-CB 3.34Å; Q221-A225 PolarHBondContact O-N 3.39Å; Q221-A237 HydrophobicContact CB-CB 4.49Å
222	L	82	Confident	83.3	Confident	21 Å²	21	79 Å²	79	11%	0.11	39%	0.393	C	S	.	.	H	α-helix	trans	-59.2	-50	174.3	176.6	61.9	0	0	0	110.4	H218 T219 Q224 A225 E226 A234 A237 L238	H218-L222 WeakPolarHBondContact O-CB 3.34Å; H218-L222 PolarHBondContact O-N 2.93Å; T219-L222 WeakPolarHBondContact O-CB 3.39Å; T219-L222 PolarHBondContact O-N 3.29Å; L222-Q224 VanDerWaalsContact C-N 3.32Å; L222-Q224 PolarHBondContact O-N 3.5Å; L222-A225 PolarHBondContact O-N 3.15Å; L222-E226 HydrophobicContact CD1-CG 4.25Å; L222-E226 WeakPolarHBondContact O-CB 3.42Å; L222-E226 VanDerWaalsContact O-CG 3.28Å; L222-E226 WeakPolarHBondContact O-CG 3.37Å; L222-E226 PolarHBondContact O-N 2.76Å; L222-A234 HydrophobicContact CD1-CB 3.95Å; L222-A234 VanDerWaalsContact CD1-O 3.32Å; L222-A234 WeakPolarHBondContact CD1-O 3.33Å; L222-A237 HydrophobicContact CB-CB 4.05Å; L222-A237 HydrophobicContact CD1-CB 4.46Å; L222-L238 HydrophobicContact CD1-CB 4.11Å; L222-L238 HydrophobicContact CD2-CB 4.43Å; L222-L238 HydrophobicContact CD2-CD1 4.02Å
223	Q	85	Confident	83	Confident	108 Å²	108	76 Å²	76	51%	0.505	39%	0.386	S	S	.	.	H	α-helix	trans	-59.1	-41.2	176.5	-71.5	171.6	-7.6	0	0	112.4	T219 T220 L227	T219-Q223 WeakPolarHBondContact O-CG 3.22Å; T219-Q223 PolarHBondContact O-N 3.26Å; T220-Q223 PolarHBondContact O-N 2.87Å; Q223-L227 WeakPolarHBondContact O-CB 3.49Å; Q223-L227 WeakPolarHBondContact O-CD1 3.31Å; Q223-L227 VanDerWaalsContact O-CG 3.3Å; Q223-L227 WeakPolarHBondContact O-CG 3.37Å; Q223-L227 PolarHBondContact O-N 2.95Å
224	Q	83.3	Confident	82.9	Confident	88 Å²	88	73.6 Å²	73.6	41%	0.411	38%	0.377	S	S	.	.	H	α-helix	trans	-67.9	-43.2	177.3	-173.3	58.4	49.5	0	0	112	T220 Q221 L222 E226 L227 D228	T220-Q224 WeakPolarHBondContact O-CB 3.3Å; T220-Q224 PolarHBondContact O-N 3.2Å; Q221-Q224 PolarHBondContact O-N 3.23Å; L222-Q224 VanDerWaalsContact C-N 3.32Å; L222-Q224 PolarHBondContact O-N 3.5Å; Q224-E226 VanDerWaalsContact C-N 3.34Å; Q224-E226 PolarHBondContact O-N 3.22Å; Q224-L227 WeakPolarHBondContact O-CB 3.43Å; Q224-L227 PolarHBondContact O-N 2.93Å; Q224-D228 PolarHBondContact NE2-OD1 3.05Å; Q224-D228 PolarHBondContact NE2-OD2 2.82Å; Q224-D228 WeakPolarHBondContact O-CB 3.24Å; Q224-D228 VanDerWaalsContact O-CG 3.26Å; Q224-D228 PolarHBondContact O-N 2.67Å
225	A	83.3	Confident	82.8	Confident	9 Å²	9	78 Å²	78	7%	0.074	40%	0.4	C	S	.	.	H	α-helix	trans	-67.4	-33.1	176.7	0	0	0	0	0	112.6	Q221 L222 Q229 D230 A234	Q221-A225 WeakPolarHBondContact O-CB 3.34Å; Q221-A225 PolarHBondContact O-N 3.39Å; L222-A225 PolarHBondContact O-N 3.15Å; A225-Q229 CarbonylContact O-C 3.6Å; A225-Q229 PolarHBondContact O-N 2.8Å; A225-D230 PolarHBondContact O-N 3.16Å; A225-A234 HydrophobicContact CB-CB 3.91Å
226	E	84.2	Confident	82.6	Confident	116 Å²	116	81.4 Å²	81.4	54%	0.542	42%	0.415	S	S	.	.	H	α-helix	trans	-66.1	-41	170.7	-74.6	172.8	173.4	0	0	111.8	L222 Q224 Q229 A234	L222-E226 HydrophobicContact CD1-CG 4.25Å; L222-E226 WeakPolarHBondContact O-CB 3.42Å; L222-E226 VanDerWaalsContact O-CG 3.28Å; L222-E226 WeakPolarHBondContact O-CG 3.37Å; L222-E226 PolarHBondContact O-N 2.76Å; Q224-E226 VanDerWaalsContact C-N 3.34Å; Q224-E226 PolarHBondContact O-N 3.22Å; E226-Q229 PolarHBondContact O-N 3.12Å; E226-A234 HydrophobicContact CG-CB 4.37Å
227	L	84.6	Confident	82.4	Confident	130 Å²	130	75.2 Å²	75.2	68%	0.681	39%	0.387	S	S	*	.	H	α-helix	trans	-64.1	-42.7	173.3	-78.9	162	0	0	0	112.4	Q223 Q224 Q229	Q223-L227 WeakPolarHBondContact O-CB 3.49Å; Q223-L227 WeakPolarHBondContact O-CD1 3.31Å; Q223-L227 VanDerWaalsContact O-CG 3.3Å; Q223-L227 WeakPolarHBondContact O-CG 3.37Å; Q223-L227 PolarHBondContact O-N 2.95Å; Q224-L227 WeakPolarHBondContact O-CB 3.43Å; Q224-L227 PolarHBondContact O-N 2.93Å; L227-Q229 PolarHBondContact O-N 2.78Å
228	D	83	Confident	82.4	Confident	108 Å²	108	75.5 Å²	75.5	58%	0.578	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-2.3	179.3	-64.2	-30	0	0	0	113.2	Q224 D230	Q224-D228 PolarHBondContact NE2-OD1 3.05Å; Q224-D228 PolarHBondContact NE2-OD2 2.82Å; Q224-D228 WeakPolarHBondContact O-CB 3.24Å; Q224-D228 VanDerWaalsContact O-CG 3.26Å; Q224-D228 PolarHBondContact O-N 2.67Å; D228-D230 PolarHBondContact O-N 2.87Å
229	Q	82.7	Confident	82.4	Confident	167 Å²	167	79.5 Å²	79.5	78%	0.78	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	21.2	-175.9	-55.4	-174.7	-9.1	0	0	115	A225 E226 L227 V231	A225-Q229 CarbonylContact O-C 3.6Å; A225-Q229 PolarHBondContact O-N 2.8Å; E226-Q229 PolarHBondContact O-N 3.12Å; L227-Q229 PolarHBondContact O-N 2.78Å; Q229-V231 PolarHBondContact O-N 3.3Å
230	D	85.7	Confident	82.3	Confident	69 Å²	69	77.9 Å²	77.9	37%	0.369	40%	0.401	S	S	.	.			trans	-80.9	86.8	173.3	-175.7	-7.1	0	0	0	110.9	A225 D228 M232 S233 A234	A225-D230 PolarHBondContact O-N 3.16Å; D228-D230 PolarHBondContact O-N 2.87Å; D230-M232 PolarHBondContact O-N 3.02Å; D230-M232 WeakPolarHBondContact OD1-CB 3.47Å; D230-M232 PolarHBondContact OD1-N 3.06Å; D230-S233 VanDerWaalsContact CG-CB 3.47Å; D230-S233 VanDerWaalsContact CG-OG 3.32Å; D230-S233 PolarHBondContact O-N 3.44Å; D230-S233 PolarHBondContact OD1-N 3.32Å; D230-S233 WeakPolarHBondContact OD2-CB 3.28Å; D230-S233 PolarHBondContact OD2-OG 2.95Å; D230-A234 VanDerWaalsContact O-CB 3.29Å; D230-A234 WeakPolarHBondContact O-CB 3.42Å; D230-A234 PolarHBondContact O-N 3.16Å
231	V	82.9	Confident	82.3	Confident	97 Å²	97	75.4 Å²	75.4	59%	0.588	39%	0.386	S	S	*	.	H	α-helix	trans	-55.4	-32.1	176.7	179.9	0	0	0	0	112.6	Q229 N235	Q229-V231 PolarHBondContact O-N 3.3Å; V231-N235 VanDerWaalsContact O-CB 3.31Å; V231-N235 WeakPolarHBondContact O-CB 3.48Å; V231-N235 PolarHBondContact O-N 3.2Å; V231-N235 PolarHBondContact O-ND2 2.94Å
232	M	80.8	Confident	82.5	Confident	145 Å²	145	76.2 Å²	76.2	71%	0.714	39%	0.393	S	S	*	.	H	α-helix	trans	-75.9	-45.5	-177.8	-69.3	-59.5	-62.7	0	0	111.4	D230 K236	D230-M232 PolarHBondContact O-N 3.02Å; D230-M232 WeakPolarHBondContact OD1-CB 3.47Å; D230-M232 PolarHBondContact OD1-N 3.06Å; M232-K236 WeakPolarHBondContact O-CB 3.5Å; M232-K236 PolarHBondContact O-N 3.15Å; M232-K236 VanDerWaalsContact O-N 3.11Å
233	S	79	Confident	82.4	Confident	51 Å²	51	77.9 Å²	77.9	36%	0.357	40%	0.4	S	S	.	.	H	α-helix	trans	-66.6	-39.4	174.4	-66	0	0	0	0	111.8	D230 K236 A237	D230-S233 VanDerWaalsContact CG-CB 3.47Å; D230-S233 VanDerWaalsContact CG-OG 3.32Å; D230-S233 PolarHBondContact O-N 3.44Å; D230-S233 PolarHBondContact OD1-N 3.32Å; D230-S233 WeakPolarHBondContact OD2-CB 3.28Å; D230-S233 PolarHBondContact OD2-OG 2.95Å; S233-K236 PolarHBondContact O-N 2.75Å; S233-A237 WeakPolarHBondContact O-CB 3.29Å; S233-A237 PolarHBondContact O-N 3.18Å
234	A	80.6	Confident	82.5	Confident	12 Å²	12	72.8 Å²	72.8	10%	0.099	38%	0.376	C	S	.	.	H	α-helix	trans	-60.2	-49.7	174.8	0	0	0	0	0	111.7	L222 A225 E226 D230 K236 A237 L238	L222-A234 HydrophobicContact CD1-CB 3.95Å; L222-A234 VanDerWaalsContact CD1-O 3.32Å; L222-A234 WeakPolarHBondContact CD1-O 3.33Å; A225-A234 HydrophobicContact CB-CB 3.91Å; E226-A234 HydrophobicContact CG-CB 4.37Å; D230-A234 VanDerWaalsContact O-CB 3.29Å; D230-A234 WeakPolarHBondContact O-CB 3.42Å; D230-A234 PolarHBondContact O-N 3.16Å; A234-K236 VanDerWaalsContact C-N 3.33Å; A234-K236 PolarHBondContact O-N 2.81Å; A234-A237 PolarHBondContact O-N 3.16Å; A234-L238 WeakPolarHBondContact O-CB 3.27Å; A234-L238 PolarHBondContact O-N 2.96Å
235	N	81.9	Confident	82.5	Confident	91 Å²	91	71.8 Å²	71.8	49%	0.487	37%	0.371	S	S	.	.	H	α-helix	trans	-59.6	-41.4	177.2	-78.1	-33.9	0	0	0	112.6	V231 L238 E239	V231-N235 VanDerWaalsContact O-CB 3.31Å; V231-N235 WeakPolarHBondContact O-CB 3.48Å; V231-N235 PolarHBondContact O-N 3.2Å; V231-N235 PolarHBondContact O-ND2 2.94Å; N235-L238 PolarHBondContact O-N 3.07Å; N235-E239 PolarHBondContact O-N 3.08Å
236	K	78.4	Confident	82.4	Confident	93 Å²	93	75.6 Å²	75.6	40%	0.404	39%	0.387	S	S	.	.	H	α-helix	trans	-66.7	-42.2	177.4	-174.3	-177.5	-179.6	-175.9	0	112	E176 M232 S233 A234 N240	E176-K236 IonicContact OE1-NZ 2.65Å; E176-K236 PolarHBondContact OE1-NZ 3.48Å; E176-K236 IonicContact OE2-NZ 3.58Å; M232-K236 WeakPolarHBondContact O-CB 3.5Å; M232-K236 PolarHBondContact O-N 3.15Å; M232-K236 VanDerWaalsContact O-N 3.11Å; S233-K236 PolarHBondContact O-N 2.75Å; A234-K236 VanDerWaalsContact C-N 3.33Å; A234-K236 PolarHBondContact O-N 2.81Å; K236-N240 PolarHBondContact O-N 3.36Å; K236-N240 VanDerWaalsContact O-N 3.15Å; K236-N240 PolarHBondContact O-ND2 2.85Å
237	A	81.6	Confident	82.4	Confident	7 Å²	7	70.6 Å²	70.6	6%	0.058	36%	0.364	C	S	.	.	H	α-helix	trans	-62.7	-44.5	174	0	0	0	0	0	111	Q221 L222 S233 A234 N240 V241	Q221-A237 HydrophobicContact CB-CB 4.49Å; L222-A237 HydrophobicContact CB-CB 4.05Å; L222-A237 HydrophobicContact CD1-CB 4.46Å; S233-A237 WeakPolarHBondContact O-CB 3.29Å; S233-A237 PolarHBondContact O-N 3.18Å; A234-A237 PolarHBondContact O-N 3.16Å; A237-N240 WeakPolarHBondContact O-CB 3.47Å; A237-N240 PolarHBondContact O-N 3.29Å; A237-V241 WeakPolarHBondContact O-CG2 3.28Å; A237-V241 PolarHBondContact O-N 2.88Å
238	L	83.2	Confident	82.4	Confident	70 Å²	70	64.6 Å²	64.6	37%	0.366	33%	0.332	S	S	.	.	H	α-helix	trans	-63.2	-41.4	177.6	-176.6	60.3	0	0	0	112.8	L222 A234 N235 N240 V241 N242	L222-L238 HydrophobicContact CD1-CB 4.11Å; L222-L238 HydrophobicContact CD2-CB 4.43Å; L222-L238 HydrophobicContact CD2-CD1 4.02Å; A234-L238 WeakPolarHBondContact O-CB 3.27Å; A234-L238 PolarHBondContact O-N 2.96Å; N235-L238 PolarHBondContact O-N 3.07Å; L238-N240 VanDerWaalsContact C-N 3.34Å; L238-N240 PolarHBondContact O-N 3.47Å; L238-V241 PolarHBondContact O-N 2.91Å; L238-N242 WeakPolarHBondContact O-CB 3.48Å; L238-N242 VanDerWaalsContact O-CG 3.31Å; L238-N242 PolarHBondContact O-N 3.4Å; L238-N242 PolarHBondContact O-ND2 3.29Å
239	E	81.5	Confident	82.4	Confident	92 Å²	92	61 Å²	61	43%	0.43	31%	0.313	S	S	.	.	H	α-helix	trans	-59.1	-45.9	172.6	-170.4	-174	166.9	0	0	110.6	N235 N242 Q243 K683	N235-E239 PolarHBondContact O-N 3.08Å; E239-N242 PolarHBondContact O-N 3.22Å; E239-Q243 WeakPolarHBondContact O-CG 3.48Å; E239-Q243 PolarHBondContact O-N 3.44Å; E239-Q243 PolarHBondContact OE1-NE2 2.86Å; E239-K683 IonicContact OE1-NZ 3.96Å; E239-K683 PolarHBondContact OE1-NZ 3.38Å
240	N	82.1	Confident	82.3	Confident	12 Å²	12	53.9 Å²	53.9	6%	0.064	28%	0.281	C	S	.	.	H	α-helix	trans	-62.6	-46.5	177.8	-71.1	-41.6	0	0	0	112.3	H218 K236 A237 L238 N242 Q243 L244	H218-N240 PolarHBondContact CE1-ND2 3.03Å; K236-N240 PolarHBondContact O-N 3.36Å; K236-N240 VanDerWaalsContact O-N 3.15Å; K236-N240 PolarHBondContact O-ND2 2.85Å; A237-N240 WeakPolarHBondContact O-CB 3.47Å; A237-N240 PolarHBondContact O-N 3.29Å; L238-N240 VanDerWaalsContact C-N 3.34Å; L238-N240 PolarHBondContact O-N 3.47Å; N240-N242 VanDerWaalsContact C-N 3.32Å; N240-N242 PolarHBondContact O-N 3.01Å; N240-Q243 PolarHBondContact O-N 3.07Å; N240-L244 WeakPolarHBondContact O-CB 3.33Å; N240-L244 WeakPolarHBondContact O-CD1 3.26Å; N240-L244 WeakPolarHBondContact O-CG 3.45Å; N240-L244 PolarHBondContact O-N 3.18Å
241	V	83.8	Confident	82.3	Confident	19 Å²	19	50.6 Å²	50.6	12%	0.115	26%	0.263	C	S	.	.	H	α-helix	trans	-56.7	-47.1	175.8	171.7	0	0	0	0	110.4	H218 A237 L238 Q243 L244 Q245	H218-V241 HydrophobicContact CB-CG2 3.58Å; A237-V241 WeakPolarHBondContact O-CG2 3.28Å; A237-V241 PolarHBondContact O-N 2.88Å; L238-V241 PolarHBondContact O-N 2.91Å; V241-Q243 PolarHBondContact O-N 3.31Å; V241-L244 PolarHBondContact O-N 3.5Å; V241-Q245 WeakPolarHBondContact O-CB 3.43Å; V241-Q245 PolarHBondContact O-N 2.86Å
242	N	81.9	Confident	82.4	Confident	96 Å²	96	50.5 Å²	50.5	51%	0.513	25%	0.252	S	S	.	.	H	α-helix	trans	-63.2	-43.6	-179.9	-75.3	-40.5	0	0	0	112.4	L238 E239 N240 Q245 H246	L238-N242 WeakPolarHBondContact O-CB 3.48Å; L238-N242 VanDerWaalsContact O-CG 3.31Å; L238-N242 PolarHBondContact O-N 3.4Å; L238-N242 PolarHBondContact O-ND2 3.29Å; E239-N242 PolarHBondContact O-N 3.22Å; N240-N242 VanDerWaalsContact C-N 3.32Å; N240-N242 PolarHBondContact O-N 3.01Å; N242-Q245 PolarHBondContact O-N 3.07Å; N242-H246 WeakPolarHBondContact O-CB 3.35Å; N242-H246 PolarHBondContact O-N 3.41Å
243	Q	81.9	Confident	82.5	Confident	56 Å²	56	43.7 Å²	43.7	26%	0.262	22%	0.219	S	C	.	.	H	α-helix	trans	-65.2	-44.5	176.6	-71.4	-179.9	20	0	0	112.2	E239 N240 V241 Q245 H246 R247 L679	E239-Q243 WeakPolarHBondContact O-CG 3.48Å; E239-Q243 PolarHBondContact O-N 3.44Å; E239-Q243 PolarHBondContact OE1-NE2 2.86Å; N240-Q243 PolarHBondContact O-N 3.07Å; V241-Q243 PolarHBondContact O-N 3.31Å; Q243-Q245 PolarHBondContact O-N 2.82Å; Q243-H246 PolarHBondContact O-N 3Å; Q243-R247 WeakPolarHBondContact O-CB 3.37Å; Q243-R247 PolarHBondContact O-N 3.36Å; Q243-L679 HydrophobicContact CB-CD1 3.98Å; Q243-L679 HydrophobicContact CB-CD2 3.98Å
244	L	85.4	Confident	82.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.2	-40.7	176.2	-70	165.2	0	0	0	111.8	T179 L211 H214 I215 N240 V241 R247 L248 P678 L679	T179-L244 HydrophobicContact CG2-CD1 4.1Å; T179-L244 HydrophobicContact CG2-CD2 4.29Å; T179-L244 HydrophobicContact CG2-CG 4.47Å; L211-L244 HydrophobicContact CD2-CD2 3.75Å; H214-L244 HydrophobicContact CB-CD1 3.86Å; H214-L244 HydrophobicContact CB-CD2 4.13Å; I215-L244 HydrophobicContact CD1-CB 4.11Å; I215-L244 HydrophobicContact CG1-CB 3.54Å; I215-L244 HydrophobicContact CG1-CD1 4.26Å; N240-L244 WeakPolarHBondContact O-CB 3.33Å; N240-L244 WeakPolarHBondContact O-CD1 3.26Å; N240-L244 WeakPolarHBondContact O-CG 3.45Å; N240-L244 PolarHBondContact O-N 3.18Å; V241-L244 PolarHBondContact O-N 3.5Å; L244-R247 PolarHBondContact O-N 2.95Å; L244-L248 WeakPolarHBondContact O-CB 3.29Å; L244-L248 PolarHBondContact O-N 3.46Å; L244-P678 HydrophobicContact CD2-CB 4.22Å; L244-P678 HydrophobicContact CD2-CG 3.76Å; L244-L679 HydrophobicContact CD2-CD1 4.19Å; L244-L679 HydrophobicContact CD2-CD2 4.01Å; L244-L679 HydrophobicContact CD2-CG 3.92Å; L244-L679 HydrophobicContact CG-CD1 4.09Å; L244-L679 HydrophobicContact CG-CD2 4.36Å; L244-L679 HydrophobicContact CG-CG 4.34Å
245	Q	83.9	Confident	83.1	Confident	67 Å²	67	42.7 Å²	42.7	31%	0.313	21%	0.207	S	C	.	.	H	α-helix	trans	-69.2	-40	179.1	-174.2	57.5	68.2	0	0	112	I215 V241 N242 Q243 L248 N249	I215-Q245 HydrophobicContact CD1-CB 4.47Å; V241-Q245 WeakPolarHBondContact O-CB 3.43Å; V241-Q245 PolarHBondContact O-N 2.86Å; N242-Q245 PolarHBondContact O-N 3.07Å; Q243-Q245 PolarHBondContact O-N 2.82Å; Q245-L248 PolarHBondContact O-N 3.28Å; Q245-N249 PolarHBondContact NE2-OD1 3.21Å; Q245-N249 VanDerWaalsContact NE2-OD1 3.09Å; Q245-N249 WeakPolarHBondContact O-CB 3.44Å; Q245-N249 PolarHBondContact O-N 3.14Å; Q245-N249 PolarHBondContact O-ND2 2.67Å
246	H	81.1	Confident	83.1	Confident	89 Å²	89	42.2 Å²	42.2	41%	0.412	20%	0.202	S	C	.	.	H	α-helix	trans	-58.7	-48.8	169.9	-179.7	-114.3	0	0	0	110.7	N242 Q243 L248 N249 T250 D685	N242-H246 WeakPolarHBondContact O-CB 3.35Å; N242-H246 PolarHBondContact O-N 3.41Å; Q243-H246 PolarHBondContact O-N 3Å; H246-L248 PolarHBondContact O-N 3.48Å; H246-N249 WeakPolarHBondContact O-CB 3.29Å; H246-N249 PolarHBondContact O-N 2.93Å; H246-N249 VanDerWaalsContact O-N 3.11Å; H246-T250 PolarHBondContact O-N 2.83Å; H246-T250 PolarHBondContact O-OG1 2.6Å; H246-D685 IonicContact CE1-OD2 3.55Å
247	R	83.7	Confident	83.3	Confident	12 Å²	12	38.2 Å²	38.2	5%	0.045	18%	0.184	C	C	.	.	H	α-helix	trans	-59.5	-44.3	178.8	-173.2	55.2	142.9	-100.7	-26.6	112.9	L211 Q243 L244 N249 T250 I251 L494 P678 T682	L211-R247 HydrophobicContact CD1-CG 4.14Å; Q243-R247 WeakPolarHBondContact O-CB 3.37Å; Q243-R247 PolarHBondContact O-N 3.36Å; L244-R247 PolarHBondContact O-N 2.95Å; R247-N249 VanDerWaalsContact C-N 3.31Å; R247-N249 PolarHBondContact O-N 3.47Å; R247-T250 PolarHBondContact O-N 3.15Å; R247-I251 HydrophobicContact CG-CD1 3.96Å; R247-I251 WeakPolarHBondContact O-CB 3.48Å; R247-I251 VanDerWaalsContact O-CG1 3.32Å; R247-I251 WeakPolarHBondContact O-CG1 3.5Å; R247-I251 PolarHBondContact O-N 3.21Å; R247-L494 VanDerWaalsContact CZ-CD2 3.48Å; R247-L494 PolarHBondContact NE-O 3.45Å; R247-L494 PolarHBondContact NH2-O 3.2Å; R247-L494 VanDerWaalsContact NH2-O 3.1Å; R247-P678 PolarHBondContact NH2-O 3.39Å; R247-T682 PolarHBondContact NH1-OG1 3.42Å; R247-T682 PolarHBondContact NH2-OG1 3.13Å
248	L	86.1	Confident	83.6	Confident	3 Å²	3	38 Å²	38	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-61.4	-39.1	175.5	178.8	59.7	0	0	0	111.8	K208 L211 K212 I215 L244 Q245 H246 R252	K208-L248 HydrophobicContact CB-CD1 4.18Å; K208-L248 HydrophobicContact CG-CD1 3.99Å; L211-L248 HydrophobicContact CB-CD1 4.29Å; L211-L248 HydrophobicContact CD1-CB 4.22Å; L211-L248 HydrophobicContact CD1-CD1 4.36Å; K212-L248 HydrophobicContact CG-CD2 4.25Å; I215-L248 HydrophobicContact CD1-CB 4.31Å; I215-L248 HydrophobicContact CD1-CD2 3.72Å; L244-L248 WeakPolarHBondContact O-CB 3.29Å; L244-L248 PolarHBondContact O-N 3.46Å; Q245-L248 PolarHBondContact O-N 3.28Å; H246-L248 PolarHBondContact O-N 3.48Å; L248-R252 VanDerWaalsContact O-CG 3.29Å; L248-R252 WeakPolarHBondContact O-CG 3.46Å; L248-R252 PolarHBondContact O-N 3.3Å
249	N	81.7	Confident	83.7	Confident	32 Å²	32	37.6 Å²	37.6	17%	0.171	18%	0.179	C	C	.	.	H	α-helix	trans	-67.3	-45.4	177.1	-70.9	-17.1	0	0	0	112.1	Q245 H246 R247 I251 R252 C253 L701	Q245-N249 PolarHBondContact NE2-OD1 3.21Å; Q245-N249 VanDerWaalsContact NE2-OD1 3.09Å; Q245-N249 WeakPolarHBondContact O-CB 3.44Å; Q245-N249 PolarHBondContact O-N 3.14Å; Q245-N249 PolarHBondContact O-ND2 2.67Å; H246-N249 WeakPolarHBondContact O-CB 3.29Å; H246-N249 PolarHBondContact O-N 2.93Å; H246-N249 VanDerWaalsContact O-N 3.11Å; R247-N249 VanDerWaalsContact C-N 3.31Å; R247-N249 PolarHBondContact O-N 3.47Å; N249-I251 VanDerWaalsContact C-N 3.33Å; N249-I251 PolarHBondContact O-N 3.03Å; N249-R252 PolarHBondContact O-N 3.23Å; N249-C253 PolarHBondContact O-N 2.83Å; N249-L701 HydrophobicContact CB-CD2 4.12Å
250	T	81.8	Confident	83.7	Confident	19 Å²	19	37.7 Å²	37.7	12%	0.117	18%	0.178	C	C	.	.	H	α-helix	trans	-59.9	-43.1	175.7	-58.5	0	0	0	0	111.6	H246 R247 C253 L254 L494	H246-T250 PolarHBondContact O-N 2.83Å; H246-T250 PolarHBondContact O-OG1 2.6Å; R247-T250 PolarHBondContact O-N 3.15Å; T250-C253 PolarHBondContact O-N 2.86Å; T250-L254 HydrophobicContact CG2-CD1 4.38Å; T250-L254 WeakPolarHBondContact O-CG 3.45Å; T250-L254 PolarHBondContact O-N 3.44Å; T250-L494 HydrophobicContact CG2-CD1 3.89Å
251	I	85	Confident	83.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.6	-38.5	178.1	-70	168.1	0	0	0	111.8	F204 I207 K208 L211 R247 N249 C253 L254 E255 L494	F204-I251 HydrophobicContact CD1-CG2 3.78Å; F204-I251 HydrophobicContact CE1-CG2 4.13Å; I207-I251 HydrophobicContact CG2-CD1 3.74Å; K208-I251 HydrophobicContact CG-CG2 4.27Å; L211-I251 HydrophobicContact CD1-CD1 3.68Å; R247-I251 HydrophobicContact CG-CD1 3.96Å; R247-I251 WeakPolarHBondContact O-CB 3.48Å; R247-I251 VanDerWaalsContact O-CG1 3.32Å; R247-I251 WeakPolarHBondContact O-CG1 3.5Å; R247-I251 PolarHBondContact O-N 3.21Å; N249-I251 VanDerWaalsContact C-N 3.33Å; N249-I251 PolarHBondContact O-N 3.03Å; I251-C253 VanDerWaalsContact C-N 3.33Å; I251-C253 PolarHBondContact O-N 3.24Å; I251-L254 PolarHBondContact O-N 3Å; I251-E255 WeakPolarHBondContact O-CB 3.4Å; I251-E255 PolarHBondContact O-N 3.33Å; I251-L494 HydrophobicContact CD1-CB 4.41Å; I251-L494 HydrophobicContact CG1-CB 4.36Å; I251-L494 HydrophobicContact CG1-CD1 4.46Å
252	R	85.9	Confident	83.4	Confident	94 Å²	94	38.9 Å²	38.9	36%	0.355	18%	0.18	S	C	.	.	H	α-helix	trans	-62	-39.2	171.5	-74.3	172.9	-178	-167.3	4.4	112.3	K208 L248 N249 E255 H256 F700	K208-R252 HydrophobicContact CD-CG 4.39Å; L248-R252 VanDerWaalsContact O-CG 3.29Å; L248-R252 WeakPolarHBondContact O-CG 3.46Å; L248-R252 PolarHBondContact O-N 3.3Å; N249-R252 PolarHBondContact O-N 3.23Å; R252-E255 PolarHBondContact O-N 3.02Å; R252-H256 PolarHBondContact O-N 3.43Å; R252-F700 HydrophobicContact CB-CE1 3.97Å; R252-F700 HydrophobicContact CB-CZ 4.16Å
253	C	81.8	Confident	83.1	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.02	19%	0.185	C	C	.	.	H	α-helix	trans	-68.4	-39.7	177.4	-164.4	0	0	0	0	111.8	N249 T250 I251 H256 E257 L692 L697 F700	N249-C253 PolarHBondContact O-N 2.83Å; T250-C253 PolarHBondContact O-N 2.86Å; I251-C253 VanDerWaalsContact C-N 3.33Å; I251-C253 PolarHBondContact O-N 3.24Å; C253-H256 PolarHBondContact O-N 3.06Å; C253-E257 PolarHBondContact O-N 3.31Å; C253-L692 HydrophobicContact CB-CD1 4.39Å; C253-L692 HydrophobicContact CB-CD2 4.19Å; C253-L697 HydrophobicContact CB-CD1 3.71Å; C253-F700 HydrophobicContact CB-CD1 4.16Å; C253-F700 HydrophobicContact CB-CG 4.49Å
254	L	85.3	Confident	82.7	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-64.6	-41.8	173.8	-73.4	170.5	0	0	0	112.2	F204 T250 I251 H256 E257 Y258 I487 Q490 L494 Y690 L692	F204-L254 HydrophobicContact CE1-CB 4.2Å; F204-L254 HydrophobicContact CZ-CB 4.3Å; T250-L254 HydrophobicContact CG2-CD1 4.38Å; T250-L254 WeakPolarHBondContact O-CG 3.45Å; T250-L254 PolarHBondContact O-N 3.44Å; I251-L254 PolarHBondContact O-N 3Å; L254-H256 VanDerWaalsContact C-N 3.34Å; L254-H256 PolarHBondContact O-N 3.11Å; L254-E257 PolarHBondContact O-N 3.43Å; L254-Y258 VanDerWaalsContact O-CB 3.23Å; L254-Y258 WeakPolarHBondContact O-CB 3.16Å; L254-Y258 PolarHBondContact O-N 3.4Å; L254-I487 HydrophobicContact CB-CG2 4.15Å; L254-I487 HydrophobicContact CD2-CG1 4.43Å; L254-I487 HydrophobicContact CD2-CG2 4.11Å; L254-Q490 HydrophobicContact CD1-CB 4.36Å; L254-Q490 HydrophobicContact CD1-CG 3.88Å; L254-Q490 HydrophobicContact CD2-CG 4.33Å; L254-L494 HydrophobicContact CD1-CD1 3.36Å; L254-Y690 HydrophobicContact CD2-CD1 3.91Å; L254-L692 HydrophobicContact CD2-CD1 3.82Å; L254-L692 HydrophobicContact CG-CD1 4.28Å
255	E	87.8	Confident	82.3	Confident	39 Å²	39	42.7 Å²	42.7	18%	0.182	19%	0.193	C	C	.	.	H	α-helix	trans	-60.1	-43.7	173.5	-178.5	-177.8	-155.6	0	0	111.6	F204 K208 I251 R252 Y258 M259	F204-E255 HydrophobicContact CB-CG 4.48Å; F204-E255 HydrophobicContact CD1-CB 3.93Å; F204-E255 HydrophobicContact CD2-CB 4.24Å; F204-E255 HydrophobicContact CD2-CG 4.18Å; F204-E255 HydrophobicContact CE1-CB 3.99Å; F204-E255 HydrophobicContact CE2-CB 4.29Å; F204-E255 HydrophobicContact CG-CB 4.08Å; F204-E255 HydrophobicContact CG-CG 4.18Å; F204-E255 HydrophobicContact CZ-CB 4.18Å; K208-E255 WeakPolarHBondContact CD-OE2 3.47Å; K208-E255 WeakPolarHBondContact CE-OE2 3.41Å; K208-E255 IonicContact NZ-OE1 3.8Å; K208-E255 PolarHBondContact NZ-OE1 3.5Å; K208-E255 IonicContact NZ-OE2 3.78Å; K208-E255 PolarHBondContact NZ-OE2 2.93Å; I251-E255 WeakPolarHBondContact O-CB 3.4Å; I251-E255 PolarHBondContact O-N 3.33Å; R252-E255 PolarHBondContact O-N 3.02Å; E255-Y258 PolarHBondContact O-N 3.29Å; E255-M259 WeakPolarHBondContact O-CB 3.38Å; E255-M259 WeakPolarHBondContact O-CG 3.37Å; E255-M259 PolarHBondContact O-N 2.86Å
256	H	81.6	Confident	81.9	Confident	82 Å²	82	46.8 Å²	46.8	38%	0.38	21%	0.206	S	C	.	.	H	α-helix	trans	-62.2	-49.4	177.6	-178.6	88.6	0	0	0	112	R252 C253 L254 M259 K260 F700	R252-H256 PolarHBondContact O-N 3.43Å; C253-H256 PolarHBondContact O-N 3.06Å; L254-H256 VanDerWaalsContact C-N 3.34Å; L254-H256 PolarHBondContact O-N 3.11Å; H256-M259 PolarHBondContact O-N 2.89Å; H256-K260 WeakPolarHBondContact O-CB 3.41Å; H256-K260 PolarHBondContact O-N 3.13Å; H256-F700 HydrophobicContact CB-CD2 4.28Å; H256-F700 HydrophobicContact CB-CE2 3.82Å; H256-F700 HydrophobicContact CB-CZ 4.49Å; H256-F700 AromaticContact CG-CE2 3.86Å
257	E	83.1	Confident	81.4	Confident	8 Å²	8	46.9 Å²	46.9	4%	0.037	21%	0.207	C	C	.	.	H	α-helix	trans	-63.5	-40.5	176.1	-81.4	-80.1	123.2	0	0	111.7	C253 L254 M259 K260 H261 I487 Y690	C253-E257 PolarHBondContact O-N 3.31Å; L254-E257 PolarHBondContact O-N 3.43Å; E257-M259 PolarHBondContact O-N 2.9Å; E257-K260 WeakPolarHBondContact O-CB 3.03Å; E257-K260 PolarHBondContact O-N 2.75Å; E257-K260 WeakPolarHBondContact OE1-CD 3.27Å; E257-K260 IonicContact OE1-NZ 2.72Å; E257-K260 PolarHBondContact OE1-NZ 2.98Å; E257-H261 PolarHBondContact O-CD2 3.16Å; E257-H261 PolarHBondContact O-N 3.35Å; E257-H261 IonicContact OE2-CD2 2.99Å; E257-H261 IonicContact OE2-CE1 2.79Å; E257-H261 IonicContact OE2-NE2 2.68Å; E257-H261 PolarHBondContact OE2-NE2 3Å; E257-I487 HydrophobicContact CB-CD1 4.37Å; E257-Y690 PolarHBondContact OE2-OH 3.39Å
258	Y	87.6	Confident	80.7	Confident	3 Å²	3	47.3 Å²	47.3	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-57.3	-49.1	174.8	-169.6	-94	0	0	0	111.5	I197 T200 F204 L254 E255 K260 H261 W262 L484 I487 E488	I197-Y258 VanDerWaalsContact CA-OH 3.3Å; I197-Y258 WeakPolarHBondContact CA-OH 3.48Å; I197-Y258 HydrophobicContact CG2-CE1 4.47Å; T200-Y258 HydrophobicContact CG2-CD2 4.49Å; T200-Y258 HydrophobicContact CG2-CE1 4.09Å; T200-Y258 HydrophobicContact CG2-CE2 3.98Å; F204-Y258 HydrophobicContact CE2-CD1 4.4Å; F204-Y258 HydrophobicContact CE2-CG 4.17Å; L254-Y258 VanDerWaalsContact O-CB 3.23Å; L254-Y258 WeakPolarHBondContact O-CB 3.16Å; L254-Y258 PolarHBondContact O-N 3.4Å; E255-Y258 PolarHBondContact O-N 3.29Å; Y258-K260 VanDerWaalsContact C-N 3.28Å; Y258-K260 PolarHBondContact O-N 3Å; Y258-H261 PolarHBondContact O-N 2.54Å; Y258-W262 VanDerWaalsContact O-CB 3.26Å; Y258-W262 WeakPolarHBondContact O-CB 3.27Å; Y258-W262 PolarHBondContact O-N 3.34Å; Y258-L484 HydrophobicContact CD1-CD2 4.33Å; Y258-L484 HydrophobicContact CD2-CD2 3.61Å; Y258-L484 HydrophobicContact CE1-CD2 4.31Å; Y258-L484 HydrophobicContact CE2-CB 3.99Å; Y258-L484 HydrophobicContact CE2-CD2 3.59Å; Y258-L484 HydrophobicContact CE2-CG 4.41Å; Y258-L484 HydrophobicContact CG-CD2 4Å; Y258-L484 WeakPolarHBondContact O-CD2 3.49Å; Y258-I487 HydrophobicContact CD2-CB 4.01Å; Y258-I487 HydrophobicContact CD2-CG2 3.76Å; Y258-I487 HydrophobicContact CG-CG2 4.34Å; Y258-E488 HydrophobicContact CE2-CG 3.85Å; Y258-E488 PolarHBondContact OH-OE1 3.01Å
259	M	85.5	Confident	79.9	Confident	61 Å²	61	52.7 Å²	52.7	30%	0.3	23%	0.23	S	C	.	.	H	α-helix	trans	-65.5	-30.1	178.6	-71.9	-58.3	-58	0	0	112.9	E255 H256 E257 K263	E255-M259 WeakPolarHBondContact O-CB 3.38Å; E255-M259 WeakPolarHBondContact O-CG 3.37Å; E255-M259 PolarHBondContact O-N 2.86Å; H256-M259 PolarHBondContact O-N 2.89Å; E257-M259 PolarHBondContact O-N 2.9Å; M259-K263 VanDerWaalsContact O-CG 3.31Å; M259-K263 WeakPolarHBondContact O-CG 3.35Å; M259-K263 PolarHBondContact O-N 3.16Å; M259-K263 VanDerWaalsContact O-N 3.09Å
260	K	81	Confident	79.1	Confident	94 Å²	94	54 Å²	54	41%	0.409	25%	0.245	S	C	.	.	H	α-helix	trans	-72	-49.4	174.8	178.6	180	170	-169.9	0	111.9	H256 E257 Y258 W262 K263 L264	H256-K260 WeakPolarHBondContact O-CB 3.41Å; H256-K260 PolarHBondContact O-N 3.13Å; E257-K260 WeakPolarHBondContact O-CB 3.03Å; E257-K260 PolarHBondContact O-N 2.75Å; E257-K260 WeakPolarHBondContact OE1-CD 3.27Å; E257-K260 IonicContact OE1-NZ 2.72Å; E257-K260 PolarHBondContact OE1-NZ 2.98Å; Y258-K260 VanDerWaalsContact C-N 3.28Å; Y258-K260 PolarHBondContact O-N 3Å; K260-W262 VanDerWaalsContact C-N 3.28Å; K260-W262 PolarHBondContact O-N 2.81Å; K260-K263 PolarHBondContact O-N 3.3Å; K260-L264 HydrophobicContact CG-CD1 4.34Å; K260-L264 WeakPolarHBondContact O-CG 3.45Å; K260-L264 PolarHBondContact O-N 2.78Å
261	H	79.5	Confident	78	Confident	8 Å²	8	59.3 Å²	59.3	4%	0.037	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-33.7	174.9	-64.9	-55.4	0	0	0	111.8	E257 Y258 L264 Y265 L480 L484 Y690	E257-H261 PolarHBondContact O-CD2 3.16Å; E257-H261 PolarHBondContact O-N 3.35Å; E257-H261 IonicContact OE2-CD2 2.99Å; E257-H261 IonicContact OE2-CE1 2.79Å; E257-H261 IonicContact OE2-NE2 2.68Å; E257-H261 PolarHBondContact OE2-NE2 3Å; Y258-H261 PolarHBondContact O-N 2.54Å; H261-L264 PolarHBondContact O-N 3.44Å; H261-Y265 VanDerWaalsContact O-CB 3.3Å; H261-Y265 WeakPolarHBondContact O-CB 2.82Å; H261-Y265 PolarHBondContact O-N 3.38Å; H261-L480 HydrophobicContact CB-CD2 4.1Å; H261-L484 HydrophobicContact CB-CD2 3.94Å; H261-L484 HydrophobicContact CB-CG 4.32Å; H261-Y690 PolarHBondContact NE2-OH 2.76Å
262	W	80.1	Confident	76.6	Confident	49 Å²	49	61.3 Å²	61.3	19%	0.186	28%	0.277	C	S	.	.	H	α-helix	trans	-66.5	-42.5	174.1	175.1	-127.4	0	0	0	113	I197 Y258 K260 Y265 R266 L484	I197-W262 HydrophobicContact CD1-CD2 4.48Å; I197-W262 HydrophobicContact CD1-CE3 3.9Å; I197-W262 HydrophobicContact CD1-CH2 3.55Å; I197-W262 HydrophobicContact CD1-CZ2 4.14Å; I197-W262 HydrophobicContact CD1-CZ3 3.39Å; I197-W262 HydrophobicContact CG1-CD2 4.3Å; I197-W262 HydrophobicContact CG1-CE3 4.03Å; I197-W262 HydrophobicContact CG1-CH2 4.34Å; I197-W262 HydrophobicContact CG1-CZ3 4.05Å; I197-W262 HydrophobicContact CG2-CD2 4.29Å; I197-W262 HydrophobicContact CG2-CZ2 4.29Å; Y258-W262 VanDerWaalsContact O-CB 3.26Å; Y258-W262 WeakPolarHBondContact O-CB 3.27Å; Y258-W262 PolarHBondContact O-N 3.34Å; K260-W262 VanDerWaalsContact C-N 3.28Å; K260-W262 PolarHBondContact O-N 2.81Å; W262-Y265 AromaticContact CE3-CD1 3.74Å; W262-Y265 HydrophobicContact CE3-CD1 3.74Å; W262-Y265 HydrophobicContact CE3-CE1 4.47Å; W262-Y265 HydrophobicContact CH2-CD1 4.41Å; W262-Y265 AromaticContact CZ3-CD1 3.42Å; W262-Y265 HydrophobicContact CZ3-CD1 3.42Å; W262-Y265 VanDerWaalsContact CZ3-CD1 3.42Å; W262-Y265 AromaticContact CZ3-CE1 3.72Å; W262-Y265 HydrophobicContact CZ3-CE1 3.72Å; W262-Y265 PolarHBondContact O-N 2.97Å; W262-R266 WeakPolarHBondContact O-CB 3.43Å; W262-R266 PolarHBondContact O-N 2.95Å; W262-L484 HydrophobicContact CB-CD2 4.24Å; W262-L484 HydrophobicContact CE3-CD1 4.28Å
263	K	76.1	Confident	74.9	Confident	142 Å²	142	63.6 Å²	63.6	62%	0.617	29%	0.291	S	S	*	.	H	α-helix	trans	-61.5	-47.2	173.3	-77.8	175	178.3	-174.8	0	111.4	M259 K260 Y265 R266 E267	M259-K263 VanDerWaalsContact O-CG 3.31Å; M259-K263 WeakPolarHBondContact O-CG 3.35Å; M259-K263 PolarHBondContact O-N 3.16Å; M259-K263 VanDerWaalsContact O-N 3.09Å; K260-K263 PolarHBondContact O-N 3.3Å; K263-Y265 PolarHBondContact O-N 3.17Å; K263-R266 PolarHBondContact O-N 3.18Å; K263-E267 PolarHBondContact O-N 2.77Å
264	L	73	Confident	73.1	Confident	69 Å²	69	65.3 Å²	65.3	36%	0.361	31%	0.309	S	S	.	.	H	α-helix	trans	-59.7	-44.5	175.8	-75.9	161.5	0	0	0	112.1	K260 H261 R266 E267 I268 L480	K260-L264 HydrophobicContact CG-CD1 4.34Å; K260-L264 WeakPolarHBondContact O-CG 3.45Å; K260-L264 PolarHBondContact O-N 2.78Å; H261-L264 PolarHBondContact O-N 3.44Å; L264-R266 PolarHBondContact O-N 3.47Å; L264-E267 PolarHBondContact O-N 2.92Å; L264-I268 WeakPolarHBondContact O-CG1 3.41Å; L264-I268 PolarHBondContact O-N 2.76Å; L264-L480 HydrophobicContact CB-CD1 4.02Å; L264-L480 HydrophobicContact CB-CD2 4.44Å
265	Y	77.6	Confident	70.5	Confident	21 Å²	21	69.8 Å²	69.8	8%	0.082	33%	0.331	C	S	.	.	H	α-helix	trans	-61.6	-44	176.9	172	-95	0	0	0	111.6	H261 W262 K263 E267 R269 Q477 L480 L481	H261-Y265 VanDerWaalsContact O-CB 3.3Å; H261-Y265 WeakPolarHBondContact O-CB 2.82Å; H261-Y265 PolarHBondContact O-N 3.38Å; W262-Y265 AromaticContact CE3-CD1 3.74Å; W262-Y265 HydrophobicContact CE3-CD1 3.74Å; W262-Y265 HydrophobicContact CE3-CE1 4.47Å; W262-Y265 HydrophobicContact CH2-CD1 4.41Å; W262-Y265 AromaticContact CZ3-CD1 3.42Å; W262-Y265 HydrophobicContact CZ3-CD1 3.42Å; W262-Y265 VanDerWaalsContact CZ3-CD1 3.42Å; W262-Y265 AromaticContact CZ3-CE1 3.72Å; W262-Y265 HydrophobicContact CZ3-CE1 3.72Å; W262-Y265 PolarHBondContact O-N 2.97Å; K263-Y265 PolarHBondContact O-N 3.17Å; Y265-E267 VanDerWaalsContact C-N 3.34Å; Y265-E267 PolarHBondContact O-N 3.25Å; Y265-R269 WeakPolarHBondContact O-CB 3.33Å; Y265-R269 PolarHBondContact O-N 3.44Å; Y265-R269 PolarHBondContact OH-NH1 3.12Å; Y265-Q477 HydrophobicContact CD2-CB 4.47Å; Y265-Q477 HydrophobicContact CE2-CB 4.21Å; Y265-Q477 HydrophobicContact CE2-CG 4.43Å; Y265-L480 HydrophobicContact CD2-CB 4.38Å; Y265-L481 HydrophobicContact CD2-CG 4.12Å; Y265-L481 HydrophobicContact CE2-CD1 3.84Å; Y265-L481 HydrophobicContact CE2-CD2 3.96Å; Y265-L481 HydrophobicContact CE2-CG 3.65Å
266	R	73.8	Confident	67.9	Low	152 Å²	152	76.1 Å²	76.1	57%	0.574	37%	0.365	S	S	*	.	H	α-helix	trans	-60.5	-44.3	175.6	-171.7	-166.3	-59.3	-154	-4.2	111.5	W262 K263 L264 R269 A270	W262-R266 WeakPolarHBondContact O-CB 3.43Å; W262-R266 PolarHBondContact O-N 2.95Å; K263-R266 PolarHBondContact O-N 3.18Å; L264-R266 PolarHBondContact O-N 3.47Å; R266-R269 PolarHBondContact O-N 3.29Å; R266-A270 WeakPolarHBondContact O-CB 3.32Å; R266-A270 PolarHBondContact O-N 3.3Å
267	E	71.6	Confident	65.2	Low	92 Å²	92	80.7 Å²	80.7	43%	0.43	38%	0.38	S	S	.	.	H	α-helix	trans	-65.3	-47.3	-179.9	-169.5	-178	168	0	0	111.9	K263 L264 Y265 R269 A270 R271	K263-E267 PolarHBondContact O-N 2.77Å; L264-E267 PolarHBondContact O-N 2.92Å; Y265-E267 VanDerWaalsContact C-N 3.34Å; Y265-E267 PolarHBondContact O-N 3.25Å; E267-R269 VanDerWaalsContact C-N 3.33Å; E267-R269 PolarHBondContact O-N 3.07Å; E267-A270 PolarHBondContact O-N 3.41Å; E267-R271 WeakPolarHBondContact O-CG 3.27Å; E267-R271 PolarHBondContact O-N 2.84Å; E267-R271 IonicContact OE1-CZ 3.41Å; E267-R271 IonicContact OE1-NE 3.96Å; E267-R271 PolarHBondContact OE1-NE 3.37Å; E267-R271 IonicContact OE1-NH2 3.38Å; E267-R271 PolarHBondContact OE1-NH2 3.29Å
268	I	68.6	Low	62.4	Low	20 Å²	20	85.3 Å²	85.3	10%	0.103	41%	0.412	C	S	.	.	H	α-helix	trans	-66.3	-36.4	177.9	-66.7	170.5	0	0	0	111.1	L264 R271 S272 L473 Q476 Q477 L480	L264-I268 WeakPolarHBondContact O-CG1 3.41Å; L264-I268 PolarHBondContact O-N 2.76Å; I268-R271 PolarHBondContact O-N 3.46Å; I268-S272 PolarHBondContact O-N 3.33Å; I268-S272 PolarHBondContact O-OG 3.47Å; I268-L473 HydrophobicContact CG2-CD2 3.96Å; I268-Q476 HydrophobicContact CD1-CB 4.22Å; I268-Q477 HydrophobicContact CB-CG 4.48Å; I268-Q477 HydrophobicContact CG2-CG 3.62Å; I268-Q477 PolarHBondContact O-NE2 2.91Å; I268-L480 HydrophobicContact CD1-CD1 3.69Å
269	R	70.3	Confident	59.3	Low	116 Å²	116	91.1 Å²	91.1	44%	0.438	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-45.9	173.5	-177.1	168.8	172.9	165.8	-6.4	111.4	Y265 R266 E267 R271 S272 Q273	Y265-R269 WeakPolarHBondContact O-CB 3.33Å; Y265-R269 PolarHBondContact O-N 3.44Å; Y265-R269 PolarHBondContact OH-NH1 3.12Å; R266-R269 PolarHBondContact O-N 3.29Å; E267-R269 VanDerWaalsContact C-N 3.33Å; E267-R269 PolarHBondContact O-N 3.07Å; R269-R271 PolarHBondContact O-N 3.45Å; R269-S272 PolarHBondContact O-N 3.21Å; R269-S272 PolarHBondContact O-OG 3.46Å; R269-Q273 WeakPolarHBondContact O-CG 3.41Å; R269-Q273 PolarHBondContact O-N 2.91Å; R269-Q273 VanDerWaalsContact O-N 3.12Å
270	A	63.3	Low	56.4	Low	59 Å²	59	95.6 Å²	95.6	49%	0.488	46%	0.463	S	S	.	.	H	α-helix	trans	-60.4	-42.8	174.7	0	0	0	0	0	112.1	R266 E267 Q273 G274	R266-A270 WeakPolarHBondContact O-CB 3.32Å; R266-A270 PolarHBondContact O-N 3.3Å; E267-A270 PolarHBondContact O-N 3.41Å; A270-Q273 PolarHBondContact O-N 3.42Å; A270-G274 PolarHBondContact O-N 3.12Å
271	R	59.4	Low	53.8	Low	131 Å²	131	98.1 Å²	98.1	49%	0.494	49%	0.486	S	S	.	.	H	α-helix	trans	-61	-48	174.9	-70.5	173.5	-174.4	-134.3	7.3	112.2	E267 I268 R269 Q273 G274 E275	E267-R271 WeakPolarHBondContact O-CG 3.27Å; E267-R271 PolarHBondContact O-N 2.84Å; E267-R271 IonicContact OE1-CZ 3.41Å; E267-R271 IonicContact OE1-NE 3.96Å; E267-R271 PolarHBondContact OE1-NE 3.37Å; E267-R271 IonicContact OE1-NH2 3.38Å; E267-R271 PolarHBondContact OE1-NH2 3.29Å; I268-R271 PolarHBondContact O-N 3.46Å; R269-R271 PolarHBondContact O-N 3.45Å; R271-Q273 PolarHBondContact O-N 2.89Å; R271-Q273 VanDerWaalsContact O-N 3.13Å; R271-G274 PolarHBondContact O-N 2.86Å; R271-E275 PolarHBondContact O-N 3.39Å
272	S	56.1	Low	51.1	Low	42 Å²	42	105.2 Å²	105.2	29%	0.294	52%	0.524	S	S	.	.	H	α-helix	trans	-63.1	-19.1	176.7	68.1	0	0	0	0	114.6	I268 R269 Q477	I268-S272 PolarHBondContact O-N 3.33Å; I268-S272 PolarHBondContact O-OG 3.47Å; R269-S272 PolarHBondContact O-N 3.21Å; R269-S272 PolarHBondContact O-OG 3.46Å; S272-Q477 PolarHBondContact OG-NE2 2.96Å
273	Q	50.4	Low	48.4	Very low	142 Å²	142	108.2 Å²	108.2	66%	0.664	55%	0.553	S	S	*	*	H	α-helix	trans	-93.8	-19.3	173.1	-69	-178.5	-48.1	0	0	112.6	R269 A270 R271	R269-Q273 WeakPolarHBondContact O-CG 3.41Å; R269-Q273 PolarHBondContact O-N 2.91Å; R269-Q273 VanDerWaalsContact O-N 3.12Å; A270-Q273 PolarHBondContact O-N 3.42Å; R271-Q273 PolarHBondContact O-N 2.89Å; R271-Q273 VanDerWaalsContact O-N 3.13Å
274	G	43.8	Very low	45.9	Very low	39 Å²	39	105.6 Å²	105.6	40%	0.402	57%	0.566	S	S	.	*	H	α-helix	trans	-100.1	-21	-176.6	0	0	0	0	0	115.7	A270 R271 L276 Y277	A270-G274 PolarHBondContact O-N 3.12Å; R271-G274 PolarHBondContact O-N 2.86Å; G274-L276 PolarHBondContact O-N 3.43Å; G274-L276 VanDerWaalsContact O-N 3.11Å; G274-Y277 PolarHBondContact O-N 3.42Å
275	E	30.9	Very low	43.6	Very low	97 Å²	97	107.2 Å²	107.2	45%	0.453	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-70.8	-4.4	-175.7	-81.9	-180	-178.5	0	0	114.9	R271 Y277 L473	R271-E275 PolarHBondContact O-N 3.39Å; E275-Y277 PolarHBondContact O-N 2.92Å; E275-Y277 VanDerWaalsContact O-N 3.16Å; E275-L473 WeakPolarHBondContact OE2-CD1 3.4Å
276	L	32	Very low	41	Very low	171 Å²	171	111.3 Å²	111.3	90%	0.895	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-70.1	2.1	166.3	-98.3	166.5	0	0	0	114.4	G274	G274-L276 PolarHBondContact O-N 3.43Å; G274-L276 VanDerWaalsContact O-N 3.11Å
277	Y	26.1	Very low	38.6	Very low	178 Å²	178	107.9 Å²	107.9	70%	0.698	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-120.9	0.1	-174.2	-133.9	-94	0	0	0	115.9	G274 E275	G274-Y277 PolarHBondContact O-N 3.42Å; E275-Y277 PolarHBondContact O-N 2.92Å; E275-Y277 VanDerWaalsContact O-N 3.16Å
278	C	23	Very low	36.3	Very low	105 Å²	105	109.6 Å²	109.6	71%	0.709	65%	0.649	S	S	*	*			trans	-112.3	56	-167.9	-72.2	0	0	0	0	114.6
279	D	24.1	Very low	34.1	Very low	126 Å²	126	112 Å²	112	67%	0.674	68%	0.678	S	S	*	*	S	Bend	trans	-142.5	66	171.9	-128.6	-0.3	0	0	0	111.6
280	H	24.3	Very low	32	Very low	154 Å²	154	116.7 Å²	116.7	71%	0.713	70%	0.702	S	S	*	*			trans	164	75.1	151.1	-86.7	-50.7	0	0	0	112.7
281	V	25.1	Very low	30.1	Very low	147 Å²	147	119 Å²	119	89%	0.891	71%	0.714	S	S	*	*			trans	-135	80.1	158.3	-170.8	0	0	0	0	109.6
282	N	23.6	Very low	28.4	Very low	157 Å²	157	116.3 Å²	116.3	84%	0.84	73%	0.727	S	S	*	*			trans	-113.1	120.4	165.4	-106.3	-13.7	0	0	0	109.6
283	S	24	Very low	26.8	Very low	113 Å²	113	123 Å²	123	79%	0.79	75%	0.754	S	S	*	*			trans	49	80.3	158.1	61	0	0	0	0	118.4
284	G	24.1	Very low	25.5	Very low	86 Å²	86	125.2 Å²	125.2	89%	0.887	76%	0.764	S	S	*	*			trans	-97.2	94	151	0	0	0	0	0	110.1
285	S	22.9	Very low	24.5	Very low	103 Å²	103	130.1 Å²	130.1	72%	0.72	78%	0.78	S	S	*	*			trans	-83.2	143.1	-177.9	-178.5	0	0	0	0	112.9
286	S	23	Very low	24.1	Very low	108 Å²	108	133.1 Å²	133.1	76%	0.755	80%	0.797	S	S	*	*			trans	56.6	88.9	150.5	54.7	0	0	0	0	118.8
287	G	24.1	Very low	23.6	Very low	80 Å²	80	133.2 Å²	133.2	83%	0.825	79%	0.793	S	S	*	*			trans	-114.3	96.2	143.4	0	0	0	0	0	109.3	G289	G287-G289 PolarHBondContact O-N 2.81Å; G287-G289 VanDerWaalsContact O-N 3.17Å
288	S	22.8	Very low	23.4	Very low	128 Å²	128	132.4 Å²	132.4	90%	0.895	80%	0.8	S	S	*	*			trans	-75.7	103.4	-174.5	58	0	0	0	0	111.9
289	G	24	Very low	23.3	Very low	69 Å²	69	132.6 Å²	132.6	71%	0.711	80%	0.802	S	S	*	*			trans	-135.5	52.3	-175.4	0	0	0	0	0	114.3	G287 S291	G287-G289 PolarHBondContact O-N 2.81Å; G287-G289 VanDerWaalsContact O-N 3.17Å; G289-S291 VanDerWaalsContact C-N 3.34Å; G289-S291 PolarHBondContact O-N 3.1Å
290	K	25.4	Very low	23.3	Very low	216 Å²	216	135 Å²	135	94%	0.939	81%	0.81	S	S	*	*			trans	36.6	53.3	168.2	-65	-176.5	178.6	177.5	0	115.8	G292	K290-G292 PolarHBondContact O-N 3.25Å
291	S	22.9	Very low	23.1	Very low	106 Å²	106	134.4 Å²	134.4	74%	0.741	82%	0.821	S	S	*	*			trans	-67.9	114.7	160	52.7	0	0	0	0	108.2	G289 E293	G289-S291 VanDerWaalsContact C-N 3.34Å; G289-S291 PolarHBondContact O-N 3.1Å; S291-E293 PolarHBondContact O-N 3.32Å
292	G	24.6	Very low	23	Very low	75 Å²	75	132.5 Å²	132.5	77%	0.773	81%	0.814	S	S	*	*			trans	-58.2	122.8	165.3	0	0	0	0	0	108.7	K290 E294	K290-G292 PolarHBondContact O-N 3.25Å; G292-E294 PolarHBondContact O-N 3.19Å; G292-E294 VanDerWaalsContact O-N 3.15Å
293	E	22.7	Very low	22.8	Very low	184 Å²	184	131.8 Å²	131.8	86%	0.86	82%	0.816	S	S	*	*			trans	-69.1	107.1	176.8	-64	174.9	126.3	0	0	109.3	S291	S291-E293 PolarHBondContact O-N 3.32Å
294	E	23.1	Very low	22.6	Very low	188 Å²	188	133.2 Å²	133.2	88%	0.879	82%	0.815	S	S	*	*			trans	-138.2	103.8	148.7	-121.3	170.2	-146.3	0	0	109.6	G292 I296	G292-E294 PolarHBondContact O-N 3.19Å; G292-E294 VanDerWaalsContact O-N 3.15Å; E294-I296 PolarHBondContact O-N 3.17Å
295	I	22.2	Very low	22.4	Very low	142 Å²	142	137.7 Å²	137.7	73%	0.728	82%	0.815	S	S	*	*			trans	-67.9	127.3	-175.1	-69.5	164.6	0	0	0	108.7	Q297	I295-Q297 VanDerWaalsContact C-N 3.27Å; I295-Q297 HydrophobicContact CG2-CG 4.25Å; I295-Q297 PolarHBondContact O-N 2.69Å
296	I	21.2	Very low	22.4	Very low	160 Å²	160	139.1 Å²	139.1	82%	0.821	81%	0.814	S	S	*	*			trans	-64.8	86.6	172.2	-56.9	170.5	0	0	0	108.9	E294	E294-I296 PolarHBondContact O-N 3.17Å
297	Q	22	Very low	22.4	Very low	172 Å²	172	140.7 Å²	140.7	80%	0.804	81%	0.814	S	S	*	*			trans	-89.2	114.5	158.4	-72.1	-164.1	-1.5	0	0	108.4	I295 S299	I295-Q297 VanDerWaalsContact C-N 3.27Å; I295-Q297 HydrophobicContact CG2-CG 4.25Å; I295-Q297 PolarHBondContact O-N 2.69Å; Q297-S299 PolarHBondContact O-N 3.35Å
298	L	22	Very low	22.2	Very low	162 Å²	162	141.4 Å²	141.4	85%	0.848	81%	0.806	S	S	*	*			trans	-54.7	94.4	173.7	-75	148.1	0	0	0	110.2	Q300	L298-Q300 PolarHBondContact O-N 2.95Å; L298-Q300 VanDerWaalsContact O-N 3.11Å
299	S	22.4	Very low	22.3	Very low	108 Å²	108	140.3 Å²	140.3	76%	0.755	80%	0.799	S	S	*	*			trans	-67.7	109.5	-179.5	58.5	0	0	0	0	110.1	Q297 C301	Q297-S299 PolarHBondContact O-N 3.35Å; S299-C301 PolarHBondContact O-N 3.03Å
300	Q	22.6	Very low	22.2	Very low	177 Å²	177	144.8 Å²	144.8	83%	0.827	81%	0.806	S	S	*	*			trans	-62.9	126.2	172.9	-64.9	167.9	-12.6	0	0	109.3	L298 S302	L298-Q300 PolarHBondContact O-N 2.95Å; L298-Q300 VanDerWaalsContact O-N 3.11Å; Q300-S302 VanDerWaalsContact C-N 3.3Å; Q300-S302 PolarHBondContact O-N 3.27Å
301	C	20.6	Very low	22.2	Very low	142 Å²	142	141.5 Å²	141.5	96%	0.959	80%	0.798	S	S	*	*			trans	-72.6	85.6	169.1	-69.5	0	0	0	0	109.8	S299	S299-C301 PolarHBondContact O-N 3.03Å
302	S	22	Very low	22.3	Very low	106 Å²	106	141 Å²	141	74%	0.741	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-93.6	131.5	163.8	40.8	0	0	0	0	110.3	Q300	Q300-S302 VanDerWaalsContact C-N 3.3Å; Q300-S302 PolarHBondContact O-N 3.27Å
303	T	20.1	Very low	22.3	Very low	143 Å²	143	147 Å²	147	88%	0.877	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.7	153.4	173	33.2	0	0	0	0	111.7	M305	T303-M305 PolarHBondContact O-N 2.98Å
304	N	19.2	Very low	22.3	Very low	142 Å²	142	146.1 Å²	146.1	76%	0.759	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-58.3	118.2	-170.8	-131.5	8.1	0	0	0	113
305	M	20.4	Very low	22.4	Very low	181 Å²	181	147 Å²	147	89%	0.892	80%	0.801	S	S	*	*			trans	-139.8	130	151.7	-88.8	-63.1	174.5	0	0	107.8	T303	T303-M305 PolarHBondContact O-N 2.98Å
306	N	22.8	Very low	22.5	Very low	133 Å²	133	148 Å²	148	71%	0.711	81%	0.807	S	S	*	*			trans	-80	173.2	-171.9	-78	-30.6	0	0	0	112.9
307	N	23	Very low	22.6	Very low	141 Å²	141	145.1 Å²	145.1	75%	0.754	80%	0.801	S	S	*	*			trans	89.6	86.7	160.9	-63.5	-1.6	0	0	0	118.5
308	S	20.9	Very low	22.7	Very low	94 Å²	94	146.8 Å²	146.8	66%	0.657	81%	0.805	S	S	*	*				62.7	102.6	114.4	63.2	0	0	0	0	120.4
309	S	23.4	Very low	22.7	Very low	106 Å²	106	144.8 Å²	144.8	74%	0.741	81%	0.805	S	S	*	*				49.5	106.4	129.7	62.7	0	0	0	0	120.1
310	L	23.1	Very low	22.7	Very low	162 Å²	162	146 Å²	146	85%	0.848	81%	0.808	S	S	*	*				-179.4	94.5	117.4	-94.2	155.9	0	0	0	108.6
311	L	25.1	Very low	22.6	Very low	148 Å²	148	145.7 Å²	145.7	78%	0.775	81%	0.811	S	S	*	*				51.3	105.9	96.3	-94.9	166.8	0	0	0	116.3
312	S	24.3	Very low	22.8	Very low	94 Å²	94	142.7 Å²	142.7	66%	0.657	80%	0.797	S	S	*	*			trans	52.8	109.4	137.6	64.8	0	0	0	0	119.9
313	K	24.7	Very low	22.9	Very low	202 Å²	202	145.9 Å²	145.9	88%	0.878	81%	0.805	S	S	*	*				-169.4	108.2	127.3	-103.6	158.7	-172.6	176.3	0	110.6
314	N	24.1	Very low	23.2	Very low	165 Å²	165	145.8 Å²	145.8	88%	0.882	80%	0.804	S	S	*	*				-171.9	103.6	129	-94.6	-19.8	0	0	0	110.4
315	K	25.2	Very low	23.3	Very low	206 Å²	206	142.4 Å²	142.4	90%	0.896	80%	0.802	S	S	*	*			trans	-66.8	130.6	162.6	-68.4	173.3	175.3	177.1	0	107.8
316	L	23.3	Very low	23.5	Very low	164 Å²	164	143.2 Å²	143.2	86%	0.859	80%	0.801	S	S	*	*			trans	-141.4	104.8	151	-101.6	170.1	0	0	0	110.5
317	S	23.6	Very low	23.5	Very low	100 Å²	100	144.1 Å²	144.1	70%	0.699	81%	0.806	S	S	*	*			trans	45.2	97.8	156.7	53	0	0	0	0	119.2
318	K	24.2	Very low	23.6	Very low	206 Å²	206	140.6 Å²	140.6	90%	0.896	80%	0.803	S	S	*	*			trans	-60	134.3	145.5	-72.9	-179.9	173.7	-177.3	0	109
319	S	22	Very low	23.6	Very low	120 Å²	120	141.6 Å²	141.6	84%	0.839	81%	0.81	S	S	*	*			trans	-127.4	74.3	162.6	59.1	0	0	0	0	109.2
320	T	22.1	Very low	23.5	Very low	133 Å²	133	142.4 Å²	142.4	82%	0.816	81%	0.806	S	S	*	*			trans	-106.9	110.6	167.9	-51.4	0	0	0	0	106.5
321	L	21.5	Very low	23.6	Very low	172 Å²	172	142.6 Å²	142.6	90%	0.901	80%	0.802	S	S	*	*			trans	-108	121	175.6	-104.7	163.2	0	0	0	108.5
322	A	23.9	Very low	23.4	Very low	79 Å²	79	141.7 Å²	141.7	65%	0.653	80%	0.797	S	S	*	*			trans	-94.2	151.5	173.8	0	0	0	0	0	110.3
323	L	24.4	Very low	23.4	Very low	173 Å²	173	145.8 Å²	145.8	91%	0.906	81%	0.805	S	S	*	*			trans	-138.9	140.8	165.5	-73.4	174.8	0	0	0	109.2
324	T	25.6	Very low	23.9	Very low	141 Å²	141	141.2 Å²	141.2	87%	0.865	80%	0.796	S	S	*	*			trans	-148.5	148.6	-163.7	48.4	0	0	0	0	112.1
325	G	22.4	Very low	23.7	Very low	70 Å²	70	138 Å²	138	72%	0.722	79%	0.787	S	S	*	*			trans	119.6	153.3	170.7	0	0	0	0	0	114.6
326	F	23.8	Very low	23.6	Very low	199 Å²	199	134.4 Å²	134.4	87%	0.873	78%	0.783	S	S	*	*			cis	-157.7	-169.2	0.2	-133.3	-96.4	0	0	0	111.9
327	N	22.4	Very low	23.6	Very low	152 Å²	152	132.3 Å²	132.3	81%	0.813	78%	0.777	S	S	*	*			trans	-97.9	168.9	-153.6	-59	-33.3	0	0	0	120.6
328	G	25.3	Very low	23.5	Very low	67 Å²	67	132.4 Å²	132.4	69%	0.691	77%	0.768	S	S	*	*			trans	140.4	121.3	156.6	0	0	0	0	0	114.3
329	S	21.5	Very low	23.6	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	77%	0.766	S	S	*	*				84.3	129.5	57.6	65.7	0	0	0	0	115.7
330	D	21.9	Very low	23.6	Very low	124 Å²	124	130.4 Å²	130.4	66%	0.663	76%	0.763	S	S	*	*			cis	-165.7	-157.5	-19.4	-146.5	-89.6	0	0	0	112.1
331	H	24.7	Very low	23.7	Very low	165 Å²	165	128.4 Å²	128.4	76%	0.764	76%	0.76	S	S	*	*			trans	78.7	131.8	179.2	-59.5	-71.7	0	0	0	117.9
332	I	21	Very low	23.7	Very low	130 Å²	130	126 Å²	126	67%	0.667	75%	0.753	S	S	*	*			cis	81.1	125.2	32.6	-61.9	175	0	0	0	111.8
333	Q	23.4	Very low	24	Very low	179 Å²	179	129.6 Å²	129.6	84%	0.836	76%	0.761	S	S	*	*			cis	-157.6	-178.5	2.5	-122.9	-175.8	-45.8	0	0	110.2
334	P	35.6	Very low	24.6	Very low	106 Å²	106	125.8 Å²	125.8	69%	0.688	75%	0.746	S	S	*	*			trans	-101.3	-174.9	-176.6	42.3	-37	0	0	0	114.4
335	S	20.8	Very low	24.5	Very low	99 Å²	99	128.6 Å²	128.6	69%	0.692	74%	0.742	S	S	*	*			trans	172.6	135.1	134.2	-78.4	0	0	0	0	116.8
336	T	21.3	Very low	24.6	Very low	130 Å²	130	132 Å²	132	80%	0.798	74%	0.739	S	S	*	*			trans	59.3	160.8	141	62.2	0	0	0	0	120.5
337	T	23.3	Very low	24.6	Very low	120 Å²	120	128 Å²	128	74%	0.736	73%	0.727	S	S	*	*			cis	-160.1	146.5	15.3	-25.5	0	0	0	0	113.6
338	I	22.7	Very low	24.9	Very low	102 Å²	102	129.3 Å²	129.3	52%	0.523	73%	0.728	S	S	.	*			trans	-18.7	152.3	157	-28.1	176.2	0	0	0	120.6	E888	I338-E888 WeakPolarHBondContact CD1-OE1 3.3Å; I338-E888 VanDerWaalsContact CG1-OE1 3.27Å; I338-E888 WeakPolarHBondContact CG1-OE1 3.31Å
339	V	25.3	Very low	24.8	Very low	140 Å²	140	130.6 Å²	130.6	85%	0.848	73%	0.726	S	S	*	*				-170.8	153	125.1	143.5	0	0	0	0	114.3
340	N	21.9	Very low	25.1	Very low	144 Å²	144	133.2 Å²	133.2	77%	0.77	73%	0.726	S	S	*	*			trans	-94.3	167.1	-173.2	-57.7	-71.5	0	0	0	115.4
341	A	24.5	Very low	25.2	Very low	91 Å²	91	133.4 Å²	133.4	75%	0.752	73%	0.727	S	S	*	*				159.4	113.4	114.7	0	0	0	0	0	118.6
342	T	21.8	Very low	25.1	Very low	122 Å²	122	130.7 Å²	130.7	75%	0.748	72%	0.718	S	S	*	*			trans	40.6	120.7	134.3	53.7	0	0	0	0	126.7
343	N	29.7	Very low	25.3	Very low	154 Å²	154	129.2 Å²	129.2	82%	0.824	71%	0.711	S	S	*	*				57	180	124.7	-71.9	-3.7	0	0	0	121.3
344	P	37.9	Very low	25.4	Very low	92 Å²	92	125.1 Å²	125.1	60%	0.597	70%	0.695	S	S	*	*			cis	-141.6	-175.8	-3.5	27.5	-1	0	0	0	118.9
345	Y	23.8	Very low	24.9	Very low	200 Å²	200	123.4 Å²	123.4	78%	0.784	69%	0.685	S	S	*	*			trans	74.7	154.6	147.9	-63.5	-36.9	0	0	0	122.3
346	Q	24	Very low	25	Very low	142 Å²	142	122.8 Å²	122.8	66%	0.664	67%	0.673	S	S	*	*			cis	-163.7	155.4	-4.8	-118.9	171.9	-5.2	0	0	114.5
347	N	23	Very low	25.2	Very low	114 Å²	114	127 Å²	127	61%	0.61	68%	0.677	S	S	*	*			trans	47.2	151.9	144.7	-55.4	-15.4	0	0	0	122.3
348	H	29.2	Very low	25.3	Very low	181 Å²	181	127.7 Å²	127.7	84%	0.838	68%	0.676	S	S	*	*			cis	-157.6	176.5	47.3	-90.1	-82.8	0	0	0	115.3
349	S	23	Very low	25.4	Very low	93 Å²	93	128.2 Å²	128.2	65%	0.65	68%	0.684	S	S	*	*			trans	-130	159.1	-165	56.3	0	0	0	0	115.3
350	H	27.6	Very low	25.3	Very low	170 Å²	170	126.9 Å²	126.9	79%	0.787	68%	0.676	S	S	*	*			trans	-170.9	123.5	147.6	-91.9	-43.8	0	0	0	116.3
351	N	24.7	Very low	25.5	Very low	128 Å²	128	126.7 Å²	126.7	68%	0.684	68%	0.675	S	S	*	*				46.5	151.2	117.8	-60.8	-2	0	0	0	122.8
352	N	23.1	Very low	25.5	Very low	108 Å²	108	132.5 Å²	132.5	58%	0.578	68%	0.679	S	S	*	*			cis	-167.4	163.9	-1.2	-116	-2.4	0	0	0	116.4	K1021	N352-K1021 PolarHBondContact O-NZ 2.9Å; N352-K1021 VanDerWaalsContact O-NZ 3.15Å
353	N	24.8	Very low	25.8	Very low	99 Å²	99	133.5 Å²	133.5	53%	0.529	68%	0.679	S	S	.	*			trans	66.9	119.8	139.7	-62.3	-2	0	0	0	129.3	K1021	N353-K1021 VanDerWaalsContact C-CE 3.5Å; N353-K1021 WeakPolarHBondContact O-CD 3.24Å; N353-K1021 VanDerWaalsContact O-CE 3.29Å; N353-K1021 WeakPolarHBondContact O-CE 3.36Å; N353-K1021 PolarHBondContact O-NZ 3.37Å
354	N	25.7	Very low	26.1	Very low	93 Å²	93	131.7 Å²	131.7	50%	0.497	68%	0.676	S	S	.	*				88.2	140.2	118.9	-59.3	3.8	0	0	0	130.3	K1021	N354-K1021 PolarHBondContact O-N 3.3Å; N354-K1021 VanDerWaalsContact O-N 3.13Å
355	S	23.9	Very low	25.3	Very low	69 Å²	69	133 Å²	133	48%	0.483	68%	0.682	S	S	.	*			trans	58	132.7	154.5	61.5	0	0	0	0	125.8	P1020 K1021 S1022	S355-P1020 WeakPolarHBondContact O-CB 3.48Å; S355-K1021 CarbonylContact C-O 2.97Å; S355-K1021 CarbonylContact O-C 3.41Å; S355-S1022 VanDerWaalsContact C-N 3.35Å; S355-S1022 VanDerWaalsContact CA-OG 3.27Å; S355-S1022 WeakPolarHBondContact CA-OG 3.31Å; S355-S1022 PolarHBondContact N-OG 2.84Å
356	I	24.6	Very low	25.3	Very low	86 Å²	86	131 Å²	131	44%	0.441	68%	0.683	S	S	.	*			cis	174.8	164.3	-15.7	-97	149.8	0	0	0	108.2	K1021 S1022 I1023	I356-K1021 PolarHBondContact N-O 3.35Å; I356-S1022 WeakPolarHBondContact CG1-O 3.49Å; I356-S1022 WeakPolarHBondContact CG1-OG 3.41Å; I356-I1023 VanDerWaalsContact CG1-O 3.24Å; I356-I1023 WeakPolarHBondContact CG1-O 3.42Å
357	Y	25	Very low	25.4	Very low	220 Å²	220	131.3 Å²	131.3	86%	0.863	69%	0.688	S	S	*	*			trans	113.2	158.8	159.7	-64.9	-64	0	0	0	119.7
358	D	26	Very low	25.4	Very low	134 Å²	134	134 Å²	134	72%	0.717	70%	0.697	S	S	*	*				-162.6	174.1	-83.6	-158.7	-2.1	0	0	0	111.8
359	T	24.6	Very low	25.3	Very low	113 Å²	113	134.3 Å²	134.3	69%	0.693	70%	0.696	S	S	*	*			trans	70.9	112.4	164.4	63	0	0	0	0	119.4
360	T	23.2	Very low	25.3	Very low	112 Å²	112	139.7 Å²	139.7	69%	0.687	70%	0.702	S	S	*	*				77.1	119.9	67.2	61.9	0	0	0	0	117.9
361	N	25.8	Very low	25.2	Very low	139 Å²	139	137.3 Å²	137.3	74%	0.743	70%	0.701	S	S	*	*				171.4	121.8	128.9	-86.3	-27.3	0	0	0	117.8
362	Y	24	Very low	25.4	Very low	213 Å²	213	140.6 Å²	140.6	84%	0.835	71%	0.709	S	S	*	*			trans	59.9	145.3	140.5	-73	-85	0	0	0	128.4
363	L	27.6	Very low	25.5	Very low	143 Å²	143	146.1 Å²	146.1	75%	0.749	72%	0.724	S	S	*	*			trans	-51	173.4	167.6	-91.4	92.7	0	0	0	116.7
364	P	35.9	Very low	25.7	Very low	117 Å²	117	145.8 Å²	145.8	76%	0.76	73%	0.729	S	S	*	*			cis	-148	-176.8	33.3	42.3	-20.3	0	0	0	120.1
365	T	21.5	Very low	26.1	Very low	118 Å²	118	146 Å²	146	72%	0.724	74%	0.738	S	S	*	*			trans	-76.7	144.2	176.1	-14.1	0	0	0	0	114.2
366	I	23.6	Very low	26.3	Very low	159 Å²	159	147.9 Å²	147.9	82%	0.815	74%	0.742	S	S	*	*			trans	-130.8	145	164.7	-63.7	-178.7	0	0	0	109.8
367	I	25.9	Very low	26.5	Very low	148 Å²	148	150.3 Å²	150.3	76%	0.759	76%	0.755	S	S	*	*			trans	-127.6	116.5	-174	-60.4	166.6	0	0	0	109.5
368	E	24.6	Very low	27	Very low	170 Å²	170	145.3 Å²	145.3	79%	0.794	74%	0.744	S	S	*	*			trans	-150	105.3	167.8	-105.7	173.1	178.7	0	0	111
369	K	26.5	Very low	27.3	Very low	188 Å²	188	145.1 Å²	145.1	82%	0.817	74%	0.742	S	S	*	*				80	106.5	85.8	-79.1	-177.3	-178.9	166.8	0	115.9
370	R	21.9	Very low	27.6	Very low	207 Å²	207	146.1 Å²	146.1	78%	0.781	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-64.7	136.2	176	-66.9	173	170.6	166.4	-5.7	113.8
371	P	26.6	Very low	28.2	Very low	120 Å²	120	150.8 Å²	150.8	78%	0.779	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-85.2	158.8	165.9	33	-31.5	0	0	0	112.9
372	K	28.1	Very low	28.5	Very low	196 Å²	196	151.7 Å²	151.7	85%	0.852	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-93.1	137.8	-171	-69.1	176.7	177.8	175.2	0	113.7	S374	K372-S374 PolarHBondContact O-N 3.04Å; K372-S374 VanDerWaalsContact O-N 3.1Å
373	Y	26.6	Very low	28.7	Very low	224 Å²	224	151.3 Å²	151.3	88%	0.878	75%	0.749	S	S	*	*			trans	-76.6	84.3	178.3	-73.4	-100.6	0	0	0	113.3
374	S	29.4	Very low	28.6	Very low	92 Å²	92	149.5 Å²	149.5	64%	0.643	75%	0.748	S	S	*	*			trans	-121.9	-12.5	169.8	59.3	0	0	0	0	114.9	K372	K372-S374 PolarHBondContact O-N 3.04Å; K372-S374 VanDerWaalsContact O-N 3.1Å
375	S	33.8	Very low	28.2	Very low	97 Å²	97	152.8 Å²	152.8	68%	0.678	75%	0.75	S	S	*	*	S	Bend	trans	-85.2	-24.5	-175.1	39.7	0	0	0	0	115.1
376	L	26.7	Very low	28.5	Very low	109 Å²	109	156.4 Å²	156.4	57%	0.571	76%	0.756	S	S	*	*	H	α-helix	trans	-70.9	-34.1	-176	-156.6	78.6	0	0	0	113.5	N378 L379	L376-N378 VanDerWaalsContact C-N 3.28Å; L376-N378 PolarHBondContact O-N 2.77Å; L376-L379 PolarHBondContact O-N 3.04Å
377	L	29.5	Very low	28.7	Very low	137 Å²	137	154.7 Å²	154.7	72%	0.717	75%	0.753	S	S	*	*	H	α-helix	trans	-68.8	-22.9	-176.8	-92.7	162.8	0	0	0	114
378	N	36.2	Very low	28.6	Very low	116 Å²	116	153.3 Å²	153.3	62%	0.62	75%	0.752	S	S	*	*	H	α-helix	trans	-80.2	-25.4	177.1	-75.5	-19.9	0	0	0	112.9	L376	L376-N378 VanDerWaalsContact C-N 3.28Å; L376-N378 PolarHBondContact O-N 2.77Å
379	L	31.1	Very low	28.7	Very low	130 Å²	130	153.1 Å²	153.1	68%	0.681	76%	0.756	S	S	*	*	H	α-helix	trans	-73.8	-34.1	-177.5	-158	69.7	0	0	0	112.4	L376 R381 H382	L376-L379 PolarHBondContact O-N 3.04Å; L379-R381 VanDerWaalsContact C-N 3.29Å; L379-R381 PolarHBondContact O-N 2.64Å; L379-H382 PolarHBondContact O-N 3.09Å
380	I	31.7	Very low	28.6	Very low	134 Å²	134	150.1 Å²	150.1	69%	0.687	75%	0.749	S	S	*	*	H	α-helix	trans	-69.1	-26	179.4	-62.8	178.1	0	0	0	111.9	H382	I380-H382 VanDerWaalsContact C-N 3.33Å; I380-H382 PolarHBondContact O-N 2.85Å
381	R	35.4	Very low	28.7	Very low	210 Å²	210	151.9 Å²	151.9	79%	0.792	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-9.1	178.8	-84.5	-173.7	172.5	179.7	-0.8	115.4	L379	L379-R381 VanDerWaalsContact C-N 3.29Å; L379-R381 PolarHBondContact O-N 2.64Å
382	H	32.1	Very low	28.7	Very low	157 Å²	157	153.1 Å²	153.1	73%	0.727	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	-0.8	-171.5	-99.8	-86.3	0	0	0	117	L379 I380	L379-H382 PolarHBondContact O-N 3.09Å; I380-H382 VanDerWaalsContact C-N 3.33Å; I380-H382 PolarHBondContact O-N 2.85Å
383	K	28.1	Very low	28.5	Very low	206 Å²	206	149.7 Å²	149.7	90%	0.896	75%	0.747	S	S	*	*	S	Bend	trans	-103.1	5.3	176.7	-83.3	-168.3	173.9	-177.7	0	116.5
384	S	25.8	Very low	28.5	Very low	105 Å²	105	148.4 Å²	148.4	73%	0.734	75%	0.749	S	S	*	*			trans	-101.6	48.9	172.1	60	0	0	0	0	113.8
385	K	27.1	Very low	28.2	Very low	185 Å²	185	149.9 Å²	149.9	80%	0.804	75%	0.75	S	S	*	*			trans	-134.7	93.1	170.1	-85	-172.7	175.6	178.3	0	112
386	K	27.9	Very low	27.7	Very low	195 Å²	195	153.5 Å²	153.5	85%	0.848	76%	0.756	S	S	*	*	S	Bend	trans	-155.7	108.6	145.7	-114.2	169.5	-174.4	-179.1	0	112.1
387	T	28	Very low	27.5	Very low	122 Å²	122	155.4 Å²	155.4	75%	0.748	77%	0.767	S	S	*	*			trans	55.9	81.2	147.6	50.4	0	0	0	0	118.4
388	T	23.9	Very low	27.3	Very low	120 Å²	120	159.5 Å²	159.5	74%	0.736	77%	0.773	S	S	*	*			trans	-34.4	126.9	134.7	44.9	0	0	0	0	113
389	N	26	Very low	27	Very low	166 Å²	166	160 Å²	160	89%	0.888	78%	0.782	S	S	*	*			trans	-108.1	120.3	151.9	-97.8	-23.7	0	0	0	107.8
390	N	25.8	Very low	26.6	Very low	125 Å²	125	165.8 Å²	165.8	67%	0.668	80%	0.795	S	S	*	*			trans	-78.2	127.1	-170.1	-62.7	-42.8	0	0	0	111.6
391	Y	23.3	Very low	26.1	Very low	244 Å²	244	163.5 Å²	163.5	96%	0.957	80%	0.796	S	S	*	*			trans	-126.2	132.3	140.1	-91.3	-80.4	0	0	0	108.5
392	L	25.8	Very low	25.5	Very low	145 Å²	145	158.1 Å²	158.1	76%	0.759	80%	0.796	S	S	*	*			trans	-104.1	130.7	-153.7	-170.2	78	0	0	0	111.7
393	L	24.4	Very low	25.1	Very low	125 Å²	125	157.3 Å²	157.3	65%	0.654	80%	0.803	S	S	*	*			trans	27.1	118.9	154.3	-67.4	159.6	0	0	0	119.5
394	Q	26.8	Very low	24.9	Very low	196 Å²	196	153.7 Å²	153.7	92%	0.916	80%	0.798	S	S	*	*				-128.6	117.9	122.1	-80.2	-167.2	-19.4	0	0	110.2
395	N	21.8	Very low	24.8	Very low	124 Å²	124	153.4 Å²	153.4	66%	0.663	80%	0.802	S	S	*	*			trans	-92.3	114.9	173	-108.5	-17.6	0	0	0	108.2
396	E	24.7	Very low	24.6	Very low	173 Å²	173	149.7 Å²	149.7	81%	0.808	80%	0.8	S	S	*	*			trans	-121.5	69.6	165.1	-89	-76.5	148.9	0	0	108.6	R398	E396-R398 PolarHBondContact O-N 3.14Å
397	N	22.7	Very low	24.8	Very low	149 Å²	149	146 Å²	146	80%	0.797	80%	0.796	S	S	*	*			trans	-73.3	103.3	164.8	-94.3	-33.4	0	0	0	108.7
398	R	23.8	Very low	24.6	Very low	222 Å²	222	146.3 Å²	146.3	84%	0.838	80%	0.797	S	S	*	*			trans	-144.8	109.1	159.2	-142.4	170.3	-172.7	169.7	3.4	112.6	E396 R400	E396-R398 PolarHBondContact O-N 3.14Å; R398-R400 PolarHBondContact O-N 3.46Å
399	P	30.2	Very low	24.5	Very low	127 Å²	127	146.4 Å²	146.4	83%	0.825	80%	0.798	S	S	*	*			trans	-72.9	126.6	174.8	30.5	-32.3	0	0	0	108.8
400	R	22.6	Very low	24.4	Very low	251 Å²	251	144.8 Å²	144.8	95%	0.947	79%	0.794	S	S	*	*			trans	-102.8	114.7	170.7	-159.4	164.7	-171.8	151.1	1.4	109.4	R398	R398-R400 PolarHBondContact O-N 3.46Å
401	A	22.9	Very low	24.2	Very low	86 Å²	86	144.6 Å²	144.6	71%	0.711	80%	0.798	S	S	*	*			trans	-64.9	164	-173.6	0	0	0	0	0	113.1	T403	A401-T403 PolarHBondContact O-N 3.15Å
402	A	22	Very low	24.1	Very low	97 Å²	97	137.2 Å²	137.2	80%	0.802	79%	0.787	S	S	*	*			trans	-55.2	127	174.7	0	0	0	0	0	112.1
403	T	23.6	Very low	24.1	Very low	141 Å²	141	136.6 Å²	136.6	87%	0.865	79%	0.789	S	S	*	*			trans	-96.1	101.2	160.3	-4.6	0	0	0	0	108.5	A401 A405	A401-T403 PolarHBondContact O-N 3.15Å; T403-A405 PolarHBondContact O-N 3.26Å
404	T	23.2	Very low	24	Very low	130 Å²	130	137.2 Å²	137.2	80%	0.798	79%	0.793	S	S	*	*			trans	-61.7	116.6	165.5	45.4	0	0	0	0	109.9
405	A	23.5	Very low	24	Very low	99 Å²	99	136 Å²	136	82%	0.818	79%	0.787	S	S	*	*			trans	-123.2	88.1	165	0	0	0	0	0	108.2	T403	T403-A405 PolarHBondContact O-N 3.26Å
406	S	23.4	Very low	23.9	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	79%	0.793	S	S	*	*			trans	-63.9	157	176.1	-68.2	0	0	0	0	111.6
407	P	31.8	Very low	24	Very low	117 Å²	117	138.9 Å²	138.9	76%	0.76	79%	0.793	S	S	*	*			trans	-76.6	147	-158.9	30.5	-36.2	0	0	0	113.3	T409	P407-T409 PolarHBondContact O-N 3.05Å; P407-T409 VanDerWaalsContact O-N 3.1Å
408	V	23.8	Very low	23.9	Very low	128 Å²	128	136.7 Å²	136.7	78%	0.776	79%	0.79	S	S	*	*			trans	-73.4	100.8	172.2	177.5	0	0	0	0	109.3	T410	V408-T410 HydrophobicContact CG1-CG2 4.28Å; V408-T410 PolarHBondContact O-N 3.26Å
409	T	22.2	Very low	23.8	Very low	123 Å²	123	136 Å²	136	76%	0.755	79%	0.793	S	S	*	*			trans	-67.9	108.6	158.3	30.1	0	0	0	0	109.9	P407	P407-T409 PolarHBondContact O-N 3.05Å; P407-T409 VanDerWaalsContact O-N 3.1Å
410	T	23.5	Very low	23.4	Very low	132 Å²	132	136.9 Å²	136.9	81%	0.81	79%	0.79	S	S	*	*			trans	-96.9	99	156.2	33.1	0	0	0	0	109.2	V408	V408-T410 HydrophobicContact CG1-CG2 4.28Å; V408-T410 PolarHBondContact O-N 3.26Å
411	T	23	Very low	23.4	Very low	121 Å²	121	131.8 Å²	131.8	74%	0.742	78%	0.777	S	S	*	*			trans	-68.9	142.4	175.6	42.7	0	0	0	0	112.6
412	A	21.7	Very low	23.4	Very low	89 Å²	89	136.2 Å²	136.2	74%	0.736	79%	0.788	S	S	*	*			trans	32.2	116	143.5	0	0	0	0	0	119.3
413	V	25.4	Very low	23.3	Very low	131 Å²	131	137.4 Å²	137.4	79%	0.794	78%	0.78	S	S	*	*			trans	-123.5	107.7	143.2	177.5	0	0	0	0	107.9	Q415	V413-Q415 HydrophobicContact CG1-CG 4.49Å; V413-Q415 PolarHBondContact O-N 3.2Å
414	D	21.9	Very low	23.2	Very low	139 Å²	139	142.1 Å²	142.1	74%	0.743	78%	0.782	S	S	*	*			trans	-61.8	128.2	166.3	-81.8	-58.1	0	0	0	110.1
415	Q	25.8	Very low	23.1	Very low	170 Å²	170	142.7 Å²	142.7	79%	0.794	78%	0.776	S	S	*	*			trans	-126.3	89	154.6	-75.2	-165.2	-8.1	0	0	110.3	V413 H417	V413-Q415 HydrophobicContact CG1-CG 4.49Å; V413-Q415 PolarHBondContact O-N 3.2Å; Q415-H417 PolarHBondContact O-N 3.02Å
416	K	21	Very low	22.9	Very low	183 Å²	183	143.3 Å²	143.3	80%	0.796	77%	0.774	S	S	*	*			trans	-61.9	111.5	160.4	-71.6	171.7	176.1	170.8	0	109.2
417	H	26.3	Very low	22.8	Very low	175 Å²	175	143.5 Å²	143.5	81%	0.81	77%	0.767	S	S	*	*			trans	-130.6	93.4	150.7	-84.3	-63.1	0	0	0	110.3	Q415	Q415-H417 PolarHBondContact O-N 3.02Å
418	S	20.1	Very low	22.4	Very low	102 Å²	102	145 Å²	145	71%	0.713	77%	0.767	S	S	*	*			trans	-70.3	124.3	165.3	49.1	0	0	0	0	110.4
419	F	23.2	Very low	22.3	Very low	209 Å²	209	145.2 Å²	145.2	92%	0.917	76%	0.764	S	S	*	*			trans	-136.6	136.6	148.4	-104.5	-78	0	0	0	111.2
420	L	21.6	Very low	22.3	Very low	144 Å²	144	146.9 Å²	146.9	75%	0.754	77%	0.768	S	S	*	*			trans	-76.5	149.7	-157.7	-68.4	152.9	0	0	0	114.6
421	H	21.6	Very low	22.2	Very low	144 Å²	144	146 Å²	146	67%	0.667	76%	0.763	S	S	*	*			trans	47.1	113.6	140.1	-79.8	-111.8	0	0	0	120.2
422	L	22.4	Very low	22.2	Very low	180 Å²	180	144.6 Å²	144.6	94%	0.942	76%	0.763	S	S	*	*				-134.1	81.9	126.3	-112.6	161	0	0	0	109.6	R424	L422-R424 PolarHBondContact O-N 3.48Å
423	N	20.6	Very low	22.3	Very low	122 Å²	122	146.5 Å²	146.5	65%	0.652	77%	0.766	S	S	*	*			trans	-73.9	115.9	174.3	-128.4	1.8	0	0	0	108.8
424	R	22.3	Very low	22.1	Very low	239 Å²	239	149.6 Å²	149.6	90%	0.902	77%	0.771	S	S	*	*			trans	-143.6	78.4	154.5	-144.5	176.3	-165.4	-174.2	4	111.6	L422 S426	L422-R424 PolarHBondContact O-N 3.48Å; R424-S426 PolarHBondContact O-N 3.37Å
425	Q	19.3	Very low	22.1	Very low	143 Å²	143	149.9 Å²	149.9	67%	0.668	77%	0.771	S	S	*	*			trans	-73	104.5	171	-173.2	172.3	12	0	0	109.3	N427	Q425-N427 WeakPolarHBondContact CG-OD1 3.29Å; Q425-N427 PolarHBondContact NE2-ND2 3.34Å; Q425-N427 PolarHBondContact NE2-OD1 3.09Å; Q425-N427 PolarHBondContact O-N 3.44Å
426	S	21.1	Very low	22	Very low	112 Å²	112	147.1 Å²	147.1	78%	0.783	77%	0.768	S	S	*	*			trans	-94.7	76.8	164.6	59	0	0	0	0	109.2	R424 L428	R424-S426 PolarHBondContact O-N 3.37Å; S426-L428 PolarHBondContact O-N 3.09Å
427	N	21.2	Very low	22	Very low	110 Å²	110	146.8 Å²	146.8	59%	0.588	77%	0.774	S	S	*	*			trans	-63.8	116.5	159.7	-68.4	-12	0	0	0	107	Q425	Q425-N427 WeakPolarHBondContact CG-OD1 3.29Å; Q425-N427 PolarHBondContact NE2-ND2 3.34Å; Q425-N427 PolarHBondContact NE2-OD1 3.09Å; Q425-N427 PolarHBondContact O-N 3.44Å
428	L	23.1	Very low	21.8	Very low	148 Å²	148	148 Å²	148	78%	0.775	78%	0.777	S	S	*	*			trans	-117.7	84.3	157.1	-135.5	83.9	0	0	0	107.7	S426 L430	S426-L428 PolarHBondContact O-N 3.09Å; L428-L430 HydrophobicContact CD2-CD1 4.19Å; L428-L430 HydrophobicContact CD2-CG 4.45Å; L428-L430 PolarHBondContact O-N 3.18Å; L428-L430 VanDerWaalsContact O-N 3.12Å
429	D	20.1	Very low	21.8	Very low	133 Å²	133	153 Å²	153	71%	0.711	79%	0.786	S	S	*	*			trans	-61.4	108.6	160.3	-84.5	-53.3	0	0	0	108
430	L	23.8	Very low	21.7	Very low	158 Å²	158	148.8 Å²	148.8	83%	0.827	78%	0.782	S	S	*	*			trans	-106.2	72.8	159.4	-80.8	170.7	0	0	0	108.5	L428	L428-L430 HydrophobicContact CD2-CD1 4.19Å; L428-L430 HydrophobicContact CD2-CG 4.45Å; L428-L430 PolarHBondContact O-N 3.18Å; L428-L430 VanDerWaalsContact O-N 3.12Å
431	T	20.7	Very low	21.7	Very low	114 Å²	114	146.5 Å²	146.5	70%	0.699	78%	0.784	S	S	*	*			trans	-65.7	133.3	166.6	42.4	0	0	0	0	110.6
432	A	23.6	Very low	21.6	Very low	91 Å²	91	146 Å²	146	75%	0.752	79%	0.791	S	S	*	*			trans	53.3	107.7	155.2	0	0	0	0	0	119.8
433	T	23.1	Very low	21.6	Very low	129 Å²	129	145.2 Å²	145.2	79%	0.791	79%	0.787	S	S	*	*				-147.9	93.2	124.6	43.3	0	0	0	0	111.2	I435	T433-I435 PolarHBondContact O-N 3.17Å
434	H	21.9	Very low	21.6	Very low	196 Å²	196	146.7 Å²	146.7	91%	0.907	79%	0.794	S	S	*	*			trans	-68.8	107.1	156.7	-100.7	-90	0	0	0	108.2	P436	H434-P436 WeakPolarHBondContact O-CD 3.28Å
435	I	22.2	Very low	21.7	Very low	146 Å²	146	142 Å²	142	75%	0.749	79%	0.792	S	S	*	*			trans	-93.5	114.1	166.7	-61.5	178.9	0	0	0	107.8	T433 L437	T433-I435 PolarHBondContact O-N 3.17Å; I435-L437 PolarHBondContact O-N 2.9Å
436	P	22.1	Very low	21.8	Very low	111 Å²	111	143 Å²	143	72%	0.721	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-78.5	123.8	-172.8	29.9	-33.8	0	0	0	111.8	H434 K438	H434-P436 WeakPolarHBondContact O-CD 3.28Å; P436-K438 PolarHBondContact O-N 3.23Å
437	L	22.3	Very low	21.6	Very low	177 Å²	177	144 Å²	144	93%	0.927	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-69.6	118.5	171.1	-80.7	163.9	0	0	0	110.3	I435	I435-L437 PolarHBondContact O-N 2.9Å
438	K	21.1	Very low	21.7	Very low	201 Å²	201	145.4 Å²	145.4	87%	0.874	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-60.9	134	-177.9	-77.7	177.9	172.8	176.1	0	111.8	P436 S440	P436-K438 PolarHBondContact O-N 3.23Å; K438-S440 PolarHBondContact O-N 3.32Å
439	K	21	Very low	21.5	Very low	206 Å²	206	145.1 Å²	145.1	90%	0.896	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-60.3	127.4	166.9	-70.2	177.6	174.1	179.1	0	110.4
440	S	20.8	Very low	21.6	Very low	120 Å²	120	143.7 Å²	143.7	84%	0.839	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-69.2	137	161.5	-55.5	0	0	0	0	109.4	K438	K438-S440 PolarHBondContact O-N 3.32Å
441	A	21.7	Very low	21.5	Very low	96 Å²	96	143.8 Å²	143.8	79%	0.793	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-73.2	151.8	-165.4	0	0	0	0	0	114.8
442	T	20.1	Very low	21.6	Very low	133 Å²	133	148.6 Å²	148.6	82%	0.816	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-48.1	129.1	166.3	1	0	0	0	0	112.4
443	L	20.9	Very low	21.5	Very low	164 Å²	164	152 Å²	152	86%	0.859	81%	0.809	S	S	*	*			trans	-105.5	110	159.5	-109.2	164.2	0	0	0	108.3
444	L	20.3	Very low	21.6	Very low	153 Å²	153	155.1 Å²	155.1	80%	0.801	81%	0.811	S	S	*	*			trans	-62.8	132.5	169.1	-79.8	106.1	0	0	0	109.7
445	V	24.6	Very low	21.7	Very low	142 Å²	142	149.6 Å²	149.6	86%	0.861	81%	0.808	S	S	*	*			trans	-129.3	136.6	153.9	-178.1	0	0	0	0	107.9
446	H	21.2	Very low	21.9	Very low	163 Å²	163	150.7 Å²	150.7	76%	0.755	81%	0.814	S	S	*	*			trans	-78.8	145.4	-160.2	-147.6	46.7	0	0	0	112.8	N448	H446-N448 PolarHBondContact O-N 3.26Å
447	N	18.9	Very low	22.1	Very low	132 Å²	132	150.3 Å²	150.3	71%	0.706	81%	0.814	S	S	*	*			trans	-91.9	93.1	-176.4	-173.9	23	0	0	0	110.8	N449	N447-N449 PolarHBondContact O-N 3.16Å
448	N	21.4	Very low	22.3	Very low	141 Å²	141	150.4 Å²	150.4	75%	0.754	81%	0.807	S	S	*	*			trans	-93	96.8	176.8	-79.2	0.4	0	0	0	111.5	H446	H446-N448 PolarHBondContact O-N 3.26Å
449	N	19.9	Very low	22.6	Very low	141 Å²	141	145.7 Å²	145.7	75%	0.754	80%	0.799	S	S	*	*			trans	-69.8	126.1	162.7	-80.3	-35.4	0	0	0	110.7	N447	N447-N449 PolarHBondContact O-N 3.16Å
450	S	21.7	Very low	23.1	Very low	103 Å²	103	147.8 Å²	147.8	72%	0.72	80%	0.801	S	S	*	*			trans	-178	128.9	134.2	58.5	0	0	0	0	114.9
451	H	22.9	Very low	23.6	Very low	160 Å²	160	146.1 Å²	146.1	74%	0.741	79%	0.79	S	S	*	*			trans	74.3	108	146.4	-67.6	-52	0	0	0	124
452	Y	22.4	Very low	24.3	Very low	215 Å²	215	144.8 Å²	144.8	84%	0.843	77%	0.774	S	S	*	*			trans	74	111.8	135.7	-76.1	-70.1	0	0	0	122.8
453	N	21	Very low	25	Very low	164 Å²	164	141.3 Å²	141.3	88%	0.877	76%	0.76	S	S	*	*			trans	-58.8	138.3	155.3	-72.3	-37.5	0	0	0	112.7
454	K	24.4	Very low	25.5	Very low	193 Å²	193	142 Å²	142	84%	0.839	75%	0.751	S	S	*	*			trans	-140.8	120	149.7	-118.9	179.3	-179.7	179.9	0	108.2
455	G	24.7	Very low	26.3	Very low	81 Å²	81	139.6 Å²	139.6	84%	0.835	74%	0.739	S	S	*	*			trans	-75	148.8	-179.7	0	0	0	0	0	112
456	L	25.6	Very low	27	Very low	169 Å²	169	137.7 Å²	137.7	89%	0.885	72%	0.723	S	S	*	*			trans	-122.7	140.4	178.6	-93.3	162.6	0	0	0	113
457	S	26.4	Very low	27.8	Very low	103 Å²	103	135.9 Å²	135.9	72%	0.72	72%	0.718	S	S	*	*			trans	-49.4	143.9	-173	43.8	0	0	0	0	117.9	S459	S457-S459 PolarHBondContact O-N 3.36Å
458	K	27.4	Very low	28.9	Very low	179 Å²	179	133.5 Å²	133.5	78%	0.778	71%	0.708	S	S	*	*			trans	-57.8	113.1	171.6	-67.7	173.7	171.9	-179.6	0	112.9
459	S	28.4	Very low	30.2	Very low	101 Å²	101	130.5 Å²	130.5	71%	0.706	69%	0.692	S	S	*	*			trans	-83.6	123.3	163.2	44.5	0	0	0	0	110.4	S457 S461	S457-S459 PolarHBondContact O-N 3.36Å; S459-S461 VanDerWaalsContact C-N 3.31Å; S459-S461 PolarHBondContact O-N 2.99Å
460	R	30.3	Very low	31.9	Very low	250 Å²	250	128.2 Å²	128.2	94%	0.943	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	45.8	-162.1	-158.7	178	-177.6	177.8	-0.1	113.8
461	S	31.2	Very low	33.7	Very low	86 Å²	86	125.8 Å²	125.8	60%	0.601	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-19.8	-175.3	45.4	0	0	0	0	115.8	S459 A463	S459-S461 VanDerWaalsContact C-N 3.31Å; S459-S461 PolarHBondContact O-N 2.99Å; S461-A463 VanDerWaalsContact C-N 3.27Å; S461-A463 PolarHBondContact O-N 2.85Å
462	S	36.1	Very low	35.9	Very low	67 Å²	67	120.1 Å²	120.1	47%	0.469	64%	0.644	S	S	.	*	H	α-helix	trans	-66.8	-19	-173	63.3	0	0	0	0	115.6	R464 D465 L466	S462-R464 PolarHBondContact O-N 3.23Å; S462-D465 PolarHBondContact O-N 3.44Å; S462-L466 PolarHBondContact O-N 2.9Å
463	A	35.3	Very low	38.1	Very low	61 Å²	61	110.8 Å²	110.8	50%	0.504	61%	0.609	S	S	.	*	H	α-helix	trans	-67.2	-30.7	-172.9	0	0	0	0	0	114.5	S461 I467	S461-A463 VanDerWaalsContact C-N 3.27Å; S461-A463 PolarHBondContact O-N 2.85Å; A463-I467 WeakPolarHBondContact O-CD1 3.46Å; A463-I467 WeakPolarHBondContact O-CG1 3.34Å
464	R	32.3	Very low	40.5	Very low	177 Å²	177	110.5 Å²	110.5	67%	0.668	60%	0.6	S	S	*	*	H	α-helix	trans	-73.3	-38.2	174.2	-91.4	-176.4	175.2	165.6	0	111.1	S462 T468 D759	S462-R464 PolarHBondContact O-N 3.23Å; R464-T468 PolarHBondContact O-N 3.27Å; R464-D759 IonicContact CZ-OD2 3.19Å; R464-D759 IonicContact NH1-OD2 2.67Å; R464-D759 IonicContact NH2-OD2 3.06Å; R464-D759 PolarHBondContact NH2-OD2 2.91Å
465	D	37.3	Very low	42.7	Very low	104 Å²	104	107.4 Å²	107.4	56%	0.556	59%	0.588	S	S	*	*	H	α-helix	trans	-69.9	-40	179.4	-66.6	-24.7	0	0	0	112	S462 I467 T468 N469	S462-D465 PolarHBondContact O-N 3.44Å; D465-I467 PolarHBondContact O-N 3.41Å; D465-T468 PolarHBondContact O-N 3.17Å; D465-T468 VanDerWaalsContact O-N 3.08Å; D465-T468 PolarHBondContact O-OG1 3.4Å; D465-N469 PolarHBondContact O-N 3.22Å
466	L	38.1	Very low	44.9	Very low	102 Å²	102	108 Å²	108	53%	0.534	57%	0.569	S	S	.	*	H	α-helix	trans	-57.9	-45.9	179	-153.9	80.6	0	0	0	112.2	S462 T468 N469 D470	S462-L466 PolarHBondContact O-N 2.9Å; L466-T468 VanDerWaalsContact C-N 3.28Å; L466-T468 PolarHBondContact O-N 3.45Å; L466-N469 PolarHBondContact O-N 2.88Å; L466-D470 PolarHBondContact O-N 2.73Å
467	I	37.7	Very low	47.3	Very low	125 Å²	125	101.6 Å²	101.6	64%	0.641	54%	0.535	S	S	*	.	H	α-helix	trans	-63.5	-34.9	177.8	-64.1	169.4	0	0	0	111.2	A463 D465 A471	A463-I467 WeakPolarHBondContact O-CD1 3.46Å; A463-I467 WeakPolarHBondContact O-CG1 3.34Å; D465-I467 PolarHBondContact O-N 3.41Å; I467-A471 PolarHBondContact O-N 2.7Å
468	T	42.6	Very low	49.6	Very low	81 Å²	81	103 Å²	103	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-72.3	-32.6	176.3	61.1	0	0	0	0	113.2	R464 D465 L466 S472	R464-T468 PolarHBondContact O-N 3.27Å; D465-T468 PolarHBondContact O-N 3.17Å; D465-T468 VanDerWaalsContact O-N 3.08Å; D465-T468 PolarHBondContact O-OG1 3.4Å; L466-T468 VanDerWaalsContact C-N 3.28Å; L466-T468 PolarHBondContact O-N 3.45Å; T468-S472 WeakPolarHBondContact O-CB 3.22Å; T468-S472 PolarHBondContact O-N 2.98Å
469	N	48.5	Very low	52	Low	79 Å²	79	98.1 Å²	98.1	42%	0.422	52%	0.515	S	S	.	.	H	α-helix	trans	-66.2	-49.2	176.6	-73.5	-16.3	0	0	0	111.3	D465 L466 A471 S472 L473	D465-N469 PolarHBondContact O-N 3.22Å; L466-N469 PolarHBondContact O-N 2.88Å; N469-A471 PolarHBondContact O-N 3.27Å; N469-S472 WeakPolarHBondContact O-CA 3.49Å; N469-S472 WeakPolarHBondContact O-CB 3.34Å; N469-S472 PolarHBondContact O-N 2.93Å; N469-S472 PolarHBondContact O-OG 3.2Å; N469-L473 WeakPolarHBondContact O-CG 3.47Å; N469-L473 PolarHBondContact O-N 3.17Å
470	D	55.7	Low	54.5	Low	93 Å²	93	93.9 Å²	93.9	50%	0.497	48%	0.484	S	S	.	.	H	α-helix	trans	-57.2	-46.2	176.9	-102.4	-19.1	0	0	0	112.4	L466 S472 L473 K474	L466-D470 PolarHBondContact O-N 2.73Å; D470-S472 VanDerWaalsContact C-N 3.28Å; D470-S472 PolarHBondContact O-N 3.25Å; D470-L473 PolarHBondContact O-N 3.02Å; D470-K474 WeakPolarHBondContact O-CB 3.33Å; D470-K474 PolarHBondContact O-N 2.8Å
471	A	60.2	Low	56.9	Low	51 Å²	51	84.3 Å²	84.3	42%	0.421	45%	0.452	S	S	.	.	H	α-helix	trans	-60.7	-38.7	175.7	0	0	0	0	0	111.9	I467 N469 Q475	I467-A471 PolarHBondContact O-N 2.7Å; N469-A471 PolarHBondContact O-N 3.27Å; A471-Q475 WeakPolarHBondContact O-CG 3.27Å; A471-Q475 PolarHBondContact O-N 3.12Å; A471-Q475 VanDerWaalsContact O-N 3.09Å
472	S	67.4	Low	59.2	Low	42 Å²	42	86.7 Å²	86.7	29%	0.294	45%	0.451	S	S	.	.	H	α-helix	trans	-70	-41	177.6	84.2	0	0	0	0	112.8	T468 N469 D470 Q475 Q476	T468-S472 WeakPolarHBondContact O-CB 3.22Å; T468-S472 PolarHBondContact O-N 2.98Å; N469-S472 WeakPolarHBondContact O-CA 3.49Å; N469-S472 WeakPolarHBondContact O-CB 3.34Å; N469-S472 PolarHBondContact O-N 2.93Å; N469-S472 PolarHBondContact O-OG 3.2Å; D470-S472 VanDerWaalsContact C-N 3.28Å; D470-S472 PolarHBondContact O-N 3.25Å; S472-Q475 PolarHBondContact O-N 2.89Å; S472-Q476 VanDerWaalsContact O-CG 3.32Å; S472-Q476 WeakPolarHBondContact O-CG 3.39Å; S472-Q476 PolarHBondContact O-N 3.41Å
473	L	69.9	Low	61.4	Low	19 Å²	19	88.5 Å²	88.5	10%	0.099	45%	0.448	C	S	.	.	H	α-helix	trans	-64.7	-43.6	177.6	-72.2	169	0	0	0	110.5	I268 E275 N469 D470 Q475 Q476 Q477	I268-L473 HydrophobicContact CG2-CD2 3.96Å; E275-L473 WeakPolarHBondContact OE2-CD1 3.4Å; N469-L473 WeakPolarHBondContact O-CG 3.47Å; N469-L473 PolarHBondContact O-N 3.17Å; D470-L473 PolarHBondContact O-N 3.02Å; L473-Q475 PolarHBondContact O-N 3.19Å; L473-Q476 PolarHBondContact O-N 3.33Å; L473-Q477 WeakPolarHBondContact O-CG 3.41Å; L473-Q477 PolarHBondContact O-N 2.86Å
474	K	71.6	Confident	63.7	Low	157 Å²	157	85.6 Å²	85.6	68%	0.683	42%	0.424	S	S	*	.	H	α-helix	trans	-62.3	-42.2	176	-167.7	171.5	-178	177.9	0	112.1	D470 Q477 E478	D470-K474 WeakPolarHBondContact O-CB 3.33Å; D470-K474 PolarHBondContact O-N 2.8Å; K474-Q477 PolarHBondContact O-N 3.23Å; K474-E478 PolarHBondContact O-N 3.44Å
475	Q	69.9	Low	66.1	Low	128 Å²	128	77.3 Å²	77.3	60%	0.598	39%	0.393	S	S	*	.	H	α-helix	trans	-62.9	-40.6	172.5	-75.4	177.6	5.5	0	0	112.5	A471 S472 L473 E478 V479	A471-Q475 WeakPolarHBondContact O-CG 3.27Å; A471-Q475 PolarHBondContact O-N 3.12Å; A471-Q475 VanDerWaalsContact O-N 3.09Å; S472-Q475 PolarHBondContact O-N 2.89Å; L473-Q475 PolarHBondContact O-N 3.19Å; Q475-E478 PolarHBondContact O-N 3.16Å; Q475-V479 WeakPolarHBondContact O-CG2 3.29Å; Q475-V479 PolarHBondContact O-N 2.97Å
476	Q	71.5	Confident	68.2	Low	94 Å²	94	75 Å²	75	44%	0.439	38%	0.379	S	S	.	.	H	α-helix	trans	-64.1	-40.9	175.8	-72.9	175.7	14.7	0	0	112.2	I268 S472 L473 V479 L480	I268-Q476 HydrophobicContact CD1-CB 4.22Å; S472-Q476 VanDerWaalsContact O-CG 3.32Å; S472-Q476 WeakPolarHBondContact O-CG 3.39Å; S472-Q476 PolarHBondContact O-N 3.41Å; L473-Q476 PolarHBondContact O-N 3.33Å; Q476-V479 PolarHBondContact O-N 3.45Å; Q476-L480 WeakPolarHBondContact O-CG 3.19Å; Q476-L480 PolarHBondContact O-N 2.61Å
477	Q	75.5	Confident	70.3	Confident	34 Å²	34	70.1 Å²	70.1	16%	0.159	35%	0.353	C	S	.	.	H	α-helix	trans	-60.7	-45.2	174.4	-70.9	177.4	17.2	0	0	111.8	Y265 I268 S272 L473 K474 L480 L481	Y265-Q477 HydrophobicContact CD2-CB 4.47Å; Y265-Q477 HydrophobicContact CE2-CB 4.21Å; Y265-Q477 HydrophobicContact CE2-CG 4.43Å; I268-Q477 HydrophobicContact CB-CG 4.48Å; I268-Q477 HydrophobicContact CG2-CG 3.62Å; I268-Q477 PolarHBondContact O-NE2 2.91Å; S272-Q477 PolarHBondContact OG-NE2 2.96Å; L473-Q477 WeakPolarHBondContact O-CG 3.41Å; L473-Q477 PolarHBondContact O-N 2.86Å; K474-Q477 PolarHBondContact O-N 3.23Å; Q477-L480 PolarHBondContact O-N 3.29Å; Q477-L481 WeakPolarHBondContact O-CB 3.26Å; Q477-L481 WeakPolarHBondContact O-CG 3.48Å; Q477-L481 PolarHBondContact O-N 3.12Å
478	E	75	Confident	72.5	Confident	134 Å²	134	64.2 Å²	64.2	63%	0.626	32%	0.323	S	S	*	.	H	α-helix	trans	-64	-41.6	178.4	-169.5	177.9	176.1	0	0	112.1	K474 Q475 L480 L481 K482	K474-E478 PolarHBondContact O-N 3.44Å; Q475-E478 PolarHBondContact O-N 3.16Å; E478-L480 PolarHBondContact O-N 3Å; E478-L481 PolarHBondContact O-N 3.34Å; E478-K482 WeakPolarHBondContact O-CB 3.31Å; E478-K482 PolarHBondContact O-N 3.39Å
479	V	77.9	Confident	74.3	Confident	75 Å²	75	60.4 Å²	60.4	46%	0.455	30%	0.3	S	S	.	.	H	α-helix	trans	-62.4	-40.7	174.1	169.7	0	0	0	0	111.7	Q475 Q476 R483	Q475-V479 WeakPolarHBondContact O-CG2 3.29Å; Q475-V479 PolarHBondContact O-N 2.97Å; Q476-V479 PolarHBondContact O-N 3.45Å; V479-R483 WeakPolarHBondContact O-CG 3.36Å; V479-R483 PolarHBondContact O-N 3.22Å
480	L	79.8	Confident	75.9	Confident	12 Å²	12	57.1 Å²	57.1	6%	0.063	28%	0.282	C	S	.	.	H	α-helix	trans	-70.1	-41.4	177.2	-72.5	171.8	0	0	0	112.4	H261 L264 Y265 I268 Q476 Q477 E478 K482 R483 L484	H261-L480 HydrophobicContact CB-CD2 4.1Å; L264-L480 HydrophobicContact CB-CD1 4.02Å; L264-L480 HydrophobicContact CB-CD2 4.44Å; Y265-L480 HydrophobicContact CD2-CB 4.38Å; I268-L480 HydrophobicContact CD1-CD1 3.69Å; Q476-L480 WeakPolarHBondContact O-CG 3.19Å; Q476-L480 PolarHBondContact O-N 2.61Å; Q477-L480 PolarHBondContact O-N 3.29Å; E478-L480 PolarHBondContact O-N 3Å; L480-K482 VanDerWaalsContact C-N 3.34Å; L480-K482 PolarHBondContact O-N 2.85Å; L480-R483 PolarHBondContact O-N 3.36Å; L480-L484 WeakPolarHBondContact O-CG 3.37Å; L480-L484 PolarHBondContact O-N 3.27Å
481	L	81.2	Confident	77.2	Confident	49 Å²	49	52.7 Å²	52.7	26%	0.257	26%	0.258	S	S	.	.	H	α-helix	trans	-56.6	-48.4	171.9	-78.6	160.8	0	0	0	110.9	P195 Y265 Q477 E478 R483 L484 C485	P195-L481 HydrophobicContact CG-CD2 3.86Å; Y265-L481 HydrophobicContact CD2-CG 4.12Å; Y265-L481 HydrophobicContact CE2-CD1 3.84Å; Y265-L481 HydrophobicContact CE2-CD2 3.96Å; Y265-L481 HydrophobicContact CE2-CG 3.65Å; Q477-L481 WeakPolarHBondContact O-CB 3.26Å; Q477-L481 WeakPolarHBondContact O-CG 3.48Å; Q477-L481 PolarHBondContact O-N 3.12Å; E478-L481 PolarHBondContact O-N 3.34Å; L481-R483 VanDerWaalsContact C-N 3.35Å; L481-R483 PolarHBondContact O-N 2.82Å; L481-L484 PolarHBondContact O-N 3.41Å; L481-C485 PolarHBondContact O-N 3.13Å; L481-C485 PolarHBondContact O-SG 2.9Å; L481-C485 VanDerWaalsContact O-SG 3.36Å
482	K	79.1	Confident	78.2	Confident	137 Å²	137	50.5 Å²	50.5	60%	0.596	24%	0.239	S	C	*	.	H	α-helix	trans	-59.3	-42.6	176.5	-172.2	171.3	-177.4	172.8	0	112.1	E478 L480 C485 Q486	E478-K482 WeakPolarHBondContact O-CB 3.31Å; E478-K482 PolarHBondContact O-N 3.39Å; L480-K482 VanDerWaalsContact C-N 3.34Å; L480-K482 PolarHBondContact O-N 2.85Å; K482-C485 PolarHBondContact O-N 3.25Å; K482-Q486 WeakPolarHBondContact O-CB 3.36Å; K482-Q486 VanDerWaalsContact O-CG 3.25Å; K482-Q486 WeakPolarHBondContact O-CG 3.41Å; K482-Q486 PolarHBondContact O-N 3.1Å
483	R	82.5	Confident	78.7	Confident	105 Å²	105	49.4 Å²	49.4	40%	0.396	23%	0.229	S	C	.	.	H	α-helix	trans	-64.4	-41.6	175.5	-75.9	177.6	179.7	-176	0.1	113.1	V479 L480 L481 Q486 I487 Y690	V479-R483 WeakPolarHBondContact O-CG 3.36Å; V479-R483 PolarHBondContact O-N 3.22Å; L480-R483 PolarHBondContact O-N 3.36Å; L481-R483 VanDerWaalsContact C-N 3.35Å; L481-R483 PolarHBondContact O-N 2.82Å; R483-Q486 PolarHBondContact O-N 3.09Å; R483-I487 WeakPolarHBondContact O-CG1 3.5Å; R483-I487 PolarHBondContact O-N 3.4Å; R483-Y690 HydrophobicContact CB-CE2 4.35Å; R483-Y690 HydrophobicContact CG-CE2 4.26Å
484	L	84.1	Confident	79.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-46.4	176	-70.3	168.1	0	0	0	110.6	P195 Y258 H261 W262 L480 L481 Q486 I487 E488	P195-L484 HydrophobicContact CB-CB 3.85Å; P195-L484 HydrophobicContact CG-CB 4.25Å; P195-L484 HydrophobicContact CG-CD1 4.24Å; Y258-L484 HydrophobicContact CD1-CD2 4.33Å; Y258-L484 HydrophobicContact CD2-CD2 3.61Å; Y258-L484 HydrophobicContact CE1-CD2 4.31Å; Y258-L484 HydrophobicContact CE2-CB 3.99Å; Y258-L484 HydrophobicContact CE2-CD2 3.59Å; Y258-L484 HydrophobicContact CE2-CG 4.41Å; Y258-L484 HydrophobicContact CG-CD2 4Å; Y258-L484 WeakPolarHBondContact O-CD2 3.49Å; H261-L484 HydrophobicContact CB-CD2 3.94Å; H261-L484 HydrophobicContact CB-CG 4.32Å; W262-L484 HydrophobicContact CB-CD2 4.24Å; W262-L484 HydrophobicContact CE3-CD1 4.28Å; L480-L484 WeakPolarHBondContact O-CG 3.37Å; L480-L484 PolarHBondContact O-N 3.27Å; L481-L484 PolarHBondContact O-N 3.41Å; L484-Q486 PolarHBondContact O-N 2.92Å; L484-I487 PolarHBondContact O-N 2.67Å; L484-E488 WeakPolarHBondContact O-CG 3.23Å; L484-E488 PolarHBondContact O-N 2.98Å
485	C	82.6	Confident	79.5	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.02	19%	0.193	C	C	.	.	H	α-helix	trans	-65.3	-34.5	175.9	-63.1	0	0	0	0	113.5	V191 Q192 L481 K482 E488 A489	V191-C485 HydrophobicContact CG1-CB 3.89Å; Q192-C485 WeakPolarHBondContact O-CB 3.44Å; Q192-C485 PolarHBondContact O-SG 3.39Å; L481-C485 PolarHBondContact O-N 3.13Å; L481-C485 PolarHBondContact O-SG 2.9Å; L481-C485 VanDerWaalsContact O-SG 3.36Å; K482-C485 PolarHBondContact O-N 3.25Å; C485-E488 WeakPolarHBondContact O-CB 3.41Å; C485-E488 PolarHBondContact O-N 2.83Å; C485-A489 PolarHBondContact O-N 3.4Å
486	Q	81.4	Confident	79.8	Confident	54 Å²	54	35.2 Å²	35.2	25%	0.252	16%	0.164	S	C	.	.	H	α-helix	trans	-65.4	-41.1	173.3	-79.6	173.9	-37.1	0	0	112.3	K482 R483 L484 E488 A489 Q490 F689 Y690	K482-Q486 WeakPolarHBondContact O-CB 3.36Å; K482-Q486 VanDerWaalsContact O-CG 3.25Å; K482-Q486 WeakPolarHBondContact O-CG 3.41Å; K482-Q486 PolarHBondContact O-N 3.1Å; R483-Q486 PolarHBondContact O-N 3.09Å; L484-Q486 PolarHBondContact O-N 2.92Å; Q486-E488 VanDerWaalsContact C-N 3.34Å; Q486-A489 PolarHBondContact O-N 3Å; Q486-Q490 WeakPolarHBondContact O-CB 3.47Å; Q486-Q490 PolarHBondContact O-N 3.23Å; Q486-F689 WeakPolarHBondContact CB-O 3.32Å; Q486-F689 VanDerWaalsContact CG-O 3.31Å; Q486-F689 WeakPolarHBondContact CG-O 3.39Å; Q486-Y690 HydrophobicContact CB-CD2 4.24Å
487	I	82.7	Confident	80.1	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-68.1	-35.4	175	-66.2	163.9	0	0	0	110.8	F204 L254 E257 Y258 R483 L484 Q490 T491 Y690	F204-I487 HydrophobicContact CZ-CG2 4.28Å; L254-I487 HydrophobicContact CB-CG2 4.15Å; L254-I487 HydrophobicContact CD2-CG1 4.43Å; L254-I487 HydrophobicContact CD2-CG2 4.11Å; E257-I487 HydrophobicContact CB-CD1 4.37Å; Y258-I487 HydrophobicContact CD2-CB 4.01Å; Y258-I487 HydrophobicContact CD2-CG2 3.76Å; Y258-I487 HydrophobicContact CG-CG2 4.34Å; R483-I487 WeakPolarHBondContact O-CG1 3.5Å; R483-I487 PolarHBondContact O-N 3.4Å; L484-I487 PolarHBondContact O-N 2.67Å; I487-Q490 PolarHBondContact O-N 2.89Å; I487-T491 WeakPolarHBondContact O-CB 3.4Å; I487-T491 PolarHBondContact O-N 2.83Å; I487-T491 PolarHBondContact O-OG1 3.21Å; I487-Y690 HydrophobicContact CD1-CD1 4.48Å; I487-Y690 HydrophobicContact CD1-CD2 4.2Å; I487-Y690 HydrophobicContact CD1-CE1 4.22Å; I487-Y690 HydrophobicContact CD1-CE2 3.94Å; I487-Y690 HydrophobicContact CD1-CG 4.46Å; I487-Y690 HydrophobicContact CG1-CD1 3.84Å; I487-Y690 HydrophobicContact CG1-CD2 3.62Å; I487-Y690 HydrophobicContact CG1-CE1 4.09Å; I487-Y690 HydrophobicContact CG1-CE2 3.89Å; I487-Y690 HydrophobicContact CG1-CG 3.59Å
488	E	84.2	Confident	80.2	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-59.5	-54.6	171	-76.5	-176.8	-162.4	0	0	111.4	P195 R196 T200 Y258 L484 C485 Q486 Q490 T491 E492 I620	P195-E488 WeakPolarHBondContact CA-OE1 3.45Å; P195-E488 WeakPolarHBondContact CB-OE1 3.41Å; R196-E488 IonicContact CZ-OE2 2.8Å; R196-E488 PolarHBondContact N-OE1 2.9Å; R196-E488 PolarHBondContact N-OE2 3.07Å; R196-E488 IonicContact NE-OE2 3.54Å; R196-E488 PolarHBondContact NE-OE2 3.24Å; R196-E488 IonicContact NH2-OE2 3.16Å; R196-E488 PolarHBondContact NH2-OE2 2.88Å; T200-E488 HydrophobicContact CG2-CG 3.73Å; T200-E488 PolarHBondContact OG1-OE1 3.1Å; Y258-E488 HydrophobicContact CE2-CG 3.85Å; Y258-E488 PolarHBondContact OH-OE1 3.01Å; L484-E488 WeakPolarHBondContact O-CG 3.23Å; L484-E488 PolarHBondContact O-N 2.98Å; C485-E488 WeakPolarHBondContact O-CB 3.41Å; C485-E488 PolarHBondContact O-N 2.83Å; Q486-E488 VanDerWaalsContact C-N 3.34Å; E488-Q490 VanDerWaalsContact C-N 3.3Å; E488-Q490 PolarHBondContact O-N 3.28Å; E488-T491 CarbonylContact O-C 3.58Å; E488-T491 WeakPolarHBondContact O-CA 3.38Å; E488-T491 WeakPolarHBondContact O-CB 3.2Å; E488-T491 PolarHBondContact O-N 2.89Å; E488-E492 VanDerWaalsContact O-CG 3.3Å; E488-E492 WeakPolarHBondContact O-CG 3.33Å; E488-E492 PolarHBondContact O-N 2.7Å; E488-I620 HydrophobicContact CB-CD1 3.64Å; E488-I620 HydrophobicContact CG-CD1 3.62Å
489	A	79.8	Confident	80.1	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-59.9	-38.2	178.1	0	0	0	0	0	112.6	P189 V191 C485 Q486 E492 Y493 F689	P189-A489 WeakPolarHBondContact CG-O 3.17Å; V191-A489 HydrophobicContact CB-CB 4.47Å; V191-A489 HydrophobicContact CG2-CB 3.79Å; C485-A489 PolarHBondContact O-N 3.4Å; Q486-A489 PolarHBondContact O-N 3Å; A489-E492 PolarHBondContact O-N 3.25Å; A489-Y493 WeakPolarHBondContact O-CB 3.01Å; A489-Y493 PolarHBondContact O-N 2.84Å; A489-F689 HydrophobicContact CB-CB 4.1Å; A489-F689 HydrophobicContact CB-CD1 4Å; A489-F689 HydrophobicContact CB-CG 3.95Å
490	Q	82.1	Confident	80	Confident	10 Å²	10	20.2 Å²	20.2	5%	0.047	9%	0.09	C	C	.	.	H	α-helix	trans	-62.7	-41.9	172.5	-165	67.6	31.1	0	0	111.5	L254 Q486 I487 E488 Y493 L494 M687 F689	L254-Q490 HydrophobicContact CD1-CB 4.36Å; L254-Q490 HydrophobicContact CD1-CG 3.88Å; L254-Q490 HydrophobicContact CD2-CG 4.33Å; Q486-Q490 WeakPolarHBondContact O-CB 3.47Å; Q486-Q490 PolarHBondContact O-N 3.23Å; I487-Q490 PolarHBondContact O-N 2.89Å; E488-Q490 VanDerWaalsContact C-N 3.3Å; E488-Q490 PolarHBondContact O-N 3.28Å; Q490-Y493 PolarHBondContact O-N 2.84Å; Q490-L494 HydrophobicContact CG-CD1 3.96Å; Q490-L494 HydrophobicContact CG-CG 4.43Å; Q490-L494 VanDerWaalsContact O-CB 3.32Å; Q490-L494 WeakPolarHBondContact O-CB 3.5Å; Q490-L494 WeakPolarHBondContact O-CG 3.45Å; Q490-L494 PolarHBondContact O-N 3.37Å; Q490-M687 PolarHBondContact NE2-O 3.34Å; Q490-M687 VanDerWaalsContact NE2-O 3.11Å; Q490-M687 PolarHBondContact OE1-O 3.34Å; Q490-F689 HydrophobicContact CB-CB 4.37Å
491	T	83	Confident	79.7	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-69.5	-37.1	-179.9	-54.2	0	0	0	0	111.5	F203 F204 I207 I487 E488 L494 S495	F203-T491 HydrophobicContact CD1-CG2 3.91Å; F203-T491 HydrophobicContact CE1-CG2 4.04Å; F204-T491 HydrophobicContact CD1-CG2 3.83Å; F204-T491 HydrophobicContact CE1-CG2 3.43Å; F204-T491 VanDerWaalsContact CE1-CG2 3.43Å; F204-T491 WeakPolarHBondContact CE1-OG1 3.48Å; F204-T491 HydrophobicContact CZ-CG2 3.94Å; F204-T491 WeakPolarHBondContact CZ-OG1 3.47Å; I207-T491 HydrophobicContact CD1-CG2 4.42Å; I487-T491 WeakPolarHBondContact O-CB 3.4Å; I487-T491 PolarHBondContact O-N 2.83Å; I487-T491 PolarHBondContact O-OG1 3.21Å; E488-T491 CarbonylContact O-C 3.58Å; E488-T491 WeakPolarHBondContact O-CA 3.38Å; E488-T491 WeakPolarHBondContact O-CB 3.2Å; E488-T491 PolarHBondContact O-N 2.89Å; T491-L494 CarbonylContact O-C 3.46Å; T491-L494 PolarHBondContact O-N 2.8Å; T491-S495 WeakPolarHBondContact O-CB 3.41Å; T491-S495 PolarHBondContact O-N 2.88Å
492	E	81.6	Confident	79.5	Confident	5 Å²	5	18.4 Å²	18.4	2%	0.023	8%	0.081	C	C	.	.	H	α-helix	trans	-63.5	-47	172.8	-66.6	174	150.3	0	0	110.9	P189 R196 F203 E488 A489 L494 S495 T619 I620	P189-E492 HydrophobicContact CB-CB 4.04Å; R196-E492 IonicContact CZ-OE1 2.77Å; R196-E492 IonicContact NH1-OE1 3.38Å; R196-E492 PolarHBondContact NH1-OE1 2.86Å; R196-E492 IonicContact NH2-OE1 3.19Å; R196-E492 PolarHBondContact NH2-OE1 2.74Å; R196-E492 IonicContact NH2-OE2 2.7Å; F203-E492 HydrophobicContact CE1-CG 4.05Å; F203-E492 HydrophobicContact CZ-CG 4.47Å; E488-E492 VanDerWaalsContact O-CG 3.3Å; E488-E492 WeakPolarHBondContact O-CG 3.33Å; E488-E492 PolarHBondContact O-N 2.7Å; A489-E492 PolarHBondContact O-N 3.25Å; E492-L494 VanDerWaalsContact C-N 3.31Å; E492-L494 PolarHBondContact O-N 2.73Å; E492-S495 VanDerWaalsContact O-CB 3.3Å; E492-S495 WeakPolarHBondContact O-CB 3.45Å; E492-S495 PolarHBondContact O-N 2.94Å; E492-S495 VanDerWaalsContact O-N 3.1Å; E492-S495 PolarHBondContact O-OG 2.89Å; E492-T619 VanDerWaalsContact OE1-CB 3.27Å; E492-T619 WeakPolarHBondContact OE1-CB 3.43Å; E492-T619 PolarHBondContact OE1-OG1 3.49Å; E492-I620 HydrophobicContact CG-CB 4.43Å; E492-I620 HydrophobicContact CG-CD1 3.76Å; E492-I620 HydrophobicContact CG-CG1 3.78Å; E492-I620 WeakPolarHBondContact OE1-CB 3.4Å; E492-I620 PolarHBondContact OE1-N 3.48Å
493	Y	77.4	Confident	79.2	Confident	20 Å²	20	13.7 Å²	13.7	8%	0.078	6%	0.062	C	C	.	.	H	α-helix	trans	-58.6	-41.9	172.3	-176.2	-102.9	0	0	0	112.2	R186 A489 Q490 S495 T682 M687 F689	R186-Y493 PolarHBondContact NH1-O 3.37Å; A489-Y493 WeakPolarHBondContact O-CB 3.01Å; A489-Y493 PolarHBondContact O-N 2.84Å; Q490-Y493 PolarHBondContact O-N 2.84Å; Y493-S495 PolarHBondContact O-N 3.33Å; Y493-T682 HydrophobicContact CE1-CG2 4.32Å; Y493-M687 HydrophobicContact CE1-CB 3.97Å; Y493-M687 HydrophobicContact CE2-CB 4.24Å; Y493-M687 HydrophobicContact CE2-SD 4.11Å; Y493-F689 HydrophobicContact CD2-CE2 4.23Å; Y493-F689 HydrophobicContact CG-CE2 4.14Å
494	L	79	Confident	78.8	Confident	4 Å²	4	8.7 Å²	8.7	2%	0.021	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-4.6	178.8	-67.5	173.8	0	0	0	113.7	R247 T250 I251 L254 Q490 T491 E492	R247-L494 VanDerWaalsContact CZ-CD2 3.48Å; R247-L494 PolarHBondContact NE-O 3.45Å; R247-L494 PolarHBondContact NH2-O 3.2Å; R247-L494 VanDerWaalsContact NH2-O 3.1Å; T250-L494 HydrophobicContact CG2-CD1 3.89Å; I251-L494 HydrophobicContact CD1-CB 4.41Å; I251-L494 HydrophobicContact CG1-CB 4.36Å; I251-L494 HydrophobicContact CG1-CD1 4.46Å; L254-L494 HydrophobicContact CD1-CD1 3.36Å; Q490-L494 HydrophobicContact CG-CD1 3.96Å; Q490-L494 HydrophobicContact CG-CG 4.43Å; Q490-L494 VanDerWaalsContact O-CB 3.32Å; Q490-L494 WeakPolarHBondContact O-CB 3.5Å; Q490-L494 WeakPolarHBondContact O-CG 3.45Å; Q490-L494 PolarHBondContact O-N 3.37Å; T491-L494 CarbonylContact O-C 3.46Å; T491-L494 PolarHBondContact O-N 2.8Å; E492-L494 VanDerWaalsContact C-N 3.31Å; E492-L494 PolarHBondContact O-N 2.73Å
495	S	78.5	Confident	78.3	Confident	1 Å²	1	8.8 Å²	8.8	1%	0.007	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-22.4	-172.1	74	0	0	0	0	115.4	F203 T491 E492 Y493 P618 W676	F203-S495 VanDerWaalsContact CZ-CB 3.46Å; T491-S495 WeakPolarHBondContact O-CB 3.41Å; T491-S495 PolarHBondContact O-N 2.88Å; E492-S495 VanDerWaalsContact O-CB 3.3Å; E492-S495 WeakPolarHBondContact O-CB 3.45Å; E492-S495 PolarHBondContact O-N 2.94Å; E492-S495 VanDerWaalsContact O-N 3.1Å; E492-S495 PolarHBondContact O-OG 2.89Å; Y493-S495 PolarHBondContact O-N 3.33Å; S495-P618 WeakPolarHBondContact OG-CD 3.44Å; S495-P618 WeakPolarHBondContact OG-CG 3.38Å; S495-P618 PolarHBondContact OG-O 3.43Å; S495-W676 WeakPolarHBondContact O-CZ2 3.12Å; S495-W676 PolarHBondContact O-NE1 3.05Å
496	G	77.9	Confident	77.6	Confident	0 Å²	0	9 Å²	9	0%	0	5%	0.045	C	C	.	.			trans	115.6	-163.1	-177.1	0	0	0	0	0	113.4	R186 P618 C677	R186-G496 PolarHBondContact NH2-O 3.33Å; G496-P618 WeakPolarHBondContact O-CD 3.27Å; G496-C677 CarbonylContact C-O 3.56Å; G496-C677 WeakPolarHBondContact CA-O 3.19Å
497	T	77	Confident	76.9	Confident	0 Å²	0	7.6 Å²	7.6	0%	0	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	161.2	160.7	54	0	0	0	0	110.4	R186 I615 F616 C677 A680	R186-T497 HydrophobicContact CG-CG2 3.59Å; T497-I615 HydrophobicContact CG2-CG2 3.87Å; T497-F616 CarbonylContact C-O 3.55Å; T497-F616 WeakPolarHBondContact CA-O 3.35Å; T497-C677 PolarHBondContact N-O 3.46Å; T497-C677 PolarHBondContact O-N 2.9Å; T497-A680 HydrophobicContact CG2-CB 4.07Å; T497-A680 WeakPolarHBondContact OG1-CB 3.49Å
498	L	77	Confident	75.8	Confident	0 Å²	0	10 Å²	10	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.8	168.6	-75.4	158.6	0	0	0	108.3	I615 F616 P618 I647 L674 K675 W676	L498-I615 WeakPolarHBondContact O-CA 3.5Å; L498-F616 HydrophobicContact CB-CD2 3.98Å; L498-F616 HydrophobicContact CB-CE1 4.31Å; L498-F616 HydrophobicContact CB-CE2 3.54Å; L498-F616 HydrophobicContact CB-CZ 3.74Å; L498-F616 HydrophobicContact CD1-CD2 4.26Å; L498-F616 HydrophobicContact CD1-CE2 3.52Å; L498-F616 HydrophobicContact CD1-CZ 4.2Å; L498-F616 HydrophobicContact CG-CE2 4.17Å; L498-F616 PolarHBondContact N-O 3.27Å; L498-F616 PolarHBondContact O-N 3.18Å; L498-P618 HydrophobicContact CD1-CB 4.07Å; L498-P618 HydrophobicContact CD1-CG 3.79Å; L498-P618 HydrophobicContact CG-CG 4.02Å; L498-I647 HydrophobicContact CD1-CG2 3.35Å; L498-L674 HydrophobicContact CB-CD1 4.23Å; L498-L674 HydrophobicContact CD2-CD2 4.09Å; L498-L674 HydrophobicContact CD2-CG 4.06Å; L498-K675 CarbonylContact C-O 3.3Å; L498-K675 WeakPolarHBondContact CA-O 3.38Å; L498-W676 HydrophobicContact CD2-CB 3.71Å; L498-W676 HydrophobicContact CD2-CG 4.19Å
499	I	72.7	Confident	74.2	Confident	22 Å²	22	11.8 Å²	11.8	11%	0.113	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	118.9	175.6	-52.5	-175.9	0	0	0	107.7	I615 L674 K675 C677	I499-I615 HydrophobicContact CD1-CD1 4.21Å; I499-I615 HydrophobicContact CG1-CD1 4.09Å; I499-I615 HydrophobicContact CG1-CG1 4.05Å; I499-I615 HydrophobicContact CG2-CG1 4.3Å; I499-L674 WeakPolarHBondContact O-CA 3.22Å; I499-K675 HydrophobicContact CB-CB 4.48Å; I499-K675 PolarHBondContact N-O 3.47Å; I499-K675 PolarHBondContact O-N 2.61Å; I499-C677 VanDerWaalsContact CD1-SG 3.53Å
500	C	75.8	Confident	72.8	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	120.4	173.2	-165.1	0	0	0	0	109.2	W563 K613 H614 F616 F672 I673 L674	C500-W563 HydrophobicContact CB-CH2 4.38Å; C500-W563 HydrophobicContact CB-CZ3 3.78Å; C500-W563 WeakPolarHBondContact O-CH2 3.2Å; C500-K613 WeakPolarHBondContact O-CA 3.27Å; C500-H614 PolarHBondContact N-O 3.01Å; C500-H614 PolarHBondContact O-N 2.97Å; C500-F616 HydrophobicContact CB-CE1 4.09Å; C500-F672 WeakPolarHBondContact SG-CD2 3.46Å; C500-I673 WeakPolarHBondContact CA-O 3.27Å; C500-L674 HydrophobicContact CB-CD1 3.89Å
501	E	74.2	Confident	71.3	Confident	13 Å²	13	19.1 Å²	19.1	6%	0.061	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	117	-175.1	178.2	168.7	-149.4	0	0	109.6	L592 T612 K613 F672 I673 K675	E501-L592 WeakPolarHBondContact OE1-CD2 3.45Å; E501-T612 WeakPolarHBondContact CA-O 3.44Å; E501-K613 HydrophobicContact CB-CG 4.32Å; E501-K613 HydrophobicContact CG-CG 4.18Å; E501-K613 WeakPolarHBondContact OE1-CE 3.41Å; E501-K613 IonicContact OE1-NZ 2.68Å; E501-K613 PolarHBondContact OE1-NZ 3.28Å; E501-F672 CarbonylContact O-C 3.53Å; E501-F672 VanDerWaalsContact O-CA 3.32Å; E501-F672 WeakPolarHBondContact O-CA 3.45Å; E501-I673 PolarHBondContact N-O 3.06Å; E501-I673 PolarHBondContact O-N 2.91Å; E501-K675 IonicContact OE2-NZ 3.96Å; E501-K675 PolarHBondContact OE2-NZ 3.22Å
502	V	77.6	Confident	69.9	Low	11 Å²	11	19.4 Å²	19.4	7%	0.067	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	125.3	-178.8	171.9	0	0	0	0	111.4	W563 I565 W609 T612 F670 F672	V502-W563 HydrophobicContact CG2-CH2 3.97Å; V502-W563 HydrophobicContact CG2-CZ3 4.45Å; V502-I565 HydrophobicContact CB-CD1 4.47Å; V502-I565 HydrophobicContact CG2-CD1 3.37Å; V502-W609 HydrophobicContact CG1-CD2 4.15Å; V502-W609 HydrophobicContact CG1-CE3 4.42Å; V502-W609 HydrophobicContact CG1-CG 4.4Å; V502-T612 PolarHBondContact N-O 2.95Å; V502-F670 HydrophobicContact CG1-CE2 3.61Å; V502-F670 HydrophobicContact CG1-CZ 3.95Å; V502-F670 HydrophobicContact CG2-CE2 4.34Å; V502-F670 HydrophobicContact CG2-CZ 3.81Å; V502-F672 HydrophobicContact CG2-CB 4.26Å
503	I	72.5	Confident	68.5	Low	38 Å²	38	22.3 Å²	22.3	20%	0.195	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-39.4	170.4	-52	177.7	0	0	0	109.9	L604 Q607 H657 H671 I673	I503-L604 HydrophobicContact CG2-CD1 3.8Å; I503-Q607 PolarHBondContact O-NE2 2.7Å; I503-H657 VanDerWaalsContact CD1-CD2 3.49Å; I503-H657 WeakPolarHBondContact CD1-CD2 3.23Å; I503-H657 WeakPolarHBondContact CD1-NE2 3.32Å; I503-H671 HydrophobicContact CB-CB 3.95Å; I503-H671 HydrophobicContact CD1-CB 4.24Å; I503-H671 PolarHBondContact N-O 2.84Å; I503-I673 HydrophobicContact CD1-CD1 3.94Å; I503-I673 HydrophobicContact CD1-CG1 3.63Å; I503-I673 HydrophobicContact CG1-CD1 4.17Å; I503-I673 HydrophobicContact CG1-CG1 3.85Å
504	G	73.4	Confident	67.4	Low	0 Å²	0	26.8 Å²	26.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	123.9	-154.8	174.6	0	0	0	0	0	113.7	F670 H671	G504-F670 WeakPolarHBondContact O-CD2 3.32Å; G504-H671 PolarHBondContact N-O 3.39Å; G504-H671 PolarHBondContact O-N 3.15Å
505	V	73.5	Confident	66.6	Low	1 Å²	1	27.9 Å²	27.9	1%	0.006	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	132.2	-179	172.6	0	0	0	0	110.1	F517 L604 P605 W609 L668 Q669 F670	V505-F517 HydrophobicContact CG2-CD1 4.46Å; V505-L604 WeakPolarHBondContact O-CD2 3.27Å; V505-P605 WeakPolarHBondContact O-CD 3.33Å; V505-W609 HydrophobicContact CB-CZ2 4.37Å; V505-W609 HydrophobicContact CG2-CH2 3.93Å; V505-W609 HydrophobicContact CG2-CZ2 3.8Å; V505-L668 HydrophobicContact CG1-CD2 4.34Å; V505-Q669 CarbonylContact C-O 3.6Å; V505-Q669 WeakPolarHBondContact CA-O 3.44Å; V505-F670 HydrophobicContact CG2-CB 4.34Å; V505-F670 HydrophobicContact CG2-CD2 3.95Å
506	S	68.5	Low	65.8	Low	8 Å²	8	29.6 Å²	29.6	6%	0.056	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	158.8	171.5	78.6	0	0	0	0	111.5	L668 Q669 H671	S506-L668 WeakPolarHBondContact O-CA 3.48Å; S506-Q669 PolarHBondContact N-O 3.36Å; S506-Q669 PolarHBondContact O-N 3.44Å; S506-H671 WeakPolarHBondContact CB-NE2 3.29Å; S506-H671 PolarHBondContact OG-NE2 2.94Å
507	G	67.2	Low	65.3	Low	25 Å²	25	29.6 Å²	29.6	26%	0.258	18%	0.184	S	C	.	.	S	Bend	trans	128.5	-171.8	174	0	0	0	0	0	113.7	V509 D667	G507-V509 PolarHBondContact O-N 3.18Å; G507-D667 VanDerWaalsContact CA-O 3.28Å; G507-D667 WeakPolarHBondContact CA-O 3.28Å
508	S	59.5	Low	64.8	Low	51 Å²	51	34 Å²	34	36%	0.357	20%	0.2	S	C	.	.			trans	-71.5	119.2	-169.4	-163.7	0	0	0	0	113.3	S510 S511	S508-S510 VanDerWaalsContact C-N 3.26Å; S508-S510 PolarHBondContact O-N 2.74Å; S508-S510 PolarHBondContact OG-OG 3.44Å; S508-S511 PolarHBondContact O-OG 3.21Å
509	V	49.8	Very low	64.3	Low	37 Å²	37	34 Å²	34	22%	0.224	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-67.6	-24.4	-172.2	-167.5	0	0	0	0	113.1	G507 S511 L512 P605	G507-V509 PolarHBondContact O-N 3.18Å; V509-S511 PolarHBondContact O-N 3.45Å; V509-L512 PolarHBondContact O-N 3.43Å; V509-L512 VanDerWaalsContact O-N 3.14Å; V509-P605 HydrophobicContact CG1-CB 4.49Å; V509-P605 HydrophobicContact CG2-CB 3.87Å; V509-P605 HydrophobicContact CG2-CG 4.49Å
510	S	51.4	Low	63.8	Low	109 Å²	109	33.2 Å²	33.2	76%	0.762	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-57	-23.4	-174.8	53.7	0	0	0	0	114.1	S508	S508-S510 VanDerWaalsContact C-N 3.26Å; S508-S510 PolarHBondContact O-N 2.74Å; S508-S510 PolarHBondContact OG-OG 3.44Å
511	S	50.4	Low	63.2	Low	57 Å²	57	33.6 Å²	33.6	40%	0.399	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-95.5	-3.6	-176.6	62.3	0	0	0	0	115.5	S508 V509	S508-S511 PolarHBondContact O-OG 3.21Å; V509-S511 PolarHBondContact O-N 3.45Å
512	L	52.4	Low	62.6	Low	5 Å²	5	35.6 Å²	35.6	3%	0.026	21%	0.207	C	C	.	.			trans	-133.1	7.4	-164.2	-64.5	178.8	0	0	0	116.8	V509 K514 D515 F517 L569 F665 L668	V509-L512 PolarHBondContact O-N 3.43Å; V509-L512 VanDerWaalsContact O-N 3.14Å; L512-K514 PolarHBondContact O-N 3.33Å; L512-D515 PolarHBondContact O-N 2.96Å; L512-F517 HydrophobicContact CD1-CE2 4.32Å; L512-F517 HydrophobicContact CD1-CZ 3.99Å; L512-F517 HydrophobicContact CD2-CE2 4.26Å; L512-F517 HydrophobicContact CD2-CZ 3.78Å; L512-F517 HydrophobicContact CG-CZ 4.49Å; L512-L569 HydrophobicContact CB-CD1 3.8Å; L512-L569 HydrophobicContact CD1-CD1 3.31Å; L512-L569 HydrophobicContact CG-CD1 4.2Å; L512-F665 HydrophobicContact CD2-CE1 3.95Å; L512-F665 HydrophobicContact CD2-CE2 4.34Å; L512-F665 HydrophobicContact CD2-CZ 3.83Å; L512-L668 HydrophobicContact CD1-CD1 3.48Å; L512-L668 VanDerWaalsContact CD1-CD1 3.48Å; L512-L668 HydrophobicContact CD1-CD2 3.6Å; L512-L668 HydrophobicContact CD1-CG 4.18Å; L512-L668 HydrophobicContact CD2-CD1 3.79Å; L512-L668 HydrophobicContact CG-CD1 3.93Å
513	S	51.9	Low	61.5	Low	66 Å²	66	36.1 Å²	36.1	46%	0.462	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	115.9	-173	71.1	0	0	0	0	111.9
514	K	54.7	Low	60.3	Low	114 Å²	114	36.7 Å²	36.7	50%	0.496	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	9.3	176.7	-50.7	161.5	179.2	169.3	0	117.7	L512	L512-K514 PolarHBondContact O-N 3.33Å
515	D	63.7	Low	59.2	Low	27 Å²	27	40.4 Å²	40.4	14%	0.144	23%	0.234	C	C	.	.			trans	-75.8	151.3	174.5	-85.7	-22.6	0	0	0	113.3	L512 F517 V630	L512-D515 PolarHBondContact O-N 2.96Å; D515-F517 HydrophobicContact CB-CE2 4.41Å; D515-V630 HydrophobicContact CB-CG1 4.27Å
516	V	61.4	Low	57.7	Low	38 Å²	38	43 Å²	43	23%	0.23	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	120.6	176.9	-179.6	0	0	0	0	109.6	T566 G567 R568 M631	V516-T566 HydrophobicContact CG1-CG2 4.41Å; V516-G567 WeakPolarHBondContact CA-O 3.17Å; V516-R568 HydrophobicContact CG2-CG 4.36Å; V516-M631 HydrophobicContact CB-CB 4.47Å; V516-M631 HydrophobicContact CB-CE 4.4Å; V516-M631 HydrophobicContact CG1-CE 3.78Å; V516-M631 PolarHBondContact O-N 2.84Å
517	F	66.6	Low	56.2	Low	0 Å²	0	46 Å²	46	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	133.8	174.1	-71.6	-103.2	0	0	0	109	V505 L512 D515 T566 G567 L569 W609 V628 V630 L640 L662	V505-F517 HydrophobicContact CG2-CD1 4.46Å; L512-F517 HydrophobicContact CD1-CE2 4.32Å; L512-F517 HydrophobicContact CD1-CZ 3.99Å; L512-F517 HydrophobicContact CD2-CE2 4.26Å; L512-F517 HydrophobicContact CD2-CZ 3.78Å; L512-F517 HydrophobicContact CG-CZ 4.49Å; D515-F517 HydrophobicContact CB-CE2 4.41Å; F517-T566 CarbonylContact O-C 3.54Å; F517-T566 WeakPolarHBondContact O-CA 3.36Å; F517-G567 PolarHBondContact N-O 3.23Å; F517-G567 PolarHBondContact O-N 2.96Å; F517-L569 HydrophobicContact CD2-CD1 4.24Å; F517-L569 HydrophobicContact CD2-CG 4.3Å; F517-L569 HydrophobicContact CE2-CD1 3.54Å; F517-L569 HydrophobicContact CE2-CG 4.07Å; F517-L569 HydrophobicContact CZ-CD1 4.22Å; F517-W609 HydrophobicContact CB-CH2 3.93Å; F517-W609 HydrophobicContact CB-CZ3 4.24Å; F517-V628 HydrophobicContact CD1-CG1 4.12Å; F517-V630 HydrophobicContact CD1-CG2 3.54Å; F517-V630 HydrophobicContact CD2-CG2 4.34Å; F517-V630 HydrophobicContact CE1-CG2 3.33Å; F517-V630 HydrophobicContact CE2-CG2 4.14Å; F517-V630 HydrophobicContact CG-CG2 4.06Å; F517-V630 HydrophobicContact CZ-CG2 3.65Å; F517-L640 HydrophobicContact CE1-CD1 3.93Å; F517-L662 HydrophobicContact CE1-CD1 3.97Å
518	R	66	Low	54.7	Low	92 Å²	92	50.6 Å²	50.6	35%	0.347	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	109.7	168.8	-168	177.6	76.3	-179.8	1.3	109	T564 I565 T566 V629 M631	R518-T564 HydrophobicContact CG-CG2 3.54Å; R518-I565 CarbonylContact C-O 3.6Å; R518-I565 WeakPolarHBondContact CA-O 3.16Å; R518-T566 HydrophobicContact CB-CG2 4.14Å; R518-T566 HydrophobicContact CG-CG2 3.92Å; R518-V629 PolarHBondContact N-O 2.75Å; R518-V629 PolarHBondContact O-N 3.48Å; R518-M631 HydrophobicContact CB-CE 4.38Å; R518-M631 HydrophobicContact CB-SD 4.38Å
519	I	67	Low	53.3	Low	0 Å²	0	54.2 Å²	54.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.4	-177.7	-58.5	-172.4	0	0	0	107.7	T564 I565 W609 V628 F670	I519-T564 CarbonylContact O-C 3.48Å; I519-T564 WeakPolarHBondContact O-CA 3.19Å; I519-I565 PolarHBondContact N-O 3.12Å; I519-I565 PolarHBondContact O-N 3.29Å; I519-W609 HydrophobicContact CD1-CH2 3.58Å; I519-W609 HydrophobicContact CD1-CZ3 3.56Å; I519-W609 HydrophobicContact CG1-CH2 4.35Å; I519-W609 HydrophobicContact CG1-CZ3 4Å; I519-V628 HydrophobicContact CD1-CG1 4.31Å; I519-V628 HydrophobicContact CD1-CG2 4.12Å; I519-V628 HydrophobicContact CG1-CB 4.38Å; I519-V628 HydrophobicContact CG1-CG1 3.96Å; I519-V628 HydrophobicContact CG1-CG2 4Å; I519-V628 HydrophobicContact CG2-CG2 4.19Å; I519-F670 HydrophobicContact CD1-CD1 4.06Å; I519-F670 HydrophobicContact CD1-CD2 3.26Å; I519-F670 HydrophobicContact CD1-CE1 3.94Å; I519-F670 HydrophobicContact CD1-CE2 3.13Å; I519-F670 HydrophobicContact CD1-CG 3.73Å; I519-F670 HydrophobicContact CD1-CZ 3.49Å; I519-F670 VanDerWaalsContact CD1-CZ 3.49Å; I519-F670 HydrophobicContact CG2-CE1 4.02Å; I519-F670 HydrophobicContact CG2-CZ 4.07Å
520	S	62.4	Low	52.4	Low	6 Å²	6	56.3 Å²	56.3	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	118.8	174.1	43.5	0	0	0	0	110.2	K562 W563 K627	S520-K562 VanDerWaalsContact CB-CE 3.46Å; S520-W563 CarbonylContact C-O 3.55Å; S520-W563 WeakPolarHBondContact CA-O 3.29Å; S520-K627 PolarHBondContact N-O 3.25Å; S520-K627 PolarHBondContact O-N 3.19Å; S520-K627 PolarHBondContact OG-O 3.08Å
521	L	62.8	Low	51.5	Low	7 Å²	7	53.1 Å²	53.1	4%	0.037	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.5	170.5	-74.4	156.3	0	0	0	106.6	K562 W563 I565 L624 T625 I626	L521-K562 CarbonylContact O-C 3.44Å; L521-K562 WeakPolarHBondContact O-CA 3.44Å; L521-W563 HydrophobicContact CB-CE3 4.07Å; L521-W563 HydrophobicContact CD1-CD2 4.44Å; L521-W563 HydrophobicContact CD1-CE3 3.31Å; L521-W563 HydrophobicContact CD1-CZ3 3.36Å; L521-W563 HydrophobicContact CG-CE3 4.28Å; L521-W563 PolarHBondContact N-O 3.06Å; L521-W563 PolarHBondContact O-N 3.24Å; L521-I565 HydrophobicContact CD1-CD1 4.42Å; L521-L624 HydrophobicContact CD2-CD1 4Å; L521-L624 HydrophobicContact CD2-CD2 4.48Å; L521-L624 HydrophobicContact CD2-CG 4.25Å; L521-T625 WeakPolarHBondContact CA-O 3.39Å; L521-I626 HydrophobicContact CD2-CB 4.08Å; L521-I626 HydrophobicContact CD2-CG1 3.69Å; L521-I626 HydrophobicContact CD2-CG2 3.97Å
522	K	62.2	Low	50.6	Low	55 Å²	55	52.8 Å²	52.8	24%	0.239	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.6	174.7	-84.5	-162	169.2	-149	0	109.2	G557 G558 K562 T625	K522-G557 PolarHBondContact NZ-O 2.91Å; K522-G558 PolarHBondContact NZ-O 2.92Å; K522-K562 HydrophobicContact CG-CB 4.06Å; K522-K562 HydrophobicContact CG-CG 3.78Å; K522-T625 PolarHBondContact N-O 3.23Å; K522-T625 PolarHBondContact O-N 3.47Å
523	Y	53.1	Low	49.6	Very low	22 Å²	22	54 Å²	54	9%	0.086	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	112.7	177.6	-177.5	-83.5	0	0	0	107.6	D561 F616 S617 P618 T619 D622 I647	Y523-D561 PolarHBondContact N-O 3.17Å; Y523-F616 AromaticContact CD2-CD2 3.4Å; Y523-F616 HydrophobicContact CD2-CD2 3.4Å; Y523-F616 AromaticContact CD2-CE2 3.47Å; Y523-F616 HydrophobicContact CD2-CE2 3.47Å; Y523-F616 VanDerWaalsContact CD2-CE2 3.47Å; Y523-F616 HydrophobicContact CD2-CG 4.06Å; Y523-F616 HydrophobicContact CD2-CZ 4.19Å; Y523-F616 AromaticContact CE2-CD2 3.17Å; Y523-F616 HydrophobicContact CE2-CD2 3.17Å; Y523-F616 AromaticContact CE2-CE2 3.27Å; Y523-F616 HydrophobicContact CE2-CE2 3.27Å; Y523-F616 HydrophobicContact CE2-CG 4.21Å; Y523-F616 HydrophobicContact CE2-CZ 4.35Å; Y523-F616 HydrophobicContact CG-CD2 4.3Å; Y523-F616 AromaticContact CZ-CD2 3.97Å; Y523-S617 VanDerWaalsContact CZ-O 3.28Å; Y523-S617 PolarHBondContact OH-O 2.93Å; Y523-P618 VanDerWaalsContact OH-CA 3.28Å; Y523-P618 WeakPolarHBondContact OH-CA 3.46Å; Y523-T619 HydrophobicContact CE1-CG2 4.3Å; Y523-T619 PolarHBondContact OH-N 3.22Å; Y523-D622 HydrophobicContact CD1-CB 4.34Å; Y523-D622 HydrophobicContact CD2-CB 4.41Å; Y523-D622 HydrophobicContact CE1-CB 3.66Å; Y523-D622 WeakPolarHBondContact CE1-OD1 3.35Å; Y523-D622 WeakPolarHBondContact CE1-OD2 3.34Å; Y523-D622 HydrophobicContact CE2-CB 3.77Å; Y523-D622 WeakPolarHBondContact OH-CB 3.31Å; Y523-D622 PolarHBondContact OH-OD2 3.12Å; Y523-I647 HydrophobicContact CD2-CD1 3.54Å; Y523-I647 HydrophobicContact CE2-CD1 3.17Å
524	N	49.3	Very low	48.3	Very low	50 Å²	50	54.1 Å²	54.1	27%	0.267	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	166.7	-177.8	-96.2	-71.6	0	0	0	111.6	N560 D622 V623	N524-N560 PolarHBondContact ND2-O 3.48Å; N524-N560 VanDerWaalsContact ND2-O 3.14Å; N524-D622 VanDerWaalsContact C-OD1 3.31Å; N524-V623 PolarHBondContact O-N 2.88Å; N524-V623 VanDerWaalsContact O-N 3.12Å
525	T	50.1	Low	47.2	Very low	79 Å²	79	52.3 Å²	52.3	49%	0.485	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-56.5	137.8	165.5	50.2	0	0	0	0	111.4	A527	T525-A527 PolarHBondContact O-N 3.25Å
526	P	41.5	Very low	45.6	Very low	54 Å²	54	55.4 Å²	55.4	35%	0.351	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-62.6	128.7	-179.1	22.5	-31	0	0	0	111.6	L528 I531 G621 V623	P526-L528 PolarHBondContact O-N 3.14Å; P526-I531 HydrophobicContact CB-CD1 4.24Å; P526-I531 HydrophobicContact CG-CD1 4.47Å; P526-G621 WeakPolarHBondContact CD-O 3.47Å; P526-V623 HydrophobicContact CB-CG2 3.96Å; P526-V623 HydrophobicContact CG-CG2 3.98Å
527	A	37	Very low	44.4	Very low	71 Å²	71	60.6 Å²	60.6	59%	0.587	34%	0.344	S	S	*	.	S	Bend	trans	-77.7	116.1	161.5	0	0	0	0	0	108.1	T525	T525-A527 PolarHBondContact O-N 3.25Å
528	L	36.2	Very low	42.7	Very low	123 Å²	123	68.9 Å²	68.9	64%	0.644	38%	0.38	S	S	*	.	S	Bend	trans	92.7	140.1	-177.7	-56	161.4	0	0	0	116.2	P526 S530	P526-L528 PolarHBondContact O-N 3.14Å; L528-S530 PolarHBondContact O-N 2.96Å; L528-S530 VanDerWaalsContact O-N 3.16Å
529	S	29.6	Very low	41.3	Very low	127 Å²	127	74 Å²	74	89%	0.888	41%	0.408	S	S	*	.	S	Bend	trans	-85.5	70.3	-169.6	52.1	0	0	0	0	113.1
530	S	30	Very low	39.5	Very low	81 Å²	81	80.6 Å²	80.6	57%	0.566	44%	0.443	S	S	*	.			trans	-163.4	94.3	174.8	46	0	0	0	0	113.6	L528	L528-S530 PolarHBondContact O-N 2.96Å; L528-S530 VanDerWaalsContact O-N 3.16Å
531	I	34	Very low	37.8	Very low	41 Å²	41	83.2 Å²	83.2	21%	0.21	46%	0.46	C	S	.	.	S	Bend	trans	-133.2	-31.7	163.8	-62.9	-174.3	0	0	0	113.4	P526 P545 L546 V623 D646	P526-I531 HydrophobicContact CB-CD1 4.24Å; P526-I531 HydrophobicContact CG-CD1 4.47Å; I531-P545 HydrophobicContact CG2-CB 4.45Å; I531-P545 CarbonylContact O-C 3.58Å; I531-P545 WeakPolarHBondContact O-CA 3.32Å; I531-L546 PolarHBondContact O-N 3.41Å; I531-V623 HydrophobicContact CD1-CG1 4.3Å; I531-V623 HydrophobicContact CD1-CG2 3.44Å; I531-V623 VanDerWaalsContact CD1-CG2 3.44Å; I531-D646 HydrophobicContact CG2-CB 4.06Å
532	Y	31.6	Very low	36.2	Very low	50 Å²	50	87.5 Å²	87.5	20%	0.196	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145	-169.6	-70.6	-67.7	0	0	0	114.8	V543 P545 D646 L648	Y532-V543 HydrophobicContact CD1-CG1 3.68Å; Y532-V543 HydrophobicContact CG-CG1 3.94Å; Y532-P545 HydrophobicContact CD1-CB 4.13Å; Y532-P545 HydrophobicContact CE1-CB 3.91Å; Y532-D646 VanDerWaalsContact CE2-OD2 3.3Å; Y532-D646 WeakPolarHBondContact CE2-OD2 3.46Å; Y532-D646 WeakPolarHBondContact OH-CB 3.42Å; Y532-D646 PolarHBondContact OH-OD1 3.02Å; Y532-D646 PolarHBondContact OH-OD2 3.42Å; Y532-L648 HydrophobicContact CE2-CD1 4.18Å
533	E	29.8	Very low	34.8	Very low	30 Å²	30	86.1 Å²	86.1	14%	0.14	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	140.5	166.6	-159.2	-163.6	159.6	0	0	110.6	V543 K544 L546 Q1374	E533-V543 WeakPolarHBondContact O-CA 3.46Å; E533-V543 WeakPolarHBondContact O-CG1 3.33Å; E533-K544 PolarHBondContact N-O 3.05Å; E533-K544 PolarHBondContact O-N 3.05Å; E533-K544 VanDerWaalsContact O-N 3.09Å; E533-L546 HydrophobicContact CB-CD1 4.36Å; E533-L546 HydrophobicContact CB-CD2 4.18Å; E533-L546 HydrophobicContact CB-CG 4.08Å; E533-Q1374 WeakPolarHBondContact OE1-CB 3.3Å; E533-Q1374 VanDerWaalsContact OE1-CD 3.31Å; E533-Q1374 VanDerWaalsContact OE1-CG 3.27Å; E533-Q1374 WeakPolarHBondContact OE1-CG 3.33Å; E533-Q1374 PolarHBondContact OE1-NE2 3.37Å; E533-Q1374 WeakPolarHBondContact OE2-CB 3.32Å; E533-Q1374 VanDerWaalsContact OE2-CD 3.27Å; E533-Q1374 PolarHBondContact OE2-NE2 3.39Å
534	L	26	Very low	33.7	Very low	69 Å²	69	90.4 Å²	90.4	36%	0.361	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	128.1	176.4	-105.5	103.9	0	0	0	110.3	P541 V543 L1382	L534-P541 HydrophobicContact CD2-CB 3.65Å; L534-P541 HydrophobicContact CD2-CG 4.19Å; L534-V543 HydrophobicContact CG-CG2 4.26Å; L534-L1382 HydrophobicContact CD1-CD2 4.33Å
535	Q	30.5	Very low	32.9	Very low	76 Å²	76	89.8 Å²	89.8	36%	0.355	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	111.7	171.8	-139.7	166.5	30.5	0	0	109.7	D537 D542	Q535-D537 PolarHBondContact O-N 3.01Å; Q535-D542 PolarHBondContact N-O 3.39Å; Q535-D542 PolarHBondContact O-N 3.47Å
536	S	30.4	Very low	32.1	Very low	92 Å²	92	88.8 Å²	88.8	64%	0.643	49%	0.488	S	S	*	.			trans	-99.4	35.1	-164.2	63.8	0	0	0	0	115
537	D	35.4	Very low	31.5	Very low	147 Å²	147	93.9 Å²	93.9	79%	0.786	50%	0.501	S	S	*	.	S	Bend	trans	-93.8	8.9	-176.5	-75.8	-17.5	0	0	0	113.9	Q535	Q535-D537 PolarHBondContact O-N 3.01Å
538	K	30.8	Very low	31.1	Very low	174 Å²	174	96.9 Å²	96.9	76%	0.757	51%	0.513	S	S	*	.	S	Bend	trans	-143.4	156.2	178.2	-64.6	-172.1	180	-177.8	0	111.4	L540	K538-L540 CarbonylContact O-C 3.52Å; K538-L540 VanDerWaalsContact O-C 3.29Å; K538-L540 PolarHBondContact O-N 3.5Å
539	E	38	Very low	30.7	Very low	200 Å²	200	94.2 Å²	94.2	94%	0.935	50%	0.504	S	S	*	.	S	Bend	trans	-58.1	-20.8	-178.3	-65.2	-175.3	139.4	0	0	114.4
540	L	29.2	Very low	30.7	Very low	138 Å²	138	89.4 Å²	89.4	72%	0.723	47%	0.47	S	S	*	.	S	Bend	trans	-108.4	123.4	157.7	-82.5	82.1	0	0	0	109.1	K538 D542	K538-L540 CarbonylContact O-C 3.52Å; K538-L540 VanDerWaalsContact O-C 3.29Å; K538-L540 PolarHBondContact O-N 3.5Å; L540-D542 PolarHBondContact O-N 3.01Å
541	P	26	Very low	30.6	Very low	62 Å²	62	89.4 Å²	89.4	40%	0.403	47%	0.466	S	S	.	.			trans	-66.7	125.7	175.1	25.7	-32.4	0	0	0	110.5	L534	L534-P541 HydrophobicContact CD2-CB 3.65Å; L534-P541 HydrophobicContact CD2-CG 4.19Å
542	D	30.1	Very low	30.3	Very low	97 Å²	97	91.2 Å²	91.2	52%	0.519	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	140.4	175.9	-168.9	13	0	0	0	109.7	Q535 L540	Q535-D542 PolarHBondContact N-O 3.39Å; Q535-D542 PolarHBondContact O-N 3.47Å; L540-D542 PolarHBondContact O-N 3.01Å
543	V	31.8	Very low	30.4	Very low	26 Å²	26	91.2 Å²	91.2	16%	0.158	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	108.5	-169	-166.4	0	0	0	0	109.8	I202 Y532 E533 L534	I202-V543 HydrophobicContact CD1-CG1 4.3Å; I202-V543 HydrophobicContact CD1-CG2 4.34Å; Y532-V543 HydrophobicContact CD1-CG1 3.68Å; Y532-V543 HydrophobicContact CG-CG1 3.94Å; E533-V543 WeakPolarHBondContact O-CA 3.46Å; E533-V543 WeakPolarHBondContact O-CG1 3.33Å; L534-V543 HydrophobicContact CG-CG2 4.26Å
544	K	30.5	Very low	30.3	Very low	112 Å²	112	97.2 Å²	97.2	49%	0.487	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	135.6	178.8	-76.3	175.7	-176.2	159.7	0	110.5	E533	E533-K544 PolarHBondContact N-O 3.05Å; E533-K544 PolarHBondContact O-N 3.05Å; E533-K544 VanDerWaalsContact O-N 3.09Å
545	P	32	Very low	30.4	Very low	37 Å²	37	100.8 Å²	100.8	24%	0.24	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	132.9	173.8	30.8	-31.4	0	0	0	108.1	I531 Y532 Y547 K649	I531-P545 HydrophobicContact CG2-CB 4.45Å; I531-P545 CarbonylContact O-C 3.58Å; I531-P545 WeakPolarHBondContact O-CA 3.32Å; Y532-P545 HydrophobicContact CD1-CB 4.13Å; Y532-P545 HydrophobicContact CE1-CB 3.91Å; P545-Y547 PolarHBondContact O-N 3.28Å; P545-K649 VanDerWaalsContact CD-NZ 3.33Å; P545-K649 HydrophobicContact CG-CD 4.16Å
546	L	33.9	Very low	30.3	Very low	57 Å²	57	107.6 Å²	107.6	30%	0.298	56%	0.56	S	S	.	*	S	Bend	trans	-63	-26.8	-170.8	-87	158.4	0	0	0	113.3	I531 E533	I531-L546 PolarHBondContact O-N 3.41Å; E533-L546 HydrophobicContact CB-CD1 4.36Å; E533-L546 HydrophobicContact CB-CD2 4.18Å; E533-L546 HydrophobicContact CB-CG 4.08Å
547	Y	28.2	Very low	30.2	Very low	161 Å²	161	105.7 Å²	105.7	63%	0.631	55%	0.554	S	S	*	*			trans	-141.3	122.2	178.5	-63.7	-79.6	0	0	0	112.3	P545	P545-Y547 PolarHBondContact O-N 3.28Å
548	T	28.8	Very low	29.9	Very low	134 Å²	134	101.5 Å²	101.5	82%	0.822	55%	0.546	S	S	*	.	S	Bend	trans	-77.4	-1.9	152.9	48	0	0	0	0	111.9	T550	T548-T550 PolarHBondContact O-N 2.83Å
549	S	27.8	Very low	29.9	Very low	68 Å²	68	98.6 Å²	98.6	48%	0.476	55%	0.548	S	S	.	.	S	Bend	trans	-91.3	87.9	177.3	-172	0	0	0	0	111.7	V551	S549-V551 WeakPolarHBondContact O-CG2 3.27Å; S549-V551 PolarHBondContact O-N 3.23Å
550	T	29.7	Very low	30.1	Very low	26 Å²	26	94.4 Å²	94.4	16%	0.16	53%	0.532	C	S	.	.				28.3	64.6	122.8	66.9	0	0	0	0	117.8	M166 T548 P552 Q643	M166-T550 HydrophobicContact CB-CG2 4.06Å; T548-T550 PolarHBondContact O-N 2.83Å; T550-P552 WeakPolarHBondContact O-CD 3.35Å; T550-Q643 VanDerWaalsContact CB-NE2 3.27Å; T550-Q643 HydrophobicContact CG2-CG 4.11Å
551	V	28.7	Very low	31.1	Very low	80 Å²	80	92.6 Å²	92.6	49%	0.485	52%	0.523	S	S	.	.			trans	-76.2	120.9	176.4	-178.3	0	0	0	0	111.1	S549 L553	S549-V551 WeakPolarHBondContact O-CG2 3.27Å; S549-V551 PolarHBondContact O-N 3.23Å; V551-L553 HydrophobicContact CG1-CD2 4.49Å; V551-L553 PolarHBondContact O-N 3.08Å; V551-L553 VanDerWaalsContact O-N 3.09Å
552	P	28.2	Very low	32.7	Very low	79 Å²	79	94 Å²	94	51%	0.513	52%	0.523	S	S	.	.			trans	-74.6	97.5	173.8	29.7	-33.1	0	0	0	111.6	T550 N554 Q642	T550-P552 WeakPolarHBondContact O-CD 3.35Å; P552-N554 PolarHBondContact O-N 2.95Å; P552-Q642 WeakPolarHBondContact CA-O 3.48Å
553	L	31.7	Very low	34.2	Very low	51 Å²	51	90.2 Å²	90.2	27%	0.267	50%	0.501	S	S	.	.			trans	-74.4	89	-177.1	-72.6	167.4	0	0	0	113.4	V551 Q555 T625 Q642 A644	V551-L553 HydrophobicContact CG1-CD2 4.49Å; V551-L553 PolarHBondContact O-N 3.08Å; V551-L553 VanDerWaalsContact O-N 3.09Å; L553-Q555 PolarHBondContact O-N 3.27Å; L553-T625 HydrophobicContact CD1-CG2 4.29Å; L553-Q642 HydrophobicContact CB-CG 4.44Å; L553-Q642 VanDerWaalsContact O-CD 3.3Å; L553-Q642 PolarHBondContact O-NE2 3.26Å; L553-A644 HydrophobicContact CD1-CB 3.93Å
554	N	29.2	Very low	35.7	Very low	155 Å²	155	91.1 Å²	91.1	83%	0.829	51%	0.507	S	S	*	.			trans	-79.5	48.8	176.1	-79.2	-17	0	0	0	114.2	P552	P552-N554 PolarHBondContact O-N 2.95Å
555	Q	28.4	Very low	37.5	Very low	145 Å²	145	85.9 Å²	85.9	68%	0.678	48%	0.484	S	S	*	.	S	Bend	trans	-134.3	146.5	175.5	-67.5	-167.1	5.3	0	0	113.9	L553 G557	L553-Q555 PolarHBondContact O-N 3.27Å; Q555-G557 PolarHBondContact O-N 3.49Å
556	K	27.3	Very low	39.3	Very low	219 Å²	219	86.1 Å²	86.1	95%	0.952	49%	0.485	S	S	*	.			trans	-78.5	77.8	179.5	-72.2	-174.4	175.9	-176.1	0	111.1
557	G	29.2	Very low	41	Very low	51 Å²	51	83.5 Å²	83.5	53%	0.526	47%	0.471	S	S	.	.			trans	-67.8	136.5	169	0	0	0	0	0	111.8	K522 Q555	K522-G557 PolarHBondContact NZ-O 2.91Å; Q555-G557 PolarHBondContact O-N 3.49Å
558	G	27.8	Very low	42.9	Very low	59 Å²	59	81.1 Å²	81.1	61%	0.608	46%	0.461	S	S	*	.			trans	-65.8	-171	-171.5	0	0	0	0	0	116.6	K522	K522-G558 PolarHBondContact NZ-O 2.92Å
559	S	32	Very low	44.6	Very low	114 Å²	114	75 Å²	75	80%	0.797	42%	0.424	S	S	*	.	S	Bend	trans	-78.9	113	176.8	48.9	0	0	0	0	111.1
560	N	42.4	Very low	46	Very low	112 Å²	112	75.2 Å²	75.2	60%	0.599	42%	0.416	S	S	*	.	S	Bend	trans	-162.8	149.8	145.8	-92	-12.9	0	0	0	106.7	N524 K562	N524-N560 PolarHBondContact ND2-O 3.48Å; N524-N560 VanDerWaalsContact ND2-O 3.14Å; N560-K562 PolarHBondContact O-N 2.81Å
561	D	50	Low	47	Very low	99 Å²	99	77.1 Å²	77.1	53%	0.529	43%	0.43	S	S	.	.			trans	6.1	97.4	-175	-61.7	-11.9	0	0	0	117.2	Y523	Y523-D561 PolarHBondContact N-O 3.17Å
562	K	58.2	Low	47.7	Very low	93 Å²	93	74.8 Å²	74.8	40%	0.404	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	86	178.9	-178.8	-158.7	173.7	-118.8	0	109.3	S520 L521 K522 N560 T564	S520-K562 VanDerWaalsContact CB-CE 3.46Å; L521-K562 CarbonylContact O-C 3.44Å; L521-K562 WeakPolarHBondContact O-CA 3.44Å; K522-K562 HydrophobicContact CG-CB 4.06Å; K522-K562 HydrophobicContact CG-CG 3.78Å; N560-K562 PolarHBondContact O-N 2.81Å; K562-T564 WeakPolarHBondContact CE-OG1 3.23Å; K562-T564 PolarHBondContact NZ-OG1 3.49Å; K562-T564 PolarHBondContact O-N 3.27Å; K562-T564 PolarHBondContact O-OG1 3.06Å
563	W	61.5	Low	48	Very low	16 Å²	16	75.7 Å²	75.7	6%	0.061	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	125.5	167.1	-179.7	43.2	0	0	0	109.2	C500 V502 S520 L521 I565 Q611 K613 H614	C500-W563 HydrophobicContact CB-CH2 4.38Å; C500-W563 HydrophobicContact CB-CZ3 3.78Å; C500-W563 WeakPolarHBondContact O-CH2 3.2Å; V502-W563 HydrophobicContact CG2-CH2 3.97Å; V502-W563 HydrophobicContact CG2-CZ3 4.45Å; S520-W563 CarbonylContact C-O 3.55Å; S520-W563 WeakPolarHBondContact CA-O 3.29Å; L521-W563 HydrophobicContact CB-CE3 4.07Å; L521-W563 HydrophobicContact CD1-CD2 4.44Å; L521-W563 HydrophobicContact CD1-CE3 3.31Å; L521-W563 HydrophobicContact CD1-CZ3 3.36Å; L521-W563 HydrophobicContact CG-CE3 4.28Å; L521-W563 PolarHBondContact N-O 3.06Å; L521-W563 PolarHBondContact O-N 3.24Å; W563-I565 HydrophobicContact CD2-CD1 3.82Å; W563-I565 HydrophobicContact CD2-CG1 3.73Å; W563-I565 VanDerWaalsContact CE2-CD1 3.47Å; W563-I565 HydrophobicContact CE3-CD1 3.88Å; W563-I565 HydrophobicContact CE3-CG1 4.29Å; W563-I565 HydrophobicContact CG-CG1 4.27Å; W563-I565 HydrophobicContact CH2-CD1 3.4Å; W563-I565 HydrophobicContact CH2-CG1 4.22Å; W563-I565 HydrophobicContact CZ2-CD1 3.29Å; W563-I565 HydrophobicContact CZ2-CG1 3.64Å; W563-I565 HydrophobicContact CZ3-CD1 3.67Å; W563-I565 HydrophobicContact CZ3-CG1 4.49Å; W563-Q611 WeakPolarHBondContact CZ2-O 3.11Å; W563-K613 VanDerWaalsContact CZ2-C 3.47Å; W563-H614 HydrophobicContact CB-CB 4.4Å; W563-H614 HydrophobicContact CD2-CB 3.21Å; W563-H614 AromaticContact CD2-CD2 3.87Å; W563-H614 AromaticContact CD2-CG 3.64Å; W563-H614 HydrophobicContact CE3-CB 3.42Å; W563-H614 VanDerWaalsContact CE3-CB 3.42Å; W563-H614 AromaticContact CE3-CD2 3.79Å; W563-H614 AromaticContact CE3-CG 3.89Å; W563-H614 HydrophobicContact CG-CB 3.69Å; W563-H614 AromaticContact CG-CD2 3.82Å; W563-H614 AromaticContact CG-CG 3.63Å; W563-H614 HydrophobicContact CH2-CB 3.69Å; W563-H614 HydrophobicContact CZ2-CB 3.49Å; W563-H614 VanDerWaalsContact CZ2-CB 3.49Å; W563-H614 HydrophobicContact CZ3-CB 3.67Å
564	T	64.6	Low	48	Very low	46 Å²	46	81.2 Å²	81.2	28%	0.282	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	113.2	-179.6	-52	0	0	0	0	108.9	R518 I519 K562	R518-T564 HydrophobicContact CG-CG2 3.54Å; I519-T564 CarbonylContact O-C 3.48Å; I519-T564 WeakPolarHBondContact O-CA 3.19Å; K562-T564 WeakPolarHBondContact CE-OG1 3.23Å; K562-T564 PolarHBondContact NZ-OG1 3.49Å; K562-T564 PolarHBondContact O-N 3.27Å; K562-T564 PolarHBondContact O-OG1 3.06Å
565	I	68.9	Low	47.9	Very low	1 Å²	1	78.3 Å²	78.3	1%	0.005	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	137.7	-177.4	-48.7	171.6	0	0	0	107.7	V502 R518 I519 L521 W563 W609 D610	V502-I565 HydrophobicContact CB-CD1 4.47Å; V502-I565 HydrophobicContact CG2-CD1 3.37Å; R518-I565 CarbonylContact C-O 3.6Å; R518-I565 WeakPolarHBondContact CA-O 3.16Å; I519-I565 PolarHBondContact N-O 3.12Å; I519-I565 PolarHBondContact O-N 3.29Å; L521-I565 HydrophobicContact CD1-CD1 4.42Å; W563-I565 HydrophobicContact CD2-CD1 3.82Å; W563-I565 HydrophobicContact CD2-CG1 3.73Å; W563-I565 VanDerWaalsContact CE2-CD1 3.47Å; W563-I565 HydrophobicContact CE3-CD1 3.88Å; W563-I565 HydrophobicContact CE3-CG1 4.29Å; W563-I565 HydrophobicContact CG-CG1 4.27Å; W563-I565 HydrophobicContact CH2-CD1 3.4Å; W563-I565 HydrophobicContact CH2-CG1 4.22Å; W563-I565 HydrophobicContact CZ2-CD1 3.29Å; W563-I565 HydrophobicContact CZ2-CG1 3.64Å; W563-I565 HydrophobicContact CZ3-CD1 3.67Å; W563-I565 HydrophobicContact CZ3-CG1 4.49Å; I565-W609 HydrophobicContact CG2-CB 4.44Å; I565-W609 HydrophobicContact CG2-CE3 3.67Å; I565-W609 HydrophobicContact CG2-CZ3 4.41Å; I565-D610 VanDerWaalsContact CG2-O 3.28Å; I565-D610 WeakPolarHBondContact CG2-O 3.29Å
566	T	69.3	Low	48	Very low	43 Å²	43	76.6 Å²	76.6	26%	0.264	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	139.5	165.2	29.6	0	0	0	0	110.5	V516 F517 R518 W609 D610 M631	V516-T566 HydrophobicContact CG1-CG2 4.41Å; F517-T566 CarbonylContact O-C 3.54Å; F517-T566 WeakPolarHBondContact O-CA 3.36Å; R518-T566 HydrophobicContact CB-CG2 4.14Å; R518-T566 HydrophobicContact CG-CG2 3.92Å; T566-W609 WeakPolarHBondContact O-CA 3.42Å; T566-D610 VanDerWaalsContact CB-OD2 3.3Å; T566-D610 WeakPolarHBondContact CB-OD2 3.24Å; T566-D610 PolarHBondContact O-N 3.11Å; T566-D610 PolarHBondContact OG1-OD2 2.85Å; T566-M631 HydrophobicContact CG2-CE 4.39Å
567	G	68.5	Low	48	Very low	1 Å²	1	71.1 Å²	71.1	1%	0.01	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	136.1	180	0	0	0	0	0	110.9	V516 F517 R608	V516-G567 WeakPolarHBondContact CA-O 3.17Å; F517-G567 PolarHBondContact N-O 3.23Å; F517-G567 PolarHBondContact O-N 2.96Å; G567-R608 CarbonylContact C-O 3.29Å; G567-R608 VanDerWaalsContact CA-O 3.28Å; G567-R608 WeakPolarHBondContact CA-O 3.44Å
568	R	68	Low	47.9	Very low	111 Å²	111	73.5 Å²	73.5	42%	0.419	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	126.4	177.7	-165.1	-178.4	-156.9	179.1	10.4	110.1	V516 F570 Q607 R608	V516-R568 HydrophobicContact CG2-CG 4.36Å; R568-F570 HydrophobicContact CB-CE2 4.4Å; R568-Q607 WeakPolarHBondContact O-CA 3.33Å; R568-R608 PolarHBondContact N-O 3.48Å; R568-R608 PolarHBondContact O-N 2.88Å; R568-R608 VanDerWaalsContact O-N 3.1Å
569	L	65.2	Low	47.9	Very low	6 Å²	6	76.4 Å²	76.4	3%	0.031	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	128.4	171.8	-62.4	-178.5	0	0	0	109.9	L512 F517 P605 Q607	L512-L569 HydrophobicContact CB-CD1 3.8Å; L512-L569 HydrophobicContact CD1-CD1 3.31Å; L512-L569 HydrophobicContact CG-CD1 4.2Å; F517-L569 HydrophobicContact CD2-CD1 4.24Å; F517-L569 HydrophobicContact CD2-CG 4.3Å; F517-L569 HydrophobicContact CE2-CD1 3.54Å; F517-L569 HydrophobicContact CE2-CG 4.07Å; F517-L569 HydrophobicContact CZ-CD1 4.22Å; L569-P605 HydrophobicContact CD2-CG 3.98Å; L569-Q607 HydrophobicContact CD2-CB 3.69Å
570	F	57.7	Low	47.6	Very low	72 Å²	72	75.3 Å²	75.3	32%	0.316	46%	0.457	S	S	.	.			trans	-94.3	137.9	173.8	-65.4	-90	0	0	0	109.4	R568 S572 E606 R608	R568-F570 HydrophobicContact CB-CE2 4.4Å; F570-S572 VanDerWaalsContact C-N 3.3Å; F570-S572 PolarHBondContact O-N 3.03Å; F570-S572 VanDerWaalsContact O-N 3.08Å; F570-E606 HydrophobicContact CB-CB 4.01Å; F570-E606 PolarHBondContact N-O 3.34Å; F570-R608 HydrophobicContact CE2-CB 3.92Å; F570-R608 HydrophobicContact CE2-CG 3.7Å; F570-R608 HydrophobicContact CZ-CG 4.38Å
571	S	50.2	Low	47.2	Very low	66 Å²	66	75.8 Å²	75.8	46%	0.462	47%	0.466	S	S	.	.			trans	-82.9	79.2	175.6	-178.3	0	0	0	0	108.7	S573	S571-S573 PolarHBondContact O-N 3.5Å; S571-S573 VanDerWaalsContact O-N 3.1Å
572	S	43.1	Very low	46.1	Very low	32 Å²	32	79 Å²	79	22%	0.224	48%	0.482	C	S	.	.			trans	-68.1	104.4	166.5	57.6	0	0	0	0	108.3	F570 F574	F570-S572 VanDerWaalsContact C-N 3.3Å; F570-S572 PolarHBondContact O-N 3.03Å; F570-S572 VanDerWaalsContact O-N 3.08Å; S572-F574 PolarHBondContact O-N 2.83Å; S572-F574 VanDerWaalsContact O-N 3.09Å
573	S	35.5	Very low	44.6	Very low	98 Å²	98	80 Å²	80	69%	0.685	50%	0.5	S	S	*	.			trans	-55.9	115	165.1	-52.2	0	0	0	0	107.5	S571 S575	S571-S573 PolarHBondContact O-N 3.5Å; S571-S573 VanDerWaalsContact O-N 3.1Å; S573-S575 PolarHBondContact O-N 3.43Å
574	F	30.8	Very low	43	Very low	167 Å²	167	85.9 Å²	85.9	73%	0.732	53%	0.533	S	S	*	.			trans	-72	73.7	170.5	-77.5	-81.8	0	0	0	108.9	S572 A576	S572-F574 PolarHBondContact O-N 2.83Å; S572-F574 VanDerWaalsContact O-N 3.09Å; F574-A576 PolarHBondContact O-N 2.99Å; F574-A576 VanDerWaalsContact O-N 3.09Å
575	S	27.7	Very low	41.2	Very low	94 Å²	94	89.1 Å²	89.1	66%	0.657	56%	0.558	S	S	*	*			trans	-58.2	112	164	-62.2	0	0	0	0	106.9	S573 S577	S573-S575 PolarHBondContact O-N 3.43Å; S575-S577 PolarHBondContact O-N 3.39Å
576	A	29.6	Very low	39.2	Very low	109 Å²	109	94.3 Å²	94.3	90%	0.901	59%	0.594	S	S	*	*			trans	-72.5	67.1	178.2	0	0	0	0	0	110.5	F574 S578	F574-A576 PolarHBondContact O-N 2.99Å; F574-A576 VanDerWaalsContact O-N 3.09Å; A576-S578 PolarHBondContact O-N 3.05Å
577	S	27.4	Very low	37.3	Very low	103 Å²	103	102.1 Å²	102.1	72%	0.72	62%	0.624	S	S	*	*			trans	-84.1	103.4	174.5	59.3	0	0	0	0	109.8	S575 S579	S575-S577 PolarHBondContact O-N 3.39Å; S577-S579 PolarHBondContact O-N 3.24Å
578	S	26.7	Very low	35.6	Very low	101 Å²	101	106.5 Å²	106.5	71%	0.706	66%	0.655	S	S	*	*			trans	-43.9	132.1	162.1	49.2	0	0	0	0	112.4	A576	A576-S578 PolarHBondContact O-N 3.05Å
579	S	28	Very low	33.8	Very low	120 Å²	120	106.6 Å²	106.6	84%	0.839	66%	0.663	S	S	*	*			trans	34.3	86.7	149.7	59.4	0	0	0	0	117.6	S577	S577-S579 PolarHBondContact O-N 3.24Å
580	A	26.2	Very low	32.2	Very low	91 Å²	91	109.4 Å²	109.4	75%	0.752	69%	0.687	S	S	*	*			trans	-130.5	133.2	156.9	0	0	0	0	0	108.8
581	P	35	Very low	31	Very low	122 Å²	122	112.8 Å²	112.8	79%	0.792	70%	0.704	S	S	*	*			trans	-80.6	135.1	-166.1	30.3	-34.6	0	0	0	113.5	S583	P581-S583 PolarHBondContact O-N 3.31Å
582	I	27.1	Very low	30.1	Very low	167 Å²	167	113.7 Å²	113.7	86%	0.856	70%	0.703	S	S	*	*			trans	-7	101.3	157.4	-50.7	172.1	0	0	0	114.1
583	S	25.9	Very low	29.6	Very low	113 Å²	113	116 Å²	116	79%	0.79	71%	0.71	S	S	*	*			trans	-119.7	143.4	163.4	66.1	0	0	0	0	110.5	P581	P581-S583 PolarHBondContact O-N 3.31Å
584	N	28	Very low	29.6	Very low	141 Å²	141	114.3 Å²	114.3	75%	0.754	70%	0.702	S	S	*	*			trans	-81.7	125.2	-163.1	-64	-68.1	0	0	0	113
585	S	26.6	Very low	29.9	Very low	114 Å²	114	109 Å²	109	80%	0.797	68%	0.684	S	S	*	*			trans	172.7	106.4	131.8	45.4	0	0	0	0	113.9
586	S	27.1	Very low	30.5	Very low	110 Å²	110	106.2 Å²	106.2	77%	0.769	66%	0.659	S	S	*	*			trans	169.5	60.3	147.8	40.3	0	0	0	0	111.1	S588	S586-S588 PolarHBondContact O-N 2.84Å
587	K	29.9	Very low	31	Very low	206 Å²	206	102.8 Å²	102.8	90%	0.896	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	85.4	177.4	-69.3	-178.8	177.9	179.4	0	111.5
588	S	32.3	Very low	31.8	Very low	94 Å²	94	105.2 Å²	105.2	66%	0.657	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.1	-43.1	155.7	69.7	0	0	0	0	113.6	S586	S586-S588 PolarHBondContact O-N 2.84Å
589	L	30.7	Very low	32.4	Very low	113 Å²	113	108.1 Å²	108.1	59%	0.592	64%	0.638	S	S	*	*	H	α-helix	trans	-79.5	-39	-175.5	-144.2	78.1	0	0	0	113.6	H591 L592	L589-H591 VanDerWaalsContact C-N 3.26Å; L589-H591 PolarHBondContact O-N 3.45Å; L589-L592 PolarHBondContact O-N 3.02Å
590	A	30.9	Very low	33.1	Very low	65 Å²	65	104.2 Å²	104.2	54%	0.537	61%	0.609	S	S	.	*	H	α-helix	trans	-62.9	-29	-175.1	0	0	0	0	0	113.7	Q593 A594	A590-Q593 PolarHBondContact O-N 3.34Å; A590-A594 PolarHBondContact O-N 3.33Å; A590-A594 VanDerWaalsContact O-N 3.1Å
591	H	31.3	Very low	34.1	Very low	143 Å²	143	108.3 Å²	108.3	66%	0.662	62%	0.618	S	S	*	*	H	α-helix	trans	-71.5	-32.2	-176.8	-155.1	-22.9	0	0	0	112.6	L589 Q593 T595	L589-H591 VanDerWaalsContact C-N 3.26Å; L589-H591 PolarHBondContact O-N 3.45Å; H591-Q593 VanDerWaalsContact C-N 3.33Å; H591-T595 PolarHBondContact ND1-OG1 2.86Å; H591-T595 PolarHBondContact O-OG1 3.3Å
592	L	31.8	Very low	34.9	Very low	85 Å²	85	104.4 Å²	104.4	45%	0.445	59%	0.59	S	S	.	*	H	α-helix	trans	-70.8	-30.5	174.7	-76.9	171.5	0	0	0	112.4	E501 L589	E501-L592 WeakPolarHBondContact OE1-CD2 3.45Å; L589-L592 PolarHBondContact O-N 3.02Å
593	Q	33.7	Very low	36.2	Very low	79 Å²	79	105.1 Å²	105.1	37%	0.369	59%	0.587	S	S	.	*	H	α-helix	trans	-73.2	-48.1	176	-73.7	178.9	-24.3	0	0	111.5	A590 H591 T595 L597	A590-Q593 PolarHBondContact O-N 3.34Å; H591-Q593 VanDerWaalsContact C-N 3.33Å; Q593-T595 VanDerWaalsContact C-N 3.35Å; Q593-T595 PolarHBondContact O-N 3Å; Q593-L597 HydrophobicContact CB-CD1 4.19Å; Q593-L597 HydrophobicContact CG-CD1 4.39Å; Q593-L597 WeakPolarHBondContact O-CB 3.24Å; Q593-L597 WeakPolarHBondContact O-CD1 3.45Å
594	A	34.3	Very low	37.9	Very low	63 Å²	63	101.2 Å²	101.2	52%	0.521	56%	0.557	S	S	.	*	H	α-helix	trans	-61.1	-37.9	-175.2	0	0	0	0	0	114	A590 Y596	A590-A594 PolarHBondContact O-N 3.33Å; A590-A594 VanDerWaalsContact O-N 3.1Å; A594-Y596 VanDerWaalsContact C-N 3.33Å; A594-Y596 PolarHBondContact O-N 2.98Å
595	T	38.5	Very low	39.5	Very low	56 Å²	56	95 Å²	95	34%	0.344	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-14.8	-168.9	-41.6	0	0	0	0	114.8	T174 H591 Q593	T174-T595 HydrophobicContact CG2-CG2 3.51Å; H591-T595 PolarHBondContact ND1-OG1 2.86Å; H591-T595 PolarHBondContact O-OG1 3.3Å; Q593-T595 VanDerWaalsContact C-N 3.35Å; Q593-T595 PolarHBondContact O-N 3Å
596	Y	39.4	Very low	41.2	Very low	36 Å²	36	95.6 Å²	95.6	14%	0.141	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123	-6.6	-172.3	-69.7	-94.2	0	0	0	114.8	V171 A173 T174 A594 I673 K675	V171-Y596 HydrophobicContact CG1-CD1 3.87Å; A173-Y596 HydrophobicContact CB-CE1 3.53Å; T174-Y596 PolarHBondContact OG1-OH 3.37Å; A594-Y596 VanDerWaalsContact C-N 3.33Å; A594-Y596 PolarHBondContact O-N 2.98Å; Y596-I673 HydrophobicContact CD1-CD1 3.84Å; Y596-I673 HydrophobicContact CE1-CD1 4.25Å; Y596-I673 HydrophobicContact CG-CD1 4.12Å; Y596-K675 PolarHBondContact OH-NZ 3.36Å
597	L	39.8	Very low	43.4	Very low	36 Å²	36	91.3 Å²	91.3	19%	0.188	48%	0.483	C	S	.	.			trans	-113.3	7.3	-164.3	-82.9	160.5	0	0	0	116.1	Q593 D599 V600 L602	Q593-L597 HydrophobicContact CB-CD1 4.19Å; Q593-L597 HydrophobicContact CG-CD1 4.39Å; Q593-L597 WeakPolarHBondContact O-CB 3.24Å; Q593-L597 WeakPolarHBondContact O-CD1 3.45Å; L597-D599 PolarHBondContact O-N 2.99Å; L597-V600 HydrophobicContact CD2-CB 4.35Å; L597-V600 PolarHBondContact O-N 3.29Å; L597-L602 HydrophobicContact CD2-CB 4.21Å; L597-L602 HydrophobicContact CD2-CD1 3.89Å; L597-L602 HydrophobicContact CD2-CG 4.42Å
598	N	44.4	Very low	45.2	Very low	155 Å²	155	90.2 Å²	90.2	83%	0.829	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-29.5	-178.1	-75	-11.2	0	0	0	114
599	D	40.6	Very low	47.2	Very low	162 Å²	162	87.1 Å²	87.1	87%	0.866	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-3.7	179.6	-73.4	-22	0	0	0	115.3	L597	L597-D599 PolarHBondContact O-N 2.99Å
600	V	42.6	Very low	48.8	Very low	38 Å²	38	86.1 Å²	86.1	23%	0.23	44%	0.442	C	S	.	.			trans	-141.8	112.3	-176.7	-146.5	0	0	0	0	113	L597 L602	L597-V600 HydrophobicContact CD2-CB 4.35Å; L597-V600 PolarHBondContact O-N 3.29Å; V600-L602 HydrophobicContact CB-CD1 4.18Å; V600-L602 HydrophobicContact CB-CG 4.06Å; V600-L602 HydrophobicContact CG1-CD1 4.06Å; V600-L602 HydrophobicContact CG1-CD2 4.26Å; V600-L602 HydrophobicContact CG1-CG 3.67Å; V600-L602 PolarHBondContact O-N 2.64Å
601	N	45.7	Very low	50.3	Low	177 Å²	177	90.2 Å²	90.2	95%	0.947	45%	0.45	S	S	*	.			trans	-67.8	57.1	169.7	-79.6	-52	0	0	0	112.8	K603	N601-K603 PolarHBondContact O-N 3.4Å
602	L	52.7	Low	52	Low	39 Å²	39	86 Å²	86	20%	0.204	43%	0.434	C	S	.	.			trans	-79.9	99.1	174.7	-72.2	170.4	0	0	0	109.8	L597 V600 L604 H657	L597-L602 HydrophobicContact CD2-CB 4.21Å; L597-L602 HydrophobicContact CD2-CD1 3.89Å; L597-L602 HydrophobicContact CD2-CG 4.42Å; V600-L602 HydrophobicContact CB-CD1 4.18Å; V600-L602 HydrophobicContact CB-CG 4.06Å; V600-L602 HydrophobicContact CG1-CD1 4.06Å; V600-L602 HydrophobicContact CG1-CD2 4.26Å; V600-L602 HydrophobicContact CG1-CG 3.67Å; V600-L602 PolarHBondContact O-N 2.64Å; L602-L604 PolarHBondContact O-N 3.05Å; L602-H657 WeakPolarHBondContact CD1-CE1 3.5Å
603	K	54.4	Low	53.9	Low	183 Å²	183	87.1 Å²	87.1	80%	0.796	44%	0.436	S	S	*	.			trans	-69.5	101.4	166.3	-70.8	-173	178.4	-177.8	0	109.2	N601	N601-K603 PolarHBondContact O-N 3.4Å
604	L	61.4	Low	55.7	Low	30 Å²	30	85.8 Å²	85.8	16%	0.157	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-87.6	126.7	172.1	-66.3	164.3	0	0	0	108.8	I503 V505 L602	I503-L604 HydrophobicContact CG2-CD1 3.8Å; V505-L604 WeakPolarHBondContact O-CD2 3.27Å; L602-L604 PolarHBondContact O-N 3.05Å
605	P	62.1	Low	57.4	Low	12 Å²	12	84 Å²	84	8%	0.078	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-62.6	161.2	169.5	25.9	-33.7	0	0	0	111.7	V505 V509 L569 Q607	V505-P605 WeakPolarHBondContact O-CD 3.33Å; V509-P605 HydrophobicContact CG1-CB 4.49Å; V509-P605 HydrophobicContact CG2-CB 3.87Å; V509-P605 HydrophobicContact CG2-CG 4.49Å; L569-P605 HydrophobicContact CD2-CG 3.98Å; P605-Q607 WeakPolarHBondContact O-CG 3.32Å; P605-Q607 PolarHBondContact O-N 2.79Å; P605-Q607 VanDerWaalsContact O-N 3.16Å
606	E	62.1	Low	58.9	Low	125 Å²	125	82.1 Å²	82.1	58%	0.584	40%	0.398	S	S	*	.	S	Bend	trans	-58.1	120.9	170.3	-74.4	-167.4	160.8	0	0	110.5	F570	F570-E606 HydrophobicContact CB-CB 4.01Å; F570-E606 PolarHBondContact N-O 3.34Å
607	Q	73	Confident	60.4	Low	20 Å²	20	81.4 Å²	81.4	9%	0.093	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	140.7	-172.2	59.7	-175.1	-22.6	0	0	110.3	I503 R568 L569 P605 W609	I503-Q607 PolarHBondContact O-NE2 2.7Å; R568-Q607 WeakPolarHBondContact O-CA 3.33Å; L569-Q607 HydrophobicContact CD2-CB 3.69Å; P605-Q607 WeakPolarHBondContact O-CG 3.32Å; P605-Q607 PolarHBondContact O-N 2.79Å; P605-Q607 VanDerWaalsContact O-N 3.16Å; Q607-W609 VanDerWaalsContact CD-NE1 3.28Å
608	R	68.5	Low	62	Low	184 Å²	184	79.8 Å²	79.8	69%	0.694	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	137.1	167.4	-66.4	-178.8	-175.1	-174	1.1	108.9	G567 R568 F570	G567-R608 CarbonylContact C-O 3.29Å; G567-R608 VanDerWaalsContact CA-O 3.28Å; G567-R608 WeakPolarHBondContact CA-O 3.44Å; R568-R608 PolarHBondContact N-O 3.48Å; R568-R608 PolarHBondContact O-N 2.88Å; R568-R608 VanDerWaalsContact O-N 3.1Å; F570-R608 HydrophobicContact CE2-CB 3.92Å; F570-R608 HydrophobicContact CE2-CG 3.7Å; F570-R608 HydrophobicContact CZ-CG 4.38Å
609	W	73.9	Confident	63.4	Low	29 Å²	29	73.9 Å²	73.9	11%	0.11	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.6	-179.1	-67.6	92.1	0	0	0	109.2	V502 V505 F517 I519 I565 T566 Q607 T612 F670	V502-W609 HydrophobicContact CG1-CD2 4.15Å; V502-W609 HydrophobicContact CG1-CE3 4.42Å; V502-W609 HydrophobicContact CG1-CG 4.4Å; V505-W609 HydrophobicContact CB-CZ2 4.37Å; V505-W609 HydrophobicContact CG2-CH2 3.93Å; V505-W609 HydrophobicContact CG2-CZ2 3.8Å; F517-W609 HydrophobicContact CB-CH2 3.93Å; F517-W609 HydrophobicContact CB-CZ3 4.24Å; I519-W609 HydrophobicContact CD1-CH2 3.58Å; I519-W609 HydrophobicContact CD1-CZ3 3.56Å; I519-W609 HydrophobicContact CG1-CH2 4.35Å; I519-W609 HydrophobicContact CG1-CZ3 4Å; I565-W609 HydrophobicContact CG2-CB 4.44Å; I565-W609 HydrophobicContact CG2-CE3 3.67Å; I565-W609 HydrophobicContact CG2-CZ3 4.41Å; T566-W609 WeakPolarHBondContact O-CA 3.42Å; Q607-W609 VanDerWaalsContact CD-NE1 3.28Å; W609-T612 HydrophobicContact CB-CG2 3.71Å; W609-F670 HydrophobicContact CH2-CD2 4.5Å; W609-F670 HydrophobicContact CH2-CE2 4.34Å
610	D	63	Low	64.7	Low	92 Å²	92	66.2 Å²	66.2	49%	0.492	32%	0.318	S	S	.	.	S	Bend	trans	-82.1	124.1	179.8	-53.2	-44.6	0	0	0	109.2	I565 T566	I565-D610 VanDerWaalsContact CG2-O 3.28Å; I565-D610 WeakPolarHBondContact CG2-O 3.29Å; T566-D610 VanDerWaalsContact CB-OD2 3.3Å; T566-D610 WeakPolarHBondContact CB-OD2 3.24Å; T566-D610 PolarHBondContact O-N 3.11Å; T566-D610 PolarHBondContact OG1-OD2 2.85Å
611	Q	63	Low	65.7	Low	151 Å²	151	64.6 Å²	64.6	71%	0.706	31%	0.309	S	S	*	.	S	Bend	trans	52.2	75.4	-176.8	-58.8	178	-9.5	0	0	112.8	W563 K613	W563-Q611 WeakPolarHBondContact CZ2-O 3.11Å; Q611-K613 PolarHBondContact O-N 3.39Å
612	T	66.6	Low	66.7	Low	53 Å²	53	56.6 Å²	56.6	33%	0.325	27%	0.267	S	S	.	.			trans	-68.1	-13.6	-176.4	49.2	0	0	0	0	115.8	E501 V502 W609	E501-T612 WeakPolarHBondContact CA-O 3.44Å; V502-T612 PolarHBondContact N-O 2.95Å; W609-T612 HydrophobicContact CB-CG2 3.71Å
613	K	71.9	Confident	67.3	Low	109 Å²	109	55 Å²	55	47%	0.474	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.9	-176.3	-69.2	180	176.3	-176.5	0	111.5	C500 E501 W563 Q611	C500-K613 WeakPolarHBondContact O-CA 3.27Å; E501-K613 HydrophobicContact CB-CG 4.32Å; E501-K613 HydrophobicContact CG-CG 4.18Å; E501-K613 WeakPolarHBondContact OE1-CE 3.41Å; E501-K613 IonicContact OE1-NZ 2.68Å; E501-K613 PolarHBondContact OE1-NZ 3.28Å; W563-K613 VanDerWaalsContact CZ2-C 3.47Å; Q611-K613 PolarHBondContact O-N 3.39Å
614	H	71.6	Confident	67.8	Low	51 Å²	51	46.4 Å²	46.4	24%	0.236	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	144.8	169.9	173.4	66.3	0	0	0	110.4	C500 W563 F616	C500-H614 PolarHBondContact N-O 3.01Å; C500-H614 PolarHBondContact O-N 2.97Å; W563-H614 HydrophobicContact CB-CB 4.4Å; W563-H614 HydrophobicContact CD2-CB 3.21Å; W563-H614 AromaticContact CD2-CD2 3.87Å; W563-H614 AromaticContact CD2-CG 3.64Å; W563-H614 HydrophobicContact CE3-CB 3.42Å; W563-H614 VanDerWaalsContact CE3-CB 3.42Å; W563-H614 AromaticContact CE3-CD2 3.79Å; W563-H614 AromaticContact CE3-CG 3.89Å; W563-H614 HydrophobicContact CG-CB 3.69Å; W563-H614 AromaticContact CG-CD2 3.82Å; W563-H614 AromaticContact CG-CG 3.63Å; W563-H614 HydrophobicContact CH2-CB 3.69Å; W563-H614 HydrophobicContact CZ2-CB 3.49Å; W563-H614 VanDerWaalsContact CZ2-CB 3.49Å; W563-H614 HydrophobicContact CZ3-CB 3.67Å; H614-F616 AromaticContact CD2-CD1 3.75Å
615	I	70	Confident	68	Low	25 Å²	25	46.1 Å²	46.1	13%	0.128	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.2	-175.7	-55	-171.8	0	0	0	107.6	L182 C185 T497 L498 I499	L182-I615 HydrophobicContact CB-CD1 3.79Å; L182-I615 HydrophobicContact CD1-CD1 3.68Å; L182-I615 HydrophobicContact CG-CD1 3.79Å; C185-I615 HydrophobicContact CB-CB 4.48Å; C185-I615 HydrophobicContact CB-CG2 4.33Å; T497-I615 HydrophobicContact CG2-CG2 3.87Å; L498-I615 WeakPolarHBondContact O-CA 3.5Å; I499-I615 HydrophobicContact CD1-CD1 4.21Å; I499-I615 HydrophobicContact CG1-CD1 4.09Å; I499-I615 HydrophobicContact CG1-CG1 4.05Å; I499-I615 HydrophobicContact CG2-CG1 4.3Å
616	F	71	Confident	68.2	Low	17 Å²	17	45.6 Å²	45.6	8%	0.075	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	155.1	176.6	56.5	-93.4	0	0	0	110.8	T497 L498 C500 Y523 H614 L624 I647 L674	T497-F616 CarbonylContact C-O 3.55Å; T497-F616 WeakPolarHBondContact CA-O 3.35Å; L498-F616 HydrophobicContact CB-CD2 3.98Å; L498-F616 HydrophobicContact CB-CE1 4.31Å; L498-F616 HydrophobicContact CB-CE2 3.54Å; L498-F616 HydrophobicContact CB-CZ 3.74Å; L498-F616 HydrophobicContact CD1-CD2 4.26Å; L498-F616 HydrophobicContact CD1-CE2 3.52Å; L498-F616 HydrophobicContact CD1-CZ 4.2Å; L498-F616 HydrophobicContact CG-CE2 4.17Å; L498-F616 PolarHBondContact N-O 3.27Å; L498-F616 PolarHBondContact O-N 3.18Å; C500-F616 HydrophobicContact CB-CE1 4.09Å; Y523-F616 AromaticContact CD2-CD2 3.4Å; Y523-F616 HydrophobicContact CD2-CD2 3.4Å; Y523-F616 AromaticContact CD2-CE2 3.47Å; Y523-F616 HydrophobicContact CD2-CE2 3.47Å; Y523-F616 VanDerWaalsContact CD2-CE2 3.47Å; Y523-F616 HydrophobicContact CD2-CG 4.06Å; Y523-F616 HydrophobicContact CD2-CZ 4.19Å; Y523-F616 AromaticContact CE2-CD2 3.17Å; Y523-F616 HydrophobicContact CE2-CD2 3.17Å; Y523-F616 AromaticContact CE2-CE2 3.27Å; Y523-F616 HydrophobicContact CE2-CE2 3.27Å; Y523-F616 HydrophobicContact CE2-CG 4.21Å; Y523-F616 HydrophobicContact CE2-CZ 4.35Å; Y523-F616 HydrophobicContact CG-CD2 4.3Å; Y523-F616 AromaticContact CZ-CD2 3.97Å; H614-F616 AromaticContact CD2-CD1 3.75Å; F616-L624 HydrophobicContact CZ-CD1 4.4Å; F616-I647 HydrophobicContact CE2-CD1 4.24Å; F616-L674 HydrophobicContact CE1-CD1 4.21Å; F616-L674 HydrophobicContact CZ-CD1 3.86Å
617	S	69.8	Low	68.7	Low	22 Å²	22	42.5 Å²	42.5	15%	0.154	20%	0.202	C	C	.	.			trans	-84.7	131.7	176.7	-51.6	0	0	0	0	110.2	R186 Y523 T619	R186-S617 WeakPolarHBondContact CG-OG 3.46Å; Y523-S617 VanDerWaalsContact CZ-O 3.28Å; Y523-S617 PolarHBondContact OH-O 2.93Å; S617-T619 PolarHBondContact O-N 3.4Å
618	P	74.1	Confident	68.5	Low	1 Å²	1	41.5 Å²	41.5	1%	0.006	20%	0.197	C	C	.	.			trans	-62.3	132.2	166.1	-4.5	16	0	0	0	110.2	F203 S495 G496 L498 Y523 I651	F203-P618 HydrophobicContact CE2-CB 4.13Å; F203-P618 HydrophobicContact CZ-CB 4.27Å; S495-P618 WeakPolarHBondContact OG-CD 3.44Å; S495-P618 WeakPolarHBondContact OG-CG 3.38Å; S495-P618 PolarHBondContact OG-O 3.43Å; G496-P618 WeakPolarHBondContact O-CD 3.27Å; L498-P618 HydrophobicContact CD1-CB 4.07Å; L498-P618 HydrophobicContact CD1-CG 3.79Å; L498-P618 HydrophobicContact CG-CG 4.02Å; Y523-P618 VanDerWaalsContact OH-CA 3.28Å; Y523-P618 WeakPolarHBondContact OH-CA 3.46Å; P618-I651 HydrophobicContact CB-CD1 4.49Å
619	T	72.7	Confident	68.6	Low	32 Å²	32	33 Å²	33	20%	0.196	17%	0.165	C	C	.	.			trans	-119.4	161.4	165	105.9	0	0	0	0	109.4	E492 Y523 S617 G621 D622	E492-T619 VanDerWaalsContact OE1-CB 3.27Å; E492-T619 WeakPolarHBondContact OE1-CB 3.43Å; E492-T619 PolarHBondContact OE1-OG1 3.49Å; Y523-T619 HydrophobicContact CE1-CG2 4.3Å; Y523-T619 PolarHBondContact OH-N 3.22Å; S617-T619 PolarHBondContact O-N 3.4Å; T619-G621 PolarHBondContact O-N 2.78Å; T619-G621 VanDerWaalsContact O-N 3.1Å; T619-G621 PolarHBondContact OG1-N 3.33Å; T619-D622 WeakPolarHBondContact CA-OD2 3.36Å; T619-D622 WeakPolarHBondContact CB-OD2 3.37Å; T619-D622 WeakPolarHBondContact CG2-OD2 3.41Å; T619-D622 PolarHBondContact N-OD2 3.26Å; T619-D622 PolarHBondContact O-N 3.09Å; T619-D622 PolarHBondContact OG1-OD2 3.46Å
620	I	68.6	Low	68.3	Low	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.4	-177.7	-67.4	154.6	0	0	0	110.3	R196 R199 T200 F203 E488 E492	R196-I620 HydrophobicContact CB-CG2 4.1Å; R199-I620 HydrophobicContact CB-CG2 3.86Å; R199-I620 WeakPolarHBondContact CD-O 3.42Å; R199-I620 HydrophobicContact CG-CG2 3.96Å; R199-I620 VanDerWaalsContact CG-O 3.28Å; R199-I620 WeakPolarHBondContact CG-O 3.42Å; R199-I620 PolarHBondContact NE-O 2.97Å; T200-I620 HydrophobicContact CG2-CD1 3.94Å; F203-I620 HydrophobicContact CB-CG1 4.06Å; F203-I620 HydrophobicContact CD1-CB 4.43Å; F203-I620 HydrophobicContact CD1-CD1 4.11Å; F203-I620 HydrophobicContact CD1-CG1 3.24Å; F203-I620 HydrophobicContact CE1-CD1 4.42Å; F203-I620 HydrophobicContact CE1-CG1 3.59Å; F203-I620 HydrophobicContact CG-CG1 3.75Å; F203-I620 HydrophobicContact CZ-CG1 4.35Å; E488-I620 HydrophobicContact CB-CD1 3.64Å; E488-I620 HydrophobicContact CG-CD1 3.62Å; E492-I620 HydrophobicContact CG-CB 4.43Å; E492-I620 HydrophobicContact CG-CD1 3.76Å; E492-I620 HydrophobicContact CG-CG1 3.78Å; E492-I620 WeakPolarHBondContact OE1-CB 3.4Å; E492-I620 PolarHBondContact OE1-N 3.48Å
621	G	64.2	Low	68.3	Low	4 Å²	4	30.3 Å²	30.3	4%	0.041	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-13.8	-170.4	0	0	0	0	0	117	P526 T619	P526-G621 WeakPolarHBondContact CD-O 3.47Å; T619-G621 PolarHBondContact O-N 2.78Å; T619-G621 VanDerWaalsContact O-N 3.1Å; T619-G621 PolarHBondContact OG1-N 3.33Å
622	D	67.2	Low	68.3	Low	10 Å²	10	29 Å²	29	5%	0.053	14%	0.141	C	C	.	.			trans	-98.9	150.9	-144.8	-62.8	-58.9	0	0	0	118.3	R199 Y523 N524 T619 I647	R199-D622 PolarHBondContact NH2-O 3.44Å; Y523-D622 HydrophobicContact CD1-CB 4.34Å; Y523-D622 HydrophobicContact CD2-CB 4.41Å; Y523-D622 HydrophobicContact CE1-CB 3.66Å; Y523-D622 WeakPolarHBondContact CE1-OD1 3.35Å; Y523-D622 WeakPolarHBondContact CE1-OD2 3.34Å; Y523-D622 HydrophobicContact CE2-CB 3.77Å; Y523-D622 WeakPolarHBondContact OH-CB 3.31Å; Y523-D622 PolarHBondContact OH-OD2 3.12Å; N524-D622 VanDerWaalsContact C-OD1 3.31Å; T619-D622 WeakPolarHBondContact CA-OD2 3.36Å; T619-D622 WeakPolarHBondContact CB-OD2 3.37Å; T619-D622 WeakPolarHBondContact CG2-OD2 3.41Å; T619-D622 PolarHBondContact N-OD2 3.26Å; T619-D622 PolarHBondContact O-N 3.09Å; T619-D622 PolarHBondContact OG1-OD2 3.46Å; D622-I647 HydrophobicContact CB-CD1 4Å
623	V	63.6	Low	67.7	Low	5 Å²	5	33.5 Å²	33.5	3%	0.03	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	122.3	179.9	176.2	0	0	0	0	108.5	N524 P526 I531 T625 A644 C645	N524-V623 PolarHBondContact O-N 2.88Å; N524-V623 VanDerWaalsContact O-N 3.12Å; P526-V623 HydrophobicContact CB-CG2 3.96Å; P526-V623 HydrophobicContact CG-CG2 3.98Å; I531-V623 HydrophobicContact CD1-CG1 4.3Å; I531-V623 HydrophobicContact CD1-CG2 3.44Å; I531-V623 VanDerWaalsContact CD1-CG2 3.44Å; V623-T625 PolarHBondContact O-N 3Å; V623-A644 HydrophobicContact CG1-CB 3.78Å; V623-C645 CarbonylContact C-O 3.57Å; V623-C645 WeakPolarHBondContact CA-O 3.29Å; V623-C645 WeakPolarHBondContact CG1-O 3.43Å
624	L	65.8	Low	66.6	Low	3 Å²	3	38.5 Å²	38.5	2%	0.016	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	111	179.8	-179.8	69.2	0	0	0	109	L521 F616 A644 C645 I647 F672	L521-L624 HydrophobicContact CD2-CD1 4Å; L521-L624 HydrophobicContact CD2-CD2 4.48Å; L521-L624 HydrophobicContact CD2-CG 4.25Å; F616-L624 HydrophobicContact CZ-CD1 4.4Å; L624-A644 CarbonylContact O-C 3.49Å; L624-A644 WeakPolarHBondContact O-CA 3.3Å; L624-C645 PolarHBondContact N-O 2.82Å; L624-C645 PolarHBondContact O-N 3.39Å; L624-C645 PolarHBondContact O-SG 3.49Å; L624-C645 VanDerWaalsContact O-SG 3.37Å; L624-I647 HydrophobicContact CB-CD1 3.82Å; L624-I647 HydrophobicContact CB-CG1 3.83Å; L624-F672 HydrophobicContact CD2-CE2 4.19Å; L624-F672 HydrophobicContact CD2-CZ 4.35Å
625	T	64.7	Low	65.8	Low	24 Å²	24	38.1 Å²	38.1	15%	0.147	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	113.7	179.8	-57	0	0	0	0	110.8	L521 K522 L553 V623 Q642 Q643	L521-T625 WeakPolarHBondContact CA-O 3.39Å; K522-T625 PolarHBondContact N-O 3.23Å; K522-T625 PolarHBondContact O-N 3.47Å; L553-T625 HydrophobicContact CD1-CG2 4.29Å; V623-T625 PolarHBondContact O-N 3Å; T625-Q642 HydrophobicContact CG2-CG 4.33Å; T625-Q643 CarbonylContact C-O 3.56Å; T625-Q643 VanDerWaalsContact CA-O 3.25Å; T625-Q643 WeakPolarHBondContact CA-O 3.46Å; T625-Q643 WeakPolarHBondContact CG2-O 3.39Å
626	I	67.9	Low	65.2	Low	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	124.8	179.5	-41.7	173	0	0	0	108.5	M166 L521 V628 Q642 Q643 V660 F672	M166-I626 HydrophobicContact SD-CD1 4.27Å; L521-I626 HydrophobicContact CD2-CB 4.08Å; L521-I626 HydrophobicContact CD2-CG1 3.69Å; L521-I626 HydrophobicContact CD2-CG2 3.97Å; I626-V628 HydrophobicContact CG2-CG2 4.36Å; I626-Q642 CarbonylContact O-C 3.56Å; I626-Q642 VanDerWaalsContact O-CA 3.26Å; I626-Q642 WeakPolarHBondContact O-CA 3.5Å; I626-Q643 PolarHBondContact N-O 3.19Å; I626-Q643 PolarHBondContact O-N 3.1Å; I626-V660 HydrophobicContact CD1-CG2 3.88Å; I626-F672 HydrophobicContact CD1-CE1 3.63Å; I626-F672 HydrophobicContact CD1-CZ 3.65Å; I626-F672 HydrophobicContact CG1-CZ 4.47Å
627	K	71.8	Confident	64.7	Low	60 Å²	60	49.5 Å²	49.5	26%	0.261	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	115.7	172.1	-178.5	-170.3	-178.3	98.2	0	110.4	S520 V629 T639 I641 Q642	S520-K627 PolarHBondContact N-O 3.25Å; S520-K627 PolarHBondContact O-N 3.19Å; S520-K627 PolarHBondContact OG-O 3.08Å; K627-V629 HydrophobicContact CD-CG2 4.39Å; K627-V629 HydrophobicContact CG-CG2 4.26Å; K627-T639 HydrophobicContact CD-CG2 4.49Å; K627-T639 WeakPolarHBondContact CE-OG1 3.26Å; K627-T639 HydrophobicContact CG-CG2 4Å; K627-T639 PolarHBondContact NZ-OG1 2.75Å; K627-I641 CarbonylContact C-O 3.6Å; K627-I641 VanDerWaalsContact CA-O 3.32Å; K627-I641 WeakPolarHBondContact CA-O 3.4Å; K627-Q642 HydrophobicContact CB-CB 4.4Å; K627-Q642 HydrophobicContact CB-CG 4.1Å; K627-Q642 HydrophobicContact CG-CB 4.23Å; K627-Q642 HydrophobicContact CG-CG 4.24Å
628	V	68.5	Low	64.3	Low	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	129.3	178.4	-177.2	0	0	0	0	109.4	F517 I519 I626 T639 L640 I641 L662 F670	F517-V628 HydrophobicContact CD1-CG1 4.12Å; I519-V628 HydrophobicContact CD1-CG1 4.31Å; I519-V628 HydrophobicContact CD1-CG2 4.12Å; I519-V628 HydrophobicContact CG1-CB 4.38Å; I519-V628 HydrophobicContact CG1-CG1 3.96Å; I519-V628 HydrophobicContact CG1-CG2 4Å; I519-V628 HydrophobicContact CG2-CG2 4.19Å; I626-V628 HydrophobicContact CG2-CG2 4.36Å; V628-T639 CarbonylContact O-C 3.57Å; V628-L640 PolarHBondContact O-N 3.4Å; V628-I641 HydrophobicContact CB-CG2 3.81Å; V628-I641 HydrophobicContact CG2-CG2 3.73Å; V628-I641 PolarHBondContact N-O 3.36Å; V628-I641 PolarHBondContact O-N 3.49Å; V628-L662 HydrophobicContact CB-CD2 3.93Å; V628-L662 HydrophobicContact CG1-CD1 4.49Å; V628-L662 HydrophobicContact CG1-CD2 3.91Å; V628-L662 HydrophobicContact CG2-CD2 3.98Å; V628-F670 HydrophobicContact CG2-CD1 4.49Å
629	V	69.7	Low	63.9	Low	4 Å²	4	54.4 Å²	54.4	2%	0.024	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.6	-179.7	-179.9	0	0	0	0	108.6	R518 K627 P637 E638	R518-V629 PolarHBondContact N-O 2.75Å; R518-V629 PolarHBondContact O-N 3.48Å; K627-V629 HydrophobicContact CD-CG2 4.39Å; K627-V629 HydrophobicContact CG-CG2 4.26Å; V629-P637 HydrophobicContact CG1-CB 3.62Å; V629-E638 CarbonylContact C-O 3.59Å; V629-E638 VanDerWaalsContact CA-O 3.25Å; V629-E638 WeakPolarHBondContact CA-O 3.44Å; V629-E638 WeakPolarHBondContact CG1-O 3.45Å
630	V	68.9	Low	63.3	Low	1 Å²	1	53 Å²	53	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	132.9	167.7	162.4	0	0	0	0	109.9	D515 F517 R632 E638 L640	D515-V630 HydrophobicContact CB-CG1 4.27Å; F517-V630 HydrophobicContact CD1-CG2 3.54Å; F517-V630 HydrophobicContact CD2-CG2 4.34Å; F517-V630 HydrophobicContact CE1-CG2 3.33Å; F517-V630 HydrophobicContact CE2-CG2 4.14Å; F517-V630 HydrophobicContact CG-CG2 4.06Å; F517-V630 HydrophobicContact CZ-CG2 3.65Å; V630-R632 HydrophobicContact CG1-CG 3.89Å; V630-E638 PolarHBondContact N-O 3.37Å; V630-E638 PolarHBondContact O-N 2.9Å; V630-L640 HydrophobicContact CB-CD1 4.29Å; V630-L640 HydrophobicContact CB-CG 4.28Å; V630-L640 HydrophobicContact CG2-CD1 3.44Å; V630-L640 VanDerWaalsContact CG2-CD1 3.44Å; V630-L640 HydrophobicContact CG2-CG 3.94Å
631	M	63.1	Low	63	Low	64 Å²	64	53.4 Å²	53.4	32%	0.315	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	94.9	172.5	-56.3	-166.7	-54.9	0	0	108	V516 R518 T566 P637	V516-M631 HydrophobicContact CB-CB 4.47Å; V516-M631 HydrophobicContact CB-CE 4.4Å; V516-M631 HydrophobicContact CG1-CE 3.78Å; V516-M631 PolarHBondContact O-N 2.84Å; R518-M631 HydrophobicContact CB-CE 4.38Å; R518-M631 HydrophobicContact CB-SD 4.38Å; T566-M631 HydrophobicContact CG2-CE 4.39Å; M631-P637 HydrophobicContact CG-CB 4.48Å
632	R	63.7	Low	62.9	Low	124 Å²	124	54.8 Å²	54.8	47%	0.468	26%	0.264	S	S	.	.			trans	-70.9	142.8	172.8	-54	-170.5	-162.8	-162.6	4.9	109.1	V630 F634 G635 E638	V630-R632 HydrophobicContact CG1-CG 3.89Å; R632-F634 PolarHBondContact O-N 2.77Å; R632-G635 PolarHBondContact O-N 2.71Å; R632-G635 VanDerWaalsContact O-N 3.07Å; R632-E638 IonicContact CZ-OE2 3.03Å; R632-E638 IonicContact NE-OE2 3.99Å; R632-E638 PolarHBondContact NE-OE2 2.85Å; R632-E638 IonicContact NH2-OE1 2.61Å; R632-E638 IonicContact NH2-OE2 2.92Å; R632-E638 PolarHBondContact NH2-OE2 2.95Å
633	R	52.6	Low	62.7	Low	148 Å²	148	54.5 Å²	54.5	56%	0.558	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-25	-171.7	-71.1	-174.4	175.3	-148.8	-1.7	116.4
634	F	49.4	Very low	62.5	Low	214 Å²	214	55.9 Å²	55.9	94%	0.939	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.7	22.7	-179.4	-62	-74.6	0	0	0	113.1	R632	R632-F634 PolarHBondContact O-N 2.77Å
635	G	54.7	Low	62.3	Low	43 Å²	43	56.8 Å²	56.8	44%	0.443	28%	0.281	S	S	.	.	S	Bend	trans	-124.5	158.3	-170.5	0	0	0	0	0	114.9	R632	R632-G635 PolarHBondContact O-N 2.71Å; R632-G635 VanDerWaalsContact O-N 3.07Å
636	K	56.3	Low	62.4	Low	199 Å²	199	56.5 Å²	56.5	87%	0.865	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-61.3	143.1	165.6	-71.2	177.5	179.6	173.1	0	109.5	E638	K636-E638 PolarHBondContact O-N 3.02Å
637	P	60.6	Low	62.5	Low	81 Å²	81	56.8 Å²	56.8	53%	0.526	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-63.4	121.6	-179	24.3	-33.7	0	0	0	111.5	V629 M631	V629-P637 HydrophobicContact CG1-CB 3.62Å; M631-P637 HydrophobicContact CG-CB 4.48Å
638	E	62.7	Low	62.3	Low	62 Å²	62	54.1 Å²	54.1	29%	0.29	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	120.1	-176.6	-171.9	173.7	-163.1	0	0	110	V629 V630 R632 K636 L640 N664	V629-E638 CarbonylContact C-O 3.59Å; V629-E638 VanDerWaalsContact CA-O 3.25Å; V629-E638 WeakPolarHBondContact CA-O 3.44Å; V629-E638 WeakPolarHBondContact CG1-O 3.45Å; V630-E638 PolarHBondContact N-O 3.37Å; V630-E638 PolarHBondContact O-N 2.9Å; R632-E638 IonicContact CZ-OE2 3.03Å; R632-E638 IonicContact NE-OE2 3.99Å; R632-E638 PolarHBondContact NE-OE2 2.85Å; R632-E638 IonicContact NH2-OE1 2.61Å; R632-E638 IonicContact NH2-OE2 2.92Å; R632-E638 PolarHBondContact NH2-OE2 2.95Å; K636-E638 PolarHBondContact O-N 3.02Å; E638-L640 HydrophobicContact CG-CD2 4.45Å; E638-L640 PolarHBondContact O-N 3.39Å; E638-N664 PolarHBondContact OE1-ND2 3.07Å
639	T	65	Low	62.2	Low	65 Å²	65	58.6 Å²	58.6	40%	0.399	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	101.4	176.3	-60	0	0	0	0	109.1	K627 V628 I641	K627-T639 HydrophobicContact CD-CG2 4.49Å; K627-T639 WeakPolarHBondContact CE-OG1 3.26Å; K627-T639 HydrophobicContact CG-CG2 4Å; K627-T639 PolarHBondContact NZ-OG1 2.75Å; V628-T639 CarbonylContact O-C 3.57Å; T639-I641 VanDerWaalsContact C-N 3.31Å; T639-I641 WeakPolarHBondContact CG2-O 3.32Å
640	L	59.7	Low	62.1	Low	2 Å²	2	59.1 Å²	59.1	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	-32.3	175.9	-62.9	-169.5	0	0	0	112.4	F517 V628 V630 E638 L662 K663 N664 F665	F517-L640 HydrophobicContact CE1-CD1 3.93Å; V628-L640 PolarHBondContact O-N 3.4Å; V630-L640 HydrophobicContact CB-CD1 4.29Å; V630-L640 HydrophobicContact CB-CG 4.28Å; V630-L640 HydrophobicContact CG2-CD1 3.44Å; V630-L640 VanDerWaalsContact CG2-CD1 3.44Å; V630-L640 HydrophobicContact CG2-CG 3.94Å; E638-L640 HydrophobicContact CG-CD2 4.45Å; E638-L640 PolarHBondContact O-N 3.39Å; L640-L662 HydrophobicContact CB-CB 4.4Å; L640-L662 HydrophobicContact CB-CD2 4.47Å; L640-L662 HydrophobicContact CD1-CB 4.16Å; L640-L662 HydrophobicContact CD1-CD1 3.95Å; L640-L662 HydrophobicContact CD1-CG 4.5Å; L640-K663 WeakPolarHBondContact O-CB 3.48Å; L640-K663 PolarHBondContact O-N 3.06Å; L640-N664 HydrophobicContact CD2-CB 4.13Å; L640-F665 HydrophobicContact CD1-CD2 4.32Å; L640-F665 HydrophobicContact CD1-CE2 4.06Å; L640-F665 HydrophobicContact CD2-CE2 4.03Å
641	I	62.9	Low	62.3	Low	9 Å²	9	59.1 Å²	59.1	5%	0.046	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	153.1	179.9	-137.3	180	0	0	0	113.2	K627 V628 T639 Q643 V660 G661 L662	K627-I641 CarbonylContact C-O 3.6Å; K627-I641 VanDerWaalsContact CA-O 3.32Å; K627-I641 WeakPolarHBondContact CA-O 3.4Å; V628-I641 HydrophobicContact CB-CG2 3.81Å; V628-I641 HydrophobicContact CG2-CG2 3.73Å; V628-I641 PolarHBondContact N-O 3.36Å; V628-I641 PolarHBondContact O-N 3.49Å; T639-I641 VanDerWaalsContact C-N 3.31Å; T639-I641 WeakPolarHBondContact CG2-O 3.32Å; I641-Q643 VanDerWaalsContact CD1-CD 3.47Å; I641-Q643 HydrophobicContact CD1-CG 3.92Å; I641-Q643 HydrophobicContact CG1-CG 4.05Å; I641-V660 HydrophobicContact CD1-CG1 3.38Å; I641-V660 HydrophobicContact CG2-CG1 4.3Å; I641-G661 WeakPolarHBondContact CD1-O 3.43Å; I641-L662 HydrophobicContact CB-CD2 4.4Å; I641-L662 HydrophobicContact CG2-CD2 4.23Å
642	Q	61.4	Low	62.6	Low	33 Å²	33	57 Å²	57	15%	0.154	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	122.7	162.1	-171.3	164.7	-25.8	0	0	108.4	P552 L553 T625 I626 K627	P552-Q642 WeakPolarHBondContact CA-O 3.48Å; L553-Q642 HydrophobicContact CB-CG 4.44Å; L553-Q642 VanDerWaalsContact O-CD 3.3Å; L553-Q642 PolarHBondContact O-NE2 3.26Å; T625-Q642 HydrophobicContact CG2-CG 4.33Å; I626-Q642 CarbonylContact O-C 3.56Å; I626-Q642 VanDerWaalsContact O-CA 3.26Å; I626-Q642 WeakPolarHBondContact O-CA 3.5Å; K627-Q642 HydrophobicContact CB-CB 4.4Å; K627-Q642 HydrophobicContact CB-CG 4.1Å; K627-Q642 HydrophobicContact CG-CB 4.23Å; K627-Q642 HydrophobicContact CG-CG 4.24Å
643	Q	63.2	Low	62.9	Low	3 Å²	3	52.3 Å²	52.3	1%	0.014	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	156.8	-176.1	-65.8	-174.5	-9.4	0	0	110.2	S164 T550 T625 I626 I641	S164-Q643 PolarHBondContact O-NE2 3.4Å; T550-Q643 VanDerWaalsContact CB-NE2 3.27Å; T550-Q643 HydrophobicContact CG2-CG 4.11Å; T625-Q643 CarbonylContact C-O 3.56Å; T625-Q643 VanDerWaalsContact CA-O 3.25Å; T625-Q643 WeakPolarHBondContact CA-O 3.46Å; T625-Q643 WeakPolarHBondContact CG2-O 3.39Å; I626-Q643 PolarHBondContact N-O 3.19Å; I626-Q643 PolarHBondContact O-N 3.1Å; I641-Q643 VanDerWaalsContact CD1-CD 3.47Å; I641-Q643 HydrophobicContact CD1-CG 3.92Å; I641-Q643 HydrophobicContact CG1-CG 4.05Å
644	A	59.3	Low	63.8	Low	35 Å²	35	48.8 Å²	48.8	29%	0.289	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	141.7	-179.7	0	0	0	0	0	110.6	L553 V623 L624	L553-A644 HydrophobicContact CD1-CB 3.93Å; V623-A644 HydrophobicContact CG1-CB 3.78Å; L624-A644 CarbonylContact O-C 3.49Å; L624-A644 WeakPolarHBondContact O-CA 3.3Å
645	C	63.3	Low	64.7	Low	21 Å²	21	38.6 Å²	38.6	14%	0.142	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	142.2	179.1	61.1	0	0	0	0	111.4	M166 V623 L624	M166-C645 HydrophobicContact CE-CB 3.64Å; M166-C645 HydrophobicContact SD-CB 4.23Å; V623-C645 CarbonylContact C-O 3.57Å; V623-C645 WeakPolarHBondContact CA-O 3.29Å; V623-C645 WeakPolarHBondContact CG1-O 3.43Å; L624-C645 PolarHBondContact N-O 2.82Å; L624-C645 PolarHBondContact O-N 3.39Å; L624-C645 PolarHBondContact O-SG 3.49Å; L624-C645 VanDerWaalsContact O-SG 3.37Å
646	D	65.7	Low	65.7	Low	18 Å²	18	37 Å²	37	10%	0.096	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	130.4	-177.5	-156.8	-55.2	0	0	0	111.5	R199 I531 Y532 L648	R199-D646 IonicContact CZ-OD1 3.42Å; R199-D646 IonicContact CZ-OD2 3.67Å; R199-D646 IonicContact NH1-OD2 2.63Å; R199-D646 PolarHBondContact NH1-OD2 3.19Å; R199-D646 VanDerWaalsContact NH2-CG 3.27Å; R199-D646 IonicContact NH2-OD1 2.82Å; R199-D646 PolarHBondContact NH2-OD1 3.44Å; R199-D646 IonicContact NH2-OD2 2.82Å; R199-D646 PolarHBondContact NH2-OD2 3.42Å; I531-D646 HydrophobicContact CG2-CB 4.06Å; Y532-D646 VanDerWaalsContact CE2-OD2 3.3Å; Y532-D646 WeakPolarHBondContact CE2-OD2 3.46Å; Y532-D646 WeakPolarHBondContact OH-CB 3.42Å; Y532-D646 PolarHBondContact OH-OD1 3.02Å; Y532-D646 PolarHBondContact OH-OD2 3.42Å; D646-L648 VanDerWaalsContact C-N 3.35Å; D646-L648 WeakPolarHBondContact OD1-CB 3.05Å; D646-L648 VanDerWaalsContact OD1-CG 3.29Å; D646-L648 WeakPolarHBondContact OD1-CG 3.41Å; D646-L648 PolarHBondContact OD1-N 2.81Å; D646-L648 VanDerWaalsContact OD1-N 3.09Å
647	I	69.6	Low	66.4	Low	6 Å²	6	28.1 Å²	28.1	3%	0.031	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-78.4	-24.3	-169.9	-57.7	-178.6	0	0	0	111.2	L498 Y523 F616 D622 L624 K649 L650	L498-I647 HydrophobicContact CD1-CG2 3.35Å; Y523-I647 HydrophobicContact CD2-CD1 3.54Å; Y523-I647 HydrophobicContact CE2-CD1 3.17Å; F616-I647 HydrophobicContact CE2-CD1 4.24Å; D622-I647 HydrophobicContact CB-CD1 4Å; L624-I647 HydrophobicContact CB-CD1 3.82Å; L624-I647 HydrophobicContact CB-CG1 3.83Å; I647-K649 PolarHBondContact O-N 2.78Å; I647-L650 PolarHBondContact O-N 3.17Å
648	L	67.8	Low	67	Low	4 Å²	4	24.2 Å²	24.2	2%	0.021	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-56.4	-25.7	-179.6	-64	176.2	0	0	0	113.4	R199 I202 F203 Q206 Y532 D646	R199-L648 HydrophobicContact CG-CD1 3.9Å; I202-L648 HydrophobicContact CG2-CD1 4.08Å; F203-L648 HydrophobicContact CB-CD2 4.08Å; F203-L648 HydrophobicContact CD2-CD2 3.46Å; F203-L648 VanDerWaalsContact CD2-CD2 3.46Å; F203-L648 HydrophobicContact CE2-CD2 4.29Å; F203-L648 HydrophobicContact CG-CD2 4.23Å; Q206-L648 VanDerWaalsContact CG-O 3.28Å; Q206-L648 WeakPolarHBondContact CG-O 3.16Å; Y532-L648 HydrophobicContact CE2-CD1 4.18Å; D646-L648 VanDerWaalsContact C-N 3.35Å; D646-L648 WeakPolarHBondContact OD1-CB 3.05Å; D646-L648 VanDerWaalsContact OD1-CG 3.29Å; D646-L648 WeakPolarHBondContact OD1-CG 3.41Å; D646-L648 PolarHBondContact OD1-N 2.81Å; D646-L648 VanDerWaalsContact OD1-N 3.09Å
649	K	67.7	Low	67.4	Low	95 Å²	95	21.4 Å²	21.4	41%	0.413	11%	0.113	S	C	.	.	G	3₁₀ helix	trans	-89.1	-8.1	178.4	-71.3	-158.8	165	-143.4	0	115	P545 I647	P545-K649 VanDerWaalsContact CD-NZ 3.33Å; P545-K649 HydrophobicContact CG-CD 4.16Å; I647-K649 PolarHBondContact O-N 2.78Å
650	L	66	Low	67.7	Low	14 Å²	14	18.3 Å²	18.3	7%	0.073	9%	0.094	C	C	.	.	S	Bend	trans	-102.1	-1.8	-177.3	-54.9	175	0	0	0	112.3	V168 I647 T652 H656 I658 L674	V168-L650 HydrophobicContact CG1-CD2 4.35Å; I647-L650 PolarHBondContact O-N 3.17Å; L650-T652 VanDerWaalsContact C-N 3.35Å; L650-T652 PolarHBondContact O-N 2.98Å; L650-T652 VanDerWaalsContact O-N 3.13Å; L650-H656 HydrophobicContact CD2-CB 4.41Å; L650-H656 PolarHBondContact O-CE1 3.36Å; L650-H656 PolarHBondContact O-ND1 3.05Å; L650-I658 HydrophobicContact CD1-CD1 4.15Å; L650-L674 HydrophobicContact CB-CD2 3.88Å; L650-L674 HydrophobicContact CD1-CD2 3.59Å; L650-L674 HydrophobicContact CG-CD2 4.36Å
651	I	72.9	Confident	68	Low	2 Å²	2	18.9 Å²	18.9	1%	0.01	10%	0.1	C	C	.	.			trans	-81.2	79.4	174.5	-58.4	172.6	0	0	0	108.4	F203 I207 P618 W676	F203-I651 HydrophobicContact CD2-CD1 4.19Å; F203-I651 HydrophobicContact CE2-CD1 3.96Å; I207-I651 HydrophobicContact CG1-CG2 4.42Å; P618-I651 HydrophobicContact CB-CD1 4.49Å; I651-W676 HydrophobicContact CG2-CD2 3.72Å; I651-W676 HydrophobicContact CG2-CE3 3.89Å; I651-W676 HydrophobicContact CG2-CG 4.35Å; I651-W676 HydrophobicContact CG2-CH2 3.82Å; I651-W676 HydrophobicContact CG2-CZ2 3.66Å; I651-W676 HydrophobicContact CG2-CZ3 3.94Å
652	T	70.6	Confident	68.1	Low	19 Å²	19	18.7 Å²	18.7	12%	0.117	10%	0.099	C	C	.	.	S	Bend	trans	-135.6	165	173.9	67.6	0	0	0	0	109.8	E213 L650 K654 H656	E213-T652 WeakPolarHBondContact OE2-CA 3.35Å; E213-T652 WeakPolarHBondContact OE2-CB 3.36Å; L650-T652 VanDerWaalsContact C-N 3.35Å; L650-T652 PolarHBondContact O-N 2.98Å; L650-T652 VanDerWaalsContact O-N 3.13Å; T652-K654 VanDerWaalsContact C-N 3.32Å; T652-K654 PolarHBondContact O-N 3.46Å; T652-K654 PolarHBondContact OG1-N 3.17Å; T652-K654 PolarHBondContact OG1-O 3.35Å; T652-H656 PolarHBondContact OG1-CE1 3.29Å
653	F	68.8	Low	67.9	Low	26 Å²	26	24.1 Å²	24.1	11%	0.114	12%	0.122	C	C	.	.	S	Bend	trans	-57.6	-42.4	171.8	170.2	-99.6	0	0	0	112.6	A175 M178 E213 H214 W217	A175-F653 HydrophobicContact CB-CZ 4.15Å; M178-F653 WeakPolarHBondContact CE-O 3.43Å; M178-F653 HydrophobicContact SD-CE2 4.47Å; M178-F653 HydrophobicContact SD-CZ 4.37Å; E213-F653 HydrophobicContact CB-CB 3.62Å; E213-F653 PolarHBondContact OE2-N 2.96Å; H214-F653 AromaticContact CE1-CD2 3.7Å; H214-F653 AromaticContact CG-CD2 3.81Å; H214-F653 AromaticContact ND1-CD2 3.55Å; W217-F653 HydrophobicContact CB-CD2 4.26Å; W217-F653 HydrophobicContact CB-CE1 4.35Å; W217-F653 HydrophobicContact CB-CE2 3.88Å; W217-F653 HydrophobicContact CB-CZ 3.94Å; W217-F653 AromaticContact CD1-CE1 3.71Å; W217-F653 AromaticContact CD1-CZ 3.48Å; W217-F653 VanDerWaalsContact CD1-CZ 3.48Å; W217-F653 HydrophobicContact CD2-CE1 4.35Å; W217-F653 AromaticContact CD2-CE2 3.6Å; W217-F653 HydrophobicContact CD2-CE2 3.6Å; W217-F653 AromaticContact CD2-CZ 3.37Å; W217-F653 HydrophobicContact CD2-CZ 3.37Å; W217-F653 AromaticContact CE2-CZ 3.7Å; W217-F653 AromaticContact CE3-CE2 3.79Å; W217-F653 HydrophobicContact CE3-CE2 3.79Å; W217-F653 AromaticContact CE3-CZ 4Å; W217-F653 HydrophobicContact CE3-CZ 4Å; W217-F653 HydrophobicContact CG-CD2 4.42Å; W217-F653 AromaticContact CG-CE1 3.86Å; W217-F653 HydrophobicContact CG-CE1 3.86Å; W217-F653 AromaticContact CG-CE2 3.61Å; W217-F653 HydrophobicContact CG-CE2 3.61Å; W217-F653 AromaticContact CG-CZ 3.28Å; W217-F653 HydrophobicContact CG-CZ 3.28Å; W217-F653 AromaticContact NE1-CZ 3.69Å
654	K	71.4	Confident	67.4	Low	74 Å²	74	28 Å²	28	32%	0.322	14%	0.143	S	C	.	.	S	Bend	trans	-72.5	144.4	-177.3	-65.1	-160.6	175.6	-145	0	112.3	Q170 D172 T652	Q170-K654 HydrophobicContact CB-CB 4.15Å; Q170-K654 HydrophobicContact CB-CD 4.03Å; Q170-K654 HydrophobicContact CG-CB 4.12Å; Q170-K654 HydrophobicContact CG-CD 4.47Å; D172-K654 WeakPolarHBondContact OD1-CD 3.46Å; D172-K654 VanDerWaalsContact OD1-CE 3.28Å; D172-K654 WeakPolarHBondContact OD1-CE 3.4Å; D172-K654 IonicContact OD1-NZ 2.7Å; D172-K654 PolarHBondContact OD1-NZ 3.01Å; D172-K654 IonicContact OD2-NZ 3.67Å; T652-K654 VanDerWaalsContact C-N 3.32Å; T652-K654 PolarHBondContact O-N 3.46Å; T652-K654 PolarHBondContact OG1-N 3.17Å; T652-K654 PolarHBondContact OG1-O 3.35Å
655	G	69.8	Low	67	Low	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	146.9	173.3	0	0	0	0	0	110.3	Q170 V171 M178	Q170-G655 CarbonylContact C-O 3.56Å; Q170-G655 WeakPolarHBondContact CA-O 3.27Å; V171-G655 PolarHBondContact N-O 2.78Å; V171-G655 PolarHBondContact O-N 3.36Å; M178-G655 VanDerWaalsContact CE-N 3.35Å
656	H	74.2	Confident	66.6	Low	9 Å²	9	32.2 Å²	32.2	4%	0.042	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	109.3	-179.3	-70.3	103.9	0	0	0	110.7	V168 R169 L650 T652 I658 I673 L674	V168-H656 HydrophobicContact CG1-CB 4.15Å; R169-H656 CarbonylContact O-C 3.6Å; R169-H656 WeakPolarHBondContact O-CA 3.41Å; L650-H656 HydrophobicContact CD2-CB 4.41Å; L650-H656 PolarHBondContact O-CE1 3.36Å; L650-H656 PolarHBondContact O-ND1 3.05Å; T652-H656 PolarHBondContact OG1-CE1 3.29Å; H656-I658 HydrophobicContact CB-CG1 4.37Å; H656-I673 CarbonylContact O-C 3.56Å; H656-I673 VanDerWaalsContact O-CA 3.3Å; H656-I673 WeakPolarHBondContact O-CA 3.32Å; H656-L674 HydrophobicContact CB-CB 4.49Å; H656-L674 PolarHBondContact N-O 2.63Å; H656-L674 PolarHBondContact O-N 3.41Å
657	H	71.9	Confident	66.4	Low	12 Å²	12	35.6 Å²	35.6	6%	0.056	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	120.7	165.2	171.4	-135.6	0	0	0	109.3	V168 R169 V171 I503 L602 S659 H671	V168-H657 WeakPolarHBondContact CA-O 3.38Å; R169-H657 PolarHBondContact N-O 3.01Å; R169-H657 PolarHBondContact O-N 3.12Å; V171-H657 HydrophobicContact CG2-CB 3.43Å; V171-H657 VanDerWaalsContact CG2-CB 3.43Å; I503-H657 VanDerWaalsContact CD1-CD2 3.49Å; I503-H657 WeakPolarHBondContact CD1-CD2 3.23Å; I503-H657 WeakPolarHBondContact CD1-NE2 3.32Å; L602-H657 WeakPolarHBondContact CD1-CE1 3.5Å; H657-S659 PolarHBondContact CE1-OG 2.92Å; H657-H671 AromaticContact CE1-CE1 3.84Å; H657-H671 AromaticContact CE1-ND1 3.41Å; H657-H671 PolarHBondContact CE1-ND1 2.99Å; H657-H671 WeakPolarHBondContact NE2-CB 3.5Å; H657-H671 AromaticContact NE2-CD2 3.93Å; H657-H671 AromaticContact NE2-CE1 3.66Å; H657-H671 AromaticContact NE2-CG 2.75Å; H657-H671 AromaticContact NE2-ND1 2.53Å; H657-H671 PolarHBondContact NE2-ND1 3.23Å
658	I	73.6	Confident	66.2	Low	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	120.4	-177.2	-57.2	-175.5	0	0	0	108.4	M166 V168 L650 H656 V660 H671 F672	M166-I658 HydrophobicContact CE-CD1 4.11Å; M166-I658 HydrophobicContact CE-CG2 3.58Å; M166-I658 HydrophobicContact CG-CG2 3.87Å; M166-I658 HydrophobicContact SD-CG2 3.98Å; V168-I658 HydrophobicContact CG1-CG1 4.21Å; V168-I658 HydrophobicContact CG2-CD1 4.41Å; V168-I658 HydrophobicContact CG2-CG1 4.12Å; V168-I658 HydrophobicContact CG2-CG2 4.43Å; L650-I658 HydrophobicContact CD1-CD1 4.15Å; H656-I658 HydrophobicContact CB-CG1 4.37Å; I658-V660 HydrophobicContact CG2-CG2 4.1Å; I658-H671 WeakPolarHBondContact O-CA 3.14Å; I658-F672 HydrophobicContact CB-CD1 4.12Å; I658-F672 HydrophobicContact CB-CD2 4.42Å; I658-F672 HydrophobicContact CB-CE1 3.6Å; I658-F672 HydrophobicContact CB-CE2 3.98Å; I658-F672 HydrophobicContact CB-CZ 3.55Å; I658-F672 HydrophobicContact CD1-CE2 3.77Å; I658-F672 HydrophobicContact CD1-CZ 3.75Å; I658-F672 HydrophobicContact CG1-CE2 4.24Å; I658-F672 HydrophobicContact CG1-CZ 4.14Å; I658-F672 HydrophobicContact CG2-CD1 4.37Å; I658-F672 HydrophobicContact CG2-CE1 3.47Å; I658-F672 VanDerWaalsContact CG2-CE1 3.47Å; I658-F672 HydrophobicContact CG2-CE2 4.42Å; I658-F672 HydrophobicContact CG2-CZ 3.53Å; I658-F672 PolarHBondContact N-O 3.4Å; I658-F672 PolarHBondContact O-N 2.77Å; I658-F672 VanDerWaalsContact O-N 3.08Å
659	S	69.9	Low	66.4	Low	3 Å²	3	38.3 Å²	38.3	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.3	178.7	-52.5	0	0	0	0	109.7	M166 V167 H657 F670 H671	M166-S659 CarbonylContact C-O 3.52Å; M166-S659 WeakPolarHBondContact CA-O 3.12Å; V167-S659 PolarHBondContact N-O 3.33Å; V167-S659 PolarHBondContact O-N 2.93Å; H657-S659 PolarHBondContact CE1-OG 2.92Å; S659-F670 CarbonylContact C-O 3.56Å; S659-F670 WeakPolarHBondContact CA-O 3.49Å; S659-H671 WeakPolarHBondContact CB-ND1 3.18Å; S659-H671 PolarHBondContact OG-CE1 3.25Å; S659-H671 VanDerWaalsContact OG-CE1 3.32Å; S659-H671 PolarHBondContact OG-ND1 3.3Å
660	V	72.3	Confident	66.7	Low	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	112	-174.2	178.1	0	0	0	0	109.9	M166 I626 I641 I658 Q669 F670 F672	M166-V660 HydrophobicContact CB-CG2 4.4Å; M166-V660 HydrophobicContact CG-CG2 4.1Å; M166-V660 HydrophobicContact SD-CG2 4.34Å; I626-V660 HydrophobicContact CD1-CG2 3.88Å; I641-V660 HydrophobicContact CD1-CG1 3.38Å; I641-V660 HydrophobicContact CG2-CG1 4.3Å; I658-V660 HydrophobicContact CG2-CG2 4.1Å; V660-Q669 WeakPolarHBondContact O-CA 3.39Å; V660-F670 PolarHBondContact N-O 2.85Å; V660-F670 PolarHBondContact O-N 3.35Å; V660-F672 HydrophobicContact CG2-CE1 4.37Å
661	G	66.9	Low	67.3	Low	14 Å²	14	33.1 Å²	33.1	14%	0.144	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	131.7	179.1	0	0	0	0	0	113.1	S164 N165 I641 L668	S164-G661 WeakPolarHBondContact CB-O 3.47Å; N165-G661 PolarHBondContact O-N 2.75Å; I641-G661 WeakPolarHBondContact CD1-O 3.43Å; G661-L668 WeakPolarHBondContact CA-O 3.46Å
662	L	64.7	Low	67.6	Low	5 Å²	5	33 Å²	33	3%	0.026	17%	0.168	C	C	.	.			trans	-91	127	-172.6	-59.2	177.9	0	0	0	112	F517 V628 L640 I641 N664 F665 L668 F670	F517-L662 HydrophobicContact CE1-CD1 3.97Å; V628-L662 HydrophobicContact CB-CD2 3.93Å; V628-L662 HydrophobicContact CG1-CD1 4.49Å; V628-L662 HydrophobicContact CG1-CD2 3.91Å; V628-L662 HydrophobicContact CG2-CD2 3.98Å; L640-L662 HydrophobicContact CB-CB 4.4Å; L640-L662 HydrophobicContact CB-CD2 4.47Å; L640-L662 HydrophobicContact CD1-CB 4.16Å; L640-L662 HydrophobicContact CD1-CD1 3.95Å; L640-L662 HydrophobicContact CD1-CG 4.5Å; I641-L662 HydrophobicContact CB-CD2 4.4Å; I641-L662 HydrophobicContact CG2-CD2 4.23Å; L662-N664 PolarHBondContact O-N 3.47Å; L662-F665 PolarHBondContact O-N 3.12Å; L662-F665 VanDerWaalsContact O-N 3.1Å; L662-F665 VanDerWaalsContact O-O 3.14Å; L662-L668 HydrophobicContact CB-CB 4.33Å; L662-L668 HydrophobicContact CD1-CB 4.11Å; L662-L668 HydrophobicContact CG-CB 4.47Å; L662-L668 PolarHBondContact N-O 3.48Å; L662-F670 HydrophobicContact CD2-CB 4.37Å
663	K	56.7	Low	67.9	Low	146 Å²	146	32.4 Å²	32.4	64%	0.635	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-10.6	-157.8	-156.2	178.8	177.6	-175.3	0	117	L640	L640-K663 WeakPolarHBondContact O-CB 3.48Å; L640-K663 PolarHBondContact O-N 3.06Å
664	N	53.3	Low	68.4	Low	86 Å²	86	31.3 Å²	31.3	46%	0.46	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-2	-179.4	-65.3	3.7	0	0	0	114.1	E638 L640 L662	E638-N664 PolarHBondContact OE1-ND2 3.07Å; L640-N664 HydrophobicContact CD2-CB 4.13Å; L662-N664 PolarHBondContact O-N 3.47Å
665	F	50.3	Low	68.7	Low	45 Å²	45	28.3 Å²	28.3	20%	0.197	15%	0.146	C	C	.	.			trans	-139.6	111.2	-177.6	-55.1	-95.3	0	0	0	108.9	L512 L640 L662 D667 L668	L512-F665 HydrophobicContact CD2-CE1 3.95Å; L512-F665 HydrophobicContact CD2-CE2 4.34Å; L512-F665 HydrophobicContact CD2-CZ 3.83Å; L640-F665 HydrophobicContact CD1-CD2 4.32Å; L640-F665 HydrophobicContact CD1-CE2 4.06Å; L640-F665 HydrophobicContact CD2-CE2 4.03Å; L662-F665 PolarHBondContact O-N 3.12Å; L662-F665 VanDerWaalsContact O-N 3.1Å; L662-F665 VanDerWaalsContact O-O 3.14Å; F665-D667 PolarHBondContact O-N 3.04Å; F665-L668 HydrophobicContact CB-CB 3.9Å; F665-L668 HydrophobicContact CB-CD1 3.41Å; F665-L668 VanDerWaalsContact CB-CD1 3.41Å; F665-L668 HydrophobicContact CB-CG 3.49Å; F665-L668 VanDerWaalsContact CB-CG 3.49Å; F665-L668 HydrophobicContact CD1-CD1 3.87Å; F665-L668 HydrophobicContact CD2-CD1 3.54Å; F665-L668 HydrophobicContact CE1-CD1 4.47Å; F665-L668 HydrophobicContact CE2-CD1 4.18Å; F665-L668 HydrophobicContact CG-CD1 3.35Å; F665-L668 HydrophobicContact CG-CG 4.02Å; F665-L668 PolarHBondContact O-N 3.23Å
666	T	54.4	Low	69.3	Low	98 Å²	98	28.4 Å²	28.4	60%	0.601	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	-30.6	-176.6	47.1	0	0	0	0	113.6
667	D	62.7	Low	69.6	Low	90 Å²	90	28 Å²	28	48%	0.481	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-10.5	-169.3	-59.4	5.4	0	0	0	112.8	G507 F665	G507-D667 VanDerWaalsContact CA-O 3.28Å; G507-D667 WeakPolarHBondContact CA-O 3.28Å; F665-D667 PolarHBondContact O-N 3.04Å
668	L	63.9	Low	70	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.01	14%	0.142	C	C	.	.			trans	-94.7	127.4	-172.1	-60.3	-178.8	0	0	0	113.5	V505 S506 L512 G661 L662 F665	V505-L668 HydrophobicContact CG1-CD2 4.34Å; S506-L668 WeakPolarHBondContact O-CA 3.48Å; L512-L668 HydrophobicContact CD1-CD1 3.48Å; L512-L668 VanDerWaalsContact CD1-CD1 3.48Å; L512-L668 HydrophobicContact CD1-CD2 3.6Å; L512-L668 HydrophobicContact CD1-CG 4.18Å; L512-L668 HydrophobicContact CD2-CD1 3.79Å; L512-L668 HydrophobicContact CG-CD1 3.93Å; G661-L668 WeakPolarHBondContact CA-O 3.46Å; L662-L668 HydrophobicContact CB-CB 4.33Å; L662-L668 HydrophobicContact CD1-CB 4.11Å; L662-L668 HydrophobicContact CG-CB 4.47Å; L662-L668 PolarHBondContact N-O 3.48Å; F665-L668 HydrophobicContact CB-CB 3.9Å; F665-L668 HydrophobicContact CB-CD1 3.41Å; F665-L668 VanDerWaalsContact CB-CD1 3.41Å; F665-L668 HydrophobicContact CB-CG 3.49Å; F665-L668 VanDerWaalsContact CB-CG 3.49Å; F665-L668 HydrophobicContact CD1-CD1 3.87Å; F665-L668 HydrophobicContact CD2-CD1 3.54Å; F665-L668 HydrophobicContact CE1-CD1 4.47Å; F665-L668 HydrophobicContact CE2-CD1 4.18Å; F665-L668 HydrophobicContact CG-CD1 3.35Å; F665-L668 HydrophobicContact CG-CG 4.02Å; F665-L668 PolarHBondContact O-N 3.23Å
669	Q	72.4	Confident	69.9	Low	65 Å²	65	28.1 Å²	28.1	30%	0.304	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	132.9	175.2	-64	179.1	30.7	0	0	110.3	V505 S506 V660 H671	V505-Q669 CarbonylContact C-O 3.6Å; V505-Q669 WeakPolarHBondContact CA-O 3.44Å; S506-Q669 PolarHBondContact N-O 3.36Å; S506-Q669 PolarHBondContact O-N 3.44Å; V660-Q669 WeakPolarHBondContact O-CA 3.39Å; Q669-H671 WeakPolarHBondContact CB-NE2 3.32Å; Q669-H671 PolarHBondContact O-CD2 3Å; Q669-H671 VanDerWaalsContact O-CD2 3.29Å; Q669-H671 PolarHBondContact O-NE2 3.18Å
670	F	75	Confident	69.7	Low	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	133.7	168.7	174	-115.4	0	0	0	110.4	V502 G504 V505 I519 W609 V628 S659 V660 L662 F672	V502-F670 HydrophobicContact CG1-CE2 3.61Å; V502-F670 HydrophobicContact CG1-CZ 3.95Å; V502-F670 HydrophobicContact CG2-CE2 4.34Å; V502-F670 HydrophobicContact CG2-CZ 3.81Å; G504-F670 WeakPolarHBondContact O-CD2 3.32Å; V505-F670 HydrophobicContact CG2-CB 4.34Å; V505-F670 HydrophobicContact CG2-CD2 3.95Å; I519-F670 HydrophobicContact CD1-CD1 4.06Å; I519-F670 HydrophobicContact CD1-CD2 3.26Å; I519-F670 HydrophobicContact CD1-CE1 3.94Å; I519-F670 HydrophobicContact CD1-CE2 3.13Å; I519-F670 HydrophobicContact CD1-CG 3.73Å; I519-F670 HydrophobicContact CD1-CZ 3.49Å; I519-F670 VanDerWaalsContact CD1-CZ 3.49Å; I519-F670 HydrophobicContact CG2-CE1 4.02Å; I519-F670 HydrophobicContact CG2-CZ 4.07Å; W609-F670 HydrophobicContact CH2-CD2 4.5Å; W609-F670 HydrophobicContact CH2-CE2 4.34Å; V628-F670 HydrophobicContact CG2-CD1 4.49Å; S659-F670 CarbonylContact C-O 3.56Å; S659-F670 WeakPolarHBondContact CA-O 3.49Å; V660-F670 PolarHBondContact N-O 2.85Å; V660-F670 PolarHBondContact O-N 3.35Å; L662-F670 HydrophobicContact CD2-CB 4.37Å; F670-F672 HydrophobicContact CD1-CD1 4.02Å; F670-F672 HydrophobicContact CE1-CB 4.35Å; F670-F672 AromaticContact CE1-CD1 3.53Å; F670-F672 HydrophobicContact CE1-CD1 3.53Å; F670-F672 HydrophobicContact CE1-CE1 4.22Å; F670-F672 HydrophobicContact CE1-CG 4.26Å; F670-F672 HydrophobicContact CZ-CB 4.27Å; F670-F672 HydrophobicContact CZ-CD1 4.28Å
671	H	77.2	Confident	68.9	Low	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.4	-173.1	-59	-79.1	0	0	0	112.1	I503 G504 S506 H657 I658 S659 Q669	I503-H671 HydrophobicContact CB-CB 3.95Å; I503-H671 HydrophobicContact CD1-CB 4.24Å; I503-H671 PolarHBondContact N-O 2.84Å; G504-H671 PolarHBondContact N-O 3.39Å; G504-H671 PolarHBondContact O-N 3.15Å; S506-H671 WeakPolarHBondContact CB-NE2 3.29Å; S506-H671 PolarHBondContact OG-NE2 2.94Å; H657-H671 AromaticContact CE1-CE1 3.84Å; H657-H671 AromaticContact CE1-ND1 3.41Å; H657-H671 PolarHBondContact CE1-ND1 2.99Å; H657-H671 WeakPolarHBondContact NE2-CB 3.5Å; H657-H671 AromaticContact NE2-CD2 3.93Å; H657-H671 AromaticContact NE2-CE1 3.66Å; H657-H671 AromaticContact NE2-CG 2.75Å; H657-H671 AromaticContact NE2-ND1 2.53Å; H657-H671 PolarHBondContact NE2-ND1 3.23Å; I658-H671 WeakPolarHBondContact O-CA 3.14Å; S659-H671 WeakPolarHBondContact CB-ND1 3.18Å; S659-H671 PolarHBondContact OG-CE1 3.25Å; S659-H671 VanDerWaalsContact OG-CE1 3.32Å; S659-H671 PolarHBondContact OG-ND1 3.3Å; Q669-H671 WeakPolarHBondContact CB-NE2 3.32Å; Q669-H671 PolarHBondContact O-CD2 3Å; Q669-H671 VanDerWaalsContact O-CD2 3.29Å; Q669-H671 PolarHBondContact O-NE2 3.18Å
672	F	78.9	Confident	68.2	Low	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	161.1	171.7	66.7	-79.9	0	0	0	110.8	C500 E501 V502 L624 I626 I658 V660 F670	C500-F672 WeakPolarHBondContact SG-CD2 3.46Å; E501-F672 CarbonylContact O-C 3.53Å; E501-F672 VanDerWaalsContact O-CA 3.32Å; E501-F672 WeakPolarHBondContact O-CA 3.45Å; V502-F672 HydrophobicContact CG2-CB 4.26Å; L624-F672 HydrophobicContact CD2-CE2 4.19Å; L624-F672 HydrophobicContact CD2-CZ 4.35Å; I626-F672 HydrophobicContact CD1-CE1 3.63Å; I626-F672 HydrophobicContact CD1-CZ 3.65Å; I626-F672 HydrophobicContact CG1-CZ 4.47Å; I658-F672 HydrophobicContact CB-CD1 4.12Å; I658-F672 HydrophobicContact CB-CD2 4.42Å; I658-F672 HydrophobicContact CB-CE1 3.6Å; I658-F672 HydrophobicContact CB-CE2 3.98Å; I658-F672 HydrophobicContact CB-CZ 3.55Å; I658-F672 HydrophobicContact CD1-CE2 3.77Å; I658-F672 HydrophobicContact CD1-CZ 3.75Å; I658-F672 HydrophobicContact CG1-CE2 4.24Å; I658-F672 HydrophobicContact CG1-CZ 4.14Å; I658-F672 HydrophobicContact CG2-CD1 4.37Å; I658-F672 HydrophobicContact CG2-CE1 3.47Å; I658-F672 VanDerWaalsContact CG2-CE1 3.47Å; I658-F672 HydrophobicContact CG2-CE2 4.42Å; I658-F672 HydrophobicContact CG2-CZ 3.53Å; I658-F672 PolarHBondContact N-O 3.4Å; I658-F672 PolarHBondContact O-N 2.77Å; I658-F672 VanDerWaalsContact O-N 3.08Å; V660-F672 HydrophobicContact CG2-CE1 4.37Å; F670-F672 HydrophobicContact CD1-CD1 4.02Å; F670-F672 HydrophobicContact CE1-CB 4.35Å; F670-F672 AromaticContact CE1-CD1 3.53Å; F670-F672 HydrophobicContact CE1-CD1 3.53Å; F670-F672 HydrophobicContact CE1-CE1 4.22Å; F670-F672 HydrophobicContact CE1-CG 4.26Å; F670-F672 HydrophobicContact CZ-CB 4.27Å; F670-F672 HydrophobicContact CZ-CD1 4.28Å
673	I	77.9	Confident	67.6	Low	6 Å²	6	37.6 Å²	37.6	3%	0.031	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.6	175.7	-50.3	-179	0	0	0	108.6	C500 E501 I503 Y596 H656 K675	C500-I673 WeakPolarHBondContact CA-O 3.27Å; E501-I673 PolarHBondContact N-O 3.06Å; E501-I673 PolarHBondContact O-N 2.91Å; I503-I673 HydrophobicContact CD1-CD1 3.94Å; I503-I673 HydrophobicContact CD1-CG1 3.63Å; I503-I673 HydrophobicContact CG1-CD1 4.17Å; I503-I673 HydrophobicContact CG1-CG1 3.85Å; Y596-I673 HydrophobicContact CD1-CD1 3.84Å; Y596-I673 HydrophobicContact CE1-CD1 4.25Å; Y596-I673 HydrophobicContact CG-CD1 4.12Å; H656-I673 CarbonylContact O-C 3.56Å; H656-I673 VanDerWaalsContact O-CA 3.3Å; H656-I673 WeakPolarHBondContact O-CA 3.32Å; I673-K675 HydrophobicContact CG2-CG 4.04Å
674	L	78.8	Confident	67.3	Low	2 Å²	2	33.9 Å²	33.9	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.3	168	-163.4	72	0	0	0	109.7	L498 I499 C500 F616 L650 H656	L498-L674 HydrophobicContact CB-CD1 4.23Å; L498-L674 HydrophobicContact CD2-CD2 4.09Å; L498-L674 HydrophobicContact CD2-CG 4.06Å; I499-L674 WeakPolarHBondContact O-CA 3.22Å; C500-L674 HydrophobicContact CB-CD1 3.89Å; F616-L674 HydrophobicContact CE1-CD1 4.21Å; F616-L674 HydrophobicContact CZ-CD1 3.86Å; L650-L674 HydrophobicContact CB-CD2 3.88Å; L650-L674 HydrophobicContact CD1-CD2 3.59Å; L650-L674 HydrophobicContact CG-CD2 4.36Å; H656-L674 HydrophobicContact CB-CB 4.49Å; H656-L674 PolarHBondContact N-O 2.63Å; H656-L674 PolarHBondContact O-N 3.41Å
675	K	78.3	Confident	67.1	Low	11 Å²	11	33.9 Å²	33.9	5%	0.048	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	138.3	177.3	-63.1	167.9	-178.7	163.9	0	108.9	L498 I499 E501 Y596 I673	L498-K675 CarbonylContact C-O 3.3Å; L498-K675 WeakPolarHBondContact CA-O 3.38Å; I499-K675 HydrophobicContact CB-CB 4.48Å; I499-K675 PolarHBondContact N-O 3.47Å; I499-K675 PolarHBondContact O-N 2.61Å; E501-K675 IonicContact OE2-NZ 3.96Å; E501-K675 PolarHBondContact OE2-NZ 3.22Å; Y596-K675 PolarHBondContact OH-NZ 3.36Å; I673-K675 HydrophobicContact CG2-CG 4.04Å
676	W	82.8	Confident	66.9	Low	2 Å²	2	41.5 Å²	41.5	1%	0.008	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	134.2	176.3	177.5	53.5	0	0	0	111	M178 I207 L211 H214 S495 L498 I651 P678	M178-W676 VanDerWaalsContact O-O 3.07Å; I207-W676 HydrophobicContact CG2-CH2 4.4Å; I207-W676 HydrophobicContact CG2-CZ2 4.25Å; L211-W676 HydrophobicContact CD2-CH2 4.2Å; L211-W676 HydrophobicContact CG-CH2 4.08Å; H214-W676 AromaticContact CD2-CE3 3.88Å; H214-W676 AromaticContact CD2-CZ3 3.64Å; H214-W676 AromaticContact NE2-CE3 3.64Å; H214-W676 AromaticContact NE2-CZ3 3.91Å; S495-W676 WeakPolarHBondContact O-CZ2 3.12Å; S495-W676 PolarHBondContact O-NE1 3.05Å; L498-W676 HydrophobicContact CD2-CB 3.71Å; L498-W676 HydrophobicContact CD2-CG 4.19Å; I651-W676 HydrophobicContact CG2-CD2 3.72Å; I651-W676 HydrophobicContact CG2-CE3 3.89Å; I651-W676 HydrophobicContact CG2-CG 4.35Å; I651-W676 HydrophobicContact CG2-CH2 3.82Å; I651-W676 HydrophobicContact CG2-CZ2 3.66Å; I651-W676 HydrophobicContact CG2-CZ3 3.94Å; W676-P678 HydrophobicContact CH2-CB 4.16Å; W676-P678 HydrophobicContact CZ2-CB 3.92Å
677	C	79.2	Confident	66.8	Low	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	91.1	-175.8	-61.9	0	0	0	0	111	M178 G496 T497 I499 L679 A680	M178-C677 VanDerWaalsContact O-CA 3.22Å; M178-C677 WeakPolarHBondContact O-CA 3.49Å; M178-C677 PolarHBondContact O-SG 3.15Å; G496-C677 CarbonylContact C-O 3.56Å; G496-C677 WeakPolarHBondContact CA-O 3.19Å; T497-C677 PolarHBondContact N-O 3.46Å; T497-C677 PolarHBondContact O-N 2.9Å; I499-C677 VanDerWaalsContact CD1-SG 3.53Å; C677-L679 VanDerWaalsContact C-N 3.35Å; C677-L679 PolarHBondContact O-N 3.42Å; C677-A680 HydrophobicContact CB-CB 4.45Å
678	P	80.1	Confident	66.5	Low	1 Å²	1	40.4 Å²	40.4	1%	0.006	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-30.5	-174.1	23.2	-33.3	0	0	0	114.5	L211 L244 R247 W676	L211-P678 HydrophobicContact CD2-CB 3.66Å; L211-P678 HydrophobicContact CD2-CG 4.26Å; L244-P678 HydrophobicContact CD2-CB 4.22Å; L244-P678 HydrophobicContact CD2-CG 3.76Å; R247-P678 PolarHBondContact NH2-O 3.39Å; W676-P678 HydrophobicContact CH2-CB 4.16Å; W676-P678 HydrophobicContact CZ2-CB 3.92Å
679	L	71.5	Confident	66.1	Low	14 Å²	14	42.6 Å²	42.6	7%	0.073	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-3.8	-171.5	-61.7	-179.5	0	0	0	115.6	T179 Q243 L244 C677 D681 T682	T179-L679 HydrophobicContact CG2-CD1 3.84Å; T179-L679 HydrophobicContact CG2-CG 4.29Å; T179-L679 WeakPolarHBondContact O-CB 3.35Å; T179-L679 PolarHBondContact O-N 2.73Å; Q243-L679 HydrophobicContact CB-CD1 3.98Å; Q243-L679 HydrophobicContact CB-CD2 3.98Å; L244-L679 HydrophobicContact CD2-CD1 4.19Å; L244-L679 HydrophobicContact CD2-CD2 4.01Å; L244-L679 HydrophobicContact CD2-CG 3.92Å; L244-L679 HydrophobicContact CG-CD1 4.09Å; L244-L679 HydrophobicContact CG-CD2 4.36Å; L244-L679 HydrophobicContact CG-CG 4.34Å; C677-L679 VanDerWaalsContact C-N 3.35Å; C677-L679 PolarHBondContact O-N 3.42Å; L679-D681 PolarHBondContact O-N 3.06Å; L679-T682 PolarHBondContact O-N 3.37Å; L679-T682 PolarHBondContact O-OG1 2.95Å
680	A	65.4	Low	65.8	Low	1 Å²	1	40.4 Å²	40.4	1%	0.008	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	142.2	177.7	0	0	0	0	0	111.7	R186 T497 C677 T682	R186-A680 PolarHBondContact NH2-O 3.44Å; T497-A680 HydrophobicContact CG2-CB 4.07Å; T497-A680 WeakPolarHBondContact OG1-CB 3.49Å; C677-A680 HydrophobicContact CB-CB 4.45Å; A680-T682 VanDerWaalsContact O-CG2 3.25Å; A680-T682 WeakPolarHBondContact O-CG2 3.35Å; A680-T682 PolarHBondContact O-N 3.13Å; A680-T682 PolarHBondContact O-OG1 3.43Å
681	D	57.4	Low	65.2	Low	35 Å²	35	46.1 Å²	46.1	19%	0.187	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	0.2	173.4	-57	-14.2	0	0	0	118.6	L182 P183 N184 C185 R186 L679	L182-D681 VanDerWaalsContact O-OD1 3.08Å; P183-D681 WeakPolarHBondContact CA-OD1 3.35Å; N184-D681 VanDerWaalsContact N-CG 3.32Å; N184-D681 PolarHBondContact N-OD1 3.41Å; C185-D681 PolarHBondContact N-OD2 3.42Å; R186-D681 VanDerWaalsContact CD-OD2 3.32Å; R186-D681 WeakPolarHBondContact CD-OD2 3.36Å; R186-D681 WeakPolarHBondContact CG-OD2 3.34Å; R186-D681 IonicContact NE-OD2 2.62Å; L679-D681 PolarHBondContact O-N 3.06Å
682	T	52.1	Low	64.2	Low	21 Å²	21	47.4 Å²	47.4	13%	0.129	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	34.5	-162.4	59.6	0	0	0	0	116.9	R247 Y493 L679 A680 D684	R247-T682 PolarHBondContact NH1-OG1 3.42Å; R247-T682 PolarHBondContact NH2-OG1 3.13Å; Y493-T682 HydrophobicContact CE1-CG2 4.32Å; L679-T682 PolarHBondContact O-N 3.37Å; L679-T682 PolarHBondContact O-OG1 2.95Å; A680-T682 VanDerWaalsContact O-CG2 3.25Å; A680-T682 WeakPolarHBondContact O-CG2 3.35Å; A680-T682 PolarHBondContact O-N 3.13Å; A680-T682 PolarHBondContact O-OG1 3.43Å; T682-D684 VanDerWaalsContact C-N 3.27Å
683	K	51.9	Low	63.1	Low	164 Å²	164	49.5 Å²	49.5	71%	0.713	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-16.5	160.7	-70.4	-160.2	173.1	-164.6	0	112.6	E239	E239-K683 IonicContact OE1-NZ 3.96Å; E239-K683 PolarHBondContact OE1-NZ 3.38Å
684	D	48.8	Very low	62	Low	69 Å²	69	54.1 Å²	54.1	37%	0.369	27%	0.268	S	S	.	.			trans	-103.6	81.3	-175.8	-146.7	32.7	0	0	0	112.9	T682 R686	T682-D684 VanDerWaalsContact C-N 3.27Å; D684-R686 PolarHBondContact O-N 3.32Å; D684-R686 WeakPolarHBondContact OD1-CD 3.38Å; D684-R686 WeakPolarHBondContact OD1-CG 3.45Å; D684-R686 IonicContact OD1-CZ 3.9Å; D684-R686 IonicContact OD1-NE 3.9Å; D684-R686 PolarHBondContact OD1-NE 2.95Å; D684-R686 IonicContact OD1-NH2 3.25Å; D684-R686 PolarHBondContact OD1-NH2 3.12Å; D684-R686 IonicContact OD2-NE 3.03Å
685	D	49.1	Very low	60.4	Low	86 Å²	86	59.6 Å²	59.6	46%	0.46	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	1.1	173.5	-80.6	-30.7	0	0	0	113.9	H246 M687 L688	H246-D685 IonicContact CE1-OD2 3.55Å; D685-M687 VanDerWaalsContact C-N 3.28Å; D685-M687 PolarHBondContact O-N 2.89Å; D685-L688 WeakPolarHBondContact O-CD2 3.25Å; D685-L688 WeakPolarHBondContact O-CG 3.2Å
686	R	47.8	Very low	59.3	Low	204 Å²	204	62 Å²	62	77%	0.77	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-23.6	177.9	-62.7	-176.5	-133.9	-160.9	5.1	113.5	D684 L688	D684-R686 PolarHBondContact O-N 3.32Å; D684-R686 WeakPolarHBondContact OD1-CD 3.38Å; D684-R686 WeakPolarHBondContact OD1-CG 3.45Å; D684-R686 IonicContact OD1-CZ 3.9Å; D684-R686 IonicContact OD1-NE 3.9Å; D684-R686 PolarHBondContact OD1-NE 2.95Å; D684-R686 IonicContact OD1-NH2 3.25Å; D684-R686 PolarHBondContact OD1-NH2 3.12Å; D684-R686 IonicContact OD2-NE 3.03Å; R686-L688 PolarHBondContact O-N 3.35Å
687	M	51	Low	57.9	Low	78 Å²	78	62.8 Å²	62.8	38%	0.384	31%	0.312	S	S	.	.			trans	-80.2	86.3	176.7	-65.6	-150	114.7	0	0	111.5	L188 Q490 Y493 D685	L188-M687 HydrophobicContact CD1-CE 4.02Å; L188-M687 HydrophobicContact CD2-CE 3.73Å; L188-M687 HydrophobicContact CD2-SD 3.5Å; L188-M687 VanDerWaalsContact CD2-SD 3.5Å; Q490-M687 PolarHBondContact NE2-O 3.34Å; Q490-M687 VanDerWaalsContact NE2-O 3.11Å; Q490-M687 PolarHBondContact OE1-O 3.34Å; Y493-M687 HydrophobicContact CE1-CB 3.97Å; Y493-M687 HydrophobicContact CE2-CB 4.24Å; Y493-M687 HydrophobicContact CE2-SD 4.11Å; D685-M687 VanDerWaalsContact C-N 3.28Å; D685-M687 PolarHBondContact O-N 2.89Å
688	L	57.9	Low	56.8	Low	88 Å²	88	66.6 Å²	66.6	46%	0.461	33%	0.332	S	S	.	.			trans	-107	95.2	-179.5	-61.5	175.6	0	0	0	111.6	D685 R686 Y690	D685-L688 WeakPolarHBondContact O-CD2 3.25Å; D685-L688 WeakPolarHBondContact O-CG 3.2Å; R686-L688 PolarHBondContact O-N 3.35Å; L688-Y690 VanDerWaalsContact C-N 3.27Å
689	F	55.1	Low	55.9	Low	47 Å²	47	71 Å²	71	21%	0.206	36%	0.356	C	S	.	.	S	Bend	trans	-66.2	-32.8	161.9	-60.5	-86.5	0	0	0	111.3	P189 V191 Q486 A489 Q490 Y493	P189-F689 HydrophobicContact CG-CD2 4.48Å; P189-F689 HydrophobicContact CG-CE1 4.39Å; P189-F689 HydrophobicContact CG-CE2 3.75Å; P189-F689 HydrophobicContact CG-CZ 3.7Å; V191-F689 HydrophobicContact CG2-CD1 3.8Å; V191-F689 HydrophobicContact CG2-CE1 4.34Å; Q486-F689 WeakPolarHBondContact CB-O 3.32Å; Q486-F689 VanDerWaalsContact CG-O 3.31Å; Q486-F689 WeakPolarHBondContact CG-O 3.39Å; A489-F689 HydrophobicContact CB-CB 4.1Å; A489-F689 HydrophobicContact CB-CD1 4Å; A489-F689 HydrophobicContact CB-CG 3.95Å; Q490-F689 HydrophobicContact CB-CB 4.37Å; Y493-F689 HydrophobicContact CD2-CE2 4.23Å; Y493-F689 HydrophobicContact CG-CE2 4.14Å
690	Y	66.2	Low	55.2	Low	20 Å²	20	71.3 Å²	71.3	8%	0.078	36%	0.356	C	S	.	.	S	Bend	trans	-127.1	120.1	170.9	-172.8	-102.5	0	0	0	110.1	L254 E257 H261 R483 Q486 I487 L688 L692	L254-Y690 HydrophobicContact CD2-CD1 3.91Å; E257-Y690 PolarHBondContact OE2-OH 3.39Å; H261-Y690 PolarHBondContact NE2-OH 2.76Å; R483-Y690 HydrophobicContact CB-CE2 4.35Å; R483-Y690 HydrophobicContact CG-CE2 4.26Å; Q486-Y690 HydrophobicContact CB-CD2 4.24Å; I487-Y690 HydrophobicContact CD1-CD1 4.48Å; I487-Y690 HydrophobicContact CD1-CD2 4.2Å; I487-Y690 HydrophobicContact CD1-CE1 4.22Å; I487-Y690 HydrophobicContact CD1-CE2 3.94Å; I487-Y690 HydrophobicContact CD1-CG 4.46Å; I487-Y690 HydrophobicContact CG1-CD1 3.84Å; I487-Y690 HydrophobicContact CG1-CD2 3.62Å; I487-Y690 HydrophobicContact CG1-CE1 4.09Å; I487-Y690 HydrophobicContact CG1-CE2 3.89Å; I487-Y690 HydrophobicContact CG1-CG 3.59Å; L688-Y690 VanDerWaalsContact C-N 3.27Å; Y690-L692 HydrophobicContact CD1-CB 4.49Å; Y690-L692 HydrophobicContact CD1-CD1 4.35Å; Y690-L692 HydrophobicContact CE1-CD1 4.18Å; Y690-L692 PolarHBondContact O-N 3.46Å
691	N	62.1	Low	54.8	Low	119 Å²	119	73.3 Å²	73.3	64%	0.636	37%	0.367	S	S	*	.			trans	-78.5	89.8	179.2	-172	-8.1	0	0	0	110.5	S693	N691-S693 PolarHBondContact O-N 3.06Å
692	L	56.1	Low	54.7	Low	27 Å²	27	74.9 Å²	74.9	14%	0.141	38%	0.375	C	S	.	.			trans	-76.1	105	170.8	-160.5	102.5	0	0	0	108.4	C253 L254 Y690 T694 L697	C253-L692 HydrophobicContact CB-CD1 4.39Å; C253-L692 HydrophobicContact CB-CD2 4.19Å; L254-L692 HydrophobicContact CD2-CD1 3.82Å; L254-L692 HydrophobicContact CG-CD1 4.28Å; Y690-L692 HydrophobicContact CD1-CB 4.49Å; Y690-L692 HydrophobicContact CD1-CD1 4.35Å; Y690-L692 HydrophobicContact CE1-CD1 4.18Å; Y690-L692 PolarHBondContact O-N 3.46Å; L692-T694 PolarHBondContact O-N 3.49Å; L692-L697 HydrophobicContact CD2-CB 3.95Å; L692-L697 HydrophobicContact CD2-CD1 4.17Å; L692-L697 HydrophobicContact CD2-CG 4.45Å
693	S	55.6	Low	55	Low	44 Å²	44	78.5 Å²	78.5	31%	0.308	39%	0.391	S	S	.	.			trans	-65	139.8	179.9	66.1	0	0	0	0	110.7	N691 I695 Q696 L697	N691-S693 PolarHBondContact O-N 3.06Å; S693-I695 PolarHBondContact O-N 3.33Å; S693-Q696 VanDerWaalsContact N-OE1 3.07Å; S693-Q696 WeakPolarHBondContact O-CA 3.36Å; S693-Q696 WeakPolarHBondContact O-CB 3.39Å; S693-Q696 PolarHBondContact O-N 3.11Å; S693-Q696 VanDerWaalsContact OG-CD 3.29Å; S693-Q696 VanDerWaalsContact OG-CG 3.27Å; S693-Q696 WeakPolarHBondContact OG-CG 3.44Å; S693-Q696 PolarHBondContact OG-N 3.38Å; S693-Q696 PolarHBondContact OG-OE1 3.32Å; S693-L697 PolarHBondContact O-N 3.26Å
694	T	54.3	Low	55.2	Low	104 Å²	104	74.3 Å²	74.3	64%	0.638	37%	0.374	S	S	*	.	H	α-helix	trans	-55	-31.3	179.1	-36.4	0	0	0	0	111.9	L692 L697 N698	L692-T694 PolarHBondContact O-N 3.49Å; T694-L697 PolarHBondContact O-N 3.38Å; T694-N698 WeakPolarHBondContact O-CB 3.32Å; T694-N698 VanDerWaalsContact O-CG 3.28Å; T694-N698 PolarHBondContact O-N 3.05Å
695	I	46.2	Very low	55.4	Low	117 Å²	117	79.3 Å²	79.3	60%	0.6	39%	0.387	S	S	*	.	H	α-helix	trans	-63.4	-42.7	174.2	-58.5	172.3	0	0	0	111.3	S693 N699	S693-I695 PolarHBondContact O-N 3.33Å; I695-N699 VanDerWaalsContact O-CB 3.24Å; I695-N699 WeakPolarHBondContact O-CB 3.43Å; I695-N699 PolarHBondContact O-N 3.46Å; I695-N699 PolarHBondContact O-OD1 3.4Å
696	Q	55.3	Low	55.6	Low	61 Å²	61	81.2 Å²	81.2	29%	0.285	39%	0.394	S	S	.	.	H	α-helix	trans	-64.3	-40.7	175.8	-75.9	163.9	-60	0	0	112	S693 F700	S693-Q696 VanDerWaalsContact N-OE1 3.07Å; S693-Q696 WeakPolarHBondContact O-CA 3.36Å; S693-Q696 WeakPolarHBondContact O-CB 3.39Å; S693-Q696 PolarHBondContact O-N 3.11Å; S693-Q696 VanDerWaalsContact OG-CD 3.29Å; S693-Q696 VanDerWaalsContact OG-CG 3.27Å; S693-Q696 WeakPolarHBondContact OG-CG 3.44Å; S693-Q696 PolarHBondContact OG-N 3.38Å; S693-Q696 PolarHBondContact OG-OE1 3.32Å; Q696-F700 VanDerWaalsContact O-CB 3.29Å; Q696-F700 WeakPolarHBondContact O-CB 3.19Å; Q696-F700 PolarHBondContact O-N 3.32Å
697	L	53.3	Low	55.5	Low	19 Å²	19	77 Å²	77	10%	0.099	38%	0.381	C	S	.	.	H	α-helix	trans	-65.1	-46.3	177.9	-174.1	61.1	0	0	0	111.3	C253 L692 S693 T694 F700 L701	C253-L697 HydrophobicContact CB-CD1 3.71Å; L692-L697 HydrophobicContact CD2-CB 3.95Å; L692-L697 HydrophobicContact CD2-CD1 4.17Å; L692-L697 HydrophobicContact CD2-CG 4.45Å; S693-L697 PolarHBondContact O-N 3.26Å; T694-L697 PolarHBondContact O-N 3.38Å; L697-F700 PolarHBondContact O-N 3.23Å; L697-L701 HydrophobicContact CD1-CD1 4.48Å; L697-L701 HydrophobicContact CG-CD1 4.19Å; L697-L701 WeakPolarHBondContact O-CB 3.43Å; L697-L701 VanDerWaalsContact O-CG 3.3Å; L697-L701 WeakPolarHBondContact O-CG 3.13Å; L697-L701 PolarHBondContact O-N 3.04Å
698	N	55.5	Low	55.3	Low	80 Å²	80	76.1 Å²	76.1	43%	0.428	39%	0.386	S	S	.	.	H	α-helix	trans	-63.8	-48.9	177.7	-69.7	-6	0	0	0	111.4	T694 F700 L701 D702	T694-N698 WeakPolarHBondContact O-CB 3.32Å; T694-N698 VanDerWaalsContact O-CG 3.28Å; T694-N698 PolarHBondContact O-N 3.05Å; N698-F700 VanDerWaalsContact C-N 3.28Å; N698-F700 PolarHBondContact O-N 2.86Å; N698-L701 PolarHBondContact O-N 2.9Å; N698-L701 VanDerWaalsContact O-N 3.09Å; N698-D702 WeakPolarHBondContact O-CB 3.5Å; N698-D702 PolarHBondContact O-N 3.08Å
699	N	62.5	Low	54.6	Low	92 Å²	92	75 Å²	75	49%	0.492	39%	0.385	S	S	.	.	H	α-helix	trans	-57.5	-41.1	176.7	-69.2	1.3	0	0	0	111.9	I695 D702 E703	I695-N699 VanDerWaalsContact O-CB 3.24Å; I695-N699 WeakPolarHBondContact O-CB 3.43Å; I695-N699 PolarHBondContact O-N 3.46Å; I695-N699 PolarHBondContact O-OD1 3.4Å; N699-D702 PolarHBondContact O-N 3.48Å; N699-E703 PolarHBondContact O-N 3.5Å
700	F	56.3	Low	53.8	Low	21 Å²	21	75.9 Å²	75.9	9%	0.092	40%	0.398	C	S	.	.	H	α-helix	trans	-64.6	-45	175.2	175.5	-98.7	0	0	0	111.8	R252 C253 H256 Q696 L697 N698 D702 E703 Q704	R252-F700 HydrophobicContact CB-CE1 3.97Å; R252-F700 HydrophobicContact CB-CZ 4.16Å; C253-F700 HydrophobicContact CB-CD1 4.16Å; C253-F700 HydrophobicContact CB-CG 4.49Å; H256-F700 HydrophobicContact CB-CD2 4.28Å; H256-F700 HydrophobicContact CB-CE2 3.82Å; H256-F700 HydrophobicContact CB-CZ 4.49Å; H256-F700 AromaticContact CG-CE2 3.86Å; Q696-F700 VanDerWaalsContact O-CB 3.29Å; Q696-F700 WeakPolarHBondContact O-CB 3.19Å; Q696-F700 PolarHBondContact O-N 3.32Å; L697-F700 PolarHBondContact O-N 3.23Å; N698-F700 VanDerWaalsContact C-N 3.28Å; N698-F700 PolarHBondContact O-N 2.86Å; F700-D702 VanDerWaalsContact C-N 3.32Å; F700-D702 PolarHBondContact O-N 3.1Å; F700-E703 PolarHBondContact O-N 3.23Å; F700-Q704 HydrophobicContact CD1-CG 4.37Å; F700-Q704 HydrophobicContact CE1-CG 3.95Å; F700-Q704 HydrophobicContact CE2-CG 4.31Å; F700-Q704 HydrophobicContact CZ-CG 3.92Å; F700-Q704 WeakPolarHBondContact O-CG 3.47Å; F700-Q704 PolarHBondContact O-N 3.37Å
701	L	56.2	Low	52.4	Low	43 Å²	43	80.3 Å²	80.3	23%	0.225	42%	0.422	C	S	.	.	H	α-helix	trans	-63.1	-38.1	177.2	-72.5	171.8	0	0	0	112.1	N249 L697 N698 Q704 R705	N249-L701 HydrophobicContact CB-CD2 4.12Å; L697-L701 HydrophobicContact CD1-CD1 4.48Å; L697-L701 HydrophobicContact CG-CD1 4.19Å; L697-L701 WeakPolarHBondContact O-CB 3.43Å; L697-L701 VanDerWaalsContact O-CG 3.3Å; L697-L701 WeakPolarHBondContact O-CG 3.13Å; L697-L701 PolarHBondContact O-N 3.04Å; N698-L701 PolarHBondContact O-N 2.9Å; N698-L701 VanDerWaalsContact O-N 3.09Å; L701-Q704 PolarHBondContact O-N 2.79Å; L701-R705 WeakPolarHBondContact O-CB 3.26Å; L701-R705 WeakPolarHBondContact O-CG 3.4Å; L701-R705 PolarHBondContact O-N 3.28Å
702	D	55.3	Low	51.2	Low	69 Å²	69	82 Å²	82	37%	0.369	42%	0.423	S	S	.	.	H	α-helix	trans	-70.1	-39.7	176.3	-68.8	-26.7	0	0	0	111.7	N698 N699 F700 Q704 R705 Q706	N698-D702 WeakPolarHBondContact O-CB 3.5Å; N698-D702 PolarHBondContact O-N 3.08Å; N699-D702 PolarHBondContact O-N 3.48Å; F700-D702 VanDerWaalsContact C-N 3.32Å; F700-D702 PolarHBondContact O-N 3.1Å; D702-Q704 VanDerWaalsContact C-N 3.32Å; D702-Q704 PolarHBondContact O-N 3Å; D702-R705 PolarHBondContact O-N 2.94Å; D702-R705 IonicContact OD1-NH1 3.43Å; D702-Q706 WeakPolarHBondContact O-CB 3.48Å; D702-Q706 WeakPolarHBondContact O-CG 3.49Å; D702-Q706 PolarHBondContact O-N 3.38Å
703	E	58.6	Low	50.2	Low	96 Å²	96	87.6 Å²	87.6	45%	0.449	45%	0.451	S	S	.	.	H	α-helix	trans	-59	-39.7	169.6	-83	-169.8	-162.1	0	0	112.6	N699 F700 K707	N699-E703 PolarHBondContact O-N 3.5Å; F700-E703 PolarHBondContact O-N 3.23Å; E703-K707 WeakPolarHBondContact O-CD 3.36Å; E703-K707 WeakPolarHBondContact O-CG 3.1Å; E703-K707 PolarHBondContact O-N 2.89Å; E703-K707 IonicContact OE2-NZ 2.74Å
704	Q	55.8	Low	49.5	Very low	77 Å²	77	91.7 Å²	91.7	36%	0.36	47%	0.468	S	S	.	.	H	α-helix	trans	-70.7	-38.8	176.1	-62.6	-51.1	-47.6	0	0	111.6	F700 L701 D702 K707 A708	F700-Q704 HydrophobicContact CD1-CG 4.37Å; F700-Q704 HydrophobicContact CE1-CG 3.95Å; F700-Q704 HydrophobicContact CE2-CG 4.31Å; F700-Q704 HydrophobicContact CZ-CG 3.92Å; F700-Q704 WeakPolarHBondContact O-CG 3.47Å; F700-Q704 PolarHBondContact O-N 3.37Å; L701-Q704 PolarHBondContact O-N 2.79Å; D702-Q704 VanDerWaalsContact C-N 3.32Å; D702-Q704 PolarHBondContact O-N 3Å; Q704-K707 PolarHBondContact O-N 3.32Å; Q704-A708 PolarHBondContact O-N 3.01Å; Q704-A708 VanDerWaalsContact O-N 3.08Å
705	R	54.2	Low	48.7	Very low	173 Å²	173	93.2 Å²	93.2	65%	0.653	47%	0.471	S	S	*	.	H	α-helix	trans	-63.6	-44.8	176	-79.1	171.5	168.1	177.3	-5.4	112	L701 D702 K707 A708 S709	L701-R705 WeakPolarHBondContact O-CB 3.26Å; L701-R705 WeakPolarHBondContact O-CG 3.4Å; L701-R705 PolarHBondContact O-N 3.28Å; D702-R705 PolarHBondContact O-N 2.94Å; D702-R705 IonicContact OD1-NH1 3.43Å; R705-K707 VanDerWaalsContact C-N 3.28Å; R705-K707 PolarHBondContact O-N 3.45Å; R705-A708 PolarHBondContact O-N 3.06Å; R705-A708 VanDerWaalsContact O-N 3.1Å; R705-S709 PolarHBondContact O-N 3.11Å; R705-S709 PolarHBondContact O-OG 2.8Å
706	Q	52.9	Low	48.2	Very low	127 Å²	127	93.3 Å²	93.3	59%	0.593	47%	0.473	S	S	*	.	H	α-helix	trans	-59.3	-38.9	176.8	-73.5	175.4	9.7	0	0	111.8	D702 S709 S710	D702-Q706 WeakPolarHBondContact O-CB 3.48Å; D702-Q706 WeakPolarHBondContact O-CG 3.49Å; D702-Q706 PolarHBondContact O-N 3.38Å; Q706-S709 WeakPolarHBondContact CA-OG 3.46Å; Q706-S709 PolarHBondContact O-OG 3.5Å; Q706-S709 VanDerWaalsContact O-OG 3.06Å; Q706-S710 WeakPolarHBondContact O-CB 3.37Å; Q706-S710 PolarHBondContact O-N 2.91Å; Q706-S710 VanDerWaalsContact O-N 3.12Å; Q706-S710 PolarHBondContact O-OG 3.47Å
707	K	46	Very low	47	Very low	114 Å²	114	98.8 Å²	98.8	50%	0.496	50%	0.498	S	S	.	.	H	α-helix	trans	-65.3	-41.2	174.5	-72.9	166.6	-175	158.7	0	111.9	E703 Q704 R705	E703-K707 WeakPolarHBondContact O-CD 3.36Å; E703-K707 WeakPolarHBondContact O-CG 3.1Å; E703-K707 PolarHBondContact O-N 2.89Å; E703-K707 IonicContact OE2-NZ 2.74Å; Q704-K707 PolarHBondContact O-N 3.32Å; R705-K707 VanDerWaalsContact C-N 3.28Å; R705-K707 PolarHBondContact O-N 3.45Å
708	A	45.7	Very low	45.9	Very low	60 Å²	60	106.4 Å²	106.4	50%	0.496	53%	0.534	S	S	.	.	H	α-helix	trans	-70.6	-41.1	178.3	0	0	0	0	0	113.3	Q704 R705 S710 I711 K712	Q704-A708 PolarHBondContact O-N 3.01Å; Q704-A708 VanDerWaalsContact O-N 3.08Å; R705-A708 PolarHBondContact O-N 3.06Å; R705-A708 VanDerWaalsContact O-N 3.1Å; A708-S710 VanDerWaalsContact C-N 3.34Å; A708-S710 PolarHBondContact O-N 2.95Å; A708-I711 PolarHBondContact O-N 3.44Å; A708-K712 PolarHBondContact O-N 2.58Å
709	S	43.2	Very low	44.7	Very low	64 Å²	64	111.4 Å²	111.4	45%	0.448	55%	0.554	S	S	.	*	H	α-helix	trans	-66.7	-35.4	177.9	58.5	0	0	0	0	112.4	R705 Q706 I711 K712 M713	R705-S709 PolarHBondContact O-N 3.11Å; R705-S709 PolarHBondContact O-OG 2.8Å; Q706-S709 WeakPolarHBondContact CA-OG 3.46Å; Q706-S709 PolarHBondContact O-OG 3.5Å; Q706-S709 VanDerWaalsContact O-OG 3.06Å; S709-I711 PolarHBondContact O-N 3.09Å; S709-K712 PolarHBondContact O-N 3.37Å; S709-M713 PolarHBondContact O-N 3.06Å; S709-M713 VanDerWaalsContact O-N 3.07Å
710	S	38.5	Very low	43.2	Very low	66 Å²	66	114.9 Å²	114.9	46%	0.462	57%	0.571	S	S	.	*	H	α-helix	trans	-59.9	-35.6	175.8	-57.8	0	0	0	0	112	Q706 A708 I714	Q706-S710 WeakPolarHBondContact O-CB 3.37Å; Q706-S710 PolarHBondContact O-N 2.91Å; Q706-S710 VanDerWaalsContact O-N 3.12Å; Q706-S710 PolarHBondContact O-OG 3.47Å; A708-S710 VanDerWaalsContact C-N 3.34Å; A708-S710 PolarHBondContact O-N 2.95Å; S710-I714 WeakPolarHBondContact O-CD1 3.38Å; S710-I714 WeakPolarHBondContact O-CG1 3.38Å
711	I	36.9	Very low	41.8	Very low	114 Å²	114	120.7 Å²	120.7	59%	0.585	60%	0.603	S	S	*	*	H	α-helix	trans	-73.4	-32.9	176.1	-63.2	167.7	0	0	0	111.2	A708 S709	A708-I711 PolarHBondContact O-N 3.44Å; S709-I711 PolarHBondContact O-N 3.09Å
712	K	37.3	Very low	40.5	Very low	153 Å²	153	125.7 Å²	125.7	67%	0.665	63%	0.63	S	S	*	*	H	α-helix	trans	-78.7	-31.9	-176.5	-147.3	-178	-169.9	-169.2	0	113.7	A708 S709 I714 L715	A708-K712 PolarHBondContact O-N 2.58Å; S709-K712 PolarHBondContact O-N 3.37Å; K712-I714 VanDerWaalsContact C-N 3.33Å; K712-L715 PolarHBondContact O-N 3.46Å
713	M	34.7	Very low	39.2	Very low	146 Å²	146	133.3 Å²	133.3	72%	0.719	66%	0.655	S	S	*	*	H	α-helix	trans	-68.5	-32.3	174.8	-65.5	-152.9	-50.6	0	0	112.6	S709 L715 N716	S709-M713 PolarHBondContact O-N 3.06Å; S709-M713 VanDerWaalsContact O-N 3.07Å; M713-L715 PolarHBondContact O-N 2.7Å; M713-L715 VanDerWaalsContact O-N 3.16Å; M713-N716 PolarHBondContact O-N 2.92Å
714	I	41.4	Very low	37.7	Very low	130 Å²	130	134.3 Å²	134.3	67%	0.667	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-15.6	178.6	-66.1	169.1	0	0	0	112.6	S710 K712	S710-I714 WeakPolarHBondContact O-CD1 3.38Å; S710-I714 WeakPolarHBondContact O-CG1 3.38Å; K712-I714 VanDerWaalsContact C-N 3.33Å
715	L	36.8	Very low	36.2	Very low	136 Å²	136	136 Å²	136	71%	0.712	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-1.1	-177	-69	172.1	0	0	0	114.6	K712 M713	K712-L715 PolarHBondContact O-N 3.46Å; M713-L715 PolarHBondContact O-N 2.7Å; M713-L715 VanDerWaalsContact O-N 3.16Å
716	N	35.2	Very low	34.9	Very low	118 Å²	118	133.4 Å²	133.4	63%	0.631	70%	0.699	S	S	*	*			trans	-127.6	28.8	-172.2	-84.2	61	0	0	0	112.8	M713 E718	M713-N716 PolarHBondContact O-N 2.92Å; N716-E718 VanDerWaalsContact C-N 3.27Å; N716-E718 PolarHBondContact O-N 2.87Å
717	E	30.9	Very low	33.5	Very low	176 Å²	176	136.4 Å²	136.4	82%	0.822	71%	0.71	S	S	*	*			trans	-86.7	18.2	173.9	-77.4	-166	156.1	0	0	114.2
718	E	30.6	Very low	32.5	Very low	180 Å²	180	139.1 Å²	139.1	84%	0.841	73%	0.726	S	S	*	*	S	Bend	trans	-104.8	132.1	158.2	-72.5	-173.8	149.9	0	0	108.9	N716	N716-E718 VanDerWaalsContact C-N 3.27Å; N716-E718 PolarHBondContact O-N 2.87Å
719	E	29.9	Very low	31.5	Very low	185 Å²	185	142.7 Å²	142.7	86%	0.864	74%	0.737	S	S	*	*			trans	69.4	91.2	-177.2	-53.4	-171.9	163.4	0	0	117.1
720	I	30.4	Very low	30.6	Very low	165 Å²	165	151.2 Å²	151.2	85%	0.846	76%	0.761	S	S	*	*				-159.8	115.2	121.7	-91.1	142.6	0	0	0	107.7
721	N	27.2	Very low	29.9	Very low	143 Å²	143	152.2 Å²	152.2	77%	0.765	77%	0.768	S	S	*	*			trans	-81	164.1	173	-75.3	-41.9	0	0	0	111.6
722	D	28.9	Very low	29.3	Very low	147 Å²	147	153 Å²	153	79%	0.786	77%	0.774	S	S	*	*			trans	56.2	80.5	156.4	-60.4	-29.3	0	0	0	118.7
723	Y	27.7	Very low	28.8	Very low	229 Å²	229	153.8 Å²	153.8	90%	0.898	78%	0.783	S	S	*	*			trans	-129.5	121.4	140.4	-90	-80.7	0	0	0	111.9
724	S	27.4	Very low	28.3	Very low	118 Å²	118	155.2 Å²	155.2	83%	0.825	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-62.7	132.9	-174	-72.6	0	0	0	0	112.6	P726	S724-P726 VanDerWaalsContact O-CD 3.3Å; S724-P726 WeakPolarHBondContact O-CD 3.36Å
725	S	24.7	Very low	27.3	Very low	113 Å²	113	159.9 Å²	159.9	79%	0.79	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-63.5	117.6	176.8	-45.9	0	0	0	0	111.5	K727	S725-K727 PolarHBondContact O-N 3.32Å
726	P	26.5	Very low	26.7	Very low	118 Å²	118	163.7 Å²	163.7	77%	0.766	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-72.1	116.3	172.2	28	-30.1	0	0	0	109	S724 M728	S724-P726 VanDerWaalsContact O-CD 3.3Å; S724-P726 WeakPolarHBondContact O-CD 3.36Å; P726-M728 PolarHBondContact O-N 2.89Å; P726-M728 VanDerWaalsContact O-N 3.1Å
727	K	23	Very low	26	Very low	189 Å²	189	164.6 Å²	164.6	82%	0.822	80%	0.801	S	S	*	*			trans	-58.4	112.3	170.8	-66.2	174.9	179.4	175.9	0	109.1	S725	S725-K727 PolarHBondContact O-N 3.32Å
728	M	25.5	Very low	25.7	Very low	171 Å²	171	162.6 Å²	162.6	84%	0.842	80%	0.801	S	S	*	*			trans	-100.7	102.1	162.9	-95.6	-73.3	175.7	0	0	107.7	P726 Y730	P726-M728 PolarHBondContact O-N 2.89Å; P726-M728 VanDerWaalsContact O-N 3.1Å; M728-Y730 PolarHBondContact O-N 3.34Å; M728-Y730 VanDerWaalsContact O-N 3.16Å
729	D	25.2	Very low	25.4	Very low	135 Å²	135	159.4 Å²	159.4	72%	0.722	79%	0.79	S	S	*	*			trans	-65.2	112.6	-175.2	-76.2	-47.9	0	0	0	111.5	S731	D729-S731 VanDerWaalsContact C-N 3.29Å; D729-S731 PolarHBondContact O-N 3.01Å
730	Y	24.9	Very low	25.1	Very low	243 Å²	243	158.3 Å²	158.3	95%	0.953	79%	0.789	S	S	*	*			trans	-71	81.3	171.2	-95.1	-97.2	0	0	0	110.7	M728	M728-Y730 PolarHBondContact O-N 3.34Å; M728-Y730 VanDerWaalsContact O-N 3.16Å
731	S	24	Very low	24.8	Very low	87 Å²	87	158.2 Å²	158.2	61%	0.608	79%	0.789	S	S	*	*			trans	-147.1	143.2	164.2	65.7	0	0	0	0	112.5	D729	D729-S731 VanDerWaalsContact C-N 3.29Å; D729-S731 PolarHBondContact O-N 3.01Å
732	N	24.5	Very low	24.5	Very low	132 Å²	132	156.4 Å²	156.4	71%	0.706	79%	0.787	S	S	*	*			trans	75.5	64.8	169.9	-54.3	-31.9	0	0	0	119.7
733	I	26	Very low	24.4	Very low	168 Å²	168	155.2 Å²	155.2	86%	0.862	79%	0.791	S	S	*	*				-127.7	93.4	125.4	-56.6	-176.5	0	0	0	108.1
734	K	24.6	Very low	24.1	Very low	177 Å²	177	152.2 Å²	152.2	77%	0.77	79%	0.785	S	S	*	*			trans	-72.7	146.5	172.1	-78.7	177.7	177.6	172.5	0	110.1	Y736	K734-Y736 PolarHBondContact O-N 2.81Å
735	R	20.3	Very low	23.9	Very low	227 Å²	227	154.5 Å²	154.5	86%	0.857	78%	0.78	S	S	*	*			trans	-17.1	119	164.8	-65.5	171.3	174.8	158.3	-3.2	115
736	Y	24.3	Very low	23.9	Very low	217 Å²	217	154.7 Å²	154.7	85%	0.851	77%	0.772	S	S	*	*			trans	-97.6	98	144.4	-76	-81.8	0	0	0	108	K734	K734-Y736 PolarHBondContact O-N 2.81Å
737	H	20.4	Very low	23.7	Very low	137 Å²	137	155.1 Å²	155.1	63%	0.634	77%	0.768	S	S	*	*			trans	-84.8	124.9	153.9	-111.1	-98.7	0	0	0	106	D739	H737-D739 IonicContact CE1-OD1 3.85Å; H737-D739 PolarHBondContact CE1-OD1 3.1Å; H737-D739 IonicContact ND1-OD1 2.71Å; H737-D739 PolarHBondContact ND1-OD1 3.21Å; H737-D739 IonicContact ND1-OD2 3.45Å; H737-D739 PolarHBondContact ND1-OD2 2.81Å
738	T	24.6	Very low	23.8	Very low	134 Å²	134	156.2 Å²	156.2	82%	0.822	77%	0.767	S	S	*	*			trans	-131.7	92.7	158	45.8	0	0	0	0	105.8
739	D	23.7	Very low	23.6	Very low	112 Å²	112	157.8 Å²	157.8	60%	0.599	77%	0.765	S	S	*	*			trans	-70	156.9	176.3	-57.6	-59	0	0	0	110.6	H737	H737-D739 IonicContact CE1-OD1 3.85Å; H737-D739 PolarHBondContact CE1-OD1 3.1Å; H737-D739 IonicContact ND1-OD1 2.71Å; H737-D739 PolarHBondContact ND1-OD1 3.21Å; H737-D739 IonicContact ND1-OD2 3.45Å; H737-D739 PolarHBondContact ND1-OD2 2.81Å
740	L	23.1	Very low	23.7	Very low	163 Å²	163	159.3 Å²	159.3	85%	0.853	77%	0.773	S	S	*	*			trans	36.7	123.9	146.4	-70	155.8	0	0	0	119.2
741	I	24.9	Very low	23.7	Very low	163 Å²	163	156.1 Å²	156.1	84%	0.836	77%	0.767	S	S	*	*				-169.8	139.8	106.2	-93.3	151.2	0	0	0	110.4
742	S	21.5	Very low	23.9	Very low	105 Å²	105	157.4 Å²	157.4	73%	0.734	77%	0.773	S	S	*	*			trans	-69.5	140.5	172.2	43.2	0	0	0	0	112.9
743	S	26.7	Very low	23.9	Very low	122 Å²	122	160.2 Å²	160.2	85%	0.853	78%	0.782	S	S	*	*			trans	-119.7	122.9	158.8	65.8	0	0	0	0	110.4
744	E	21.4	Very low	23.8	Very low	166 Å²	166	160.6 Å²	160.6	78%	0.776	78%	0.781	S	S	*	*			trans	-81.1	164.4	-173.8	-104.5	177.1	142.8	0	0	114.2
745	F	22	Very low	23.7	Very low	165 Å²	165	162 Å²	162	72%	0.724	79%	0.787	S	S	*	*			trans	43.5	120.1	155.2	-79.6	-94.8	0	0	0	120.5
746	D	26	Very low	23.8	Very low	118 Å²	118	162.4 Å²	162.4	63%	0.631	79%	0.788	S	S	*	*				-151.6	107.3	116.9	-151.5	15.2	0	0	0	111.2	R748	D746-R748 IonicContact OD2-CZ 3.36Å; D746-R748 IonicContact OD2-NE 2.71Å; D746-R748 PolarHBondContact OD2-NE 2.71Å; D746-R748 VanDerWaalsContact OD2-NE 3.12Å; D746-R748 IonicContact OD2-NH2 2.66Å; D746-R748 PolarHBondContact OD2-NH2 3.19Å
747	N	21.5	Very low	23.7	Very low	127 Å²	127	160.3 Å²	160.3	68%	0.679	79%	0.786	S	S	*	*			trans	-90.1	113.7	173.9	-88.3	-38.3	0	0	0	109
748	R	23.9	Very low	23.9	Very low	211 Å²	211	162.8 Å²	162.8	80%	0.796	80%	0.797	S	S	*	*			trans	-121.6	104.2	164.6	-78.2	-175.8	-128.4	-165.6	1.9	111.9	D746	D746-R748 IonicContact OD2-CZ 3.36Å; D746-R748 IonicContact OD2-NE 2.71Å; D746-R748 PolarHBondContact OD2-NE 2.71Å; D746-R748 VanDerWaalsContact OD2-NE 3.12Å; D746-R748 IonicContact OD2-NH2 2.66Å; D746-R748 PolarHBondContact OD2-NH2 3.19Å
749	Y	22.6	Very low	23.8	Very low	204 Å²	204	161.4 Å²	161.4	80%	0.8	79%	0.785	S	S	*	*			trans	-53.8	142	164.5	-83.5	-112	0	0	0	111.3
750	N	27.1	Very low	23.9	Very low	168 Å²	168	165 Å²	165	90%	0.898	80%	0.798	S	S	*	*			trans	-151.3	127.6	142.3	-95.1	-35.4	0	0	0	107.6
751	E	25	Very low	23.9	Very low	176 Å²	176	165.3 Å²	165.3	82%	0.822	80%	0.795	S	S	*	*			trans	-74.8	155.4	-169.3	-79.3	-173.6	121.1	0	0	114.3
752	P	28.1	Very low	23.9	Very low	114 Å²	114	166.7 Å²	166.7	74%	0.74	80%	0.797	S	S	*	*			trans	-83.1	122.2	179.5	32.8	-33	0	0	0	112.2	Q754	P752-Q754 PolarHBondContact O-N 2.86Å; P752-Q754 VanDerWaalsContact O-N 3.16Å
753	Q	25.1	Very low	24	Very low	190 Å²	190	170.6 Å²	170.6	89%	0.888	80%	0.804	S	S	*	*			trans	-71.3	109.7	164.6	-76.8	-173.9	-16.2	0	0	110.4	F755	Q753-F755 PolarHBondContact O-N 3.31Å
754	Q	22.3	Very low	23.9	Very low	177 Å²	177	171.8 Å²	171.8	83%	0.827	80%	0.8	S	S	*	*			trans	-62	119.9	168.3	-58.5	172.2	-3.1	0	0	109.9	P752	P752-Q754 PolarHBondContact O-N 2.86Å; P752-Q754 VanDerWaalsContact O-N 3.16Å
755	F	24.2	Very low	24	Very low	205 Å²	205	169.8 Å²	169.8	90%	0.899	80%	0.8	S	S	*	*			trans	-138.3	137.7	149	-95	-71.7	0	0	0	112.3	Q753	Q753-F755 PolarHBondContact O-N 3.31Å
756	R	22.1	Very low	24.2	Very low	236 Å²	236	168.3 Å²	168.3	89%	0.891	80%	0.799	S	S	*	*			trans	-68.5	146.4	-156.1	-65.5	172	176.3	172.8	-2.1	113.8
757	H	22.1	Very low	24.2	Very low	173 Å²	173	170.6 Å²	170.6	80%	0.801	81%	0.811	S	S	*	*			trans	-43.8	136.9	155.2	-60.2	-87.5	0	0	0	112.5
758	H	24.1	Very low	24.4	Very low	189 Å²	189	171.3 Å²	171.3	88%	0.875	81%	0.813	S	S	*	*			trans	-144.1	117.1	134.3	-106.4	38.3	0	0	0	108.8
759	D	22.5	Very low	24.4	Very low	105 Å²	105	171 Å²	171	56%	0.561	82%	0.817	S	S	*	*			trans	-73	123.8	172.9	-88.2	-13.6	0	0	0	108.4	R464	R464-D759 IonicContact CZ-OD2 3.19Å; R464-D759 IonicContact NH1-OD2 2.67Å; R464-D759 IonicContact NH2-OD2 3.06Å; R464-D759 PolarHBondContact NH2-OD2 2.91Å
760	H	25.5	Very low	24.6	Very low	189 Å²	189	165.4 Å²	165.4	88%	0.875	81%	0.805	S	S	*	*			trans	-147.2	128	148.5	-107.1	-51.1	0	0	0	112.4
761	H	23.6	Very low	24.5	Very low	168 Å²	168	166.2 Å²	166.2	78%	0.778	80%	0.803	S	S	*	*			trans	-73.3	129.9	176.3	-75.2	-91.2	0	0	0	111.7
762	Q	25.2	Very low	24.5	Very low	192 Å²	192	162.9 Å²	162.9	90%	0.897	80%	0.795	S	S	*	*			trans	-135.2	138.8	146.5	-77.8	-167.7	-15.4	0	0	110.6
763	Q	23.1	Very low	24.4	Very low	188 Å²	188	161.3 Å²	161.3	88%	0.879	79%	0.786	S	S	*	*			trans	-91.9	119.3	-178.7	-66.4	167.4	-25	0	0	108.8
764	L	23.6	Very low	24.4	Very low	146 Å²	146	156.8 Å²	156.8	76%	0.764	78%	0.776	S	S	*	*			trans	-100.4	111.1	173	-131.2	96.6	0	0	0	110.1	N766	L764-N766 PolarHBondContact O-N 3.42Å
765	T	24.7	Very low	24.6	Very low	125 Å²	125	152.1 Å²	152.1	77%	0.767	76%	0.763	S	S	*	*			trans	-87.7	86.2	178.1	34.5	0	0	0	0	111.2	L767	T765-L767 PolarHBondContact O-N 2.86Å
766	N	25.7	Very low	24.8	Very low	133 Å²	133	149.1 Å²	149.1	71%	0.711	75%	0.751	S	S	*	*			trans	-70	97.7	174.8	-74.3	-19	0	0	0	111.4	L764 I768	L764-N766 PolarHBondContact O-N 3.42Å; N766-I768 PolarHBondContact O-N 3.47Å
767	L	25.3	Very low	25	Very low	167 Å²	167	146.3 Å²	146.3	87%	0.874	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-66.7	121.8	173.4	-120.7	85.9	0	0	0	111	T765	T765-L767 PolarHBondContact O-N 2.86Å
768	I	26.2	Very low	25.3	Very low	142 Å²	142	145.4 Å²	145.4	73%	0.728	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-87.5	117.2	174	-63.2	171.5	0	0	0	108.5	N766 T770	N766-I768 PolarHBondContact O-N 3.47Å; I768-T770 PolarHBondContact O-N 3.11Å
769	K	25.4	Very low	25.5	Very low	204 Å²	204	143.6 Å²	143.6	89%	0.887	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-66.7	124.1	170.1	-82.8	-172	172.9	-175	0	110.5
770	T	25.1	Very low	25.9	Very low	87 Å²	87	144 Å²	144	53%	0.534	75%	0.749	S	S	.	*			trans	-113.4	117.1	172.4	48.9	0	0	0	0	109.8	I768 V849	I768-T770 PolarHBondContact O-N 3.11Å; T770-V849 HydrophobicContact CG2-CG1 4.29Å
771	E	25.4	Very low	26.1	Very low	185 Å²	185	143.3 Å²	143.3	86%	0.864	75%	0.746	S	S	*	*			trans	-89.1	133.3	171.4	-72.3	179.5	174.1	0	0	110.8
772	T	25	Very low	26.4	Very low	106 Å²	106	143.5 Å²	143.5	65%	0.65	75%	0.753	S	S	*	*			trans	-104	103.4	-175.4	47.8	0	0	0	0	111	I847	T772-I847 HydrophobicContact CG2-CG2 4.42Å
773	S	25.5	Very low	26.7	Very low	80 Å²	80	141.3 Å²	141.3	56%	0.559	75%	0.747	S	S	*	*			trans	-93.1	108.5	169	61.3	0	0	0	0	110.4
774	S	25.9	Very low	27.1	Very low	95 Å²	95	137.5 Å²	137.5	66%	0.664	74%	0.742	S	S	*	*			trans	-72.1	135.2	170.4	47.4	0	0	0	0	110.9
775	S	27.5	Very low	27.5	Very low	80 Å²	80	138.6 Å²	138.6	56%	0.559	75%	0.748	S	S	*	*			trans	-123	108.7	171.2	-177.2	0	0	0	0	107.8	F777	S775-F777 PolarHBondContact O-N 2.85Å
776	E	27.3	Very low	27.8	Very low	141 Å²	141	138 Å²	138	66%	0.659	75%	0.749	S	S	*	*			trans	-67.4	128	173.3	-71.6	163.8	-177.2	0	0	109.4
777	F	26.5	Very low	28.1	Very low	177 Å²	177	136.9 Å²	136.9	78%	0.776	75%	0.752	S	S	*	*			trans	-130.4	100	167.7	-97.4	-83.9	0	0	0	107.7	S775 I779	S775-F777 PolarHBondContact O-N 2.85Å; F777-I779 PolarHBondContact O-N 3.42Å
778	I	27.4	Very low	28.5	Very low	155 Å²	155	136.5 Å²	136.5	80%	0.795	75%	0.75	S	S	*	*			trans	-76.4	115.5	175.7	-58	172.4	0	0	0	107.4
779	I	29.1	Very low	28.6	Very low	150 Å²	150	136.3 Å²	136.3	77%	0.769	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-83.8	122.6	170.7	-61	172.5	0	0	0	106.8	F777 Q781	F777-I779 PolarHBondContact O-N 3.42Å; I779-Q781 PolarHBondContact O-N 2.89Å
780	P	31.5	Very low	28.9	Very low	113 Å²	113	135 Å²	135	73%	0.734	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-67.6	132.5	-177.6	26.9	-33.5	0	0	0	111
781	Q	28.8	Very low	29.2	Very low	176 Å²	176	138.4 Å²	138.4	82%	0.822	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-78.2	117.9	168.6	-82.9	176.9	-60.7	0	0	109.7	I779	I779-Q781 PolarHBondContact O-N 2.89Å
782	D	31.2	Very low	29.4	Very low	171 Å²	171	137.4 Å²	137.4	91%	0.914	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-77.3	126.2	157.1	-88.1	-38.2	0	0	0	109
783	N	31.5	Very low	29.5	Very low	146 Å²	146	135.6 Å²	135.6	78%	0.781	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-80.1	132.1	-172.5	-61.7	-58.7	0	0	0	112.4
784	S	31.1	Very low	29.7	Very low	109 Å²	109	136 Å²	136	76%	0.762	76%	0.76	S	S	*	*			trans	-174.2	105.7	131	19.4	0	0	0	0	112.3
785	D	32.1	Very low	29.9	Very low	169 Å²	169	135.7 Å²	135.7	90%	0.904	75%	0.754	S	S	*	*			trans	32.2	86.8	146.8	-54.5	-18.6	0	0	0	119.2
786	S	31.4	Very low	29.9	Very low	111 Å²	111	136 Å²	136	78%	0.776	75%	0.753	S	S	*	*			trans	-136.6	81.5	144.5	74.6	0	0	0	0	110.4	D788	S786-D788 PolarHBondContact O-N 2.78Å
787	S	31.8	Very low	29.9	Very low	110 Å²	110	133.4 Å²	133.4	77%	0.769	74%	0.743	S	S	*	*			trans	-64	111.5	166.1	52.6	0	0	0	0	109.5
788	D	31.8	Very low	29.8	Very low	159 Å²	159	130.8 Å²	130.8	85%	0.85	74%	0.736	S	S	*	*			trans	168.2	49.8	154	-86.3	-11.4	0	0	0	109.7	S786	S786-D788 PolarHBondContact O-N 2.78Å
789	L	29.8	Very low	29.8	Very low	138 Å²	138	126.4 Å²	126.4	72%	0.723	72%	0.716	S	S	*	*			trans	-127.5	44.5	-179.5	-146.9	85.8	0	0	0	113.2
790	E	30.6	Very low	29.8	Very low	177 Å²	177	125.3 Å²	125.3	83%	0.827	72%	0.716	S	S	*	*			trans	-68	142.7	170.2	-63.1	-174	157.9	0	0	111.1
791	N	31	Very low	29.5	Very low	158 Å²	158	129.5 Å²	129.5	85%	0.845	72%	0.718	S	S	*	*			trans	69.8	66.8	172.6	-55.1	-42.5	0	0	0	118
792	K	30.5	Very low	29.5	Very low	164 Å²	164	125.3 Å²	125.3	71%	0.713	71%	0.708	S	S	*	*			trans	-126.4	117.3	151.4	-71.6	-172.5	179.7	176.9	0	110.9
793	G	28	Very low	29.3	Very low	68 Å²	68	125 Å²	125	70%	0.701	71%	0.706	S	S	*	*			trans	-66.5	160.7	-179	0	0	0	0	0	113.9
794	S	29.1	Very low	29.2	Very low	88 Å²	88	127 Å²	127	62%	0.615	71%	0.708	S	S	*	*			trans	-63	143.7	-176.7	47.8	0	0	0	0	113
795	V	29.5	Very low	28.9	Very low	89 Å²	89	133.2 Å²	133.2	54%	0.539	72%	0.715	S	S	.	*			trans	-118.8	111.4	-177.8	178.5	0	0	0	0	109.8	I797	V795-I797 HydrophobicContact CG1-CG1 4.16Å
796	T	27.9	Very low	28.7	Very low	88 Å²	88	131.4 Å²	131.4	54%	0.54	71%	0.71	S	S	.	*			trans	-89.9	120.3	177.8	-53.4	0	0	0	0	110.5	I847	T796-I847 HydrophobicContact CG2-CD1 4.36Å
797	I	27.7	Very low	28.5	Very low	86 Å²	86	132.3 Å²	132.3	44%	0.441	71%	0.713	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.9	116.9	-177.6	-56.9	179.2	0	0	0	110.5	V795 I847	V795-I797 HydrophobicContact CG1-CG1 4.16Å; I797-I847 PolarHBondContact O-N 3.11Å
798	L	23.2	Very low	28.2	Very low	122 Å²	122	132.6 Å²	132.6	64%	0.639	72%	0.715	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.9	115.3	178.5	-69.7	167.4	0	0	0	110.9	I847	L798-I847 HydrophobicContact CD2-CB 4.21Å
799	T	28.7	Very low	27.9	Very low	62 Å²	62	135.9 Å²	135.9	38%	0.38	72%	0.715	S	S	.	*			trans	-112.4	108.6	179	-54.9	0	0	0	0	111.7
800	V	28.4	Very low	27.6	Very low	127 Å²	127	140.5 Å²	140.5	77%	0.77	73%	0.725	S	S	*	*			trans	-91.3	104.4	179.4	-177	0	0	0	0	110.3
801	R	26.1	Very low	27.5	Very low	201 Å²	201	135.6 Å²	135.6	76%	0.758	72%	0.722	S	S	*	*			trans	-97	106.4	173.7	-85.8	-177.6	167.7	162	-2.8	111.4
802	S	28.2	Very low	27.3	Very low	88 Å²	88	137.1 Å²	137.1	62%	0.615	72%	0.724	S	S	*	*			trans	-75	125.5	169.1	64.2	0	0	0	0	111	K804	S802-K804 VanDerWaalsContact C-N 3.27Å; S802-K804 PolarHBondContact O-N 3.12Å
803	N	27.3	Very low	27.2	Very low	165 Å²	165	137.9 Å²	137.9	88%	0.882	73%	0.73	S	S	*	*			trans	-70.4	75.5	175.7	-81	-17.8	0	0	0	112.6	R805	N803-R805 VanDerWaalsContact C-N 3.33Å; N803-R805 PolarHBondContact O-N 3.14Å; N803-R805 VanDerWaalsContact O-N 3.12Å
804	K	28.4	Very low	27.2	Very low	189 Å²	189	141.7 Å²	141.7	82%	0.822	73%	0.734	S	S	*	*			trans	-78.3	83.7	161.9	-76	-172.6	177.1	-179.9	0	109.2	S802 T806	S802-K804 VanDerWaalsContact C-N 3.27Å; S802-K804 PolarHBondContact O-N 3.12Å; K804-T806 PolarHBondContact O-N 2.89Å
805	R	26.4	Very low	27.1	Very low	239 Å²	239	147.4 Å²	147.4	90%	0.902	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-63.2	133.8	166.8	-141.5	174.9	-168.6	170.9	2.6	108	N803	N803-R805 VanDerWaalsContact C-N 3.33Å; N803-R805 PolarHBondContact O-N 3.14Å; N803-R805 VanDerWaalsContact O-N 3.12Å
806	T	26.4	Very low	26.9	Very low	131 Å²	131	148.8 Å²	148.8	80%	0.804	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-58.2	128.3	-176	27	0	0	0	0	111	K804 S808	K804-T806 PolarHBondContact O-N 2.89Å; T806-S808 PolarHBondContact O-N 2.8Å
807	P	26.9	Very low	26.7	Very low	130 Å²	130	153.4 Å²	153.4	84%	0.844	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-73.9	116.1	-175.4	28.8	-33.4	0	0	0	110.7
808	S	26.9	Very low	26.7	Very low	115 Å²	115	154.9 Å²	154.9	80%	0.804	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-66.6	150.4	168.8	49.5	0	0	0	0	111.2	T806	T806-S808 PolarHBondContact O-N 2.8Å
809	R	24.8	Very low	26.8	Very low	228 Å²	228	158.5 Å²	158.5	86%	0.86	80%	0.804	S	S	*	*	S	Bend	trans	-62.1	162.9	-176.9	-65.5	175.8	172.5	168.7	-4.4	113.3
810	Y	24.5	Very low	26.6	Very low	236 Å²	236	163.2 Å²	163.2	93%	0.925	83%	0.826	S	S	*	*			trans	80.1	139.7	168.5	-76.5	-86.4	0	0	0	118.7
811	G	28.4	Very low	26.6	Very low	73 Å²	73	163 Å²	163	75%	0.753	83%	0.827	S	S	*	*			trans	118.6	81.4	170.2	0	0	0	0	0	114.4	Q813	G811-Q813 PolarHBondContact O-N 3.17Å
812	E	27.1	Very low	26.7	Very low	191 Å²	191	162.5 Å²	162.5	89%	0.893	83%	0.83	S	S	*	*			trans	-72.5	118.8	161.2	-70.8	-173.4	127.3	0	0	109.9
813	Q	26.9	Very low	26.7	Very low	179 Å²	179	169.8 Å²	169.8	84%	0.836	85%	0.845	S	S	*	*			trans	166.1	162.1	138	-89	165.6	26.2	0	0	109.9	G811	G811-Q813 PolarHBondContact O-N 3.17Å
814	N	28.8	Very low	26.7	Very low	148 Å²	148	169.8 Å²	169.8	79%	0.791	84%	0.843	S	S	*	*			trans	68.6	67.2	176.4	-56.1	-20.5	0	0	0	117.2	C816	N814-C816 VanDerWaalsContact C-N 3.31Å; N814-C816 PolarHBondContact O-N 3.03Å
815	K	26.7	Very low	26.5	Very low	209 Å²	209	165.8 Å²	165.8	91%	0.909	84%	0.838	S	S	*	*			trans	-71.7	81.1	159.4	-76.4	-178	177.8	172.5	0	111.1
816	C	25.7	Very low	26.4	Very low	118 Å²	118	161.6 Å²	161.6	80%	0.797	83%	0.833	S	S	*	*			trans	-72.9	136.6	167.7	-81.8	0	0	0	0	111.6	N814 S818	N814-C816 VanDerWaalsContact C-N 3.31Å; N814-C816 PolarHBondContact O-N 3.03Å; C816-S818 PolarHBondContact O-N 3.24Å
817	H	24.2	Very low	26.6	Very low	185 Å²	185	160.7 Å²	160.7	86%	0.856	83%	0.829	S	S	*	*			trans	-71.7	108.8	-176	-68.1	-92.9	0	0	0	112.4	K819	H817-K819 PolarHBondContact O-N 3.46Å
818	S	26.9	Very low	26.7	Very low	116 Å²	116	162 Å²	162	81%	0.811	83%	0.83	S	S	*	*			trans	-73.2	92	171.6	59.1	0	0	0	0	111.3	C816 L820	C816-S818 PolarHBondContact O-N 3.24Å; S818-L820 PolarHBondContact O-N 3.24Å
819	K	25.5	Very low	26.8	Very low	198 Å²	198	164.4 Å²	164.4	86%	0.861	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-62.5	124.5	165	-74.5	179.3	175.8	176.1	0	108.9	H817	H817-K819 PolarHBondContact O-N 3.46Å
820	L	24.4	Very low	27	Very low	162 Å²	162	162.5 Å²	162.5	85%	0.848	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-58.5	126.3	175.3	-86.4	141.5	0	0	0	110.4	S818 K822	S818-L820 PolarHBondContact O-N 3.24Å; L820-K822 PolarHBondContact O-N 3.09Å
821	P	28.4	Very low	27.2	Very low	123 Å²	123	157 Å²	157	80%	0.799	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-64.6	133.2	174	-15.3	28.4	0	0	0	109.9
822	K	28.4	Very low	27.3	Very low	190 Å²	190	162.3 Å²	162.3	83%	0.826	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-80.9	125.6	-179.1	-75.1	-178.7	175.6	-179.8	0	111.2	L820	L820-K822 PolarHBondContact O-N 3.09Å
823	W	28.1	Very low	27.4	Very low	241 Å²	241	162.3 Å²	162.3	91%	0.913	83%	0.829	S	S	*	*			trans	56.5	113.3	142.4	-67.2	60.9	0	0	0	118.3
824	I	26.3	Very low	27.3	Very low	165 Å²	165	162.3 Å²	162.3	85%	0.846	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-77.8	117.7	161.6	-60.7	164.2	0	0	0	107
825	S	24.7	Very low	27.3	Very low	104 Å²	104	160.8 Å²	160.8	73%	0.727	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-73.6	141.4	167.8	46.2	0	0	0	0	110.2
826	L	24.5	Very low	27.3	Very low	152 Å²	152	159.8 Å²	159.8	80%	0.796	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-64.8	148	170	-79.8	82.1	0	0	0	109.5
827	P	31	Very low	27.4	Very low	111 Å²	111	160 Å²	160	72%	0.721	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-70.7	141.4	169.5	-9.3	26	0	0	0	110.4	L829	P827-L829 PolarHBondContact O-N 3.31Å
828	D	28.8	Very low	27.5	Very low	159 Å²	159	160.2 Å²	160.2	85%	0.85	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-64.3	130.3	173.2	-66.7	-48.5	0	0	0	110.6
829	L	27.9	Very low	27.5	Very low	164 Å²	164	163 Å²	163	86%	0.859	84%	0.84	S	S	*	*			trans	-107.9	24.4	-171.1	-87.5	165.8	0	0	0	113.1	P827	P827-L829 PolarHBondContact O-N 3.31Å
830	E	29.9	Very low	27.6	Very low	189 Å²	189	162.2 Å²	162.2	88%	0.883	84%	0.841	S	S	*	*			trans	-94.4	-0.5	-172.9	-64.3	-162.8	157.8	0	0	115.2
831	T	29.2	Very low	27.8	Very low	119 Å²	119	159.4 Å²	159.4	73%	0.73	84%	0.835	S	S	*	*			trans	-130.3	64.5	-177.2	63.2	0	0	0	0	114.2
832	H	29.1	Very low	27.8	Very low	185 Å²	185	158.3 Å²	158.3	86%	0.856	83%	0.828	S	S	*	*			trans	-144.2	108.8	155.2	-89.9	-67.6	0	0	0	110.4
833	E	29.9	Very low	27.7	Very low	192 Å²	192	154.5 Å²	154.5	90%	0.897	81%	0.813	S	S	*	*			trans	-66.4	138.3	175.8	-64.4	179.5	140.9	0	0	110.6	S835	E833-S835 PolarHBondContact O-N 3.08Å; E833-S835 VanDerWaalsContact O-N 3.12Å
834	L	25.2	Very low	27.8	Very low	179 Å²	179	148.4 Å²	148.4	94%	0.937	80%	0.798	S	S	*	*			trans	-79.9	90.1	-175.2	-70.8	160.6	0	0	0	110.7
835	S	28.1	Very low	27.8	Very low	116 Å²	116	145.3 Å²	145.3	81%	0.811	78%	0.778	S	S	*	*			trans	-74.8	139.9	163.2	36.4	0	0	0	0	111.1	E833	E833-S835 PolarHBondContact O-N 3.08Å; E833-S835 VanDerWaalsContact O-N 3.12Å
836	E	27	Very low	28.1	Very low	188 Å²	188	144.3 Å²	144.3	88%	0.879	76%	0.764	S	S	*	*			trans	-65	139.3	-171.2	-66	-178.9	127.4	0	0	112.7	E838	E836-E838 PolarHBondContact O-N 3.12Å
837	P	27	Very low	28.3	Very low	123 Å²	123	139.8 Å²	139.8	80%	0.799	74%	0.739	S	S	*	*			trans	-85.6	110.9	-174.9	32.5	-33.1	0	0	0	112.2
838	E	27.6	Very low	28.3	Very low	189 Å²	189	137.3 Å²	137.3	88%	0.883	72%	0.723	S	S	*	*			trans	-64.3	141	161.4	-72.7	-170.5	136.7	0	0	110.7	E836 M840	E836-E838 PolarHBondContact O-N 3.12Å; E838-M840 PolarHBondContact O-N 2.79Å
839	L	26.9	Very low	28.2	Very low	175 Å²	175	132.1 Å²	132.1	92%	0.916	70%	0.696	S	S	*	*			trans	-65.8	112.9	-174.5	-77.2	113.5	0	0	0	112.4
840	M	26.9	Very low	28.2	Very low	180 Å²	180	133 Å²	133	89%	0.887	69%	0.688	S	S	*	*			trans	-131.6	145.6	162.3	-78.9	-69	166.4	0	0	110.9	E838	E838-M840 PolarHBondContact O-N 2.79Å
841	S	29.3	Very low	28.2	Very low	103 Å²	103	129.8 Å²	129.8	72%	0.72	68%	0.682	S	S	*	*			trans	-58	154.4	-171.8	-42.3	0	0	0	0	113.8	E843	S841-E843 PolarHBondContact O-N 3.09Å
842	P	28.6	Very low	28.1	Very low	101 Å²	101	131.6 Å²	131.6	66%	0.656	68%	0.682	S	S	*	*			trans	-72.1	90.3	-172.7	29.6	-36.2	0	0	0	113
843	E	26.1	Very low	28	Very low	109 Å²	109	134.2 Å²	134.2	51%	0.509	68%	0.684	S	S	.	*			trans	-84.1	119.3	177	-162.4	-176.8	-135	0	0	111.5	S841 K845	S841-E843 PolarHBondContact O-N 3.09Å; E843-K845 PolarHBondContact O-N 2.94Å; E843-K845 IonicContact OE1-NZ 2.61Å; E843-K845 WeakPolarHBondContact OE2-CE 3.33Å; E843-K845 IonicContact OE2-NZ 3.89Å; E843-K845 PolarHBondContact OE2-NZ 3.39Å
844	I	30.5	Very low	28	Very low	114 Å²	114	132.2 Å²	132.2	59%	0.585	68%	0.679	S	S	*	*			trans	-85.8	96.8	178.7	-60.3	175.2	0	0	0	109.3	I846	I844-I846 HydrophobicContact CG2-CG1 4.5Å
845	K	26.7	Very low	28	Very low	99 Å²	99	132.4 Å²	132.4	43%	0.43	68%	0.675	S	S	.	*			trans	-87.6	119.7	176.4	-88.8	168.7	167.6	147.1	0	112.2	E843	E843-K845 PolarHBondContact O-N 2.94Å; E843-K845 IonicContact OE1-NZ 2.61Å; E843-K845 WeakPolarHBondContact OE2-CE 3.33Å; E843-K845 IonicContact OE2-NZ 3.89Å; E843-K845 PolarHBondContact OE2-NZ 3.39Å
846	I	31.1	Very low	27.8	Very low	84 Å²	84	135.4 Å²	135.4	43%	0.431	68%	0.676	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.5	115.9	176.1	-57.9	176	0	0	0	108.7	I844	I844-I846 HydrophobicContact CG2-CG1 4.5Å
847	I	27.6	Very low	27.7	Very low	56 Å²	56	131.9 Å²	131.9	29%	0.287	67%	0.673	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.1	121.5	-179.4	-57.3	177.3	0	0	0	109.5	T772 T796 I797 L798 V849	T772-I847 HydrophobicContact CG2-CG2 4.42Å; T796-I847 HydrophobicContact CG2-CD1 4.36Å; I797-I847 PolarHBondContact O-N 3.11Å; L798-I847 HydrophobicContact CD2-CB 4.21Å; I847-V849 HydrophobicContact CG2-CG2 4.45Å
848	T	31	Very low	27.5	Very low	60 Å²	60	135.4 Å²	135.4	37%	0.368	68%	0.675	S	S	.	*			trans	-105.3	108.2	-179.6	-58.4	0	0	0	0	110.4
849	V	27.7	Very low	27.4	Very low	49 Å²	49	130.1 Å²	130.1	30%	0.297	67%	0.672	S	S	.	*			trans	-89.1	126.4	-179.5	-176.2	0	0	0	0	110.5	T770 I847	T770-V849 HydrophobicContact CG2-CG1 4.29Å; I847-V849 HydrophobicContact CG2-CG2 4.45Å
850	R	27.9	Very low	27.1	Very low	183 Å²	183	131.5 Å²	131.5	69%	0.691	67%	0.666	S	S	*	*			trans	-109.4	132.1	176.5	-70	179.9	177	164.4	1.5	110.8
851	T	28.7	Very low	26.9	Very low	122 Å²	122	131.9 Å²	131.9	75%	0.748	67%	0.666	S	S	*	*			trans	-100.5	115.4	177.4	49.3	0	0	0	0	111.2
852	H	26.8	Very low	26.6	Very low	157 Å²	157	133.1 Å²	133.1	73%	0.727	66%	0.664	S	S	*	*			trans	-95.7	145	172.4	-73.8	-96.4	0	0	0	110.9
853	R	28.2	Very low	26.4	Very low	239 Å²	239	136.3 Å²	136.3	90%	0.902	68%	0.676	S	S	*	*			trans	-110.1	86.7	-179.7	-170.6	-176.6	-169	-174.1	2.5	108.7
854	N	28.2	Very low	26.2	Very low	150 Å²	150	140 Å²	140	80%	0.802	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-73.4	138	179.8	-78.3	1.1	0	0	0	111.2
855	H	26.2	Very low	25.8	Very low	183 Å²	183	141.2 Å²	141.2	85%	0.847	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-80.1	153.1	175.5	-107.4	-91.7	0	0	0	111.4
856	E	24.8	Very low	25.7	Very low	179 Å²	179	141.2 Å²	141.2	84%	0.836	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-65.7	135.4	-177.2	-58	168.4	162.7	0	0	112.8
857	S	24.1	Very low	25.3	Very low	115 Å²	115	144.3 Å²	144.3	80%	0.804	72%	0.72	S	S	*	*			trans	-126.1	112	156.9	60.2	0	0	0	0	108.8	G859	S857-G859 PolarHBondContact O-N 3.44Å
858	K	23.8	Very low	25	Very low	197 Å²	197	145.6 Å²	145.6	86%	0.857	74%	0.739	S	S	*	*			trans	-64.1	124.9	-178.9	-64.5	173.9	179.5	175.9	0	110.4
859	G	23.4	Very low	24.8	Very low	78 Å²	78	149.7 Å²	149.7	80%	0.804	76%	0.758	S	S	*	*			trans	-134.2	110.9	170.3	0	0	0	0	0	109.9	S857	S857-G859 PolarHBondContact O-N 3.44Å
860	Y	22.6	Very low	24.6	Very low	204 Å²	204	152.6 Å²	152.6	80%	0.8	78%	0.776	S	S	*	*			trans	-84.1	133.7	174.4	-85.4	-98.4	0	0	0	110.5
861	Q	22.3	Very low	24.5	Very low	187 Å²	187	150.5 Å²	150.5	87%	0.874	78%	0.779	S	S	*	*			trans	170.5	101.6	144.5	-97.3	160.9	-12.7	0	0	106.2
862	N	22.1	Very low	24.2	Very low	130 Å²	130	149.4 Å²	149.4	70%	0.695	78%	0.776	S	S	*	*				40.8	100.1	73.9	-73.2	5.4	0	0	0	112.9
863	N	23.7	Very low	24	Very low	168 Å²	168	149.6 Å²	149.6	90%	0.898	78%	0.781	S	S	*	*			trans	-141.4	113	144.7	-95.1	-26.7	0	0	0	109.5
864	Y	21.8	Very low	23.7	Very low	185 Å²	185	144.7 Å²	144.7	73%	0.725	77%	0.772	S	S	*	*			trans	-66.3	147.6	163.8	-95.8	-117.5	0	0	0	110.9	D866	Y864-D866 WeakPolarHBondContact CD1-OD1 3.26Å
865	V	23.8	Very low	23.4	Very low	141 Å²	141	143.6 Å²	143.6	86%	0.855	77%	0.771	S	S	*	*				-156.8	97.3	128.7	-179.6	0	0	0	0	104.5
866	D	24.4	Very low	23.3	Very low	99 Å²	99	142 Å²	142	53%	0.529	78%	0.775	S	S	.	*				64.6	110.1	78.3	-80.5	-19.3	0	0	0	117.2	Y864	Y864-D866 WeakPolarHBondContact CD1-OD1 3.26Å
867	I	22.2	Very low	23.1	Very low	149 Å²	149	137.8 Å²	137.8	76%	0.764	77%	0.765	S	S	*	*				62.2	117.5	123.7	-57.2	164.6	0	0	0	119.3
868	A	22	Very low	23	Very low	83 Å²	83	140.2 Å²	140.2	69%	0.686	77%	0.769	S	S	*	*			trans	-157.8	149.2	132.8	0	0	0	0	0	112.1
869	D	26.3	Very low	22.9	Very low	146 Å²	146	137.7 Å²	137.7	78%	0.781	76%	0.76	S	S	*	*			trans	77.3	52.6	154.7	-55.3	-10.2	0	0	0	121.5
870	T	23.3	Very low	22.9	Very low	110 Å²	110	140.6 Å²	140.6	68%	0.675	76%	0.757	S	S	*	*				23.2	152.4	115.8	60.7	0	0	0	0	124.2
871	N	25.5	Very low	22.8	Very low	139 Å²	139	137.8 Å²	137.8	74%	0.743	76%	0.756	S	S	*	*			trans	111.6	103.2	153.9	-60	-37.6	0	0	0	115
872	S	22	Very low	22.8	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	76%	0.759	S	S	*	*				67.4	131.5	67.5	82.4	0	0	0	0	111.6
873	I	24.1	Very low	22.8	Very low	160 Å²	160	144.1 Å²	144.1	82%	0.821	77%	0.765	S	S	*	*			cis	-148.1	160.9	42.2	-77.1	172.6	0	0	0	112.3
874	N	21.7	Very low	22.7	Very low	136 Å²	136	143 Å²	143	73%	0.727	76%	0.759	S	S	*	*			trans	-68.9	159.7	178.1	-79.4	-39.2	0	0	0	116.8
875	T	21.7	Very low	22.8	Very low	127 Å²	127	140 Å²	140	78%	0.779	76%	0.755	S	S	*	*			trans	52.6	121.9	143.2	54.3	0	0	0	0	120.6
876	T	23.6	Very low	22.8	Very low	150 Å²	150	139.5 Å²	139.5	92%	0.92	75%	0.752	S	S	*	*				-149.7	120.8	123.7	-3	0	0	0	0	109.5
877	S	20.9	Very low	22.8	Very low	91 Å²	91	139.2 Å²	139.2	64%	0.636	76%	0.759	S	S	*	*			trans	-82.4	137.4	173.8	59.5	0	0	0	0	110.1
878	N	22.1	Very low	22.8	Very low	165 Å²	165	137.5 Å²	137.5	88%	0.882	75%	0.747	S	S	*	*			trans	-115.6	95.7	153.4	-98.6	-14.1	0	0	0	109.1
879	H	22.4	Very low	22.8	Very low	145 Å²	145	141.4 Å²	141.4	67%	0.671	75%	0.751	S	S	*	*				4.9	127.9	124.3	-80.5	-74.2	0	0	0	114.5
880	N	21.7	Very low	22.7	Very low	139 Å²	139	143.4 Å²	143.4	74%	0.743	75%	0.753	S	S	*	*			cis	-162.7	157.7	38.1	-94.7	-37.6	0	0	0	112.2
881	N	21.7	Very low	22.7	Very low	144 Å²	144	144.1 Å²	144.1	77%	0.77	75%	0.753	S	S	*	*			trans	-64.6	144.8	166.6	-63.4	-35.8	0	0	0	111.1
882	Y	22.2	Very low	22.7	Very low	243 Å²	243	146.4 Å²	146.4	95%	0.953	76%	0.756	S	S	*	*			trans	-129.8	67.6	148.6	-125.1	-90	0	0	0	108.9
883	Y	21.1	Very low	22.9	Very low	208 Å²	208	147.3 Å²	147.3	82%	0.816	75%	0.753	S	S	*	*			trans	-138.4	102.9	165.8	-116.1	-77.8	0	0	0	107
884	D	23.2	Very low	22.8	Very low	145 Å²	145	146.3 Å²	146.3	78%	0.775	76%	0.755	S	S	*	*			trans	-154.2	140.4	155.3	-90.8	-45.6	0	0	0	104.1
885	N	23	Very low	23.2	Very low	120 Å²	120	143.3 Å²	143.3	64%	0.642	74%	0.744	S	S	*	*			cis	152.1	137.3	-7.7	-115	-38.2	0	0	0	103
886	V	23	Very low	23.6	Very low	131 Å²	131	145.2 Å²	145.2	79%	0.794	74%	0.742	S	S	*	*			trans	64.7	132.7	144.1	175.7	0	0	0	0	117.2
887	S	24	Very low	23.7	Very low	94 Å²	94	144.2 Å²	144.2	66%	0.657	73%	0.73	S	S	*	*			cis	-178.7	160	-8.8	55	0	0	0	0	108.1
888	E	24	Very low	24.1	Very low	113 Å²	113	144 Å²	144	53%	0.528	73%	0.728	S	S	.	*				-168.3	118.2	129.9	-115.5	-177	-161.3	0	0	112.8	I338	I338-E888 WeakPolarHBondContact CD1-OE1 3.3Å; I338-E888 VanDerWaalsContact CG1-OE1 3.27Å; I338-E888 WeakPolarHBondContact CG1-OE1 3.31Å
889	Q	21.6	Very low	24.6	Very low	164 Å²	164	143.7 Å²	143.7	77%	0.766	72%	0.719	S	S	*	*			trans	-83.5	112.6	161.9	-77.3	179.5	-33.5	0	0	109.2	N891	Q889-N891 VanDerWaalsContact C-N 3.32Å; Q889-N891 PolarHBondContact O-N 3.2Å
890	K	24.5	Very low	25	Very low	189 Å²	189	140.2 Å²	140.2	82%	0.822	71%	0.708	S	S	*	*			trans	-85.7	80.5	155.5	-79.6	-174.4	178.4	174.4	0	109.9	F892	K890-F892 PolarHBondContact O-N 3.46Å
891	N	22.5	Very low	25.4	Very low	125 Å²	125	138.6 Å²	138.6	67%	0.668	70%	0.704	S	S	*	*			trans	-65.3	121.3	160.9	-78.6	-38.8	0	0	0	108.8	Q889	Q889-N891 VanDerWaalsContact C-N 3.32Å; Q889-N891 PolarHBondContact O-N 3.2Å
892	F	25.4	Very low	25.9	Very low	187 Å²	187	139.7 Å²	139.7	82%	0.82	70%	0.704	S	S	*	*			trans	-136.7	115	160.2	-123.6	-90.6	0	0	0	110.9	K890	K890-F892 PolarHBondContact O-N 3.46Å
893	N	25.9	Very low	26.2	Very low	117 Å²	117	135.2 Å²	135.2	63%	0.626	70%	0.696	S	S	*	*			trans	56.5	71.6	161.5	-65.2	-14.2	0	0	0	119.1	S895	N893-S895 PolarHBondContact O-N 3.12Å
894	V	23.5	Very low	26.5	Very low	140 Å²	140	132.1 Å²	132.1	85%	0.848	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	78.4	136.1	-176	0	0	0	0	108.6
895	S	29.7	Very low	26.4	Very low	73 Å²	73	129.8 Å²	129.8	51%	0.51	69%	0.687	S	S	.	*	T	Hydrogen-bonded Turn	trans	-123.2	-14.6	168	70.3	0	0	0	0	113.5	N893	N893-S895 PolarHBondContact O-N 3.12Å
896	F	29	Very low	26.4	Very low	167 Å²	167	130.1 Å²	130.1	73%	0.732	69%	0.694	S	S	*	*	S	Bend	trans	-81.9	-36.5	-178.1	-146.6	-98.7	0	0	0	113.6	S898 K899	F896-S898 VanDerWaalsContact C-N 3.31Å; F896-S898 PolarHBondContact O-N 2.98Å; F896-K899 PolarHBondContact O-N 3.37Å; F896-K899 VanDerWaalsContact O-N 3.17Å
897	L	25.4	Very low	26.5	Very low	129 Å²	129	129.9 Å²	129.9	68%	0.675	69%	0.688	S	S	*	*	H	α-helix	trans	-74.2	-16.5	-179	-87.6	160.1	0	0	0	114.4	K899 T901	L897-K899 PolarHBondContact O-N 2.82Å; L897-T901 PolarHBondContact O-OG1 3.16Å
898	S	29.7	Very low	26.5	Very low	85 Å²	85	133.8 Å²	133.8	59%	0.594	70%	0.701	S	S	*	*	H	α-helix	trans	-66.8	-27.1	169.2	-173.1	0	0	0	0	112.3	F896	F896-S898 VanDerWaalsContact C-N 3.31Å; F896-S898 PolarHBondContact O-N 2.98Å
899	K	32.5	Very low	26.5	Very low	159 Å²	159	138.1 Å²	138.1	69%	0.691	71%	0.713	S	S	*	*	H	α-helix	trans	-87.9	-17.8	-174.2	-116.3	179.5	179.9	-179.1	0	115.1	F896 L897	F896-K899 PolarHBondContact O-N 3.37Å; F896-K899 VanDerWaalsContact O-N 3.17Å; L897-K899 PolarHBondContact O-N 2.82Å
900	V	31.6	Very low	26.5	Very low	72 Å²	72	136.4 Å²	136.4	44%	0.436	71%	0.714	S	S	.	*	H	α-helix	trans	-88.3	-38.8	-179.5	-177.4	0	0	0	0	111.2	Q902 L903	V900-Q902 VanDerWaalsContact C-N 3.26Å; V900-Q902 PolarHBondContact O-N 3.1Å; V900-L903 PolarHBondContact O-N 3.12Å; V900-L903 VanDerWaalsContact O-N 3.16Å
901	T	29.1	Very low	26.6	Very low	106 Å²	106	134.1 Å²	134.1	65%	0.65	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-17.7	-179.2	-36.9	0	0	0	0	113.5	L897 L903	L897-T901 PolarHBondContact O-OG1 3.16Å; T901-L903 VanDerWaalsContact C-N 3.34Å
902	Q	32.3	Very low	26.5	Very low	166 Å²	166	135.3 Å²	135.3	78%	0.776	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-2.1	172.6	-98.6	-173.6	-12.8	0	0	114.5	V900	V900-Q902 VanDerWaalsContact C-N 3.26Å; V900-Q902 PolarHBondContact O-N 3.1Å
903	L	30	Very low	26.5	Very low	149 Å²	149	131.8 Å²	131.8	78%	0.78	71%	0.714	S	S	*	*	S	Bend	trans	-113.5	6.2	-173.8	-112.2	156.8	0	0	0	114.8	V900 T901	V900-L903 PolarHBondContact O-N 3.12Å; V900-L903 VanDerWaalsContact O-N 3.16Å; T901-L903 VanDerWaalsContact C-N 3.34Å
904	I	26.6	Very low	26.3	Very low	143 Å²	143	134.6 Å²	134.6	73%	0.733	72%	0.723	S	S	*	*	S	Bend	trans	-124.8	24.7	-179	-44.1	-177.7	0	0	0	111.2
905	S	21.9	Very low	26.2	Very low	96 Å²	96	133 Å²	133	67%	0.671	72%	0.719	S	S	*	*	S	Bend	trans	-140.3	45.6	-175	-64	0	0	0	0	114.8
906	T	23.3	Very low	25.9	Very low	128 Å²	128	134.6 Å²	134.6	79%	0.785	73%	0.73	S	S	*	*	S	Bend	trans	-161.7	162.2	155	14.7	0	0	0	0	111.5
907	D	24.9	Very low	25.6	Very low	126 Å²	126	133 Å²	133	67%	0.674	73%	0.733	S	S	*	*			trans	73.3	49.4	164.4	-57.7	-20.6	0	0	0	119.6	R909	D907-R909 VanDerWaalsContact C-N 3.34Å
908	N	22.6	Very low	25.5	Very low	175 Å²	175	132.7 Å²	132.7	94%	0.936	74%	0.74	S	S	*	*			trans	-92.7	72.7	133.3	-99.1	-24.6	0	0	0	109.2
909	R	24.6	Very low	25.1	Very low	204 Å²	204	136.2 Å²	136.2	77%	0.77	75%	0.747	S	S	*	*			trans	-95.3	100	178	-152.2	174.2	-168.6	174.6	2.1	109.6	D907 N911	D907-R909 VanDerWaalsContact C-N 3.34Å; R909-N911 PolarHBondContact O-N 3.06Å
910	T	21.5	Very low	24.6	Very low	128 Å²	128	136.4 Å²	136.4	79%	0.785	75%	0.747	S	S	*	*			trans	-63.4	100	176.6	45.7	0	0	0	0	111.5
911	N	26	Very low	24.2	Very low	142 Å²	142	141.2 Å²	141.2	76%	0.759	77%	0.765	S	S	*	*			trans	-91.3	98.3	164.8	-80.9	-5.2	0	0	0	109.5	R909 S913	R909-N911 PolarHBondContact O-N 3.06Å; N911-S913 PolarHBondContact O-N 3.07Å
912	I	21.7	Very low	23.8	Very low	149 Å²	149	143.2 Å²	143.2	76%	0.764	77%	0.771	S	S	*	*			trans	-63.4	128.6	166.7	-62.3	165	0	0	0	107.9
913	S	25	Very low	23.3	Very low	114 Å²	114	140.4 Å²	140.4	80%	0.797	77%	0.765	S	S	*	*			trans	-144.4	92	162	32.6	0	0	0	0	109.2	N911	N911-S913 PolarHBondContact O-N 3.07Å
914	E	21.5	Very low	23	Very low	176 Å²	176	141.1 Å²	141.1	82%	0.822	76%	0.764	S	S	*	*			trans	-62.6	138.9	156.6	-59.9	172.4	127.1	0	0	108.5
915	S	22.4	Very low	22.8	Very low	107 Å²	107	142.5 Å²	142.5	75%	0.748	77%	0.768	S	S	*	*				169.5	145.5	120.7	45.6	0	0	0	0	113.8
916	S	23.2	Very low	23	Very low	106 Å²	106	148.4 Å²	148.4	74%	0.741	78%	0.775	S	S	*	*			trans	49.3	108.5	152.2	48.1	0	0	0	0	120.5
917	T	21.4	Very low	22.9	Very low	132 Å²	132	150.2 Å²	150.2	81%	0.81	78%	0.775	S	S	*	*			trans	-39.3	147.2	144.5	42.7	0	0	0	0	114.5
918	P	24.4	Very low	22.8	Very low	124 Å²	124	151 Å²	151	81%	0.805	78%	0.777	S	S	*	*			trans	-86.9	141.5	-179.3	34.7	-34.4	0	0	0	113.3
919	E	21.5	Very low	22.9	Very low	159 Å²	159	150.7 Å²	150.7	74%	0.743	77%	0.77	S	S	*	*			trans	-129.8	115.7	152.7	-86.8	-151.9	107.8	0	0	111.2
920	K	22.1	Very low	22.9	Very low	162 Å²	162	149.5 Å²	149.5	70%	0.704	77%	0.774	S	S	*	*			trans	65.1	144.6	139.6	-70.4	174.2	-177.6	140.3	0	122
921	E	22.7	Very low	22.9	Very low	173 Å²	173	151.9 Å²	151.9	81%	0.808	78%	0.776	S	S	*	*			trans	68	146.8	158.3	-71.3	175.4	-177.6	0	0	118.1
922	L	21	Very low	22.8	Very low	148 Å²	148	151 Å²	151	78%	0.775	78%	0.775	S	S	*	*			cis	-165.9	153.1	-31.1	-158.3	75.8	0	0	0	106.6
923	V	22.3	Very low	23.7	Very low	107 Å²	107	148.8 Å²	148.8	65%	0.648	77%	0.771	S	S	*	*			trans	78.2	135.3	158.4	-167.8	0	0	0	0	120.1
924	Q	22.5	Very low	23.8	Very low	165 Å²	165	151 Å²	151	77%	0.771	77%	0.772	S	S	*	*			trans	89	110.8	151.7	-89.8	158.4	26.4	0	0	122.9
925	E	23.2	Very low	23.8	Very low	172 Å²	172	148.8 Å²	148.8	80%	0.804	77%	0.766	S	S	*	*			trans	-55.5	145.8	157.7	-53.9	158.4	118.4	0	0	114.1
926	R	24.7	Very low	24	Very low	219 Å²	219	149.3 Å²	149.3	83%	0.826	76%	0.76	S	S	*	*			trans	-176.3	106.8	135.4	-98.9	172.4	-122.2	-160.1	1.2	105.5
927	Q	22.3	Very low	23.9	Very low	167 Å²	167	154.5 Å²	154.5	78%	0.78	76%	0.763	S	S	*	*				59.7	151.7	77.9	-73.1	-161.9	-8.1	0	0	114.7
928	I	23.4	Very low	24	Very low	142 Å²	142	154 Å²	154	73%	0.728	76%	0.761	S	S	*	*			trans	80.5	126.6	174.7	-50.4	166	0	0	0	111.8
929	E	24.4	Very low	23.8	Very low	168 Å²	168	153.2 Å²	153.2	79%	0.785	76%	0.758	S	S	*	*			cis	-152.8	126.6	-0.8	-110.2	155.2	172.5	0	0	105.7
930	Q	23.8	Very low	23.9	Very low	180 Å²	180	152.7 Å²	152.7	84%	0.841	77%	0.765	S	S	*	*				26.6	111.6	78.6	-96.5	-167.5	3.9	0	0	118.4
931	Q	21.7	Very low	23.8	Very low	177 Å²	177	153.3 Å²	153.3	83%	0.827	77%	0.768	S	S	*	*			trans	157.3	155.5	133.7	-90	-178.9	33.2	0	0	111
932	V	24.1	Very low	23.7	Very low	124 Å²	124	151.6 Å²	151.6	75%	0.752	76%	0.763	S	S	*	*			cis	-165.9	163.6	-30.2	109.4	0	0	0	0	106.7
933	P	40.2	Very low	23.8	Very low	103 Å²	103	151 Å²	151	67%	0.669	76%	0.761	S	S	*	*			trans	-90.9	171.7	-157.9	36.4	-39.4	0	0	0	116.5
934	I	26.8	Very low	23.8	Very low	160 Å²	160	151.8 Å²	151.8	82%	0.821	77%	0.766	S	S	*	*			trans	-118.6	107.3	162	-59.1	175.8	0	0	0	104.6
935	N	22.3	Very low	23.7	Very low	129 Å²	129	151.5 Å²	151.5	69%	0.69	77%	0.769	S	S	*	*				52.6	132.1	95.7	-65.9	-9.9	0	0	0	112.8
936	D	26.2	Very low	23.7	Very low	119 Å²	119	152.7 Å²	152.7	64%	0.636	77%	0.774	S	S	*	*			cis	-154.3	169.5	28.2	-128.2	-44.2	0	0	0	114.3
937	R	20.9	Very low	23.6	Very low	214 Å²	214	148.8 Å²	148.8	81%	0.808	78%	0.775	S	S	*	*			trans	-13.7	154	154	-70.5	165	165.4	163.2	-7.3	118.1
938	T	23.1	Very low	23.6	Very low	123 Å²	123	145.1 Å²	145.1	76%	0.755	77%	0.773	S	S	*	*			cis	-159.9	160.2	16	-6.5	0	0	0	0	111.3
939	S	20.6	Very low	23.5	Very low	106 Å²	106	147.3 Å²	147.3	74%	0.741	78%	0.781	S	S	*	*			trans	-60.1	132	169	52.6	0	0	0	0	114.2
940	V	22.7	Very low	23.4	Very low	149 Å²	149	144.4 Å²	144.4	90%	0.903	78%	0.778	S	S	*	*			trans	-116.9	111.1	147	-178.8	0	0	0	0	107.4
941	K	21.2	Very low	23.3	Very low	174 Å²	174	147.1 Å²	147.1	76%	0.757	78%	0.781	S	S	*	*			trans	-108.6	157.5	174.8	-151.6	-177.6	-173.5	-179.9	0	106.5
942	I	21	Very low	23.4	Very low	137 Å²	137	145.9 Å²	145.9	70%	0.703	78%	0.779	S	S	*	*			trans	75.8	130.5	167.7	-55.7	156.3	0	0	0	111.4
943	N	22.5	Very low	23.2	Very low	137 Å²	137	147.8 Å²	147.8	73%	0.733	79%	0.785	S	S	*	*			cis	-145.3	160.6	16.8	-130.9	-13	0	0	0	114.1
944	T	21.9	Very low	22.5	Very low	123 Å²	123	148.8 Å²	148.8	76%	0.755	79%	0.789	S	S	*	*			trans	-55.6	129.3	160.6	38.4	0	0	0	0	112.1
945	L	21.3	Very low	22.4	Very low	159 Å²	159	146.3 Å²	146.3	83%	0.832	79%	0.786	S	S	*	*			trans	-126.8	112.5	153.6	-94	167.4	0	0	0	108.4	T947	L945-T947 PolarHBondContact O-N 2.93Å; L945-T947 VanDerWaalsContact O-N 3.16Å
946	Q	21.8	Very low	22.6	Very low	197 Å²	197	149 Å²	149	92%	0.921	79%	0.791	S	S	*	*			trans	-66.6	105.7	165	-69.7	167	-61.7	0	0	107.8
947	T	23.8	Very low	22.6	Very low	136 Å²	136	146.6 Å²	146.6	83%	0.834	78%	0.782	S	S	*	*			trans	-98.4	117.8	163.4	-43.3	0	0	0	0	107.2	L945	L945-T947 PolarHBondContact O-N 2.93Å; L945-T947 VanDerWaalsContact O-N 3.16Å
948	A	21.5	Very low	23.3	Very low	91 Å²	91	140.6 Å²	140.6	75%	0.752	77%	0.769	S	S	*	*			trans	-54.9	151.4	-163.9	0	0	0	0	0	114.5	S950	A948-S950 PolarHBondContact O-N 3.28Å
949	E	21.3	Very low	23.6	Very low	188 Å²	188	140.2 Å²	140.2	88%	0.879	76%	0.763	S	S	*	*			trans	-41.8	112.2	171.9	-62.6	170.2	144.4	0	0	111.3	R951	E949-R951 VanDerWaalsContact C-N 3.31Å; E949-R951 PolarHBondContact O-N 3.01Å
950	S	22.4	Very low	24.4	Very low	106 Å²	106	141.3 Å²	141.3	74%	0.741	76%	0.76	S	S	*	*			trans	-63.4	96	167.8	47.8	0	0	0	0	108.2	A948 L952	A948-S950 PolarHBondContact O-N 3.28Å; S950-L952 PolarHBondContact O-N 3.21Å
951	R	21.5	Very low	24.9	Very low	237 Å²	237	138.9 Å²	138.9	89%	0.894	74%	0.739	S	S	*	*			trans	-45.3	102.9	176	-73.7	178.4	173.3	169.9	-2.8	109.5	E949 L953	E949-R951 VanDerWaalsContact C-N 3.31Å; E949-R951 PolarHBondContact O-N 3.01Å; R951-L953 PolarHBondContact O-N 3.42Å
952	L	23.5	Very low	25.5	Very low	151 Å²	151	134 Å²	134	79%	0.791	72%	0.721	S	S	*	*			trans	-68.1	100.3	177.1	-136.1	90.8	0	0	0	106.9	S950 T954	S950-L952 PolarHBondContact O-N 3.21Å; L952-T954 VanDerWaalsContact C-N 3.34Å; L952-T954 PolarHBondContact O-N 3Å
953	L	21.6	Very low	26.2	Very low	165 Å²	165	134.8 Å²	134.8	86%	0.864	72%	0.719	S	S	*	*			trans	-66.1	97.6	173	-82.6	162.1	0	0	0	107.8	R951 S955	R951-L953 PolarHBondContact O-N 3.42Å; L953-S955 VanDerWaalsContact C-N 3.27Å; L953-S955 PolarHBondContact O-N 3.14Å
954	T	24.1	Very low	27	Very low	123 Å²	123	132.9 Å²	132.9	76%	0.755	71%	0.706	S	S	*	*			trans	-66.4	83.1	178.3	50.9	0	0	0	0	110	L952 K956	L952-T954 VanDerWaalsContact C-N 3.34Å; L952-T954 PolarHBondContact O-N 3Å; T954-K956 PolarHBondContact O-N 3.37Å
955	S	25.4	Very low	27.7	Very low	108 Å²	108	131.1 Å²	131.1	76%	0.755	69%	0.689	S	S	*	*			trans	-64.3	121.1	170.5	57.1	0	0	0	0	109.3	L953	L953-S955 VanDerWaalsContact C-N 3.27Å; L953-S955 PolarHBondContact O-N 3.14Å
956	K	26.7	Very low	28.4	Very low	187 Å²	187	127.6 Å²	127.6	81%	0.813	67%	0.67	S	S	*	*			trans	-42.9	123.2	-177.9	-61.5	174.2	178.5	-178.7	0	112.3	T954 T958	T954-K956 PolarHBondContact O-N 3.37Å; K956-T958 PolarHBondContact O-N 2.96Å
957	P	27	Very low	29.3	Very low	68 Å²	68	120.3 Å²	120.3	44%	0.442	64%	0.641	S	S	.	*			trans	-70.3	128.8	169.4	29.6	-32.2	0	0	0	109.2	Q961	P957-Q961 VanDerWaalsContact CA-OE1 3.27Å; P957-Q961 VanDerWaalsContact CB-OE1 3.31Å
958	T	33.8	Very low	30.2	Very low	87 Å²	87	118.2 Å²	118.2	53%	0.534	62%	0.62	S	S	.	*			trans	-80.7	156.3	176.8	47.2	0	0	0	0	110.9	K956 N960 Q961	K956-T958 PolarHBondContact O-N 2.96Å; T958-N960 PolarHBondContact O-N 3.06Å; T958-Q961 WeakPolarHBondContact O-CB 3.36Å; T958-Q961 PolarHBondContact O-N 2.67Å
959	N	29.4	Very low	30.9	Very low	116 Å²	116	115.5 Å²	115.5	62%	0.62	59%	0.593	S	S	*	*	H	α-helix	trans	-48.1	-34.6	-179.8	-69.3	1	0	0	0	113.3	Q961 L962 F963	N959-Q961 VanDerWaalsContact C-N 3.31Å; N959-Q961 PolarHBondContact O-N 2.74Å; N959-L962 PolarHBondContact O-N 3.42Å; N959-F963 WeakPolarHBondContact O-CB 3.43Å; N959-F963 PolarHBondContact O-N 2.63Å
960	N	37.4	Very low	31.8	Very low	129 Å²	129	112.8 Å²	112.8	69%	0.69	58%	0.579	S	S	*	*	H	α-helix	trans	-59.9	-36.4	176.3	-67.3	-3.7	0	0	0	112.8	T958 E964	T958-N960 PolarHBondContact O-N 3.06Å; N960-E964 WeakPolarHBondContact O-CB 3.36Å; N960-E964 PolarHBondContact O-N 3Å
961	Q	34.3	Very low	32.9	Very low	98 Å²	98	112 Å²	112	46%	0.458	57%	0.566	S	S	.	*	H	α-helix	trans	-71.2	-40.9	179.2	-68.4	-176.4	-18.9	0	0	112.3	P957 T958 N959 E964 H965	P957-Q961 VanDerWaalsContact CA-OE1 3.27Å; P957-Q961 VanDerWaalsContact CB-OE1 3.31Å; T958-Q961 WeakPolarHBondContact O-CB 3.36Å; T958-Q961 PolarHBondContact O-N 2.67Å; N959-Q961 VanDerWaalsContact C-N 3.31Å; N959-Q961 PolarHBondContact O-N 2.74Å; Q961-E964 PolarHBondContact O-N 3.47Å; Q961-H965 VanDerWaalsContact O-CB 3.29Å; Q961-H965 WeakPolarHBondContact O-CB 3.4Å; Q961-H965 PolarHBondContact O-CD2 2.92Å; Q961-H965 PolarHBondContact O-N 2.89Å
962	L	32.5	Very low	33.7	Very low	71 Å²	71	106.7 Å²	106.7	37%	0.372	55%	0.549	S	S	.	.	H	α-helix	trans	-64.9	-45.2	175.3	-162.8	99.9	0	0	0	110.4	N959 E964 H965 I966	N959-L962 PolarHBondContact O-N 3.42Å; L962-E964 PolarHBondContact O-N 3.39Å; L962-H965 PolarHBondContact O-N 3.28Å; L962-I966 HydrophobicContact CD2-CD1 3.93Å; L962-I966 HydrophobicContact CG-CD1 4.08Å; L962-I966 WeakPolarHBondContact O-CG1 3.32Å; L962-I966 PolarHBondContact O-N 3.37Å
963	F	35.8	Very low	34.4	Very low	153 Å²	153	102.2 Å²	102.2	67%	0.671	53%	0.526	S	S	*	.	H	α-helix	trans	-64.8	-39.3	177.9	-159.9	-87.4	0	0	0	112.5	N959 S967	N959-F963 WeakPolarHBondContact O-CB 3.43Å; N959-F963 PolarHBondContact O-N 2.63Å; F963-S967 WeakPolarHBondContact O-CB 3.33Å; F963-S967 PolarHBondContact O-N 3.01Å; F963-S967 PolarHBondContact O-OG 3.28Å
964	E	41.1	Very low	35.3	Very low	97 Å²	97	97.7 Å²	97.7	45%	0.453	50%	0.502	S	S	.	.	H	α-helix	trans	-69.3	-35.6	174.9	-161.9	-161.2	-174.6	0	0	111.4	N960 Q961 L962 K968	N960-E964 WeakPolarHBondContact O-CB 3.36Å; N960-E964 PolarHBondContact O-N 3Å; Q961-E964 PolarHBondContact O-N 3.47Å; L962-E964 PolarHBondContact O-N 3.39Å; E964-K968 VanDerWaalsContact CD-CE 3.49Å; E964-K968 HydrophobicContact CG-CD 4.24Å; E964-K968 VanDerWaalsContact O-CB 3.24Å; E964-K968 WeakPolarHBondContact O-CB 3.41Å; E964-K968 WeakPolarHBondContact O-CD 3.34Å; E964-K968 WeakPolarHBondContact O-CG 3.32Å; E964-K968 PolarHBondContact O-N 2.87Å; E964-K968 WeakPolarHBondContact OE1-CE 3.28Å; E964-K968 IonicContact OE1-NZ 2.86Å; E964-K968 PolarHBondContact OE1-NZ 3.37Å; E964-K968 IonicContact OE2-NZ 2.84Å; E964-K968 PolarHBondContact OE2-NZ 3.32Å
965	H	35.7	Very low	36	Very low	87 Å²	87	95.7 Å²	95.7	40%	0.403	49%	0.486	S	S	.	.	H	α-helix	trans	-69.8	-41.5	174.8	-86.8	-130.7	0	0	0	112.6	Q961 L962 K968 L969	Q961-H965 VanDerWaalsContact O-CB 3.29Å; Q961-H965 WeakPolarHBondContact O-CB 3.4Å; Q961-H965 PolarHBondContact O-CD2 2.92Å; Q961-H965 PolarHBondContact O-N 2.89Å; L962-H965 PolarHBondContact O-N 3.28Å; H965-K968 PolarHBondContact O-N 3.47Å; H965-L969 WeakPolarHBondContact O-CB 3.11Å; H965-L969 PolarHBondContact O-N 2.96Å
966	I	36.5	Very low	36.4	Very low	84 Å²	84	94.8 Å²	94.8	43%	0.431	47%	0.469	S	S	.	.	H	α-helix	trans	-67.9	-41.6	175.2	-67.5	168	0	0	0	110.5	L962 L969 K970 L997	L962-I966 HydrophobicContact CD2-CD1 3.93Å; L962-I966 HydrophobicContact CG-CD1 4.08Å; L962-I966 WeakPolarHBondContact O-CG1 3.32Å; L962-I966 PolarHBondContact O-N 3.37Å; I966-L969 PolarHBondContact O-N 3.07Å; I966-K970 WeakPolarHBondContact O-CB 3.22Å; I966-K970 PolarHBondContact O-N 3.17Å; I966-L997 HydrophobicContact CG1-CD1 4.43Å
967	S	40.6	Very low	36.9	Very low	45 Å²	45	90.1 Å²	90.1	32%	0.315	46%	0.456	S	S	.	.	H	α-helix	trans	-59.6	-47	170	-72.7	0	0	0	0	111.6	F963 L969 K970 D971	F963-S967 WeakPolarHBondContact O-CB 3.33Å; F963-S967 PolarHBondContact O-N 3.01Å; F963-S967 PolarHBondContact O-OG 3.28Å; S967-L969 VanDerWaalsContact C-N 3.3Å; S967-L969 PolarHBondContact O-N 2.77Å; S967-K970 PolarHBondContact O-N 3.45Å; S967-D971 WeakPolarHBondContact O-CB 3.25Å; S967-D971 VanDerWaalsContact O-CG 3.29Å; S967-D971 PolarHBondContact O-N 2.84Å
968	K	42.3	Very low	37.4	Very low	91 Å²	91	94.5 Å²	94.5	40%	0.396	46%	0.463	S	S	.	.	H	α-helix	trans	-62.2	-32.8	176.2	-77.9	166.8	-177.2	165.1	0	113.1	E964 H965 K972	E964-K968 VanDerWaalsContact CD-CE 3.49Å; E964-K968 HydrophobicContact CG-CD 4.24Å; E964-K968 VanDerWaalsContact O-CB 3.24Å; E964-K968 WeakPolarHBondContact O-CB 3.41Å; E964-K968 WeakPolarHBondContact O-CD 3.34Å; E964-K968 WeakPolarHBondContact O-CG 3.32Å; E964-K968 PolarHBondContact O-N 2.87Å; E964-K968 WeakPolarHBondContact OE1-CE 3.28Å; E964-K968 IonicContact OE1-NZ 2.86Å; E964-K968 PolarHBondContact OE1-NZ 3.37Å; E964-K968 IonicContact OE2-NZ 2.84Å; E964-K968 PolarHBondContact OE2-NZ 3.32Å; H965-K968 PolarHBondContact O-N 3.47Å; K968-K972 VanDerWaalsContact O-CB 3.23Å; K968-K972 WeakPolarHBondContact O-CB 3.23Å; K968-K972 WeakPolarHBondContact O-CG 3.33Å; K968-K972 PolarHBondContact O-N 3.29Å
969	L	37	Very low	37.2	Very low	35 Å²	35	95.7 Å²	95.7	18%	0.183	47%	0.466	C	S	.	.	H	α-helix	trans	-69.8	-48.4	173.7	173.7	58.8	0	0	0	110.5	H965 I966 S967 K972 I973 T993	H965-L969 WeakPolarHBondContact O-CB 3.11Å; H965-L969 PolarHBondContact O-N 2.96Å; I966-L969 PolarHBondContact O-N 3.07Å; S967-L969 VanDerWaalsContact C-N 3.3Å; S967-L969 PolarHBondContact O-N 2.77Å; L969-K972 PolarHBondContact O-N 3.35Å; L969-I973 HydrophobicContact CD1-CD1 3.77Å; L969-I973 HydrophobicContact CD1-CG1 4.19Å; L969-I973 HydrophobicContact CG-CD1 3.98Å; L969-I973 WeakPolarHBondContact O-CG1 3.25Å; L969-I973 PolarHBondContact O-N 3.07Å; L969-T993 HydrophobicContact CB-CG2 4.46Å; L969-T993 HydrophobicContact CD1-CG2 3.84Å; L969-T993 HydrophobicContact CD2-CG2 4.33Å; L969-T993 HydrophobicContact CG-CG2 4.43Å
970	K	39.7	Very low	37.2	Very low	131 Å²	131	96.4 Å²	96.4	57%	0.57	47%	0.465	S	S	*	.	H	α-helix	trans	-58.6	-50.1	176.3	-175.6	-178.7	176.9	-178.9	0	111.5	I966 S967 K972 I973 D974	I966-K970 WeakPolarHBondContact O-CB 3.22Å; I966-K970 PolarHBondContact O-N 3.17Å; S967-K970 PolarHBondContact O-N 3.45Å; K970-K972 VanDerWaalsContact C-N 3.32Å; K970-K972 PolarHBondContact O-N 2.88Å; K970-I973 PolarHBondContact O-N 2.8Å; K970-I973 VanDerWaalsContact O-N 3.1Å; K970-D974 WeakPolarHBondContact O-CB 3.5Å; K970-D974 PolarHBondContact O-N 2.87Å
971	D	46	Very low	37	Very low	88 Å²	88	97.1 Å²	97.1	47%	0.471	47%	0.469	S	S	.	.	H	α-helix	trans	-61.8	-38.9	177	-70.2	-20.1	0	0	0	111.4	S967 I973 D974 I975	S967-D971 WeakPolarHBondContact O-CB 3.25Å; S967-D971 VanDerWaalsContact O-CG 3.29Å; S967-D971 PolarHBondContact O-N 2.84Å; D971-I973 PolarHBondContact O-N 2.84Å; D971-D974 PolarHBondContact O-N 2.96Å; D971-I975 WeakPolarHBondContact O-CB 3.32Å; D971-I975 WeakPolarHBondContact O-CD1 3.39Å; D971-I975 WeakPolarHBondContact O-CG1 3.18Å; D971-I975 PolarHBondContact O-N 2.91Å
972	K	38.5	Very low	37.2	Very low	126 Å²	126	97.2 Å²	97.2	55%	0.548	47%	0.472	S	S	.	.	H	α-helix	trans	-63.5	-38.8	173.1	-84.6	175.4	177.9	179.4	0	112.7	K968 L969 K970 K976	K968-K972 VanDerWaalsContact O-CB 3.23Å; K968-K972 WeakPolarHBondContact O-CB 3.23Å; K968-K972 WeakPolarHBondContact O-CG 3.33Å; K968-K972 PolarHBondContact O-N 3.29Å; L969-K972 PolarHBondContact O-N 3.35Å; K970-K972 VanDerWaalsContact C-N 3.32Å; K970-K972 PolarHBondContact O-N 2.88Å; K972-K976 VanDerWaalsContact O-CB 3.29Å; K972-K976 WeakPolarHBondContact O-CB 3.23Å; K972-K976 PolarHBondContact O-N 3.37Å
973	I	37.6	Very low	37.4	Very low	58 Å²	58	98.3 Å²	98.3	30%	0.297	48%	0.484	S	S	.	.	H	α-helix	trans	-68.7	-47.4	175.9	-68.5	166.5	0	0	0	109.8	L969 K970 D971 I975 K976 T977 L990	L969-I973 HydrophobicContact CD1-CD1 3.77Å; L969-I973 HydrophobicContact CD1-CG1 4.19Å; L969-I973 HydrophobicContact CG-CD1 3.98Å; L969-I973 WeakPolarHBondContact O-CG1 3.25Å; L969-I973 PolarHBondContact O-N 3.07Å; K970-I973 PolarHBondContact O-N 2.8Å; K970-I973 VanDerWaalsContact O-N 3.1Å; D971-I973 PolarHBondContact O-N 2.84Å; I973-I975 VanDerWaalsContact C-N 3.32Å; I973-I975 PolarHBondContact O-N 3.13Å; I973-K976 PolarHBondContact O-N 2.91Å; I973-T977 HydrophobicContact CG2-CG2 4.21Å; I973-T977 VanDerWaalsContact O-CB 3.32Å; I973-T977 WeakPolarHBondContact O-CB 3.44Å; I973-T977 VanDerWaalsContact O-CG2 3.27Å; I973-T977 WeakPolarHBondContact O-CG2 3.16Å; I973-T977 PolarHBondContact O-N 3.43Å; I973-T977 PolarHBondContact O-OG1 3.14Å; I973-L990 HydrophobicContact CD1-CD1 4.02Å; I973-L990 HydrophobicContact CG1-CD1 4.19Å
974	D	39.8	Very low	37.6	Very low	69 Å²	69	98 Å²	98	37%	0.369	48%	0.484	S	S	.	.	H	α-helix	trans	-66.1	-29.9	178.9	-79.4	-15.8	0	0	0	112.9	K970 D971 T977 R978	K970-D974 WeakPolarHBondContact O-CB 3.5Å; K970-D974 PolarHBondContact O-N 2.87Å; D971-D974 PolarHBondContact O-N 2.96Å; D974-T977 PolarHBondContact O-OG1 3.44Å; D974-R978 WeakPolarHBondContact O-CD 3.45Å; D974-R978 VanDerWaalsContact O-CG 3.3Å; D974-R978 WeakPolarHBondContact O-CG 3.29Å; D974-R978 PolarHBondContact O-NE 3.47Å
975	I	39	Very low	37.4	Very low	82 Å²	82	94.1 Å²	94.1	42%	0.421	47%	0.47	S	S	.	.	H	α-helix	trans	-78.6	-47.3	173.9	-68.8	165.1	0	0	0	110.7	D971 I973 R978 I979	D971-I975 WeakPolarHBondContact O-CB 3.32Å; D971-I975 WeakPolarHBondContact O-CD1 3.39Å; D971-I975 WeakPolarHBondContact O-CG1 3.18Å; D971-I975 PolarHBondContact O-N 2.91Å; I973-I975 VanDerWaalsContact C-N 3.32Å; I973-I975 PolarHBondContact O-N 3.13Å; I975-R978 PolarHBondContact O-N 2.93Å; I975-I979 HydrophobicContact CG2-CD1 4.08Å; I975-I979 PolarHBondContact O-N 3.45Å; I975-I979 VanDerWaalsContact O-N 3.1Å
976	K	34.8	Very low	37.3	Very low	89 Å²	89	92 Å²	92	39%	0.387	46%	0.462	S	S	.	.	H	α-helix	trans	-73.8	-24.3	-179.2	-76.1	-162	170.8	-163.3	0	114.2	K972 I973 R978 G985 L986 N989	K972-K976 VanDerWaalsContact O-CB 3.29Å; K972-K976 WeakPolarHBondContact O-CB 3.23Å; K972-K976 PolarHBondContact O-N 3.37Å; I973-K976 PolarHBondContact O-N 2.91Å; K976-R978 VanDerWaalsContact C-N 3.26Å; K976-G985 PolarHBondContact NZ-O 3.07Å; K976-L986 HydrophobicContact CB-CD1 3.81Å; K976-L986 HydrophobicContact CB-CG 4.14Å; K976-L986 HydrophobicContact CD-CG 4.16Å; K976-N989 PolarHBondContact NZ-ND2 3.38Å
977	T	37.3	Very low	37.4	Very low	89 Å²	89	93.7 Å²	93.7	55%	0.546	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-19.8	170	50.1	0	0	0	0	112.7	I973 D974	I973-T977 HydrophobicContact CG2-CG2 4.21Å; I973-T977 VanDerWaalsContact O-CB 3.32Å; I973-T977 WeakPolarHBondContact O-CB 3.44Å; I973-T977 VanDerWaalsContact O-CG2 3.27Å; I973-T977 WeakPolarHBondContact O-CG2 3.16Å; I973-T977 PolarHBondContact O-N 3.43Å; I973-T977 PolarHBondContact O-OG1 3.14Å; D974-T977 PolarHBondContact O-OG1 3.44Å
978	R	36.2	Very low	37.6	Very low	159 Å²	159	99.3 Å²	99.3	60%	0.6	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-31.8	171.4	-68.1	177.8	-160.5	-154.9	6.3	113.3	D974 I975 K976 H980	D974-R978 WeakPolarHBondContact O-CD 3.45Å; D974-R978 VanDerWaalsContact O-CG 3.3Å; D974-R978 WeakPolarHBondContact O-CG 3.29Å; D974-R978 PolarHBondContact O-NE 3.47Å; I975-R978 PolarHBondContact O-N 2.93Å; K976-R978 VanDerWaalsContact C-N 3.26Å; R978-H980 PolarHBondContact O-N 3.49Å
979	I	29.5	Very low	37.5	Very low	113 Å²	113	98.8 Å²	98.8	58%	0.579	49%	0.491	S	S	*	.	S	Bend	trans	-94.3	90.2	179.4	-56	176.2	0	0	0	109.1	I975 D981	I975-I979 HydrophobicContact CG2-CD1 4.08Å; I975-I979 PolarHBondContact O-N 3.45Å; I975-I979 VanDerWaalsContact O-N 3.1Å; I979-D981 PolarHBondContact O-N 2.88Å
980	H	29.5	Very low	37.5	Very low	130 Å²	130	99.9 Å²	99.9	60%	0.602	50%	0.497	S	S	*	.			trans	-45.7	126.9	164.1	-103.9	-104.3	0	0	0	111.7	R978	R978-H980 PolarHBondContact O-N 3.49Å
981	D	34.1	Very low	37.5	Very low	145 Å²	145	98.6 Å²	98.6	78%	0.775	50%	0.496	S	S	*	.	S	Bend		160.6	-3.1	124.3	-80.1	-19	0	0	0	115.6	I979	I979-D981 PolarHBondContact O-N 2.88Å
982	D	38.3	Very low	37.5	Very low	99 Å²	99	100.8 Å²	100.8	53%	0.529	50%	0.502	S	S	.	.			trans	-136.1	98.7	172	-178.3	10	0	0	0	113.9	E984 G985 L986	D982-E984 PolarHBondContact OD1-N 2.98Å; D982-G985 VanDerWaalsContact CG-N 3.28Å; D982-G985 PolarHBondContact OD1-N 2.96Å; D982-G985 VanDerWaalsContact OD2-CA 3.3Å; D982-G985 WeakPolarHBondContact OD2-CA 3.3Å; D982-G985 PolarHBondContact OD2-N 3.07Å; D982-L986 PolarHBondContact O-N 3.43Å
983	P	36.2	Very low	37.4	Very low	95 Å²	95	96.6 Å²	96.6	62%	0.617	49%	0.487	S	S	*	.	S	Bend	trans	-75.1	-25.9	175	30.8	-33.7	0	0	0	113.8	L986 L987	P983-L986 WeakPolarHBondContact O-CB 3.5Å; P983-L986 PolarHBondContact O-N 3.19Å; P983-L987 PolarHBondContact O-N 3.28Å
984	E	39.8	Very low	37.4	Very low	146 Å²	146	97.1 Å²	97.1	68%	0.682	49%	0.489	S	S	*	.	H	α-helix	trans	-71.3	-42.6	177.1	-71.7	-168.8	162.6	0	0	110.7	D982 L986 L987 K988	D982-E984 PolarHBondContact OD1-N 2.98Å; E984-L986 PolarHBondContact O-N 3.06Å; E984-L987 PolarHBondContact O-N 3.44Å; E984-K988 PolarHBondContact O-N 3.06Å
985	G	37.9	Very low	37.5	Very low	15 Å²	15	97.1 Å²	97.1	16%	0.155	49%	0.492	C	S	.	.	H	α-helix	trans	-65.9	-17	171.1	0	0	0	0	0	113.8	K976 D982 N989	K976-G985 PolarHBondContact NZ-O 3.07Å; D982-G985 VanDerWaalsContact CG-N 3.28Å; D982-G985 PolarHBondContact OD1-N 2.96Å; D982-G985 VanDerWaalsContact OD2-CA 3.3Å; D982-G985 WeakPolarHBondContact OD2-CA 3.3Å; D982-G985 PolarHBondContact OD2-N 3.07Å; G985-N989 WeakPolarHBondContact O-CB 3.48Å; G985-N989 PolarHBondContact O-ND2 3.05Å
986	L	33.8	Very low	37.6	Very low	42 Å²	42	97.7 Å²	97.7	22%	0.22	50%	0.496	C	S	.	.	H	α-helix	trans	-81.2	-51	168.9	-149.7	165.1	0	0	0	109.9	K976 D982 P983 E984 K988 N989 L990	K976-L986 HydrophobicContact CB-CD1 3.81Å; K976-L986 HydrophobicContact CB-CG 4.14Å; K976-L986 HydrophobicContact CD-CG 4.16Å; D982-L986 PolarHBondContact O-N 3.43Å; P983-L986 WeakPolarHBondContact O-CB 3.5Å; P983-L986 PolarHBondContact O-N 3.19Å; E984-L986 PolarHBondContact O-N 3.06Å; L986-K988 PolarHBondContact O-N 2.84Å; L986-N989 PolarHBondContact O-N 2.9Å; L986-L990 HydrophobicContact CD2-CB 4.45Å; L986-L990 HydrophobicContact CD2-CD1 4.11Å; L986-L990 VanDerWaalsContact O-CB 3.29Å; L986-L990 WeakPolarHBondContact O-CB 3.41Å; L986-L990 PolarHBondContact O-N 3.41Å
987	L	38	Very low	37.5	Very low	120 Å²	120	95.9 Å²	95.9	63%	0.628	49%	0.49	S	S	*	.	H	α-helix	trans	-54.4	-53.8	176.1	-77.4	164.9	0	0	0	112.4	P983 E984 N989 L990 D991	P983-L987 PolarHBondContact O-N 3.28Å; E984-L987 PolarHBondContact O-N 3.44Å; L987-N989 VanDerWaalsContact C-N 3.27Å; L987-N989 PolarHBondContact O-N 3.44Å; L987-L990 PolarHBondContact O-N 3.24Å; L987-L990 VanDerWaalsContact O-N 3.15Å; L987-D991 VanDerWaalsContact O-CB 3.24Å; L987-D991 WeakPolarHBondContact O-CB 3.46Å; L987-D991 PolarHBondContact O-N 3.47Å
988	K	44.1	Very low	37.6	Very low	164 Å²	164	94.2 Å²	94.2	71%	0.713	48%	0.477	S	S	*	.	H	α-helix	trans	-59.3	-32.9	178.4	-95.8	178.3	174.9	167.1	0	114.1	E984 L986 K992	E984-K988 PolarHBondContact O-N 3.06Å; L986-K988 PolarHBondContact O-N 2.84Å; K988-K992 VanDerWaalsContact O-CB 3.22Å; K988-K992 WeakPolarHBondContact O-CB 3.47Å; K988-K992 PolarHBondContact O-N 3.39Å
989	N	39.8	Very low	37.8	Very low	79 Å²	79	88.4 Å²	88.4	42%	0.422	46%	0.463	S	S	.	.	H	α-helix	trans	-81	-34.2	177.3	-85.3	-70.8	0	0	0	112.3	K976 G985 L986 L987 T993	K976-N989 PolarHBondContact NZ-ND2 3.38Å; G985-N989 WeakPolarHBondContact O-CB 3.48Å; G985-N989 PolarHBondContact O-ND2 3.05Å; L986-N989 PolarHBondContact O-N 2.9Å; L987-N989 VanDerWaalsContact C-N 3.27Å; L987-N989 PolarHBondContact O-N 3.44Å; N989-T993 WeakPolarHBondContact O-CB 3.39Å; N989-T993 PolarHBondContact O-N 2.96Å; N989-T993 PolarHBondContact O-OG1 2.96Å
990	L	36.9	Very low	38.1	Very low	59 Å²	59	86.1 Å²	86.1	31%	0.309	45%	0.45	S	S	.	.	H	α-helix	trans	-67.9	-46.3	175.7	-168.2	132.6	0	0	0	109.4	I973 L986 L987 T993 I994	I973-L990 HydrophobicContact CD1-CD1 4.02Å; I973-L990 HydrophobicContact CG1-CD1 4.19Å; L986-L990 HydrophobicContact CD2-CB 4.45Å; L986-L990 HydrophobicContact CD2-CD1 4.11Å; L986-L990 VanDerWaalsContact O-CB 3.29Å; L986-L990 WeakPolarHBondContact O-CB 3.41Å; L986-L990 PolarHBondContact O-N 3.41Å; L987-L990 PolarHBondContact O-N 3.24Å; L987-L990 VanDerWaalsContact O-N 3.15Å; L990-T993 CarbonylContact O-C 3.58Å; L990-T993 PolarHBondContact O-N 2.78Å; L990-T993 VanDerWaalsContact O-N 3.12Å; L990-I994 HydrophobicContact CD2-CD1 3.56Å; L990-I994 HydrophobicContact CD2-CG1 4.45Å; L990-I994 HydrophobicContact CG-CD1 4.35Å; L990-I994 WeakPolarHBondContact O-CB 3.35Å; L990-I994 WeakPolarHBondContact O-CG1 3.39Å; L990-I994 PolarHBondContact O-N 3.29Å
991	D	40.3	Very low	38.3	Very low	103 Å²	103	84.9 Å²	84.9	55%	0.551	45%	0.447	S	S	*	.	H	α-helix	trans	-58.1	-50.2	172.3	-166	42.7	0	0	0	111.6	L987 T993 I994 T995	L987-D991 VanDerWaalsContact O-CB 3.24Å; L987-D991 WeakPolarHBondContact O-CB 3.46Å; L987-D991 PolarHBondContact O-N 3.47Å; D991-T993 VanDerWaalsContact C-N 3.26Å; D991-T993 PolarHBondContact O-N 3.36Å; D991-I994 CarbonylContact O-C 3.58Å; D991-I994 PolarHBondContact O-N 3.35Å; D991-I994 VanDerWaalsContact O-N 3.16Å; D991-T995 PolarHBondContact O-N 3.45Å; D991-T995 PolarHBondContact O-OG1 3.25Å
992	K	45.7	Very low	38.3	Very low	135 Å²	135	84.6 Å²	84.6	59%	0.587	44%	0.441	S	S	*	.	H	α-helix	trans	-60.4	-30.9	174	-173.5	170	-174.9	172.4	0	114	K988 T995 N996	K988-K992 VanDerWaalsContact O-CB 3.22Å; K988-K992 WeakPolarHBondContact O-CB 3.47Å; K988-K992 PolarHBondContact O-N 3.39Å; K992-T995 WeakPolarHBondContact CA-OG1 3.19Å; K992-T995 PolarHBondContact O-OG1 3.28Å; K992-T995 VanDerWaalsContact O-OG1 3.07Å; K992-N996 WeakPolarHBondContact O-CB 3.46Å; K992-N996 PolarHBondContact O-N 3.05Å; K992-N996 VanDerWaalsContact O-N 3.16Å
993	T	36.9	Very low	38.4	Very low	37 Å²	37	86 Å²	86	23%	0.227	45%	0.449	C	S	.	.	H	α-helix	trans	-82.8	-32.7	178.2	-47.1	0	0	0	0	111.3	L969 N989 L990 D991 N996 L997	L969-T993 HydrophobicContact CB-CG2 4.46Å; L969-T993 HydrophobicContact CD1-CG2 3.84Å; L969-T993 HydrophobicContact CD2-CG2 4.33Å; L969-T993 HydrophobicContact CG-CG2 4.43Å; N989-T993 WeakPolarHBondContact O-CB 3.39Å; N989-T993 PolarHBondContact O-N 2.96Å; N989-T993 PolarHBondContact O-OG1 2.96Å; L990-T993 CarbonylContact O-C 3.58Å; L990-T993 PolarHBondContact O-N 2.78Å; L990-T993 VanDerWaalsContact O-N 3.12Å; D991-T993 VanDerWaalsContact C-N 3.26Å; D991-T993 PolarHBondContact O-N 3.36Å; T993-N996 PolarHBondContact O-N 3.01Å; T993-L997 WeakPolarHBondContact O-CB 3.38Å; T993-L997 PolarHBondContact O-N 3.25Å
994	I	37.8	Very low	38	Very low	70 Å²	70	83.5 Å²	83.5	36%	0.359	43%	0.43	S	S	.	.	H	α-helix	trans	-64.4	-48.7	169.2	-74.4	176.4	0	0	0	109.9	L990 D991 N996 L997 I998	L990-I994 HydrophobicContact CD2-CD1 3.56Å; L990-I994 HydrophobicContact CD2-CG1 4.45Å; L990-I994 HydrophobicContact CG-CD1 4.35Å; L990-I994 WeakPolarHBondContact O-CB 3.35Å; L990-I994 WeakPolarHBondContact O-CG1 3.39Å; L990-I994 PolarHBondContact O-N 3.29Å; D991-I994 CarbonylContact O-C 3.58Å; D991-I994 PolarHBondContact O-N 3.35Å; D991-I994 VanDerWaalsContact O-N 3.16Å; I994-N996 VanDerWaalsContact C-N 3.28Å; I994-N996 PolarHBondContact O-N 2.9Å; I994-L997 CarbonylContact O-C 3.57Å; I994-L997 WeakPolarHBondContact O-CA 3.16Å; I994-L997 WeakPolarHBondContact O-CB 3.29Å; I994-L997 PolarHBondContact O-N 2.92Å; I994-I998 HydrophobicContact CG2-CD1 3.54Å; I994-I998 HydrophobicContact CG2-CG1 4.16Å; I994-I998 WeakPolarHBondContact O-CB 3.23Å; I994-I998 VanDerWaalsContact O-CG1 3.28Å; I994-I998 WeakPolarHBondContact O-CG1 3.36Å; I994-I998 PolarHBondContact O-N 3.1Å
995	T	40.9	Very low	37.6	Very low	69 Å²	69	79.8 Å²	79.8	42%	0.423	42%	0.421	S	S	.	.	H	α-helix	trans	-61.9	-34.7	175.9	53.8	0	0	0	0	112.4	D991 K992 A999	D991-T995 PolarHBondContact O-N 3.45Å; D991-T995 PolarHBondContact O-OG1 3.25Å; K992-T995 WeakPolarHBondContact CA-OG1 3.19Å; K992-T995 PolarHBondContact O-OG1 3.28Å; K992-T995 VanDerWaalsContact O-OG1 3.07Å; T995-A999 VanDerWaalsContact O-CB 3.24Å; T995-A999 WeakPolarHBondContact O-CB 3.11Å; T995-A999 PolarHBondContact O-N 3Å
996	N	41.1	Very low	37.2	Very low	94 Å²	94	86.2 Å²	86.2	50%	0.503	44%	0.441	S	S	.	.	H	α-helix	trans	-69	-36.7	171.5	-84	-5.4	0	0	0	112.6	K992 T993 I994 Q1000	K992-N996 WeakPolarHBondContact O-CB 3.46Å; K992-N996 PolarHBondContact O-N 3.05Å; K992-N996 VanDerWaalsContact O-N 3.16Å; T993-N996 PolarHBondContact O-N 3.01Å; I994-N996 VanDerWaalsContact C-N 3.28Å; I994-N996 PolarHBondContact O-N 2.9Å; N996-Q1000 WeakPolarHBondContact O-CB 3.33Å; N996-Q1000 VanDerWaalsContact O-CG 3.31Å; N996-Q1000 WeakPolarHBondContact O-CG 3.38Å; N996-Q1000 PolarHBondContact O-N 3.43Å
997	L	34.4	Very low	36.9	Very low	50 Å²	50	91.4 Å²	91.4	26%	0.262	46%	0.458	S	S	.	.	H	α-helix	trans	-69.7	-42.6	176.5	-162.2	90	0	0	0	110.8	I966 T993 I994 Q1000 L1001	I966-L997 HydrophobicContact CG1-CD1 4.43Å; T993-L997 WeakPolarHBondContact O-CB 3.38Å; T993-L997 PolarHBondContact O-N 3.25Å; I994-L997 CarbonylContact O-C 3.57Å; I994-L997 WeakPolarHBondContact O-CA 3.16Å; I994-L997 WeakPolarHBondContact O-CB 3.29Å; I994-L997 PolarHBondContact O-N 2.92Å; L997-Q1000 CarbonylContact O-C 3.59Å; L997-Q1000 WeakPolarHBondContact O-CB 3.41Å; L997-Q1000 PolarHBondContact O-N 2.91Å; L997-Q1000 VanDerWaalsContact O-N 3.16Å; L997-L1001 HydrophobicContact CD2-CD1 4.21Å; L997-L1001 HydrophobicContact CG-CD1 4.27Å; L997-L1001 WeakPolarHBondContact O-CB 3.15Å; L997-L1001 VanDerWaalsContact O-CG 3.29Å; L997-L1001 WeakPolarHBondContact O-CG 3.05Å; L997-L1001 PolarHBondContact O-N 3.05Å
998	I	38.3	Very low	36.5	Very low	55 Å²	55	93.5 Å²	93.5	28%	0.282	46%	0.462	S	S	.	.	H	α-helix	trans	-58.7	-52.6	172.4	-70.4	170.4	0	0	0	109.2	I994 Q1000 L1001 E1002 T1040	I994-I998 HydrophobicContact CG2-CD1 3.54Å; I994-I998 HydrophobicContact CG2-CG1 4.16Å; I994-I998 WeakPolarHBondContact O-CB 3.23Å; I994-I998 VanDerWaalsContact O-CG1 3.28Å; I994-I998 WeakPolarHBondContact O-CG1 3.36Å; I994-I998 PolarHBondContact O-N 3.1Å; I998-Q1000 PolarHBondContact O-N 3.39Å; I998-L1001 CarbonylContact O-C 3.36Å; I998-L1001 WeakPolarHBondContact O-CA 3.33Å; I998-L1001 PolarHBondContact O-N 3.38Å; I998-E1002 HydrophobicContact CG2-CG 4.11Å; I998-E1002 WeakPolarHBondContact CG2-OE1 3.27Å; I998-E1002 WeakPolarHBondContact O-CB 3.13Å; I998-E1002 VanDerWaalsContact O-CG 3.32Å; I998-E1002 WeakPolarHBondContact O-CG 3.42Å; I998-E1002 PolarHBondContact O-N 3.26Å; I998-T1040 HydrophobicContact CD1-CG2 4.27Å
999	A	41.4	Very low	35.7	Very low	36 Å²	36	90.9 Å²	90.9	30%	0.298	46%	0.456	S	S	.	.	H	α-helix	trans	-59.9	-30.9	175.8	0	0	0	0	0	112.8	T995 N1003	T995-A999 VanDerWaalsContact O-CB 3.24Å; T995-A999 WeakPolarHBondContact O-CB 3.11Å; T995-A999 PolarHBondContact O-N 3Å; A999-N1003 WeakPolarHBondContact O-CB 3.45Å; A999-N1003 PolarHBondContact O-N 3.22Å; A999-N1003 PolarHBondContact O-ND2 2.93Å
1000	Q	35	Very low	35	Very low	65 Å²	65	93.2 Å²	93.2	30%	0.304	47%	0.465	S	S	.	.	H	α-helix	trans	-73.7	-35.1	172.2	-78.9	-177.6	-19.9	0	0	112.9	N996 L997 I998 N1004	N996-Q1000 WeakPolarHBondContact O-CB 3.33Å; N996-Q1000 VanDerWaalsContact O-CG 3.31Å; N996-Q1000 WeakPolarHBondContact O-CG 3.38Å; N996-Q1000 PolarHBondContact O-N 3.43Å; L997-Q1000 CarbonylContact O-C 3.59Å; L997-Q1000 WeakPolarHBondContact O-CB 3.41Å; L997-Q1000 PolarHBondContact O-N 2.91Å; L997-Q1000 VanDerWaalsContact O-N 3.16Å; I998-Q1000 PolarHBondContact O-N 3.39Å; Q1000-N1004 VanDerWaalsContact O-CB 3.27Å; Q1000-N1004 WeakPolarHBondContact O-CB 3.21Å; Q1000-N1004 VanDerWaalsContact O-CG 3.22Å; Q1000-N1004 PolarHBondContact O-N 3.33Å; Q1000-N1004 PolarHBondContact O-ND2 3.14Å
1001	L	33.3	Very low	34.5	Very low	105 Å²	105	95.6 Å²	95.6	55%	0.55	48%	0.477	S	S	.	.	H	α-helix	trans	-72.8	-43.4	176.3	-72.5	164.6	0	0	0	111.6	L997 I998 N1003 N1004	L997-L1001 HydrophobicContact CD2-CD1 4.21Å; L997-L1001 HydrophobicContact CG-CD1 4.27Å; L997-L1001 WeakPolarHBondContact O-CB 3.15Å; L997-L1001 VanDerWaalsContact O-CG 3.29Å; L997-L1001 WeakPolarHBondContact O-CG 3.05Å; L997-L1001 PolarHBondContact O-N 3.05Å; I998-L1001 CarbonylContact O-C 3.36Å; I998-L1001 WeakPolarHBondContact O-CA 3.33Å; I998-L1001 PolarHBondContact O-N 3.38Å; L1001-N1003 VanDerWaalsContact C-N 3.33Å; L1001-N1003 PolarHBondContact O-N 3.23Å; L1001-N1004 CarbonylContact O-C 3.55Å; L1001-N1004 WeakPolarHBondContact O-CA 3.46Å; L1001-N1004 PolarHBondContact O-N 2.87Å
1002	E	35.4	Very low	33.7	Very low	138 Å²	138	99.9 Å²	99.9	65%	0.645	49%	0.487	S	S	*	.	H	α-helix	trans	-58.1	-43.4	173.1	-71.6	173.2	162.1	0	0	111.6	I998 N1004	I998-E1002 HydrophobicContact CG2-CG 4.11Å; I998-E1002 WeakPolarHBondContact CG2-OE1 3.27Å; I998-E1002 WeakPolarHBondContact O-CB 3.13Å; I998-E1002 VanDerWaalsContact O-CG 3.32Å; I998-E1002 WeakPolarHBondContact O-CG 3.42Å; I998-E1002 PolarHBondContact O-N 3.26Å; E1002-N1004 PolarHBondContact O-N 3.07Å
1003	N	38.4	Very low	32.7	Very low	128 Å²	128	99.5 Å²	99.5	68%	0.684	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-12.8	173.8	-78	-60.7	0	0	0	113.7	A999 L1001	A999-N1003 WeakPolarHBondContact O-CB 3.45Å; A999-N1003 PolarHBondContact O-N 3.22Å; A999-N1003 PolarHBondContact O-ND2 2.93Å; L1001-N1003 VanDerWaalsContact C-N 3.33Å; L1001-N1003 PolarHBondContact O-N 3.23Å
1004	N	28	Very low	32.1	Very low	43 Å²	43	102.3 Å²	102.3	23%	0.23	52%	0.517	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	26.2	-179.7	-84.1	-34.4	0	0	0	114	Q1000 L1001 E1002 Y1006 W1007	Q1000-N1004 VanDerWaalsContact O-CB 3.27Å; Q1000-N1004 WeakPolarHBondContact O-CB 3.21Å; Q1000-N1004 VanDerWaalsContact O-CG 3.22Å; Q1000-N1004 PolarHBondContact O-N 3.33Å; Q1000-N1004 PolarHBondContact O-ND2 3.14Å; L1001-N1004 CarbonylContact O-C 3.55Å; L1001-N1004 WeakPolarHBondContact O-CA 3.46Å; L1001-N1004 PolarHBondContact O-N 2.87Å; E1002-N1004 PolarHBondContact O-N 3.07Å; N1004-Y1006 PolarHBondContact O-N 2.97Å; N1004-W1007 PolarHBondContact O-N 3.29Å; N1004-W1007 VanDerWaalsContact O-N 3.08Å
1005	S	32.5	Very low	31.6	Very low	69 Å²	69	105.7 Å²	105.7	48%	0.483	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-13.7	168.7	56.8	0	0	0	0	114.9	W1007 N1009	S1005-W1007 VanDerWaalsContact C-N 3.3Å; S1005-W1007 PolarHBondContact O-N 2.97Å; S1005-N1009 PolarHBondContact O-N 3.24Å; S1005-N1009 PolarHBondContact O-ND2 3.47Å; S1005-N1009 VanDerWaalsContact O-ND2 3.16Å
1006	Y	28.5	Very low	30.7	Very low	149 Å²	149	112.1 Å²	112.1	58%	0.584	56%	0.558	S	S	*	*	H	α-helix	trans	-56.7	-34.7	170.5	-171.5	-101.7	0	0	0	114.3	N1004 N1009 Q1010	N1004-Y1006 PolarHBondContact O-N 2.97Å; Y1006-N1009 PolarHBondContact O-N 3.4Å; Y1006-Q1010 PolarHBondContact OH-NE2 2.81Å
1007	W	27.4	Very low	30	Very low	151 Å²	151	112.8 Å²	112.8	57%	0.572	57%	0.57	S	S	*	*	H	α-helix	trans	-69.5	-46.3	-179.4	-82.4	80.5	0	0	0	112.2	N1004 S1005 N1009 Q1010	N1004-W1007 PolarHBondContact O-N 3.29Å; N1004-W1007 VanDerWaalsContact O-N 3.08Å; S1005-W1007 VanDerWaalsContact C-N 3.3Å; S1005-W1007 PolarHBondContact O-N 2.97Å; W1007-N1009 PolarHBondContact O-N 3Å; W1007-Q1010 PolarHBondContact O-N 3.19Å; W1007-Q1010 VanDerWaalsContact O-N 3.13Å
1008	F	29.8	Very low	29.4	Very low	164 Å²	164	119.1 Å²	119.1	72%	0.719	60%	0.598	S	S	*	*	H	α-helix	trans	-64.4	-27.4	177	-77	-80.6	0	0	0	113.1	Q1010 L1011	F1008-Q1010 VanDerWaalsContact C-N 3.33Å; F1008-Q1010 PolarHBondContact O-N 3.34Å; F1008-L1011 PolarHBondContact O-N 3.15Å
1009	N	27.6	Very low	28.7	Very low	109 Å²	109	122.2 Å²	122.2	58%	0.583	62%	0.615	S	S	*	*	H	α-helix	trans	-74.7	-14.7	176	-72.6	-31.8	0	0	0	114.2	S1005 Y1006 W1007 Y1012	S1005-N1009 PolarHBondContact O-N 3.24Å; S1005-N1009 PolarHBondContact O-ND2 3.47Å; S1005-N1009 VanDerWaalsContact O-ND2 3.16Å; Y1006-N1009 PolarHBondContact O-N 3.4Å; W1007-N1009 PolarHBondContact O-N 3Å; N1009-Y1012 WeakPolarHBondContact O-CB 3.49Å
1010	Q	26.2	Very low	28	Very low	129 Å²	129	125.7 Å²	125.7	60%	0.603	63%	0.634	S	S	*	*	H	α-helix	trans	-79.7	-20.5	172.7	-73.9	-161.1	-1.1	0	0	113.5	Y1006 W1007 F1008 Y1012	Y1006-Q1010 PolarHBondContact OH-NE2 2.81Å; W1007-Q1010 PolarHBondContact O-N 3.19Å; W1007-Q1010 VanDerWaalsContact O-N 3.13Å; F1008-Q1010 VanDerWaalsContact C-N 3.33Å; F1008-Q1010 PolarHBondContact O-N 3.34Å; Q1010-Y1012 PolarHBondContact O-N 3.01Å
1011	L	24.8	Very low	27.5	Very low	109 Å²	109	126.6 Å²	126.6	57%	0.571	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-7.7	170.8	-74.2	167.1	0	0	0	113	F1008 V1013 I1191	F1008-L1011 PolarHBondContact O-N 3.15Å; L1011-V1013 VanDerWaalsContact C-N 3.31Å; L1011-V1013 PolarHBondContact O-N 3.24Å; L1011-I1191 HydrophobicContact CD2-CD1 3.61Å; L1011-I1191 HydrophobicContact CD2-CG1 4.12Å
1012	Y	24.3	Very low	27.1	Very low	192 Å²	192	123 Å²	123	75%	0.753	62%	0.621	S	S	*	*			trans	-76.2	83	166.2	-122.9	-90.5	0	0	0	109.8	N1009 Q1010 S1014	N1009-Y1012 WeakPolarHBondContact O-CB 3.49Å; Q1010-Y1012 PolarHBondContact O-N 3.01Å; Y1012-S1014 VanDerWaalsContact C-N 3.27Å; Y1012-S1014 PolarHBondContact O-N 3.17Å
1013	V	25	Very low	26.6	Very low	127 Å²	127	122.2 Å²	122.2	77%	0.77	62%	0.62	S	S	*	*			trans	-61.4	98.1	160.7	177.4	0	0	0	0	106.8	L1011 N1015	L1011-V1013 VanDerWaalsContact C-N 3.31Å; L1011-V1013 PolarHBondContact O-N 3.24Å; V1013-N1015 PolarHBondContact O-N 3.37Å
1014	S	23.2	Very low	25.9	Very low	97 Å²	97	123.2 Å²	123.2	68%	0.678	62%	0.624	S	S	*	*			trans	-62.3	94.3	-176.1	177.8	0	0	0	0	110	Y1012 K1016	Y1012-S1014 VanDerWaalsContact C-N 3.27Å; Y1012-S1014 PolarHBondContact O-N 3.17Å; S1014-K1016 PolarHBondContact O-N 2.99Å; S1014-K1016 VanDerWaalsContact O-N 3.14Å
1015	N	27.4	Very low	25.7	Very low	140 Å²	140	125.5 Å²	125.5	75%	0.749	64%	0.643	S	S	*	*			trans	-48.5	123.3	166.8	-91.8	-27.6	0	0	0	108.6	V1013 S1017	V1013-N1015 PolarHBondContact O-N 3.37Å; N1015-S1017 PolarHBondContact O-N 3.26Å
1016	K	22.7	Very low	25.4	Very low	204 Å²	204	127.4 Å²	127.4	89%	0.887	66%	0.656	S	S	*	*			trans	-73.3	60.1	176.3	-73.4	178.4	174.6	172.6	0	110.5	S1014 Q1018	S1014-K1016 PolarHBondContact O-N 2.99Å; S1014-K1016 VanDerWaalsContact O-N 3.14Å; K1016-Q1018 PolarHBondContact O-N 3.2Å
1017	S	26.2	Very low	25.5	Very low	108 Å²	108	126 Å²	126	76%	0.755	67%	0.665	S	S	*	*			trans	-71.5	117.5	161.2	56.5	0	0	0	0	107.9	N1015	N1015-S1017 PolarHBondContact O-N 3.26Å
1018	Q	22.6	Very low	25.2	Very low	183 Å²	183	125.3 Å²	125.3	86%	0.855	68%	0.677	S	S	*	*			trans	-61.9	152	179.6	-67.4	167.2	-33.1	0	0	111.4	K1016	K1016-Q1018 PolarHBondContact O-N 3.2Å
1019	N	23.5	Very low	24.9	Very low	121 Å²	121	126.8 Å²	126.8	65%	0.647	68%	0.684	S	S	*	*			trans	-28.5	139.8	172.5	-62.8	-75.5	0	0	0	114.8	K1021	N1019-K1021 VanDerWaalsContact OD1-CE 3.28Å; N1019-K1021 WeakPolarHBondContact OD1-CE 3.21Å; N1019-K1021 PolarHBondContact OD1-NZ 3.12Å
1020	P	25.3	Very low	24.7	Very low	108 Å²	108	127.8 Å²	127.8	70%	0.701	69%	0.694	S	S	*	*				-126.4	167.4	71.8	10.4	11.9	0	0	0	114.8	S355	S355-P1020 WeakPolarHBondContact O-CB 3.48Å
1021	K	24.9	Very low	24.6	Very low	85 Å²	85	129.3 Å²	129.3	37%	0.37	71%	0.705	S	S	.	*			trans	-93.8	-144.5	169.4	-60.2	77.7	149.1	-171.8	0	107.9	N352 N353 N354 S355 I356 N1019	N352-K1021 PolarHBondContact O-NZ 2.9Å; N352-K1021 VanDerWaalsContact O-NZ 3.15Å; N353-K1021 VanDerWaalsContact C-CE 3.5Å; N353-K1021 WeakPolarHBondContact O-CD 3.24Å; N353-K1021 VanDerWaalsContact O-CE 3.29Å; N353-K1021 WeakPolarHBondContact O-CE 3.36Å; N353-K1021 PolarHBondContact O-NZ 3.37Å; N354-K1021 PolarHBondContact O-N 3.3Å; N354-K1021 VanDerWaalsContact O-N 3.13Å; S355-K1021 CarbonylContact C-O 2.97Å; S355-K1021 CarbonylContact O-C 3.41Å; I356-K1021 PolarHBondContact N-O 3.35Å; N1019-K1021 VanDerWaalsContact OD1-CE 3.28Å; N1019-K1021 WeakPolarHBondContact OD1-CE 3.21Å; N1019-K1021 PolarHBondContact OD1-NZ 3.12Å
1022	S	25.9	Very low	24.5	Very low	28 Å²	28	132.5 Å²	132.5	20%	0.196	72%	0.717	C	S	.	*			cis	-141.8	155.3	-16.1	71.4	0	0	0	0	108.9	S355 I356	S355-S1022 VanDerWaalsContact C-N 3.35Å; S355-S1022 VanDerWaalsContact CA-OG 3.27Å; S355-S1022 WeakPolarHBondContact CA-OG 3.31Å; S355-S1022 PolarHBondContact N-OG 2.84Å; I356-S1022 WeakPolarHBondContact CG1-O 3.49Å; I356-S1022 WeakPolarHBondContact CG1-OG 3.41Å
1023	I	23.5	Very low	24.5	Very low	123 Å²	123	132.1 Å²	132.1	63%	0.631	72%	0.719	S	S	*	*				42.3	117.3	96.8	-27.6	163.6	0	0	0	110.8	I356	I356-I1023 VanDerWaalsContact CG1-O 3.24Å; I356-I1023 WeakPolarHBondContact CG1-O 3.42Å
1024	I	25.1	Very low	24.5	Very low	149 Å²	149	132.8 Å²	132.8	76%	0.764	72%	0.718	S	S	*	*				-148.7	119.8	51.5	-70.7	162.3	0	0	0	115.1
1025	S	22.8	Very low	24.5	Very low	91 Å²	91	135 Å²	135	64%	0.636	72%	0.721	S	S	*	*			trans	38.8	123.6	141.4	81.2	0	0	0	0	126
1026	S	27	Very low	24.6	Very low	108 Å²	108	134.1 Å²	134.1	76%	0.755	72%	0.716	S	S	*	*				71.8	157.9	119.9	77.2	0	0	0	0	120.3
1027	P	29.2	Very low	24.8	Very low	120 Å²	120	133.5 Å²	133.5	78%	0.779	72%	0.716	S	S	*	*			cis	-125.3	147.4	10.9	38.8	-22.3	0	0	0	118.1	K1029	P1027-K1029 PolarHBondContact O-N 3.47Å
1028	V	22.7	Very low	25	Very low	136 Å²	136	134.1 Å²	134.1	82%	0.824	71%	0.706	S	S	*	*			trans	-50.9	125.5	166	174	0	0	0	0	111.6
1029	K	23.5	Very low	25.5	Very low	195 Å²	195	131.6 Å²	131.6	85%	0.848	70%	0.698	S	S	*	*			trans	-79.5	130.3	154.1	-83.8	-172.9	176.2	179.9	0	108.8	P1027 I1031	P1027-K1029 PolarHBondContact O-N 3.47Å; K1029-I1031 PolarHBondContact O-N 3.14Å; K1029-I1031 VanDerWaalsContact O-N 3.16Å
1030	T	23.3	Very low	26.1	Very low	131 Å²	131	130.4 Å²	130.4	80%	0.804	70%	0.695	S	S	*	*			trans	-52	112.5	178.4	26.3	0	0	0	0	111.9	E1032	T1030-E1032 PolarHBondContact O-N 3.34Å
1031	I	23	Very low	26.3	Very low	161 Å²	161	129 Å²	129	83%	0.826	68%	0.681	S	S	*	*			trans	-71.9	115.1	161.3	-65.6	173.4	0	0	0	106.5	K1029	K1029-I1031 PolarHBondContact O-N 3.14Å; K1029-I1031 VanDerWaalsContact O-N 3.16Å
1032	E	23.4	Very low	26.6	Very low	176 Å²	176	131 Å²	131	82%	0.822	69%	0.69	S	S	*	*			trans	-65.2	140.2	174.2	-71.9	-177.3	136.4	0	0	110.2	T1030 N1034	T1030-E1032 PolarHBondContact O-N 3.34Å; E1032-N1034 PolarHBondContact O-N 3.07Å
1033	K	23.8	Very low	26.9	Very low	184 Å²	184	132 Å²	132	80%	0.8	70%	0.697	S	S	*	*			trans	-74.3	97.6	-174	-64.4	172.9	177.3	177.5	0	109.8	I1035	K1033-I1035 VanDerWaalsContact C-N 3.28Å; K1033-I1035 HydrophobicContact CB-CG1 4.09Å; K1033-I1035 PolarHBondContact O-N 3.43Å
1034	N	24.7	Very low	27.3	Very low	141 Å²	141	131 Å²	131	75%	0.754	69%	0.692	S	S	*	*			trans	-68.3	95.8	155.1	-87	12.4	0	0	0	108.3	E1032 D1036	E1032-N1034 PolarHBondContact O-N 3.07Å; N1034-D1036 PolarHBondContact O-N 3.49Å
1035	I	24.8	Very low	27.8	Very low	143 Å²	143	128.1 Å²	128.1	73%	0.733	67%	0.672	S	S	*	*			trans	-77.4	70.1	167.5	-54.8	171.8	0	0	0	106.6	K1033	K1033-I1035 VanDerWaalsContact C-N 3.28Å; K1033-I1035 HydrophobicContact CB-CG1 4.09Å; K1033-I1035 PolarHBondContact O-N 3.43Å
1036	D	28.1	Very low	28.3	Very low	121 Å²	121	127.4 Å²	127.4	65%	0.647	66%	0.659	S	S	*	*			trans	-82.9	120.5	163.4	-71.9	-41.7	0	0	0	107.2	N1034 K1038	N1034-D1036 PolarHBondContact O-N 3.49Å; D1036-K1038 PolarHBondContact O-N 3.38Å
1037	E	28.3	Very low	28.6	Very low	191 Å²	191	126.1 Å²	126.1	89%	0.893	65%	0.65	S	S	*	*			trans	-59.7	94	179.1	-66.4	179.3	131	0	0	109.9	N1039	E1037-N1039 PolarHBondContact O-N 3.25Å
1038	K	29.3	Very low	28.6	Very low	122 Å²	122	122.8 Å²	122.8	53%	0.53	63%	0.625	S	S	.	*			trans	-66.5	97	-178.8	-82.4	-162.4	176.6	-164.9	0	110.3	D1036 T1040 E1046	D1036-K1038 PolarHBondContact O-N 3.38Å; K1038-T1040 PolarHBondContact O-N 3.2Å; K1038-E1046 IonicContact NZ-OE1 3.63Å; K1038-E1046 PolarHBondContact NZ-OE1 3.4Å; K1038-E1046 IonicContact NZ-OE2 2.82Å; K1038-E1046 PolarHBondContact NZ-OE2 2.84Å
1039	N	32.9	Very low	28.9	Very low	129 Å²	129	117.8 Å²	117.8	69%	0.69	60%	0.598	S	S	*	*			trans	-46.7	124.3	170.4	-139.9	-23.5	0	0	0	109.9	E1037 L1041 K1042	E1037-N1039 PolarHBondContact O-N 3.25Å; N1039-L1041 PolarHBondContact O-N 3.43Å; N1039-K1042 WeakPolarHBondContact O-CB 3.35Å; N1039-K1042 PolarHBondContact O-N 3.49Å
1040	T	36.4	Very low	29.6	Very low	96 Å²	96	113.7 Å²	113.7	59%	0.589	58%	0.58	S	S	*	*	H	α-helix	trans	-56.9	-29.2	-164.1	-2.5	0	0	0	0	113.9	I998 K1038 K1042 S1043 L1044	I998-T1040 HydrophobicContact CD1-CG2 4.27Å; K1038-T1040 PolarHBondContact O-N 3.2Å; T1040-K1042 VanDerWaalsContact C-N 3.33Å; T1040-K1042 PolarHBondContact O-N 2.92Å; T1040-S1043 PolarHBondContact O-N 3.47Å; T1040-L1044 PolarHBondContact O-N 3.48Å; T1040-L1044 VanDerWaalsContact O-N 3.09Å
1041	L	29.3	Very low	29.8	Very low	79 Å²	79	111.2 Å²	111.2	41%	0.414	56%	0.561	S	S	.	*	H	α-helix	trans	-63.5	-37.8	175	-145.4	90	0	0	0	112.2	N1039 L1044 W1045 L1125	N1039-L1041 PolarHBondContact O-N 3.43Å; L1041-L1044 PolarHBondContact O-N 3.17Å; L1041-W1045 PolarHBondContact O-N 3.29Å; L1041-L1125 HydrophobicContact CD2-CD2 3.68Å
1042	K	32.7	Very low	30.1	Very low	126 Å²	126	107.7 Å²	107.7	55%	0.548	54%	0.544	S	S	.	.	H	α-helix	trans	-66.9	-37.3	178	-172.4	177.1	179.7	-176.5	0	111.1	N1039 T1040 W1045 E1046	N1039-K1042 WeakPolarHBondContact O-CB 3.35Å; N1039-K1042 PolarHBondContact O-N 3.49Å; T1040-K1042 VanDerWaalsContact C-N 3.33Å; T1040-K1042 PolarHBondContact O-N 2.92Å; K1042-W1045 CarbonylContact O-C 3.54Å; K1042-W1045 PolarHBondContact O-N 3.36Å; K1042-E1046 VanDerWaalsContact CE-OE1 3.25Å; K1042-E1046 WeakPolarHBondContact CE-OE1 3.41Å; K1042-E1046 HydrophobicContact CG-CG 4.33Å; K1042-E1046 IonicContact NZ-OE1 3.98Å; K1042-E1046 WeakPolarHBondContact O-CB 3.35Å; K1042-E1046 VanDerWaalsContact O-CG 3.25Å; K1042-E1046 WeakPolarHBondContact O-CG 3.31Å; K1042-E1046 PolarHBondContact O-N 2.96Å
1043	S	31.1	Very low	30.3	Very low	49 Å²	49	107 Å²	107	34%	0.343	54%	0.541	S	S	.	.	H	α-helix	trans	-72.8	-30.3	175.5	-68.7	0	0	0	0	113.1	T1040 E1046 S1047	T1040-S1043 PolarHBondContact O-N 3.47Å; S1043-E1046 PolarHBondContact O-N 3.25Å; S1043-S1047 PolarHBondContact O-N 2.91Å
1044	L	32.2	Very low	30.6	Very low	102 Å²	102	103.2 Å²	103.2	53%	0.534	54%	0.535	S	S	.	.	H	α-helix	trans	-64.5	-44.5	168.5	-165	113	0	0	0	111	T1040 L1041 S1047 L1048	T1040-L1044 PolarHBondContact O-N 3.48Å; T1040-L1044 VanDerWaalsContact O-N 3.09Å; L1041-L1044 PolarHBondContact O-N 3.17Å; L1044-S1047 PolarHBondContact O-N 3.06Å; L1044-S1047 PolarHBondContact O-OG 3.2Å; L1044-L1048 PolarHBondContact O-N 2.9Å
1045	W	35.6	Very low	30.7	Very low	89 Å²	89	104.3 Å²	104.3	34%	0.337	54%	0.536	S	S	.	.	H	α-helix	trans	-65.2	-38.4	172.7	-80.8	109.5	0	0	0	113.1	L1041 K1042 S1047 L1048 A1049 I1114	L1041-W1045 PolarHBondContact O-N 3.29Å; K1042-W1045 CarbonylContact O-C 3.54Å; K1042-W1045 PolarHBondContact O-N 3.36Å; W1045-S1047 VanDerWaalsContact C-N 3.26Å; W1045-S1047 PolarHBondContact O-N 2.89Å; W1045-L1048 CarbonylContact O-C 3.57Å; W1045-L1048 WeakPolarHBondContact O-CA 3.43Å; W1045-L1048 PolarHBondContact O-N 2.85Å; W1045-A1049 WeakPolarHBondContact O-CA 3.21Å; W1045-A1049 WeakPolarHBondContact O-CB 3.31Å; W1045-A1049 PolarHBondContact O-N 2.82Å; W1045-I1114 HydrophobicContact CH2-CD1 3.87Å; W1045-I1114 HydrophobicContact CH2-CG1 3.86Å; W1045-I1114 HydrophobicContact CZ2-CG1 4.1Å
1046	E	33.7	Very low	30.8	Very low	77 Å²	77	106.3 Å²	106.3	36%	0.36	54%	0.539	S	S	.	.	H	α-helix	trans	-64.4	-29.7	172.8	-74.3	169.1	173.5	0	0	111.8	K1038 K1042 S1043 L1048 A1049	K1038-E1046 IonicContact NZ-OE1 3.63Å; K1038-E1046 PolarHBondContact NZ-OE1 3.4Å; K1038-E1046 IonicContact NZ-OE2 2.82Å; K1038-E1046 PolarHBondContact NZ-OE2 2.84Å; K1042-E1046 VanDerWaalsContact CE-OE1 3.25Å; K1042-E1046 WeakPolarHBondContact CE-OE1 3.41Å; K1042-E1046 HydrophobicContact CG-CG 4.33Å; K1042-E1046 IonicContact NZ-OE1 3.98Å; K1042-E1046 WeakPolarHBondContact O-CB 3.35Å; K1042-E1046 VanDerWaalsContact O-CG 3.25Å; K1042-E1046 WeakPolarHBondContact O-CG 3.31Å; K1042-E1046 PolarHBondContact O-N 2.96Å; S1043-E1046 PolarHBondContact O-N 3.25Å; E1046-L1048 VanDerWaalsContact C-N 3.32Å; E1046-A1049 WeakPolarHBondContact O-CB 3.39Å; E1046-A1049 PolarHBondContact O-N 3.34Å
1047	S	33.6	Very low	30.7	Very low	81 Å²	81	105.1 Å²	105.1	57%	0.566	54%	0.54	S	S	*	.	H	α-helix	trans	-73.4	-22.7	171.8	77.7	0	0	0	0	113.6	S1043 L1044 W1045	S1043-S1047 PolarHBondContact O-N 2.91Å; L1044-S1047 PolarHBondContact O-N 3.06Å; L1044-S1047 PolarHBondContact O-OG 3.2Å; W1045-S1047 VanDerWaalsContact C-N 3.26Å; W1045-S1047 PolarHBondContact O-N 2.89Å
1048	L	28.8	Very low	30.6	Very low	49 Å²	49	105.9 Å²	105.9	26%	0.257	54%	0.541	S	S	.	.	H	α-helix	trans	-95.9	-7.5	172.4	-66.3	172.3	0	0	0	113.1	L1044 W1045 E1046 F1050 L1051	L1044-L1048 PolarHBondContact O-N 2.9Å; W1045-L1048 CarbonylContact O-C 3.57Å; W1045-L1048 WeakPolarHBondContact O-CA 3.43Å; W1045-L1048 PolarHBondContact O-N 2.85Å; E1046-L1048 VanDerWaalsContact C-N 3.32Å; L1048-F1050 PolarHBondContact O-N 2.98Å; L1048-L1051 WeakPolarHBondContact O-CB 3.19Å; L1048-L1051 PolarHBondContact O-N 2.84Å
1049	A	29.4	Very low	30.5	Very low	31 Å²	31	108.1 Å²	108.1	26%	0.256	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-66.5	-7.5	-170.7	0	0	0	0	0	114.6	W1045 E1046 L1051 D1052 E1053	W1045-A1049 WeakPolarHBondContact O-CA 3.21Å; W1045-A1049 WeakPolarHBondContact O-CB 3.31Å; W1045-A1049 PolarHBondContact O-N 2.82Å; E1046-A1049 WeakPolarHBondContact O-CB 3.39Å; E1046-A1049 PolarHBondContact O-N 3.34Å; A1049-L1051 PolarHBondContact O-N 2.98Å; A1049-L1051 VanDerWaalsContact O-N 3.12Å; A1049-D1052 PolarHBondContact O-N 3.43Å; A1049-E1053 PolarHBondContact O-N 2.84Å
1050	F	36.9	Very low	30	Very low	110 Å²	110	104.7 Å²	104.7	48%	0.482	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-61.9	-11.9	166.3	77.5	-92.5	0	0	0	113.3	L1048 K1095	L1048-F1050 PolarHBondContact O-N 2.98Å; F1050-K1095 HydrophobicContact CD2-CB 4.2Å; F1050-K1095 HydrophobicContact CD2-CD 4.17Å; F1050-K1095 HydrophobicContact CD2-CG 4.44Å; F1050-K1095 HydrophobicContact CE2-CB 4.02Å
1051	L	28.8	Very low	29.4	Very low	78 Å²	78	110.8 Å²	110.8	41%	0.408	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-95	-13.4	172.3	-63.6	174.9	0	0	0	113.9	L1048 A1049 I1094 L1110	L1048-L1051 WeakPolarHBondContact O-CB 3.19Å; L1048-L1051 PolarHBondContact O-N 2.84Å; A1049-L1051 PolarHBondContact O-N 2.98Å; A1049-L1051 VanDerWaalsContact O-N 3.12Å; L1051-I1094 HydrophobicContact CD2-CG2 4.23Å; L1051-L1110 HydrophobicContact CD1-CD1 4.26Å
1052	D	28	Very low	29.2	Very low	87 Å²	87	113.4 Å²	113.4	47%	0.465	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-134.7	5.4	-157	-99.7	-22	0	0	0	115.6	A1049 P1054	A1049-D1052 PolarHBondContact O-N 3.43Å; D1052-P1054 WeakPolarHBondContact O-CD 3.29Å
1053	E	27.3	Very low	28.8	Very low	162 Å²	162	115.2 Å²	115.2	76%	0.757	59%	0.591	S	S	*	*			trans	-66.4	116	177.6	-83.6	-158.1	149	0	0	112.6	A1049	A1049-E1053 PolarHBondContact O-N 2.84Å
1054	P	30.8	Very low	28.6	Very low	104 Å²	104	120.6 Å²	120.6	68%	0.675	62%	0.616	S	S	*	*			trans	-112	168.7	-173.8	40.4	-27.3	0	0	0	113	D1052	D1052-P1054 WeakPolarHBondContact O-CD 3.29Å
1055	E	27.6	Very low	28.2	Very low	165 Å²	165	119.4 Å²	119.4	77%	0.771	63%	0.628	S	S	*	*			trans	69.1	116.2	167.2	-49.1	-176.1	169	0	0	117.9
1056	K	26	Very low	27.6	Very low	184 Å²	184	120.8 Å²	120.8	80%	0.8	65%	0.652	S	S	*	*				-172.9	130.1	95.2	-95.8	153	-168.9	164.6	0	113.3
1057	S	27	Very low	27.2	Very low	96 Å²	96	123.5 Å²	123.5	67%	0.671	67%	0.674	S	S	*	*			trans	35	120	153.7	59.5	0	0	0	0	119.4
1058	F	24.9	Very low	26.7	Very low	208 Å²	208	124.9 Å²	124.9	91%	0.912	68%	0.683	S	S	*	*				-162.9	132	109.7	-107	-72.1	0	0	0	111.2
1059	D	27.1	Very low	26.5	Very low	168 Å²	168	128.3 Å²	128.3	90%	0.898	71%	0.712	S	S	*	*			trans	-75.3	143.6	173.1	-73.2	-64	0	0	0	111.6
1060	G	22.8	Very low	26.2	Very low	57 Å²	57	134.7 Å²	134.7	59%	0.588	74%	0.74	S	S	*	*			trans	153.7	116.2	155.5	0	0	0	0	0	116.9
1061	Y	24.1	Very low	25.6	Very low	225 Å²	225	134.2 Å²	134.2	88%	0.882	75%	0.75	S	S	*	*			trans	68.6	137.4	155.7	-61.7	-86.7	0	0	0	116.3
1062	I	25.3	Very low	25.5	Very low	133 Å²	133	134 Å²	134	68%	0.682	77%	0.767	S	S	*	*			cis	-149.8	142.6	5.1	-100.6	149.8	0	0	0	112.2
1063	E	24	Very low	25.3	Very low	164 Å²	164	135 Å²	135	77%	0.766	78%	0.78	S	S	*	*			trans	16.7	139.9	149.1	-50.2	175.3	141.3	0	0	124.1
1064	D	25.7	Very low	25.2	Very low	162 Å²	162	132.3 Å²	132.3	87%	0.866	78%	0.779	S	S	*	*			trans	63.7	106.1	138.3	-66.1	-2.4	0	0	0	122.4
1065	G	24.1	Very low	25	Very low	77 Å²	77	135 Å²	135	79%	0.794	78%	0.783	S	S	*	*			trans	-174.8	53.4	173.4	0	0	0	0	0	113.7	T1067	G1065-T1067 PolarHBondContact O-N 3.47Å
1066	S	23.7	Very low	24.8	Very low	119 Å²	119	130.1 Å²	130.1	83%	0.832	77%	0.767	S	S	*	*			trans	-44	117.8	-173.1	55.7	0	0	0	0	116.8
1067	T	24.7	Very low	25	Very low	134 Å²	134	126.4 Å²	126.4	82%	0.822	76%	0.755	S	S	*	*			trans	-149	109.4	139.4	32.4	0	0	0	0	112.3	G1065 S1069	G1065-T1067 PolarHBondContact O-N 3.47Å; T1067-S1069 PolarHBondContact O-N 3.37Å
1068	S	24.1	Very low	24.8	Very low	109 Å²	109	132.1 Å²	132.1	76%	0.762	76%	0.761	S	S	*	*			trans	4	102.7	161.6	55.7	0	0	0	0	119.4
1069	S	24.3	Very low	24.9	Very low	122 Å²	122	125.7 Å²	125.7	85%	0.853	74%	0.739	S	S	*	*			trans	-29.6	126	151	34.3	0	0	0	0	116.4	T1067	T1067-S1069 PolarHBondContact O-N 3.37Å
1070	I	24	Very low	24.8	Very low	165 Å²	165	123.3 Å²	123.3	85%	0.846	73%	0.731	S	S	*	*			trans	-121.3	134.6	153.7	-66.4	-178.6	0	0	0	108.9
1071	S	24.1	Very low	24.9	Very low	99 Å²	99	129.5 Å²	129.5	69%	0.692	74%	0.744	S	S	*	*			trans	-79	156.1	-168	52.6	0	0	0	0	115.4
1072	G	24.8	Very low	25	Very low	74 Å²	74	127.2 Å²	127.2	76%	0.763	74%	0.739	S	S	*	*			trans	110.2	68.3	152.6	0	0	0	0	0	114.9	S1074	G1072-S1074 PolarHBondContact O-N 3.27Å
1073	S	24.7	Very low	25	Very low	107 Å²	107	126.7 Å²	126.7	75%	0.748	74%	0.742	S	S	*	*			trans	-66.2	123	172.1	-174.6	0	0	0	0	111.4
1074	S	25.6	Very low	25.3	Very low	106 Å²	106	125 Å²	125	74%	0.741	74%	0.738	S	S	*	*			trans	-124.2	135.9	148.8	-55	0	0	0	0	104.7	G1072 S1076	G1072-S1074 PolarHBondContact O-N 3.27Å; S1074-S1076 PolarHBondContact O-N 3.5Å
1075	H	25.4	Very low	25.3	Very low	160 Å²	160	123.3 Å²	123.3	74%	0.741	73%	0.728	S	S	*	*			trans	-48.8	108.9	-155.6	-59.3	-52.6	0	0	0	113.9
1076	S	25.1	Very low	25.6	Very low	63 Å²	63	126.8 Å²	126.8	44%	0.441	72%	0.718	S	S	.	*			trans	-124	115.9	164.6	50.2	0	0	0	0	107.1	S1074 R1078	S1074-S1076 PolarHBondContact O-N 3.5Å; S1076-R1078 PolarHBondContact O-N 3.1Å
1077	I	28.7	Very low	25.6	Very low	107 Å²	107	126.6 Å²	126.6	55%	0.549	71%	0.712	S	S	.	*			trans	-65.6	103	172.3	-60.5	171.3	0	0	0	106.6	V1079	I1077-V1079 PolarHBondContact O-N 3.07Å
1078	R	24	Very low	25.8	Very low	215 Å²	215	125.4 Å²	125.4	81%	0.811	71%	0.708	S	S	*	*			trans	-83.2	103.9	178.7	-75.6	-168.9	-179.4	-165.8	1.3	109.9	S1076 V1080	S1076-R1078 PolarHBondContact O-N 3.1Å; R1078-V1080 PolarHBondContact O-N 3.05Å
1079	V	27.5	Very low	26.2	Very low	73 Å²	73	127.6 Å²	127.6	44%	0.442	71%	0.711	S	S	.	*			trans	-75.1	118.2	163.5	-176.1	0	0	0	0	107.9	I1077	I1077-V1079 PolarHBondContact O-N 3.07Å
1080	V	24.6	Very low	26.5	Very low	119 Å²	119	126.5 Å²	126.5	72%	0.721	70%	0.704	S	S	*	*			trans	-91.1	122.5	175.1	177.6	0	0	0	0	109.1	R1078 K1082	R1078-V1080 PolarHBondContact O-N 3.05Å; V1080-K1082 PolarHBondContact O-N 3.3Å
1081	E	24	Very low	27	Very low	186 Å²	186	126.2 Å²	126.2	87%	0.869	70%	0.704	S	S	*	*			trans	-74	101.8	178	-65.8	-178.1	137.7	0	0	111.8
1082	K	26.4	Very low	27.7	Very low	177 Å²	177	128.4 Å²	128.4	77%	0.77	70%	0.703	S	S	*	*			trans	-142.1	116.2	155.7	-79.3	-166.6	176.2	175.5	0	112.2	V1080	V1080-K1082 PolarHBondContact O-N 3.3Å
1083	T	26	Very low	28	Very low	122 Å²	122	130.9 Å²	130.9	75%	0.748	70%	0.703	S	S	*	*			trans	32.3	91	150.6	54.1	0	0	0	0	119	I1085	T1083-I1085 PolarHBondContact O-N 3.02Å
1084	D	29.7	Very low	28.8	Very low	128 Å²	128	131.7 Å²	131.7	68%	0.684	70%	0.698	S	S	*	*	S	Bend	trans	45.4	3.9	142.5	-59.2	-30.5	0	0	0	123.2	R1100	D1084-R1100 IonicContact OD1-NH1 3.27Å; D1084-R1100 PolarHBondContact OD1-NH1 3.23Å; D1084-R1100 VanDerWaalsContact OD1-NH1 3.12Å
1085	I	26.4	Very low	29.8	Very low	128 Å²	128	134.1 Å²	134.1	66%	0.656	70%	0.695	S	S	*	*			trans	-130.1	108	159.2	-55.3	-179.3	0	0	0	106.9	T1083 T1087	T1083-I1085 PolarHBondContact O-N 3.02Å; I1085-T1087 HydrophobicContact CG2-CG2 3.85Å; I1085-T1087 PolarHBondContact O-N 3.28Å
1086	Y	29.4	Very low	31.4	Very low	150 Å²	150	130.6 Å²	130.6	59%	0.588	69%	0.685	S	S	*	*			trans	-73.8	60.6	173.3	-72.1	-79.3	0	0	0	111	C1088 R1100	Y1086-C1088 VanDerWaalsContact C-N 3.26Å; Y1086-C1088 PolarHBondContact O-N 2.86Å; Y1086-R1100 PolarHBondContact OH-NE 3.16Å; Y1086-R1100 VanDerWaalsContact OH-NE 3.16Å; Y1086-R1100 PolarHBondContact OH-NH2 3.23Å
1087	T	24.5	Very low	33.1	Very low	114 Å²	114	129.3 Å²	129.3	70%	0.699	68%	0.675	S	S	*	*			trans	-80.4	81.4	158.7	41	0	0	0	0	107.7	I1085	I1085-T1087 HydrophobicContact CG2-CG2 3.85Å; I1085-T1087 PolarHBondContact O-N 3.28Å
1088	C	29.5	Very low	34.9	Very low	110 Å²	110	126.7 Å²	126.7	74%	0.743	67%	0.673	S	S	*	*			trans	-72.3	135.1	152.8	-149.1	0	0	0	0	106.6	Y1086 S1090	Y1086-C1088 VanDerWaalsContact C-N 3.26Å; Y1086-C1088 PolarHBondContact O-N 2.86Å; C1088-S1090 PolarHBondContact O-N 3.36Å; C1088-S1090 VanDerWaalsContact O-N 3.11Å
1089	D	31.3	Very low	37	Very low	154 Å²	154	117 Å²	117	82%	0.824	64%	0.637	S	S	*	*	S	Bend	trans	-56.7	116.9	-166.1	-69.4	-63.4	0	0	0	112.7
1090	S	31.8	Very low	38.9	Very low	100 Å²	100	119.2 Å²	119.2	70%	0.699	64%	0.637	S	S	*	*	S	Bend	trans	55.2	101	174.4	47.9	0	0	0	0	117.7	C1088 Q1092	C1088-S1090 PolarHBondContact O-N 3.36Å; C1088-S1090 VanDerWaalsContact O-N 3.11Å; S1090-Q1092 PolarHBondContact O-N 2.78Å
1091	D	34.5	Very low	41.3	Very low	159 Å²	159	115.5 Å²	115.5	85%	0.85	61%	0.612	S	S	*	*	S	Bend	trans	63.3	11.2	147.2	-60.2	-11.6	0	0	0	120.6	V1093	D1091-V1093 PolarHBondContact O-N 2.66Å; D1091-V1093 VanDerWaalsContact O-N 3.13Å
1092	Q	36.8	Very low	43.6	Very low	144 Å²	144	106.7 Å²	106.7	67%	0.673	57%	0.571	S	S	*	*			trans	-81.8	79	160.7	-68	-161.4	-17.7	0	0	111.7	S1090 I1094	S1090-Q1092 PolarHBondContact O-N 2.78Å; Q1092-I1094 PolarHBondContact O-N 3.32Å
1093	V	32.1	Very low	45.5	Very low	126 Å²	126	99.8 Å²	99.8	76%	0.764	54%	0.542	S	S	*	.			trans	-73.8	91.2	175.5	-174.8	0	0	0	0	110.5	D1091 K1095	D1091-V1093 PolarHBondContact O-N 2.66Å; D1091-V1093 VanDerWaalsContact O-N 3.13Å; V1093-K1095 PolarHBondContact O-N 3.37Å
1094	I	40.6	Very low	47.7	Very low	124 Å²	124	96.4 Å²	96.4	64%	0.636	52%	0.52	S	S	*	.			trans	-57.3	121.8	168.9	-58.6	173.4	0	0	0	108.4	L1051 Q1092 T1096	L1051-I1094 HydrophobicContact CD2-CG2 4.23Å; Q1092-I1094 PolarHBondContact O-N 3.32Å; I1094-T1096 PolarHBondContact O-N 2.99Å
1095	K	47.5	Very low	49.6	Very low	157 Å²	157	90.3 Å²	90.3	68%	0.683	49%	0.487	S	S	*	.			trans	-71	96.3	178.7	-69.4	-178.3	-179.1	175.2	0	110.5	F1050 V1093	F1050-K1095 HydrophobicContact CD2-CB 4.2Å; F1050-K1095 HydrophobicContact CD2-CD 4.17Å; F1050-K1095 HydrophobicContact CD2-CG 4.44Å; F1050-K1095 HydrophobicContact CE2-CB 4.02Å; V1093-K1095 PolarHBondContact O-N 3.37Å
1096	T	58	Low	51.7	Low	87 Å²	87	85.8 Å²	85.8	53%	0.534	46%	0.464	S	S	.	.			trans	-70.7	149	171.3	169.4	0	0	0	0	111.7	I1094 G1098 D1103	I1094-T1096 PolarHBondContact O-N 2.99Å; T1096-G1098 PolarHBondContact O-N 3.33Å; T1096-G1098 PolarHBondContact OG1-N 3.02Å; T1096-D1103 VanDerWaalsContact CB-OD2 3.27Å; T1096-D1103 WeakPolarHBondContact CB-OD2 3.28Å; T1096-D1103 PolarHBondContact OG1-OD2 3.49Å
1097	T	62.3	Low	53.4	Low	36 Å²	36	81.4 Å²	81.4	22%	0.221	45%	0.45	C	S	.	.			trans	-71	-6.9	167.1	58.9	0	0	0	0	113.3	W1099 L1102 D1103 L1106 I1190	T1097-W1099 PolarHBondContact OG1-N 2.91Å; T1097-L1102 HydrophobicContact CG2-CD2 4.29Å; T1097-D1103 VanDerWaalsContact CB-OD1 3.3Å; T1097-D1103 WeakPolarHBondContact CB-OD1 3.35Å; T1097-D1103 WeakPolarHBondContact CG2-OD1 3.42Å; T1097-D1103 PolarHBondContact N-OD1 3.18Å; T1097-D1103 PolarHBondContact OG1-OD1 2.89Å; T1097-L1106 HydrophobicContact CG2-CD1 4.05Å; T1097-I1190 WeakPolarHBondContact O-CG2 3.46Å
1098	G	65.5	Low	55.7	Low	51 Å²	51	76.9 Å²	76.9	53%	0.526	42%	0.42	S	S	.	.	S	Bend	trans	85.5	-15.3	-165.6	0	0	0	0	0	113.1	T1096	T1096-G1098 PolarHBondContact O-N 3.33Å; T1096-G1098 PolarHBondContact OG1-N 3.02Å
1099	W	69.5	Low	57.6	Low	11 Å²	11	71.7 Å²	71.7	4%	0.042	39%	0.385	C	S	.	.			trans	-109.3	91.2	180	-167.4	16.1	0	0	0	111.1	T1097 Q1101 L1102 D1103 I1190 L1194 E1198 Y1201 I1245	T1097-W1099 PolarHBondContact OG1-N 2.91Å; W1099-Q1101 PolarHBondContact O-N 2.91Å; W1099-L1102 HydrophobicContact CB-CB 3.9Å; W1099-L1102 HydrophobicContact CD2-CB 3.71Å; W1099-L1102 HydrophobicContact CE3-CB 3.61Å; W1099-L1102 HydrophobicContact CE3-CD2 3.73Å; W1099-L1102 HydrophobicContact CE3-CG 4.17Å; W1099-L1102 HydrophobicContact CG-CB 3.86Å; W1099-L1102 HydrophobicContact CZ3-CB 4.42Å; W1099-L1102 HydrophobicContact CZ3-CD2 4.34Å; W1099-L1102 WeakPolarHBondContact O-CA 3.2Å; W1099-L1102 WeakPolarHBondContact O-CB 3.33Å; W1099-L1102 PolarHBondContact O-N 3.1Å; W1099-D1103 PolarHBondContact O-N 3.49Å; W1099-I1190 HydrophobicContact CE3-CD1 3.98Å; W1099-L1194 HydrophobicContact CB-CD1 3.83Å; W1099-L1194 HydrophobicContact CG-CD1 4.2Å; W1099-E1198 VanDerWaalsContact CE2-OE1 3.31Å; W1099-E1198 HydrophobicContact CH2-CB 4.03Å; W1099-E1198 HydrophobicContact CH2-CG 4.15Å; W1099-E1198 HydrophobicContact CZ2-CB 3.79Å; W1099-E1198 HydrophobicContact CZ2-CG 3.5Å; W1099-E1198 VanDerWaalsContact CZ2-CG 3.5Å; W1099-E1198 PolarHBondContact NE1-OE1 3.23Å; W1099-Y1201 HydrophobicContact CH2-CD1 4.08Å; W1099-I1245 HydrophobicContact CH2-CD1 3.39Å; W1099-I1245 HydrophobicContact CZ2-CD1 3.22Å; W1099-I1245 HydrophobicContact CZ2-CG1 4.25Å; W1099-I1245 HydrophobicContact CZ3-CD1 4.32Å
1100	R	67.1	Low	59.3	Low	120 Å²	120	66.3 Å²	66.3	45%	0.453	36%	0.356	S	S	.	.	H	α-helix	trans	-47.9	-36.2	-176.9	-174.8	179.1	-177.5	179.7	1.1	114.1	D1084 Y1086 L1104	D1084-R1100 IonicContact OD1-NH1 3.27Å; D1084-R1100 PolarHBondContact OD1-NH1 3.23Å; D1084-R1100 VanDerWaalsContact OD1-NH1 3.12Å; Y1086-R1100 PolarHBondContact OH-NE 3.16Å; Y1086-R1100 VanDerWaalsContact OH-NE 3.16Å; Y1086-R1100 PolarHBondContact OH-NH2 3.23Å; R1100-L1104 WeakPolarHBondContact O-CG 3.32Å; R1100-L1104 PolarHBondContact O-N 3.18Å
1101	Q	74.6	Confident	60.8	Low	42 Å²	42	62.8 Å²	62.8	20%	0.196	33%	0.329	C	S	.	.	H	α-helix	trans	-73	-36.8	177.9	-73.3	-74.4	-40.7	0	0	112.8	W1099 A1105 I1245 I1246	W1099-Q1101 PolarHBondContact O-N 2.91Å; Q1101-A1105 WeakPolarHBondContact O-CB 3.4Å; Q1101-A1105 PolarHBondContact O-N 3.09Å; Q1101-A1105 VanDerWaalsContact O-N 3.16Å; Q1101-I1245 HydrophobicContact CB-CB 4.29Å; Q1101-I1246 VanDerWaalsContact OE1-N 3.14Å
1102	L	72.5	Confident	62.4	Low	1 Å²	1	55.3 Å²	55.3	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-71.2	-39.8	174.3	-177.3	65.3	0	0	0	111.5	T1097 W1099 L1104 A1105 L1106 V1183 I1190	T1097-L1102 HydrophobicContact CG2-CD2 4.29Å; W1099-L1102 HydrophobicContact CB-CB 3.9Å; W1099-L1102 HydrophobicContact CD2-CB 3.71Å; W1099-L1102 HydrophobicContact CE3-CB 3.61Å; W1099-L1102 HydrophobicContact CE3-CD2 3.73Å; W1099-L1102 HydrophobicContact CE3-CG 4.17Å; W1099-L1102 HydrophobicContact CG-CB 3.86Å; W1099-L1102 HydrophobicContact CZ3-CB 4.42Å; W1099-L1102 HydrophobicContact CZ3-CD2 4.34Å; W1099-L1102 WeakPolarHBondContact O-CA 3.2Å; W1099-L1102 WeakPolarHBondContact O-CB 3.33Å; W1099-L1102 PolarHBondContact O-N 3.1Å; L1102-L1104 VanDerWaalsContact C-N 3.35Å; L1102-L1104 PolarHBondContact O-N 3.05Å; L1102-A1105 CarbonylContact O-C 3.53Å; L1102-A1105 PolarHBondContact O-N 3.4Å; L1102-A1105 VanDerWaalsContact O-N 3.12Å; L1102-L1106 HydrophobicContact CG-CD1 4.22Å; L1102-L1106 WeakPolarHBondContact O-CB 3.44Å; L1102-L1106 PolarHBondContact O-N 3.48Å; L1102-V1183 HydrophobicContact CD1-CG1 4.44Å; L1102-V1183 HydrophobicContact CD1-CG2 4.26Å; L1102-V1183 HydrophobicContact CD2-CG1 4.4Å; L1102-I1190 HydrophobicContact CD2-CD1 3.76Å
1103	D	66.5	Low	63.6	Low	31 Å²	31	49.5 Å²	49.5	17%	0.166	26%	0.264	C	S	.	.	H	α-helix	trans	-58.5	-46.8	176.7	-65.1	-26.6	0	0	0	111.4	T1096 T1097 W1099 A1105 L1106 I1107	T1096-D1103 VanDerWaalsContact CB-OD2 3.27Å; T1096-D1103 WeakPolarHBondContact CB-OD2 3.28Å; T1096-D1103 PolarHBondContact OG1-OD2 3.49Å; T1097-D1103 VanDerWaalsContact CB-OD1 3.3Å; T1097-D1103 WeakPolarHBondContact CB-OD1 3.35Å; T1097-D1103 WeakPolarHBondContact CG2-OD1 3.42Å; T1097-D1103 PolarHBondContact N-OD1 3.18Å; T1097-D1103 PolarHBondContact OG1-OD1 2.89Å; W1099-D1103 PolarHBondContact O-N 3.49Å; D1103-A1105 VanDerWaalsContact C-N 3.31Å; D1103-A1105 PolarHBondContact O-N 3.32Å; D1103-L1106 WeakPolarHBondContact O-CB 3.39Å; D1103-L1106 PolarHBondContact O-N 3.03Å; D1103-I1107 VanDerWaalsContact O-CG1 3.32Å; D1103-I1107 WeakPolarHBondContact O-CG1 3.49Å; D1103-I1107 PolarHBondContact O-N 2.56Å
1104	L	70.8	Confident	64.8	Low	52 Å²	52	46.1 Å²	46.1	27%	0.272	24%	0.241	S	C	.	.	H	α-helix	trans	-64.5	-35.1	175.9	-69.4	170.6	0	0	0	112.1	R1100 L1102 W1108 I1246	R1100-L1104 WeakPolarHBondContact O-CG 3.32Å; R1100-L1104 PolarHBondContact O-N 3.18Å; L1102-L1104 VanDerWaalsContact C-N 3.35Å; L1102-L1104 PolarHBondContact O-N 3.05Å; L1104-W1108 PolarHBondContact O-N 2.83Å; L1104-I1246 HydrophobicContact CB-CD1 3.27Å; L1104-I1246 HydrophobicContact CD1-CD1 4.42Å; L1104-I1246 HydrophobicContact CG-CD1 4.47Å
1105	A	71.1	Confident	65.8	Low	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-70.2	-40.2	176.4	0	0	0	0	0	111.4	Q1101 L1102 D1103 W1108 H1109 I1245 I1246 P1298	Q1101-A1105 WeakPolarHBondContact O-CB 3.4Å; Q1101-A1105 PolarHBondContact O-N 3.09Å; Q1101-A1105 VanDerWaalsContact O-N 3.16Å; L1102-A1105 CarbonylContact O-C 3.53Å; L1102-A1105 PolarHBondContact O-N 3.4Å; L1102-A1105 VanDerWaalsContact O-N 3.12Å; D1103-A1105 VanDerWaalsContact C-N 3.31Å; D1103-A1105 PolarHBondContact O-N 3.32Å; A1105-W1108 WeakPolarHBondContact O-CB 3.39Å; A1105-W1108 PolarHBondContact O-N 3.11Å; A1105-H1109 PolarHBondContact O-CD2 2.94Å; A1105-H1109 PolarHBondContact O-N 2.74Å; A1105-I1245 HydrophobicContact CB-CG2 4.43Å; A1105-I1246 HydrophobicContact CB-CD1 4.41Å; A1105-I1246 HydrophobicContact CB-CG1 4.48Å; A1105-P1298 HydrophobicContact CB-CB 4.22Å
1106	L	69.1	Low	66.3	Low	33 Å²	33	35.6 Å²	35.6	17%	0.173	19%	0.189	C	C	.	.	H	α-helix	trans	-58.5	-47.2	172.2	-85.6	165.2	0	0	0	111.5	T1097 L1102 D1103 W1108 H1109 L1110 F1179 F1180 V1183	T1097-L1106 HydrophobicContact CG2-CD1 4.05Å; L1102-L1106 HydrophobicContact CG-CD1 4.22Å; L1102-L1106 WeakPolarHBondContact O-CB 3.44Å; L1102-L1106 PolarHBondContact O-N 3.48Å; D1103-L1106 WeakPolarHBondContact O-CB 3.39Å; D1103-L1106 PolarHBondContact O-N 3.03Å; L1106-W1108 VanDerWaalsContact C-N 3.31Å; L1106-W1108 PolarHBondContact O-N 2.87Å; L1106-H1109 PolarHBondContact O-N 2.97Å; L1106-L1110 WeakPolarHBondContact O-CB 3.46Å; L1106-L1110 WeakPolarHBondContact O-CG 3.36Å; L1106-L1110 PolarHBondContact O-N 3.06Å; L1106-F1179 HydrophobicContact CD2-CE1 4.09Å; L1106-F1179 HydrophobicContact CD2-CZ 4.2Å; L1106-F1180 HydrophobicContact CD2-CD1 4.48Å; L1106-F1180 HydrophobicContact CD2-CE1 4.27Å; L1106-V1183 HydrophobicContact CD1-CG1 4.16Å; L1106-V1183 HydrophobicContact CD2-CG1 3.98Å; L1106-V1183 HydrophobicContact CG-CG1 4.32Å
1107	I	66.3	Low	66.1	Low	57 Å²	57	33.7 Å²	33.7	29%	0.292	18%	0.175	S	C	.	.	H	α-helix	trans	-59.3	-42	175	-67.6	164	0	0	0	110.8	D1103 N1111	D1103-I1107 VanDerWaalsContact O-CG1 3.32Å; D1103-I1107 WeakPolarHBondContact O-CG1 3.49Å; D1103-I1107 PolarHBondContact O-N 2.56Å; I1107-N1111 WeakPolarHBondContact CG2-ND2 3.48Å; I1107-N1111 WeakPolarHBondContact O-CB 3.33Å; I1107-N1111 PolarHBondContact O-N 2.98Å; I1107-N1111 PolarHBondContact O-ND2 2.95Å
1108	W	72.3	Confident	65.6	Low	20 Å²	20	35.4 Å²	35.4	8%	0.076	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-47.9	175.7	-172.7	106.8	0	0	0	111.8	L1104 A1105 L1106 N1111 Y1112 L1294 T1296 P1298 H1301	L1104-W1108 PolarHBondContact O-N 2.83Å; A1105-W1108 WeakPolarHBondContact O-CB 3.39Å; A1105-W1108 PolarHBondContact O-N 3.11Å; L1106-W1108 VanDerWaalsContact C-N 3.31Å; L1106-W1108 PolarHBondContact O-N 2.87Å; W1108-N1111 PolarHBondContact O-N 3.24Å; W1108-Y1112 HydrophobicContact CH2-CD1 4.34Å; W1108-Y1112 HydrophobicContact CH2-CG 4.35Å; W1108-Y1112 AromaticContact CZ3-CD1 3.97Å; W1108-Y1112 HydrophobicContact CZ3-CD1 3.97Å; W1108-Y1112 HydrophobicContact CZ3-CG 4.13Å; W1108-Y1112 WeakPolarHBondContact O-CB 3.43Å; W1108-Y1112 PolarHBondContact O-N 3.06Å; W1108-L1294 HydrophobicContact CZ2-CD1 3.83Å; W1108-T1296 PolarHBondContact NE1-O 3.27Å; W1108-P1298 HydrophobicContact CD2-CG 3.56Å; W1108-P1298 HydrophobicContact CE3-CG 3.59Å; W1108-P1298 HydrophobicContact CG-CG 3.99Å; W1108-P1298 HydrophobicContact CH2-CG 4.35Å; W1108-P1298 HydrophobicContact CZ2-CG 4.27Å; W1108-P1298 HydrophobicContact CZ3-CG 4.01Å; W1108-H1301 HydrophobicContact CH2-CB 3.97Å; W1108-H1301 AromaticContact CH2-CD2 3.91Å; W1108-H1301 AromaticContact CH2-CE1 3.89Å; W1108-H1301 AromaticContact CH2-CG 3.56Å; W1108-H1301 AromaticContact CH2-ND1 3.58Å; W1108-H1301 HydrophobicContact CZ3-CB 3.9Å; W1108-H1301 AromaticContact CZ3-CG 3.8Å; W1108-H1301 AromaticContact CZ3-ND1 3.64Å
1109	H	69.1	Low	64.8	Low	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-67.3	-36.6	-179.1	-82.1	-77.4	0	0	0	112.7	A1105 L1106 Y1112 T1113 Q1176 F1179 T1300	A1105-H1109 PolarHBondContact O-CD2 2.94Å; A1105-H1109 PolarHBondContact O-N 2.74Å; L1106-H1109 PolarHBondContact O-N 2.97Å; H1109-Y1112 PolarHBondContact O-N 3.05Å; H1109-T1113 WeakPolarHBondContact O-CB 3.4Å; H1109-T1113 PolarHBondContact O-N 3.24Å; H1109-T1113 PolarHBondContact O-OG1 3.16Å; H1109-Q1176 PolarHBondContact ND1-OE1 3.17Å; H1109-F1179 HydrophobicContact CB-CD1 3.85Å; H1109-F1179 HydrophobicContact CB-CE1 3.35Å; H1109-F1179 HydrophobicContact CB-CZ 3.96Å; H1109-F1179 AromaticContact CD2-CE1 3.53Å; H1109-F1179 AromaticContact CD2-CE2 3.55Å; H1109-F1179 AromaticContact CD2-CZ 3.23Å; H1109-F1179 WeakPolarHBondContact CD2-CZ 3.26Å; H1109-F1179 AromaticContact CG-CD1 3.68Å; H1109-F1179 AromaticContact CG-CE1 3.37Å; H1109-F1179 AromaticContact CG-CZ 3.63Å; H1109-F1179 AromaticContact ND1-CD1 3.87Å; H1109-F1179 AromaticContact NE2-CD2 3.89Å; H1109-F1179 AromaticContact NE2-CE2 3.69Å; H1109-F1179 AromaticContact NE2-CZ 3.89Å; H1109-T1300 PolarHBondContact CD2-OG1 2.65Å; H1109-T1300 PolarHBondContact NE2-OG1 3.47Å
1110	L	67.3	Low	63.7	Low	42 Å²	42	35.7 Å²	35.7	22%	0.22	17%	0.171	C	C	.	.	H	α-helix	trans	-63.4	-50	171.4	-73.2	168.4	0	0	0	111.3	L1051 L1106 Y1112 T1113 I1114 F1180	L1051-L1110 HydrophobicContact CD1-CD1 4.26Å; L1106-L1110 WeakPolarHBondContact O-CB 3.46Å; L1106-L1110 WeakPolarHBondContact O-CG 3.36Å; L1106-L1110 PolarHBondContact O-N 3.06Å; L1110-Y1112 VanDerWaalsContact C-N 3.27Å; L1110-Y1112 PolarHBondContact O-N 3.43Å; L1110-T1113 WeakPolarHBondContact O-CB 3.27Å; L1110-T1113 PolarHBondContact O-N 3.14Å; L1110-T1113 VanDerWaalsContact O-N 3.11Å; L1110-I1114 WeakPolarHBondContact O-CG1 3.35Å; L1110-I1114 PolarHBondContact O-N 3.47Å; L1110-F1180 HydrophobicContact CD2-CE1 4.16Å; L1110-F1180 HydrophobicContact CD2-CZ 3.93Å; L1110-F1180 HydrophobicContact CG-CE1 4.46Å; L1110-F1180 HydrophobicContact CG-CZ 4.41Å
1111	N	64.3	Low	62.7	Low	25 Å²	25	35.4 Å²	35.4	13%	0.134	17%	0.171	C	C	.	.	H	α-helix	trans	-58.4	-38.1	175.9	-80.8	-68.9	0	0	0	112.5	I1107 W1108 R1115	I1107-N1111 WeakPolarHBondContact CG2-ND2 3.48Å; I1107-N1111 WeakPolarHBondContact O-CB 3.33Å; I1107-N1111 PolarHBondContact O-N 2.98Å; I1107-N1111 PolarHBondContact O-ND2 2.95Å; W1108-N1111 PolarHBondContact O-N 3.24Å; N1111-R1115 WeakPolarHBondContact O-CD 3.47Å; N1111-R1115 VanDerWaalsContact O-CG 3.27Å; N1111-R1115 WeakPolarHBondContact O-CG 3.43Å; N1111-R1115 PolarHBondContact O-N 3.09Å
1112	Y	66.4	Low	61.2	Low	3 Å²	3	38 Å²	38	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-67	-42.4	174.8	-176.9	-130.6	0	0	0	112	W1108 H1109 L1110 I1114 R1115 L1116 P1172 Q1176 V1289 N1290 H1301 R1305	W1108-Y1112 HydrophobicContact CH2-CD1 4.34Å; W1108-Y1112 HydrophobicContact CH2-CG 4.35Å; W1108-Y1112 AromaticContact CZ3-CD1 3.97Å; W1108-Y1112 HydrophobicContact CZ3-CD1 3.97Å; W1108-Y1112 HydrophobicContact CZ3-CG 4.13Å; W1108-Y1112 WeakPolarHBondContact O-CB 3.43Å; W1108-Y1112 PolarHBondContact O-N 3.06Å; H1109-Y1112 PolarHBondContact O-N 3.05Å; L1110-Y1112 VanDerWaalsContact C-N 3.27Å; L1110-Y1112 PolarHBondContact O-N 3.43Å; Y1112-I1114 PolarHBondContact O-N 3.1Å; Y1112-R1115 PolarHBondContact O-N 2.89Å; Y1112-L1116 HydrophobicContact CD1-CD1 3.96Å; Y1112-L1116 HydrophobicContact CD2-CD1 4.29Å; Y1112-L1116 HydrophobicContact CD2-CG 4.44Å; Y1112-L1116 HydrophobicContact CE1-CD1 3.73Å; Y1112-L1116 HydrophobicContact CE2-CD1 4.08Å; Y1112-L1116 HydrophobicContact CE2-CG 4.21Å; Y1112-L1116 HydrophobicContact CG-CD1 4.25Å; Y1112-L1116 WeakPolarHBondContact O-CG 3.44Å; Y1112-L1116 PolarHBondContact O-N 3.2Å; Y1112-P1172 HydrophobicContact CE1-CB 4.23Å; Y1112-Q1176 HydrophobicContact CD1-CG 4.39Å; Y1112-V1289 HydrophobicContact CE2-CG1 4.29Å; Y1112-N1290 WeakPolarHBondContact CD2-ND2 3.25Å; Y1112-N1290 VanDerWaalsContact CD2-OD1 3.27Å; Y1112-N1290 WeakPolarHBondContact CD2-OD1 3.13Å; Y1112-N1290 WeakPolarHBondContact CE2-ND2 3.46Å; Y1112-H1301 AromaticContact CE1-CE1 3.8Å; Y1112-R1305 PolarHBondContact OH-NH2 3.06Å
1113	T	62.6	Low	59.5	Low	22 Å²	22	43.1 Å²	43.1	14%	0.135	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-43.9	176	-56.8	0	0	0	0	111.9	H1109 L1110 L1116 L1117 L1173	H1109-T1113 WeakPolarHBondContact O-CB 3.4Å; H1109-T1113 PolarHBondContact O-N 3.24Å; H1109-T1113 PolarHBondContact O-OG1 3.16Å; L1110-T1113 WeakPolarHBondContact O-CB 3.27Å; L1110-T1113 PolarHBondContact O-N 3.14Å; L1110-T1113 VanDerWaalsContact O-N 3.11Å; T1113-L1116 WeakPolarHBondContact O-CB 3.3Å; T1113-L1116 PolarHBondContact O-N 2.85Å; T1113-L1117 HydrophobicContact CG2-CD1 4.14Å; T1113-L1117 WeakPolarHBondContact O-CG 3.28Å; T1113-L1117 PolarHBondContact O-N 3.16Å; T1113-L1173 HydrophobicContact CG2-CD2 3.69Å
1114	I	58	Low	57.8	Low	55 Å²	55	48.1 Å²	48.1	28%	0.282	24%	0.241	S	C	.	.	H	α-helix	trans	-58.8	-52.7	177.1	-65.3	163.5	0	0	0	110.4	W1045 L1110 Y1112 L1116 L1117 D1118	W1045-I1114 HydrophobicContact CH2-CD1 3.87Å; W1045-I1114 HydrophobicContact CH2-CG1 3.86Å; W1045-I1114 HydrophobicContact CZ2-CG1 4.1Å; L1110-I1114 WeakPolarHBondContact O-CG1 3.35Å; L1110-I1114 PolarHBondContact O-N 3.47Å; Y1112-I1114 PolarHBondContact O-N 3.1Å; I1114-L1116 PolarHBondContact O-N 2.87Å; I1114-L1117 WeakPolarHBondContact O-CB 3.31Å; I1114-L1117 PolarHBondContact O-N 3.34Å; I1114-D1118 PolarHBondContact O-N 3.11Å
1115	R	61	Low	55.8	Low	59 Å²	59	49 Å²	49	22%	0.223	25%	0.246	C	C	.	.	H	α-helix	trans	-59.6	-35	-179.9	-66.1	166.5	-171.3	-147.2	4.7	113.1	N1111 Y1112 Q1119 N1290 S1292	N1111-R1115 WeakPolarHBondContact O-CD 3.47Å; N1111-R1115 VanDerWaalsContact O-CG 3.27Å; N1111-R1115 WeakPolarHBondContact O-CG 3.43Å; N1111-R1115 PolarHBondContact O-N 3.09Å; Y1112-R1115 PolarHBondContact O-N 2.89Å; R1115-Q1119 PolarHBondContact O-N 3.22Å; R1115-N1290 PolarHBondContact NH1-O 3.26Å; R1115-S1292 PolarHBondContact NH1-OG 3.37Å
1116	L	58.2	Low	53.8	Low	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66.7	-45.3	174.5	-78.4	167.6	0	0	0	111.4	Y1112 T1113 I1114 Q1119 V1120 P1172 L1173 Q1176 V1289	Y1112-L1116 HydrophobicContact CD1-CD1 3.96Å; Y1112-L1116 HydrophobicContact CD2-CD1 4.29Å; Y1112-L1116 HydrophobicContact CD2-CG 4.44Å; Y1112-L1116 HydrophobicContact CE1-CD1 3.73Å; Y1112-L1116 HydrophobicContact CE2-CD1 4.08Å; Y1112-L1116 HydrophobicContact CE2-CG 4.21Å; Y1112-L1116 HydrophobicContact CG-CD1 4.25Å; Y1112-L1116 WeakPolarHBondContact O-CG 3.44Å; Y1112-L1116 PolarHBondContact O-N 3.2Å; T1113-L1116 WeakPolarHBondContact O-CB 3.3Å; T1113-L1116 PolarHBondContact O-N 2.85Å; I1114-L1116 PolarHBondContact O-N 2.87Å; L1116-Q1119 PolarHBondContact O-N 2.83Å; L1116-V1120 WeakPolarHBondContact O-CG2 3.5Å; L1116-V1120 PolarHBondContact O-N 3.28Å; L1116-V1120 VanDerWaalsContact O-N 3.15Å; L1116-P1172 HydrophobicContact CD1-CB 3.92Å; L1116-P1172 HydrophobicContact CD1-CG 3.94Å; L1116-P1172 HydrophobicContact CD2-CB 4.31Å; L1116-P1172 HydrophobicContact CD2-CG 3.49Å; L1116-P1172 VanDerWaalsContact CD2-CG 3.49Å; L1116-P1172 HydrophobicContact CG-CG 4.4Å; L1116-L1173 HydrophobicContact CB-CD1 4.15Å; L1116-L1173 HydrophobicContact CB-CD2 3.67Å; L1116-L1173 HydrophobicContact CB-CG 3.73Å; L1116-L1173 HydrophobicContact CD1-CD2 4.03Å; L1116-L1173 HydrophobicContact CD1-CG 4.06Å; L1116-L1173 HydrophobicContact CG-CG 4.44Å; L1116-Q1176 HydrophobicContact CD1-CG 4.5Å; L1116-V1289 HydrophobicContact CD2-CG1 3.49Å; L1116-V1289 VanDerWaalsContact CD2-CG1 3.49Å; L1116-V1289 HydrophobicContact CG-CG1 4.13Å
1117	L	52.9	Low	51.7	Low	47 Å²	47	60.8 Å²	60.8	25%	0.246	30%	0.301	C	S	.	.	H	α-helix	trans	-64.5	-40.1	177.8	-72	169.4	0	0	0	112.5	T1113 I1114 Q1119 V1120 Y1121 L1173	T1113-L1117 HydrophobicContact CG2-CD1 4.14Å; T1113-L1117 WeakPolarHBondContact O-CG 3.28Å; T1113-L1117 PolarHBondContact O-N 3.16Å; I1114-L1117 WeakPolarHBondContact O-CB 3.31Å; I1114-L1117 PolarHBondContact O-N 3.34Å; L1117-Q1119 PolarHBondContact O-N 3.49Å; L1117-V1120 PolarHBondContact O-N 3.43Å; L1117-Y1121 PolarHBondContact O-N 2.71Å; L1117-L1173 HydrophobicContact CD2-CD1 3.81Å; L1117-L1173 HydrophobicContact CD2-CD2 4.31Å; L1117-L1173 HydrophobicContact CG-CD1 4.26Å; L1117-L1173 HydrophobicContact CG-CD2 4.09Å
1118	D	53.1	Low	49.7	Very low	72 Å²	72	63.7 Å²	63.7	39%	0.385	33%	0.326	S	S	.	.	H	α-helix	trans	-56.6	-33.4	174	-70.7	-25.4	0	0	0	112	I1114	I1114-D1118 PolarHBondContact O-N 3.11Å
1119	Q	48.2	Very low	47.6	Very low	58 Å²	58	67.8 Å²	67.8	27%	0.271	36%	0.358	S	S	.	.	H	α-helix	trans	-81.3	-23.2	175.1	-68.3	179.6	18.5	0	0	113.7	R1115 L1116 L1117 S1166 V1289	R1115-Q1119 PolarHBondContact O-N 3.22Å; L1116-Q1119 PolarHBondContact O-N 2.83Å; L1117-Q1119 PolarHBondContact O-N 3.49Å; Q1119-S1166 WeakPolarHBondContact O-CB 3.35Å; Q1119-V1289 PolarHBondContact NE2-O 2.99Å
1120	V	46	Very low	45.6	Very low	10 Å²	10	71.4 Å²	71.4	6%	0.061	38%	0.383	C	S	.	.	H	α-helix	trans	-73.8	-42	171.6	-172.9	0	0	0	0	110.9	L1116 L1117 S1169 T1170 L1173	L1116-V1120 WeakPolarHBondContact O-CG2 3.5Å; L1116-V1120 PolarHBondContact O-N 3.28Å; L1116-V1120 VanDerWaalsContact O-N 3.15Å; L1117-V1120 PolarHBondContact O-N 3.43Å; V1120-S1169 WeakPolarHBondContact CG2-OG 3.28Å; V1120-T1170 HydrophobicContact CG2-CG2 4.48Å; V1120-L1173 HydrophobicContact CG2-CD1 3.83Å
1121	Y	45.9	Very low	43.6	Very low	115 Å²	115	77.4 Å²	77.4	45%	0.451	41%	0.41	S	S	.	.			trans	-130	58.1	-168.5	-63.5	-69.4	0	0	0	114.4	L1117 D1123 H1124	L1117-Y1121 PolarHBondContact O-N 2.71Å; Y1121-D1123 VanDerWaalsContact C-N 3.28Å; Y1121-D1123 PolarHBondContact O-N 2.72Å; Y1121-H1124 PolarHBondContact O-N 3.42Å
1122	P	43	Very low	41.8	Very low	96 Å²	96	82.2 Å²	82.2	62%	0.623	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-33.2	-175.3	24.3	-34.8	0	0	0	114
1123	D	37.7	Very low	39.9	Very low	108 Å²	108	89.1 Å²	89.1	58%	0.578	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-4.6	-172.4	-73.5	-14.4	0	0	0	114.4	Y1121	Y1121-D1123 VanDerWaalsContact C-N 3.28Å; Y1121-D1123 PolarHBondContact O-N 2.72Å
1124	H	31.5	Very low	38.1	Very low	136 Å²	136	94.8 Å²	94.8	63%	0.63	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	-18.1	-164.7	-59.4	-18	0	0	0	115.2	Y1121	Y1121-H1124 PolarHBondContact O-N 3.42Å
1125	L	28.6	Very low	36.4	Very low	72 Å²	72	96.7 Å²	96.7	38%	0.377	52%	0.518	S	S	.	.	S	Bend	trans	-83	-17.2	-177.7	-77.4	164.5	0	0	0	114.6	L1041	L1041-L1125 HydrophobicContact CD2-CD2 3.68Å
1126	Y	28.8	Very low	35.1	Very low	172 Å²	172	98.8 Å²	98.8	68%	0.675	54%	0.539	S	S	*	.	S	Bend	trans	-126.5	1.6	-172.3	-75.4	-77.6	0	0	0	116.8	S1128	Y1126-S1128 VanDerWaalsContact C-N 3.35Å; Y1126-S1128 PolarHBondContact O-N 3.24Å; Y1126-S1128 VanDerWaalsContact O-N 3.16Å
1127	V	23.9	Very low	33.5	Very low	108 Å²	108	108 Å²	108	66%	0.655	58%	0.582	S	S	*	*			trans	-90.9	63.5	177.5	-167.7	0	0	0	0	111.8
1128	S	24.9	Very low	32.2	Very low	118 Å²	118	110.2 Å²	110.2	83%	0.825	60%	0.602	S	S	*	*	S	Bend	trans	-145.8	29.5	174.2	-70.6	0	0	0	0	114.8	Y1126	Y1126-S1128 VanDerWaalsContact C-N 3.35Å; Y1126-S1128 PolarHBondContact O-N 3.24Å; Y1126-S1128 VanDerWaalsContact O-N 3.16Å
1129	S	27.8	Very low	30.8	Very low	106 Å²	106	112.4 Å²	112.4	74%	0.741	62%	0.623	S	S	*	*	S	Bend	trans	-161.4	32.9	176.2	55.6	0	0	0	0	116.6
1130	S	27.3	Very low	29.6	Very low	75 Å²	75	114.7 Å²	114.7	52%	0.524	64%	0.64	S	S	.	*			trans	-158.9	19	166.3	14.4	0	0	0	0	119	I1132	S1130-I1132 PolarHBondContact O-N 3.48Å
1131	Q	26.3	Very low	28.5	Very low	168 Å²	168	118.7 Å²	118.7	79%	0.785	67%	0.669	S	S	*	*			trans	-78	78.4	162.3	-73.9	-163.9	2	0	0	110.5	L1133	Q1131-L1133 PolarHBondContact O-N 3.31Å
1132	I	26.3	Very low	27.5	Very low	126 Å²	126	120 Å²	120	65%	0.646	68%	0.683	S	S	*	*			trans	-71	78.9	169.4	-58.9	172.8	0	0	0	107.7	S1130 L1134	S1130-I1132 PolarHBondContact O-N 3.48Å; I1132-L1134 HydrophobicContact CG2-CD1 3.57Å; I1132-L1134 HydrophobicContact CG2-CG 3.62Å; I1132-L1134 PolarHBondContact O-N 3.24Å; I1132-L1134 VanDerWaalsContact O-N 3.1Å
1133	L	25.3	Very low	26.5	Very low	148 Å²	148	120.2 Å²	120.2	78%	0.775	68%	0.683	S	S	*	*			trans	-81.5	78.1	166.8	-99.5	164.1	0	0	0	109	Q1131 S1135	Q1131-L1133 PolarHBondContact O-N 3.31Å; L1133-S1135 VanDerWaalsContact C-N 3.33Å; L1133-S1135 PolarHBondContact O-N 3.12Å
1134	L	24.6	Very low	25.9	Very low	142 Å²	142	118.9 Å²	118.9	74%	0.743	68%	0.682	S	S	*	*			trans	-63.8	89.6	170.2	-85.4	157	0	0	0	110.5	I1132	I1132-L1134 HydrophobicContact CG2-CD1 3.57Å; I1132-L1134 HydrophobicContact CG2-CG 3.62Å; I1132-L1134 PolarHBondContact O-N 3.24Å; I1132-L1134 VanDerWaalsContact O-N 3.1Å
1135	S	23.1	Very low	25.7	Very low	94 Å²	94	119.3 Å²	119.3	66%	0.657	69%	0.689	S	S	*	*			trans	-133.7	71.7	155.7	53.3	0	0	0	0	109.7	L1133 Q1137	L1133-S1135 VanDerWaalsContact C-N 3.33Å; L1133-S1135 PolarHBondContact O-N 3.12Å; S1135-Q1137 VanDerWaalsContact C-N 3.32Å; S1135-Q1137 PolarHBondContact O-N 3.28Å
1136	P	33.2	Very low	25.6	Very low	103 Å²	103	125.4 Å²	125.4	67%	0.669	71%	0.712	S	S	*	*			trans	-81	74.1	-172.9	34.6	-35.5	0	0	0	111.2
1137	Q	26.1	Very low	25.5	Very low	193 Å²	193	122 Å²	122	90%	0.902	71%	0.71	S	S	*	*			trans	-175.5	64.8	167.5	-105.2	151.4	35.7	0	0	113.9	S1135	S1135-Q1137 VanDerWaalsContact C-N 3.32Å; S1135-Q1137 PolarHBondContact O-N 3.28Å
1138	S	23.7	Very low	25.6	Very low	95 Å²	95	123.3 Å²	123.3	66%	0.664	71%	0.712	S	S	*	*			trans	-163.7	112.1	149.4	56.5	0	0	0	0	110.7	V1140	S1138-V1140 PolarHBondContact O-N 3.48Å
1139	S	24.4	Very low	25.7	Very low	118 Å²	118	124.9 Å²	124.9	83%	0.825	71%	0.711	S	S	*	*			trans	-59.1	116.3	166.3	48	0	0	0	0	110.3
1140	V	23.9	Very low	25.5	Very low	106 Å²	106	126.8 Å²	126.8	64%	0.642	71%	0.713	S	S	*	*			trans	-118.1	80.4	168.5	-175.3	0	0	0	0	108.6	S1138 V1143	S1138-V1140 PolarHBondContact O-N 3.48Å; V1140-V1143 HydrophobicContact CG1-CG2 3.7Å
1141	S	21.4	Very low	25.3	Very low	94 Å²	94	133.3 Å²	133.3	66%	0.657	73%	0.727	S	S	*	*			trans	-63.2	152.5	145.6	45.1	0	0	0	0	109.5
1142	D	25.1	Very low	25.2	Very low	141 Å²	141	131.2 Å²	131.2	75%	0.754	73%	0.726	S	S	*	*			trans	64.3	60.9	167	-56.3	-15.3	0	0	0	117.9
1143	V	23.5	Very low	25.3	Very low	102 Å²	102	130.4 Å²	130.4	62%	0.618	73%	0.729	S	S	*	*			trans	-122.2	49.3	148.5	-164.5	0	0	0	0	110.6	V1140	V1140-V1143 HydrophobicContact CG1-CG2 3.7Å
1144	S	23.8	Very low	25.4	Very low	79 Å²	79	131.1 Å²	131.1	55%	0.552	73%	0.734	S	S	*	*			trans	-82.4	151.8	155.9	47.2	0	0	0	0	110.6	K1146	S1144-K1146 PolarHBondContact O-N 3.43Å
1145	D	28.3	Very low	25.4	Very low	146 Å²	146	127 Å²	127	78%	0.781	73%	0.725	S	S	*	*	S	Bend	trans	70	9.1	159.7	-52.9	-19.7	0	0	0	121
1146	K	27	Very low	25.6	Very low	199 Å²	199	127.4 Å²	127.4	87%	0.865	73%	0.728	S	S	*	*	S	Bend	trans	-125.4	-3.8	174.3	-84.3	-173.2	177.8	175	0	119.6	S1144	S1144-K1146 PolarHBondContact O-N 3.43Å
1147	T	25.9	Very low	25.2	Very low	102 Å²	102	127.3 Å²	127.3	63%	0.626	73%	0.73	S	S	*	*	S	Bend	trans	-104.2	-3.4	179.6	28.7	0	0	0	0	115.7
1148	I	25.9	Very low	25.2	Very low	135 Å²	135	122.4 Å²	122.4	69%	0.692	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-75.5	-23.9	-176.1	-68.1	175.3	0	0	0	113.5
1149	N	26.4	Very low	25.3	Very low	150 Å²	150	122.5 Å²	122.5	80%	0.802	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-89.5	1.3	-169.2	-77.9	-3.1	0	0	0	116.9
1150	N	24.1	Very low	25.3	Very low	146 Å²	146	120.9 Å²	120.9	78%	0.781	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-108.9	12.8	-177.4	-82.5	2.6	0	0	0	115.4	T1152	N1150-T1152 PolarHBondContact O-N 3.44Å
1151	Y	23.8	Very low	25.5	Very low	212 Å²	212	124.6 Å²	124.6	83%	0.831	71%	0.705	S	S	*	*			trans	-76.7	64.4	163.7	-85.7	-80	0	0	0	111.4
1152	T	23.6	Very low	26.2	Very low	125 Å²	125	124 Å²	124	77%	0.767	70%	0.695	S	S	*	*			trans	-61.8	122.1	162.7	29.7	0	0	0	0	109.4	N1150 N1154	N1150-T1152 PolarHBondContact O-N 3.44Å; T1152-N1154 PolarHBondContact O-N 2.79Å; T1152-N1154 VanDerWaalsContact O-N 3.16Å
1153	P	27.9	Very low	26.7	Very low	109 Å²	109	120.2 Å²	120.2	71%	0.708	68%	0.679	S	S	*	*	S	Bend	trans	-81.8	102.8	-164.1	30.8	-35.4	0	0	0	112.2
1154	N	27	Very low	27.4	Very low	163 Å²	163	116.7 Å²	116.7	87%	0.872	66%	0.658	S	S	*	*			trans	-139.7	11	164.4	-96.6	-28.2	0	0	0	113.4	T1152	T1152-N1154 PolarHBondContact O-N 2.79Å; T1152-N1154 VanDerWaalsContact O-N 3.16Å
1155	G	25.1	Very low	28.1	Very low	55 Å²	55	115.2 Å²	115.2	57%	0.567	64%	0.642	S	S	*	*			trans	-105.5	-7.6	-178.6	0	0	0	0	0	115.9	S1157 S1158	G1155-S1157 PolarHBondContact O-N 3.24Å; G1155-S1157 VanDerWaalsContact O-N 3.11Å; G1155-S1158 PolarHBondContact O-OG 3.27Å
1156	S	26.7	Very low	28.7	Very low	102 Å²	102	108.4 Å²	108.4	71%	0.713	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-76.9	6.6	-168.4	50.2	0	0	0	0	115.8
1157	S	24.9	Very low	29.4	Very low	102 Å²	102	99.3 Å²	99.3	71%	0.713	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-82.2	-9.9	175.2	53.8	0	0	0	0	114.3	G1155	G1155-S1157 PolarHBondContact O-N 3.24Å; G1155-S1157 VanDerWaalsContact O-N 3.11Å
1158	S	26.3	Very low	30	Very low	90 Å²	90	96.7 Å²	96.7	63%	0.629	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-85.6	-6.2	-177.3	62.2	0	0	0	0	115.6	G1155 V1160	G1155-S1158 PolarHBondContact O-OG 3.27Å; S1158-V1160 VanDerWaalsContact C-N 3.31Å; S1158-V1160 PolarHBondContact O-N 3.33Å
1159	S	26.3	Very low	31	Very low	96 Å²	96	90.3 Å²	90.3	67%	0.671	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-82.6	-0	-179.1	-66.7	0	0	0	0	114.6	R1161	S1159-R1161 PolarHBondContact O-N 3.16Å; S1159-R1161 VanDerWaalsContact O-N 3.12Å
1160	V	25.2	Very low	32.1	Very low	85 Å²	85	86 Å²	86	52%	0.515	49%	0.493	S	S	.	.			trans	-86.6	50.8	169	-163.5	0	0	0	0	110	S1158	S1158-V1160 VanDerWaalsContact C-N 3.31Å; S1158-V1160 PolarHBondContact O-N 3.33Å
1161	R	27.5	Very low	33	Very low	184 Å²	184	79.9 Å²	79.9	69%	0.694	46%	0.46	S	S	*	.			trans	-95.7	-2.3	178.3	-139.9	179.7	-169	-167.2	2.1	113.3	S1159 S1163	S1159-R1161 PolarHBondContact O-N 3.16Å; S1159-R1161 VanDerWaalsContact O-N 3.12Å; R1161-S1163 PolarHBondContact O-N 3.04Å
1162	N	35.3	Very low	34.3	Very low	82 Å²	82	70 Å²	70	44%	0.439	42%	0.422	S	S	.	.			trans	-72.4	114.5	-176.5	-75.7	33.5	0	0	0	110.3	S1166	N1162-S1166 VanDerWaalsContact CB-OG 3.26Å; N1162-S1166 WeakPolarHBondContact CB-OG 3.32Å
1163	S	36.9	Very low	35.6	Very low	60 Å²	60	65.2 Å²	65.2	42%	0.42	39%	0.391	S	S	.	.			trans	-58.7	156.6	175.1	63.6	0	0	0	0	111.1	R1161 H1165 S1166 A1167	R1161-S1163 PolarHBondContact O-N 3.04Å; S1163-H1165 PolarHBondContact O-N 3.34Å; S1163-S1166 PolarHBondContact N-OG 3.2Å; S1163-S1166 WeakPolarHBondContact O-CB 3.16Å; S1163-S1166 PolarHBondContact O-N 3.01Å; S1163-S1166 PolarHBondContact O-OG 3.31Å; S1163-S1166 PolarHBondContact OG-N 3.27Å; S1163-A1167 PolarHBondContact O-N 3.4Å
1164	V	37.5	Very low	36.8	Very low	28 Å²	28	64 Å²	64	17%	0.17	38%	0.378	C	S	.	.	H	α-helix	trans	-67	-24.9	-178.3	-159.7	0	0	0	0	110.6	S1166 A1167 W1168 E1532	V1164-S1166 PolarHBondContact O-N 3.46Å; V1164-A1167 CarbonylContact O-C 3.56Å; V1164-A1167 WeakPolarHBondContact O-CA 3.43Å; V1164-A1167 WeakPolarHBondContact O-CB 3.46Å; V1164-A1167 PolarHBondContact O-N 3.28Å; V1164-W1168 HydrophobicContact CG1-CZ2 4.37Å; V1164-W1168 VanDerWaalsContact O-CG 3.31Å; V1164-W1168 PolarHBondContact O-N 3.28Å; V1164-E1532 WeakPolarHBondContact CA-OE1 3.11Å; V1164-E1532 WeakPolarHBondContact CB-OE1 3.4Å; V1164-E1532 WeakPolarHBondContact CB-OE2 3.41Å; V1164-E1532 WeakPolarHBondContact CG2-OE1 3.47Å; V1164-E1532 PolarHBondContact N-OE1 2.94Å
1165	H	39.5	Very low	38.3	Very low	48 Å²	48	58.2 Å²	58.2	22%	0.222	35%	0.346	C	S	.	.	H	α-helix	trans	-53.2	-46.4	164.9	-74.3	-75.4	0	0	0	113.8	S1163 A1167 W1168 S1169 E1532	S1163-H1165 PolarHBondContact O-N 3.34Å; H1165-A1167 PolarHBondContact O-N 3.41Å; H1165-W1168 AromaticContact CE1-CE3 3.94Å; H1165-W1168 AromaticContact CE1-CZ3 3.62Å; H1165-W1168 AromaticContact ND1-CE3 3.64Å; H1165-W1168 AromaticContact ND1-CZ3 3.82Å; H1165-W1168 PolarHBondContact O-N 3.44Å; H1165-W1168 VanDerWaalsContact O-N 3.09Å; H1165-S1169 PolarHBondContact O-N 3.06Å; H1165-S1169 PolarHBondContact O-OG 3.25Å; H1165-E1532 IonicContact CD2-OE2 3.44Å; H1165-E1532 PolarHBondContact NE2-O 3.05Å
1166	S	41	Very low	40.2	Very low	4 Å²	4	55.7 Å²	55.7	3%	0.028	32%	0.32	C	S	.	.	H	α-helix	trans	-64.1	-24.9	176.6	71.2	0	0	0	0	112.7	Q1119 N1162 S1163 V1164 S1169 T1170	Q1119-S1166 WeakPolarHBondContact O-CB 3.35Å; N1162-S1166 VanDerWaalsContact CB-OG 3.26Å; N1162-S1166 WeakPolarHBondContact CB-OG 3.32Å; S1163-S1166 PolarHBondContact N-OG 3.2Å; S1163-S1166 WeakPolarHBondContact O-CB 3.16Å; S1163-S1166 PolarHBondContact O-N 3.01Å; S1163-S1166 PolarHBondContact O-OG 3.31Å; S1163-S1166 PolarHBondContact OG-N 3.27Å; V1164-S1166 PolarHBondContact O-N 3.46Å; S1166-S1169 PolarHBondContact O-OG 2.96Å; S1166-T1170 WeakPolarHBondContact O-CG2 3.36Å
1167	A	41.7	Very low	41.7	Very low	7 Å²	7	55.3 Å²	55.3	6%	0.058	31%	0.309	C	S	.	.	H	α-helix	trans	-80.4	-41.6	171	0	0	0	0	0	111	S1163 V1164 H1165 S1169 T1170 C1507	S1163-A1167 PolarHBondContact O-N 3.4Å; V1164-A1167 CarbonylContact O-C 3.56Å; V1164-A1167 WeakPolarHBondContact O-CA 3.43Å; V1164-A1167 WeakPolarHBondContact O-CB 3.46Å; V1164-A1167 PolarHBondContact O-N 3.28Å; H1165-A1167 PolarHBondContact O-N 3.41Å; A1167-S1169 PolarHBondContact O-N 3.45Å; A1167-T1170 WeakPolarHBondContact O-CB 3.29Å; A1167-T1170 PolarHBondContact O-N 2.89Å; A1167-T1170 VanDerWaalsContact O-N 3.15Å; A1167-T1170 PolarHBondContact O-OG1 3.28Å; A1167-C1507 HydrophobicContact CB-CB 3.75Å; A1167-C1507 VanDerWaalsContact CB-SG 3.59Å; A1167-C1507 PolarHBondContact O-SG 3.43Å
1168	W	38.2	Very low	43.6	Very low	47 Å²	47	55.4 Å²	55.4	18%	0.178	30%	0.298	C	S	.	.	H	α-helix	trans	-59.5	-43.4	177.3	-68.4	-9.2	0	0	0	112	V1164 H1165 T1170 L1171 P1172 I1504	V1164-W1168 HydrophobicContact CG1-CZ2 4.37Å; V1164-W1168 VanDerWaalsContact O-CG 3.31Å; V1164-W1168 PolarHBondContact O-N 3.28Å; H1165-W1168 AromaticContact CE1-CE3 3.94Å; H1165-W1168 AromaticContact CE1-CZ3 3.62Å; H1165-W1168 AromaticContact ND1-CE3 3.64Å; H1165-W1168 AromaticContact ND1-CZ3 3.82Å; H1165-W1168 PolarHBondContact O-N 3.44Å; H1165-W1168 VanDerWaalsContact O-N 3.09Å; W1168-T1170 PolarHBondContact O-N 3.38Å; W1168-L1171 PolarHBondContact O-N 3.26Å; W1168-P1172 WeakPolarHBondContact O-CD 3.27Å; W1168-I1504 HydrophobicContact CZ2-CD1 3.88Å; W1168-I1504 HydrophobicContact CZ2-CG1 3.88Å; W1168-I1504 VanDerWaalsContact NE1-CG1 3.28Å
1169	S	46.9	Very low	45.6	Very low	1 Å²	1	51.1 Å²	51.1	1%	0.007	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-20.5	177.9	52.8	0	0	0	0	113.5	V1120 H1165 S1166 A1167 L1171 P1172 L1173	V1120-S1169 WeakPolarHBondContact CG2-OG 3.28Å; H1165-S1169 PolarHBondContact O-N 3.06Å; H1165-S1169 PolarHBondContact O-OG 3.25Å; S1166-S1169 PolarHBondContact O-OG 2.96Å; A1167-S1169 PolarHBondContact O-N 3.45Å; S1169-L1171 PolarHBondContact O-N 2.79Å; S1169-P1172 WeakPolarHBondContact O-CD 3.47Å; S1169-L1173 WeakPolarHBondContact O-CB 3.45Å; S1169-L1173 WeakPolarHBondContact O-CD1 3.42Å; S1169-L1173 WeakPolarHBondContact O-CG 3.25Å; S1169-L1173 PolarHBondContact O-N 3.33Å
1170	T	47.9	Very low	47.6	Very low	61 Å²	61	49.6 Å²	49.6	37%	0.374	25%	0.249	S	C	.	.	H	α-helix	trans	-64.5	-21.4	174	70.6	0	0	0	0	114.4	V1120 S1166 A1167 W1168 L1174	V1120-T1170 HydrophobicContact CG2-CG2 4.48Å; S1166-T1170 WeakPolarHBondContact O-CG2 3.36Å; A1167-T1170 WeakPolarHBondContact O-CB 3.29Å; A1167-T1170 PolarHBondContact O-N 2.89Å; A1167-T1170 VanDerWaalsContact O-N 3.15Å; A1167-T1170 PolarHBondContact O-OG1 3.28Å; W1168-T1170 PolarHBondContact O-N 3.38Å; T1170-L1174 PolarHBondContact O-N 2.97Å
1171	L	44.2	Very low	49.8	Very low	16 Å²	16	49.8 Å²	49.8	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-85.7	-48.7	-178	-76.4	125.6	0	0	0	114.9	W1168 S1169 L1173 L1174 E1175 H1503 Y1506 C1507	W1168-L1171 PolarHBondContact O-N 3.26Å; S1169-L1171 PolarHBondContact O-N 2.79Å; L1171-L1173 PolarHBondContact O-N 3.26Å; L1171-L1174 WeakPolarHBondContact O-CA 3.49Å; L1171-L1174 VanDerWaalsContact O-CB 3.32Å; L1171-L1174 WeakPolarHBondContact O-CB 3.33Å; L1171-L1174 PolarHBondContact O-N 3.3Å; L1171-E1175 PolarHBondContact O-N 3.38Å; L1171-H1503 WeakPolarHBondContact CB-ND1 3.44Å; L1171-H1503 HydrophobicContact CD1-CB 3.68Å; L1171-Y1506 HydrophobicContact CD1-CD1 4.15Å; L1171-Y1506 HydrophobicContact CD2-CD1 3.73Å; L1171-Y1506 HydrophobicContact CD2-CE1 4.34Å; L1171-Y1506 HydrophobicContact CD2-CG 4.05Å; L1171-Y1506 HydrophobicContact CG-CD1 4.12Å; L1171-C1507 WeakPolarHBondContact CD1-SG 3.43Å
1172	P	50.2	Low	51.8	Low	4 Å²	4	42.9 Å²	42.9	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-29.1	167.7	26.5	-33.5	0	0	0	110.8	Y1112 L1116 W1168 S1169 E1175 Q1176	Y1112-P1172 HydrophobicContact CE1-CB 4.23Å; L1116-P1172 HydrophobicContact CD1-CB 3.92Å; L1116-P1172 HydrophobicContact CD1-CG 3.94Å; L1116-P1172 HydrophobicContact CD2-CB 4.31Å; L1116-P1172 HydrophobicContact CD2-CG 3.49Å; L1116-P1172 VanDerWaalsContact CD2-CG 3.49Å; L1116-P1172 HydrophobicContact CG-CG 4.4Å; W1168-P1172 WeakPolarHBondContact O-CD 3.27Å; S1169-P1172 WeakPolarHBondContact O-CD 3.47Å; P1172-E1175 CarbonylContact O-C 3.42Å; P1172-E1175 PolarHBondContact O-N 3.1Å; P1172-Q1176 WeakPolarHBondContact O-CG 3.1Å; P1172-Q1176 PolarHBondContact O-N 3.16Å; P1172-Q1176 PolarHBondContact O-NE2 3.06Å; P1172-Q1176 VanDerWaalsContact O-NE2 3.12Å
1173	L	52	Low	53.4	Low	25 Å²	25	39.3 Å²	39.3	13%	0.131	20%	0.204	C	C	.	.	H	α-helix	trans	-61.6	-39.9	167	-75.3	172.1	0	0	0	112.9	T1113 L1116 L1117 V1120 S1169 L1171 Q1176 I1177	T1113-L1173 HydrophobicContact CG2-CD2 3.69Å; L1116-L1173 HydrophobicContact CB-CD1 4.15Å; L1116-L1173 HydrophobicContact CB-CD2 3.67Å; L1116-L1173 HydrophobicContact CB-CG 3.73Å; L1116-L1173 HydrophobicContact CD1-CD2 4.03Å; L1116-L1173 HydrophobicContact CD1-CG 4.06Å; L1116-L1173 HydrophobicContact CG-CG 4.44Å; L1117-L1173 HydrophobicContact CD2-CD1 3.81Å; L1117-L1173 HydrophobicContact CD2-CD2 4.31Å; L1117-L1173 HydrophobicContact CG-CD1 4.26Å; L1117-L1173 HydrophobicContact CG-CD2 4.09Å; V1120-L1173 HydrophobicContact CG2-CD1 3.83Å; S1169-L1173 WeakPolarHBondContact O-CB 3.45Å; S1169-L1173 WeakPolarHBondContact O-CD1 3.42Å; S1169-L1173 WeakPolarHBondContact O-CG 3.25Å; S1169-L1173 PolarHBondContact O-N 3.33Å; L1171-L1173 PolarHBondContact O-N 3.26Å; L1173-Q1176 WeakPolarHBondContact O-CB 3.37Å; L1173-Q1176 PolarHBondContact O-N 3.25Å; L1173-I1177 WeakPolarHBondContact O-CG1 3.28Å; L1173-I1177 PolarHBondContact O-N 3.28Å; L1173-I1177 VanDerWaalsContact O-N 3.16Å
1174	L	52	Low	54.9	Low	83 Å²	83	43.1 Å²	43.1	44%	0.435	22%	0.216	S	C	.	.	H	α-helix	trans	-65.3	-40	173.3	-162.3	98.2	0	0	0	111.6	T1170 L1171 Q1176 I1177 E1178	T1170-L1174 PolarHBondContact O-N 2.97Å; L1171-L1174 WeakPolarHBondContact O-CA 3.49Å; L1171-L1174 VanDerWaalsContact O-CB 3.32Å; L1171-L1174 WeakPolarHBondContact O-CB 3.33Å; L1171-L1174 PolarHBondContact O-N 3.3Å; L1174-Q1176 VanDerWaalsContact C-N 3.3Å; L1174-Q1176 PolarHBondContact O-N 3.39Å; L1174-I1177 WeakPolarHBondContact O-CB 3.49Å; L1174-I1177 PolarHBondContact O-N 3Å; L1174-I1177 VanDerWaalsContact O-N 3.14Å; L1174-E1178 PolarHBondContact O-N 2.93Å
1175	E	60.3	Low	56.4	Low	42 Å²	42	46 Å²	46	20%	0.196	24%	0.237	C	C	.	.	H	α-helix	trans	-66.2	-31.1	173.5	-66.5	169.9	-163.1	0	0	111.6	L1171 P1172 I1177 E1178 F1179 R1305 H1503	L1171-E1175 PolarHBondContact O-N 3.38Å; P1172-E1175 CarbonylContact O-C 3.42Å; P1172-E1175 PolarHBondContact O-N 3.1Å; E1175-I1177 VanDerWaalsContact C-N 3.32Å; E1175-I1177 PolarHBondContact O-N 3.38Å; E1175-E1178 PolarHBondContact O-N 3.33Å; E1175-F1179 PolarHBondContact O-N 2.98Å; E1175-R1305 IonicContact OE1-NH1 2.74Å; E1175-R1305 WeakPolarHBondContact OE2-CD 3.4Å; E1175-R1305 IonicContact OE2-CZ 2.81Å; E1175-R1305 VanDerWaalsContact OE2-CZ 3.3Å; E1175-R1305 IonicContact OE2-NE 3.38Å; E1175-R1305 PolarHBondContact OE2-NE 3.48Å; E1175-R1305 IonicContact OE2-NH1 3.03Å; E1175-R1305 PolarHBondContact OE2-NH1 2.63Å; E1175-H1503 IonicContact OE1-CE1 3.79Å
1176	Q	63.4	Low	57.8	Low	2 Å²	2	44.5 Å²	44.5	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-35.8	170.6	-61.8	-37.2	-83	0	0	111.6	H1109 Y1112 L1116 P1172 L1173 L1174 E1178 F1179 F1180	H1109-Q1176 PolarHBondContact ND1-OE1 3.17Å; Y1112-Q1176 HydrophobicContact CD1-CG 4.39Å; L1116-Q1176 HydrophobicContact CD1-CG 4.5Å; P1172-Q1176 WeakPolarHBondContact O-CG 3.1Å; P1172-Q1176 PolarHBondContact O-N 3.16Å; P1172-Q1176 PolarHBondContact O-NE2 3.06Å; P1172-Q1176 VanDerWaalsContact O-NE2 3.12Å; L1173-Q1176 WeakPolarHBondContact O-CB 3.37Å; L1173-Q1176 PolarHBondContact O-N 3.25Å; L1174-Q1176 VanDerWaalsContact C-N 3.3Å; L1174-Q1176 PolarHBondContact O-N 3.39Å; Q1176-E1178 VanDerWaalsContact C-N 3.33Å; Q1176-E1178 PolarHBondContact O-N 3.16Å; Q1176-F1179 WeakPolarHBondContact O-CB 3.4Å; Q1176-F1179 PolarHBondContact O-N 2.99Å; Q1176-F1180 HydrophobicContact CB-CD2 4.28Å; Q1176-F1180 HydrophobicContact CB-CE2 3.98Å; Q1176-F1180 WeakPolarHBondContact O-CD2 3.21Å; Q1176-F1180 WeakPolarHBondContact O-CG 3.44Å; Q1176-F1180 PolarHBondContact O-N 2.87Å
1177	I	59.4	Low	59.1	Low	94 Å²	94	46.3 Å²	46.3	48%	0.482	24%	0.243	S	C	.	.	H	α-helix	trans	-63.7	-40.4	174.5	-62.4	167	0	0	0	110.5	L1173 L1174 E1175 F1179 F1180 N1181	L1173-I1177 WeakPolarHBondContact O-CG1 3.28Å; L1173-I1177 PolarHBondContact O-N 3.28Å; L1173-I1177 VanDerWaalsContact O-N 3.16Å; L1174-I1177 WeakPolarHBondContact O-CB 3.49Å; L1174-I1177 PolarHBondContact O-N 3Å; L1174-I1177 VanDerWaalsContact O-N 3.14Å; E1175-I1177 VanDerWaalsContact C-N 3.32Å; E1175-I1177 PolarHBondContact O-N 3.38Å; I1177-F1179 VanDerWaalsContact C-N 3.33Å; I1177-F1179 PolarHBondContact O-N 3.24Å; I1177-F1180 PolarHBondContact O-N 3.35Å; I1177-N1181 WeakPolarHBondContact O-CB 3.34Å; I1177-N1181 PolarHBondContact O-N 3.43Å; I1177-N1181 PolarHBondContact O-ND2 3.22Å
1178	E	63.1	Low	60.3	Low	104 Å²	104	51 Å²	51	49%	0.486	26%	0.263	S	S	.	.	H	α-helix	trans	-61.8	-40	173.9	-65.3	-171.5	168.6	0	0	111.9	L1174 E1175 Q1176 E1182 L1304	L1174-E1178 PolarHBondContact O-N 2.93Å; E1175-E1178 PolarHBondContact O-N 3.33Å; Q1176-E1178 VanDerWaalsContact C-N 3.33Å; Q1176-E1178 PolarHBondContact O-N 3.16Å; E1178-E1182 PolarHBondContact O-N 3.12Å; E1178-L1304 HydrophobicContact CB-CD2 4.35Å
1179	F	68.9	Low	61.8	Low	1 Å²	1	49.6 Å²	49.6	0%	0.004	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-49.9	172	167	-102.9	0	0	0	113.1	L1106 H1109 E1175 Q1176 I1177 N1181 E1182 V1183 T1300 L1304	L1106-F1179 HydrophobicContact CD2-CE1 4.09Å; L1106-F1179 HydrophobicContact CD2-CZ 4.2Å; H1109-F1179 HydrophobicContact CB-CD1 3.85Å; H1109-F1179 HydrophobicContact CB-CE1 3.35Å; H1109-F1179 HydrophobicContact CB-CZ 3.96Å; H1109-F1179 AromaticContact CD2-CE1 3.53Å; H1109-F1179 AromaticContact CD2-CE2 3.55Å; H1109-F1179 AromaticContact CD2-CZ 3.23Å; H1109-F1179 WeakPolarHBondContact CD2-CZ 3.26Å; H1109-F1179 AromaticContact CG-CD1 3.68Å; H1109-F1179 AromaticContact CG-CE1 3.37Å; H1109-F1179 AromaticContact CG-CZ 3.63Å; H1109-F1179 AromaticContact ND1-CD1 3.87Å; H1109-F1179 AromaticContact NE2-CD2 3.89Å; H1109-F1179 AromaticContact NE2-CE2 3.69Å; H1109-F1179 AromaticContact NE2-CZ 3.89Å; E1175-F1179 PolarHBondContact O-N 2.98Å; Q1176-F1179 WeakPolarHBondContact O-CB 3.4Å; Q1176-F1179 PolarHBondContact O-N 2.99Å; I1177-F1179 VanDerWaalsContact C-N 3.33Å; I1177-F1179 PolarHBondContact O-N 3.24Å; F1179-N1181 VanDerWaalsContact C-N 3.26Å; F1179-N1181 PolarHBondContact O-N 3.15Å; F1179-E1182 PolarHBondContact O-N 2.68Å; F1179-V1183 HydrophobicContact CD1-CG2 4.46Å; F1179-V1183 HydrophobicContact CD2-CG2 3.86Å; F1179-V1183 HydrophobicContact CE1-CG2 4Å; F1179-V1183 HydrophobicContact CE2-CG2 3.33Å; F1179-V1183 HydrophobicContact CG-CG2 4.4Å; F1179-V1183 HydrophobicContact CZ-CG2 3.43Å; F1179-V1183 VanDerWaalsContact CZ-CG2 3.43Å; F1179-V1183 WeakPolarHBondContact O-CG2 3.39Å; F1179-V1183 PolarHBondContact O-N 2.87Å; F1179-T1300 HydrophobicContact CD2-CG2 4.29Å; F1179-T1300 HydrophobicContact CE2-CG2 3.7Å; F1179-L1304 HydrophobicContact CB-CD1 3.77Å; F1179-L1304 HydrophobicContact CB-CD2 4.2Å
1180	F	69.6	Low	62.9	Low	63 Å²	63	50.6 Å²	50.6	28%	0.276	27%	0.268	S	S	.	.	H	α-helix	trans	-62.5	-34.2	-179.4	-70	-58.8	0	0	0	111.9	L1106 L1110 Q1176 I1177 V1183 E1184	L1106-F1180 HydrophobicContact CD2-CD1 4.48Å; L1106-F1180 HydrophobicContact CD2-CE1 4.27Å; L1110-F1180 HydrophobicContact CD2-CE1 4.16Å; L1110-F1180 HydrophobicContact CD2-CZ 3.93Å; L1110-F1180 HydrophobicContact CG-CE1 4.46Å; L1110-F1180 HydrophobicContact CG-CZ 4.41Å; Q1176-F1180 HydrophobicContact CB-CD2 4.28Å; Q1176-F1180 HydrophobicContact CB-CE2 3.98Å; Q1176-F1180 WeakPolarHBondContact O-CD2 3.21Å; Q1176-F1180 WeakPolarHBondContact O-CG 3.44Å; Q1176-F1180 PolarHBondContact O-N 2.87Å; I1177-F1180 PolarHBondContact O-N 3.35Å; F1180-V1183 PolarHBondContact O-N 3.4Å; F1180-E1184 WeakPolarHBondContact O-CB 3.2Å; F1180-E1184 PolarHBondContact O-N 3.25Å
1181	N	69.7	Low	63.7	Low	89 Å²	89	52.2 Å²	52.2	48%	0.476	27%	0.274	S	S	.	.	H	α-helix	trans	-67.1	-39.4	171.2	-64.7	-31.4	0	0	0	112.8	I1177 F1179 S1185	I1177-N1181 WeakPolarHBondContact O-CB 3.34Å; I1177-N1181 PolarHBondContact O-N 3.43Å; I1177-N1181 PolarHBondContact O-ND2 3.22Å; F1179-N1181 VanDerWaalsContact C-N 3.26Å; F1179-N1181 PolarHBondContact O-N 3.15Å; N1181-S1185 PolarHBondContact O-N 3.45Å
1182	E	69.8	Low	64.9	Low	39 Å²	39	58.1 Å²	58.1	18%	0.182	31%	0.305	C	S	.	.	H	α-helix	trans	-66.7	-38.1	174.5	-172.9	167	-127.4	0	0	110.9	E1178 F1179 S1185 L1186 Y1201 K1204 N1303	E1178-E1182 PolarHBondContact O-N 3.12Å; F1179-E1182 PolarHBondContact O-N 2.68Å; E1182-S1185 PolarHBondContact O-N 3.04Å; E1182-L1186 HydrophobicContact CG-CD1 4.36Å; E1182-L1186 WeakPolarHBondContact O-CG 3.4Å; E1182-L1186 PolarHBondContact O-N 3.49Å; E1182-Y1201 HydrophobicContact CG-CE2 4.37Å; E1182-K1204 IonicContact OE1-NZ 2.98Å; E1182-N1303 PolarHBondContact OE2-ND2 3.16Å
1183	V	69.4	Low	65.9	Low	7 Å²	7	61.3 Å²	61.3	4%	0.042	32%	0.322	C	S	.	.	H	α-helix	trans	-71.8	-37.7	176	180	0	0	0	0	112.9	L1102 L1106 F1179 F1180 S1185 L1186 C1187	L1102-V1183 HydrophobicContact CD1-CG1 4.44Å; L1102-V1183 HydrophobicContact CD1-CG2 4.26Å; L1102-V1183 HydrophobicContact CD2-CG1 4.4Å; L1106-V1183 HydrophobicContact CD1-CG1 4.16Å; L1106-V1183 HydrophobicContact CD2-CG1 3.98Å; L1106-V1183 HydrophobicContact CG-CG1 4.32Å; F1179-V1183 HydrophobicContact CD1-CG2 4.46Å; F1179-V1183 HydrophobicContact CD2-CG2 3.86Å; F1179-V1183 HydrophobicContact CE1-CG2 4Å; F1179-V1183 HydrophobicContact CE2-CG2 3.33Å; F1179-V1183 HydrophobicContact CG-CG2 4.4Å; F1179-V1183 HydrophobicContact CZ-CG2 3.43Å; F1179-V1183 VanDerWaalsContact CZ-CG2 3.43Å; F1179-V1183 WeakPolarHBondContact O-CG2 3.39Å; F1179-V1183 PolarHBondContact O-N 2.87Å; F1180-V1183 PolarHBondContact O-N 3.4Å; V1183-S1185 PolarHBondContact O-N 2.63Å; V1183-L1186 HydrophobicContact CG2-CD1 4.49Å; V1183-L1186 CarbonylContact O-C 3.51Å; V1183-L1186 WeakPolarHBondContact O-CB 3.13Å; V1183-L1186 PolarHBondContact O-N 3.49Å; V1183-C1187 WeakPolarHBondContact O-CB 3.42Å; V1183-C1187 PolarHBondContact O-N 3.05Å; V1183-C1187 PolarHBondContact O-SG 3.28Å; V1183-C1187 VanDerWaalsContact O-SG 3.4Å
1184	E	67.6	Low	66.8	Low	141 Å²	141	62.9 Å²	62.9	66%	0.659	33%	0.33	S	S	*	.	H	α-helix	trans	-55.2	-44.9	171.3	-174.5	-178.3	-173.2	0	0	110.4	F1180 L1186 Q1188	F1180-E1184 WeakPolarHBondContact O-CB 3.2Å; F1180-E1184 PolarHBondContact O-N 3.25Å; E1184-L1186 VanDerWaalsContact C-N 3.35Å; E1184-L1186 PolarHBondContact O-N 2.95Å; E1184-Q1188 WeakPolarHBondContact O-CB 3.43Å; E1184-Q1188 PolarHBondContact O-N 3.03Å
1185	S	68.9	Low	67.5	Low	88 Å²	88	65.9 Å²	65.9	62%	0.615	34%	0.342	S	S	*	.	H	α-helix	trans	-66.7	-30.4	174.7	-172.7	0	0	0	0	113.9	N1181 E1182 V1183	N1181-S1185 PolarHBondContact O-N 3.45Å; E1182-S1185 PolarHBondContact O-N 3.04Å; V1183-S1185 PolarHBondContact O-N 2.63Å
1186	L	70.6	Confident	67.9	Low	16 Å²	16	67.1 Å²	67.1	8%	0.084	35%	0.353	C	S	.	.	H	α-helix	trans	-73.2	-50.2	175.2	-75.2	162.4	0	0	0	111	E1182 V1183 E1184 Q1188 G1189 I1190 V1197 Y1201	E1182-L1186 HydrophobicContact CG-CD1 4.36Å; E1182-L1186 WeakPolarHBondContact O-CG 3.4Å; E1182-L1186 PolarHBondContact O-N 3.49Å; V1183-L1186 HydrophobicContact CG2-CD1 4.49Å; V1183-L1186 CarbonylContact O-C 3.51Å; V1183-L1186 WeakPolarHBondContact O-CB 3.13Å; V1183-L1186 PolarHBondContact O-N 3.49Å; E1184-L1186 VanDerWaalsContact C-N 3.35Å; E1184-L1186 PolarHBondContact O-N 2.95Å; L1186-Q1188 PolarHBondContact O-N 2.83Å; L1186-G1189 WeakPolarHBondContact O-CA 3.47Å; L1186-G1189 PolarHBondContact O-N 2.91Å; L1186-I1190 WeakPolarHBondContact O-CG1 3.39Å; L1186-I1190 PolarHBondContact O-N 3.28Å; L1186-V1197 HydrophobicContact CD2-CG1 3.68Å; L1186-Y1201 HydrophobicContact CD1-CD2 3.8Å; L1186-Y1201 HydrophobicContact CD1-CE2 3.87Å; L1186-Y1201 HydrophobicContact CD1-CG 4.36Å; L1186-Y1201 HydrophobicContact CD2-CD2 3.77Å; L1186-Y1201 HydrophobicContact CD2-CG 4.02Å; L1186-Y1201 HydrophobicContact CG-CD2 4.33Å
1187	C	67.1	Low	68.2	Low	43 Å²	43	68.2 Å²	68.2	29%	0.291	36%	0.36	S	S	.	.	H	α-helix	trans	-56.3	-39.9	176.2	-69.8	0	0	0	0	111.7	V1183 G1189 I1190 I1191	V1183-C1187 WeakPolarHBondContact O-CB 3.42Å; V1183-C1187 PolarHBondContact O-N 3.05Å; V1183-C1187 PolarHBondContact O-SG 3.28Å; V1183-C1187 VanDerWaalsContact O-SG 3.4Å; C1187-G1189 VanDerWaalsContact C-N 3.26Å; C1187-G1189 PolarHBondContact O-N 3.41Å; C1187-I1190 PolarHBondContact O-N 2.81Å; C1187-I1191 WeakPolarHBondContact O-CD1 3.5Å; C1187-I1191 WeakPolarHBondContact O-CG1 3Å; C1187-I1191 PolarHBondContact O-N 3.27Å
1188	Q	68.3	Low	68.7	Low	106 Å²	106	65.2 Å²	65.2	50%	0.495	34%	0.343	S	S	.	.	H	α-helix	trans	-61.6	-32.6	175.7	-172.4	56.4	73.1	0	0	113.1	E1184 L1186	E1184-Q1188 WeakPolarHBondContact O-CB 3.43Å; E1184-Q1188 PolarHBondContact O-N 3.03Å; L1186-Q1188 PolarHBondContact O-N 2.83Å
1189	G	68.5	Low	68.8	Low	17 Å²	17	63.2 Å²	63.2	18%	0.175	34%	0.341	C	S	.	.	H	α-helix	trans	-84.6	-32.2	175.8	0	0	0	0	0	114.3	L1186 C1187 I1191 D1192 D1193	L1186-G1189 WeakPolarHBondContact O-CA 3.47Å; L1186-G1189 PolarHBondContact O-N 2.91Å; C1187-G1189 VanDerWaalsContact C-N 3.26Å; C1187-G1189 PolarHBondContact O-N 3.41Å; G1189-I1191 PolarHBondContact O-N 3.38Å; G1189-D1192 PolarHBondContact O-N 3.4Å; G1189-D1193 PolarHBondContact O-N 3.08Å; G1189-D1193 VanDerWaalsContact O-N 3.11Å
1190	I	69.5	Low	68.7	Low	21 Å²	21	67.7 Å²	67.7	11%	0.108	37%	0.365	C	S	.	.	H	α-helix	trans	-60.9	-28.7	179.7	-72.1	164.7	0	0	0	111.4	T1097 W1099 L1102 L1186 C1187 D1192 L1194 V1197	T1097-I1190 WeakPolarHBondContact O-CG2 3.46Å; W1099-I1190 HydrophobicContact CE3-CD1 3.98Å; L1102-I1190 HydrophobicContact CD2-CD1 3.76Å; L1186-I1190 WeakPolarHBondContact O-CG1 3.39Å; L1186-I1190 PolarHBondContact O-N 3.28Å; C1187-I1190 PolarHBondContact O-N 2.81Å; I1190-D1192 PolarHBondContact O-N 3.26Å; I1190-L1194 HydrophobicContact CG1-CD1 4.19Å; I1190-L1194 HydrophobicContact CG2-CB 4.35Å; I1190-L1194 HydrophobicContact CG2-CD1 3.86Å; I1190-V1197 HydrophobicContact CG1-CB 4.3Å; I1190-V1197 HydrophobicContact CG1-CG1 3.9Å
1191	I	64.5	Low	68.8	Low	95 Å²	95	65 Å²	65	49%	0.487	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-34.3	172.4	-62.9	156.6	0	0	0	112	L1011 C1187 G1189	L1011-I1191 HydrophobicContact CD2-CD1 3.61Å; L1011-I1191 HydrophobicContact CD2-CG1 4.12Å; C1187-I1191 WeakPolarHBondContact O-CD1 3.5Å; C1187-I1191 WeakPolarHBondContact O-CG1 3Å; C1187-I1191 PolarHBondContact O-N 3.27Å; G1189-I1191 PolarHBondContact O-N 3.38Å
1192	D	69.5	Low	68.7	Low	141 Å²	141	61 Å²	61	75%	0.754	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-50.3	-178.2	-65.1	-32.2	0	0	0	112	G1189 I1190	G1189-D1192 PolarHBondContact O-N 3.4Å; I1190-D1192 PolarHBondContact O-N 3.26Å
1193	D	71.7	Confident	68.5	Low	70 Å²	70	63 Å²	63	37%	0.374	34%	0.343	S	S	.	.			trans	-158.7	105.7	176.6	-179.3	-9.5	0	0	0	112.1	G1189 Q1195 T1196 V1197	G1189-D1193 PolarHBondContact O-N 3.08Å; G1189-D1193 VanDerWaalsContact O-N 3.11Å; D1193-Q1195 PolarHBondContact O-N 3.35Å; D1193-Q1195 PolarHBondContact OD1-N 3.39Å; D1193-T1196 VanDerWaalsContact CG-CB 3.46Å; D1193-T1196 PolarHBondContact OD1-N 2.96Å; D1193-T1196 VanDerWaalsContact OD1-N 3.09Å; D1193-T1196 WeakPolarHBondContact OD2-CB 3.42Å; D1193-T1196 PolarHBondContact OD2-OG1 3.49Å; D1193-V1197 WeakPolarHBondContact O-CB 3.49Å; D1193-V1197 VanDerWaalsContact O-CG2 3.26Å; D1193-V1197 WeakPolarHBondContact O-CG2 3.37Å; D1193-V1197 PolarHBondContact O-N 3.34Å; D1193-V1197 VanDerWaalsContact O-N 3.11Å
1194	L	70.9	Confident	68.3	Low	58 Å²	58	66.1 Å²	66.1	30%	0.304	36%	0.356	S	S	.	.	H	α-helix	trans	-56.9	-45.8	177	174.6	60.3	0	0	0	113.5	W1099 I1190 V1197 E1198	W1099-L1194 HydrophobicContact CB-CD1 3.83Å; W1099-L1194 HydrophobicContact CG-CD1 4.2Å; I1190-L1194 HydrophobicContact CG1-CD1 4.19Å; I1190-L1194 HydrophobicContact CG2-CB 4.35Å; I1190-L1194 HydrophobicContact CG2-CD1 3.86Å; L1194-V1197 PolarHBondContact O-N 2.99Å; L1194-E1198 WeakPolarHBondContact O-CB 3.28Å; L1194-E1198 PolarHBondContact O-N 3.35Å
1195	Q	66.7	Low	68	Low	147 Å²	147	59.5 Å²	59.5	69%	0.687	33%	0.325	S	S	*	.	H	α-helix	trans	-72.3	-40.7	-173.1	-70.6	-172.6	-7.7	0	0	111.8	D1193 V1197 S1199	D1193-Q1195 PolarHBondContact O-N 3.35Å; D1193-Q1195 PolarHBondContact OD1-N 3.39Å; Q1195-V1197 VanDerWaalsContact C-N 3.35Å; Q1195-S1199 VanDerWaalsContact O-CB 3.28Å; Q1195-S1199 WeakPolarHBondContact O-CB 3.42Å; Q1195-S1199 PolarHBondContact O-N 3.33Å; Q1195-S1199 PolarHBondContact O-OG 2.67Å
1196	T	69.4	Low	67.6	Low	68 Å²	68	55.3 Å²	55.3	42%	0.417	30%	0.296	S	S	.	.	H	α-helix	trans	-66.7	-37.6	176.1	-69.5	0	0	0	0	111.1	D1193 N1200	D1193-T1196 VanDerWaalsContact CG-CB 3.46Å; D1193-T1196 PolarHBondContact OD1-N 2.96Å; D1193-T1196 VanDerWaalsContact OD1-N 3.09Å; D1193-T1196 WeakPolarHBondContact OD2-CB 3.42Å; D1193-T1196 PolarHBondContact OD2-OG1 3.49Å; T1196-N1200 WeakPolarHBondContact CG2-ND2 3.45Å; T1196-N1200 WeakPolarHBondContact O-CB 3.25Å; T1196-N1200 PolarHBondContact O-N 2.68Å; T1196-N1200 PolarHBondContact O-ND2 2.9Å; T1196-N1200 VanDerWaalsContact O-ND2 3.07Å
1197	V	68.4	Low	67	Low	25 Å²	25	55.2 Å²	55.2	15%	0.152	30%	0.298	C	S	.	.	H	α-helix	trans	-72.5	-43.9	178.6	173.4	0	0	0	0	112.5	L1186 I1190 D1193 L1194 Q1195 S1199 N1200 Y1201	L1186-V1197 HydrophobicContact CD2-CG1 3.68Å; I1190-V1197 HydrophobicContact CG1-CB 4.3Å; I1190-V1197 HydrophobicContact CG1-CG1 3.9Å; D1193-V1197 WeakPolarHBondContact O-CB 3.49Å; D1193-V1197 VanDerWaalsContact O-CG2 3.26Å; D1193-V1197 WeakPolarHBondContact O-CG2 3.37Å; D1193-V1197 PolarHBondContact O-N 3.34Å; D1193-V1197 VanDerWaalsContact O-N 3.11Å; L1194-V1197 PolarHBondContact O-N 2.99Å; Q1195-V1197 VanDerWaalsContact C-N 3.35Å; V1197-S1199 VanDerWaalsContact C-N 3.34Å; V1197-S1199 PolarHBondContact O-N 3.32Å; V1197-N1200 PolarHBondContact O-N 3.32Å; V1197-Y1201 WeakPolarHBondContact O-CB 3.21Å; V1197-Y1201 PolarHBondContact O-N 3.28Å
1198	E	69.7	Low	66.3	Low	30 Å²	30	56.9 Å²	56.9	14%	0.14	30%	0.304	C	S	.	.	H	α-helix	trans	-54.7	-50	171.3	167.7	165.7	-127.9	0	0	111	W1099 L1194 N1200 Y1201 L1202 P1243	W1099-E1198 VanDerWaalsContact CE2-OE1 3.31Å; W1099-E1198 HydrophobicContact CH2-CB 4.03Å; W1099-E1198 HydrophobicContact CH2-CG 4.15Å; W1099-E1198 HydrophobicContact CZ2-CB 3.79Å; W1099-E1198 HydrophobicContact CZ2-CG 3.5Å; W1099-E1198 VanDerWaalsContact CZ2-CG 3.5Å; W1099-E1198 PolarHBondContact NE1-OE1 3.23Å; L1194-E1198 WeakPolarHBondContact O-CB 3.28Å; L1194-E1198 PolarHBondContact O-N 3.35Å; E1198-N1200 PolarHBondContact O-N 3.14Å; E1198-Y1201 PolarHBondContact O-N 2.77Å; E1198-L1202 HydrophobicContact CG-CD1 4.02Å; E1198-L1202 WeakPolarHBondContact O-CG 3.39Å; E1198-L1202 PolarHBondContact O-N 3.37Å; E1198-P1243 HydrophobicContact CG-CG 3.94Å; E1198-P1243 WeakPolarHBondContact OE1-CG 3.2Å
1199	S	65.4	Low	65.4	Low	62 Å²	62	52.6 Å²	52.6	43%	0.434	29%	0.289	S	S	.	.	H	α-helix	trans	-61.9	-45.6	178.2	-61	0	0	0	0	112.4	Q1195 V1197 Y1201 L1202 L1203	Q1195-S1199 VanDerWaalsContact O-CB 3.28Å; Q1195-S1199 WeakPolarHBondContact O-CB 3.42Å; Q1195-S1199 PolarHBondContact O-N 3.33Å; Q1195-S1199 PolarHBondContact O-OG 2.67Å; V1197-S1199 VanDerWaalsContact C-N 3.34Å; V1197-S1199 PolarHBondContact O-N 3.32Å; S1199-Y1201 PolarHBondContact O-N 3.07Å; S1199-L1202 PolarHBondContact O-N 3.19Å; S1199-L1203 VanDerWaalsContact O-CB 3.31Å; S1199-L1203 WeakPolarHBondContact O-CB 3.35Å; S1199-L1203 WeakPolarHBondContact O-CG 3.44Å; S1199-L1203 PolarHBondContact O-N 2.8Å
1200	N	67.9	Low	64.5	Low	95 Å²	95	57.6 Å²	57.6	51%	0.508	31%	0.306	S	S	.	.	H	α-helix	trans	-64.9	-38.6	179.3	-78	-30	0	0	0	112.3	T1196 V1197 E1198 K1204	T1196-N1200 WeakPolarHBondContact CG2-ND2 3.45Å; T1196-N1200 WeakPolarHBondContact O-CB 3.25Å; T1196-N1200 PolarHBondContact O-N 2.68Å; T1196-N1200 PolarHBondContact O-ND2 2.9Å; T1196-N1200 VanDerWaalsContact O-ND2 3.07Å; V1197-N1200 PolarHBondContact O-N 3.32Å; E1198-N1200 PolarHBondContact O-N 3.14Å; N1200-K1204 VanDerWaalsContact O-CB 3.24Å; N1200-K1204 WeakPolarHBondContact O-CB 3.24Å; N1200-K1204 PolarHBondContact O-N 2.7Å
1201	Y	70.5	Confident	63.1	Low	8 Å²	8	62 Å²	62	3%	0.031	34%	0.336	C	S	.	.	H	α-helix	trans	-64	-49.8	176.1	-176.8	-106.6	0	0	0	111.5	W1099 E1182 L1186 V1197 E1198 S1199 L1203 K1204 V1205 I1245 T1300	W1099-Y1201 HydrophobicContact CH2-CD1 4.08Å; E1182-Y1201 HydrophobicContact CG-CE2 4.37Å; L1186-Y1201 HydrophobicContact CD1-CD2 3.8Å; L1186-Y1201 HydrophobicContact CD1-CE2 3.87Å; L1186-Y1201 HydrophobicContact CD1-CG 4.36Å; L1186-Y1201 HydrophobicContact CD2-CD2 3.77Å; L1186-Y1201 HydrophobicContact CD2-CG 4.02Å; L1186-Y1201 HydrophobicContact CG-CD2 4.33Å; V1197-Y1201 WeakPolarHBondContact O-CB 3.21Å; V1197-Y1201 PolarHBondContact O-N 3.28Å; E1198-Y1201 PolarHBondContact O-N 2.77Å; S1199-Y1201 PolarHBondContact O-N 3.07Å; Y1201-L1203 VanDerWaalsContact C-N 3.35Å; Y1201-L1203 PolarHBondContact O-N 3.32Å; Y1201-K1204 WeakPolarHBondContact O-CB 3.45Å; Y1201-K1204 PolarHBondContact O-N 3.19Å; Y1201-K1204 VanDerWaalsContact O-N 3.13Å; Y1201-V1205 HydrophobicContact CD1-CG2 4.45Å; Y1201-V1205 HydrophobicContact CD2-CG2 4.19Å; Y1201-V1205 HydrophobicContact CE1-CG2 4.01Å; Y1201-V1205 HydrophobicContact CE2-CG2 3.73Å; Y1201-V1205 WeakPolarHBondContact O-CG2 3.21Å; Y1201-V1205 PolarHBondContact O-N 3.16Å; Y1201-I1245 HydrophobicContact CD1-CD1 4.12Å; Y1201-I1245 HydrophobicContact CE1-CD1 4.12Å; Y1201-T1300 HydrophobicContact CE1-CG2 4.38Å; Y1201-T1300 WeakPolarHBondContact OH-CG2 3.36Å
1202	L	68.8	Low	61.9	Low	4 Å²	4	68 Å²	68	2%	0.021	35%	0.354	C	S	.	.	H	α-helix	trans	-64.7	-38.7	-180	-66	170.1	0	0	0	112	E1198 S1199 V1205 C1206 G1207 I1225 W1226 P1243 I1245 L1299	E1198-L1202 HydrophobicContact CG-CD1 4.02Å; E1198-L1202 WeakPolarHBondContact O-CG 3.39Å; E1198-L1202 PolarHBondContact O-N 3.37Å; S1199-L1202 PolarHBondContact O-N 3.19Å; L1202-V1205 PolarHBondContact O-N 3.05Å; L1202-C1206 PolarHBondContact O-N 2.82Å; L1202-G1207 PolarHBondContact O-N 2.77Å; L1202-I1225 HydrophobicContact CD1-CG2 4.26Å; L1202-I1225 HydrophobicContact CD2-CD1 4.41Å; L1202-I1225 HydrophobicContact CD2-CG2 4.01Å; L1202-W1226 HydrophobicContact CB-CH2 4.47Å; L1202-W1226 HydrophobicContact CB-CZ2 4.41Å; L1202-W1226 HydrophobicContact CD1-CZ2 4.27Å; L1202-P1243 HydrophobicContact CD1-CB 3.43Å; L1202-P1243 VanDerWaalsContact CD1-CB 3.43Å; L1202-P1243 HydrophobicContact CD1-CG 3.36Å; L1202-I1245 HydrophobicContact CD2-CD1 4.34Å; L1202-I1245 HydrophobicContact CD2-CG1 4.07Å; L1202-L1299 HydrophobicContact CD2-CD2 4.03Å
1203	L	64.3	Low	60.7	Low	81 Å²	81	63 Å²	63	42%	0.424	33%	0.33	S	S	.	.	H	α-helix	trans	-64.9	-37.7	172.3	-73.3	170.9	0	0	0	112.4	S1199 Y1201 G1207 D1208	S1199-L1203 VanDerWaalsContact O-CB 3.31Å; S1199-L1203 WeakPolarHBondContact O-CB 3.35Å; S1199-L1203 WeakPolarHBondContact O-CG 3.44Å; S1199-L1203 PolarHBondContact O-N 2.8Å; Y1201-L1203 VanDerWaalsContact C-N 3.35Å; Y1201-L1203 PolarHBondContact O-N 3.32Å; L1203-G1207 VanDerWaalsContact O-CA 3.25Å; L1203-G1207 WeakPolarHBondContact O-CA 3.44Å; L1203-G1207 PolarHBondContact O-N 2.89Å; L1203-D1208 HydrophobicContact CD2-CB 3.98Å
1204	K	65.2	Low	59.5	Low	72 Å²	72	62 Å²	62	31%	0.313	33%	0.327	S	S	.	.	H	α-helix	trans	-67.9	-39.8	175.8	169.8	171.7	162.3	159	0	112.6	E1182 N1200 Y1201 M1312 E1313	E1182-K1204 IonicContact OE1-NZ 2.98Å; N1200-K1204 VanDerWaalsContact O-CB 3.24Å; N1200-K1204 WeakPolarHBondContact O-CB 3.24Å; N1200-K1204 PolarHBondContact O-N 2.7Å; Y1201-K1204 WeakPolarHBondContact O-CB 3.45Å; Y1201-K1204 PolarHBondContact O-N 3.19Å; Y1201-K1204 VanDerWaalsContact O-N 3.13Å; K1204-M1312 WeakPolarHBondContact O-CB 3.35Å; K1204-E1313 WeakPolarHBondContact CE-OE1 3.4Å; K1204-E1313 IonicContact NZ-OE1 2.74Å; K1204-E1313 PolarHBondContact NZ-OE1 2.76Å
1205	V	61.5	Low	58.6	Low	2 Å²	2	59.7 Å²	59.7	1%	0.012	31%	0.314	C	S	.	.	H	α-helix	trans	-87.5	-37.7	-174.9	178.8	0	0	0	0	112.7	Y1201 L1202 L1299 N1303 L1308	Y1201-V1205 HydrophobicContact CD1-CG2 4.45Å; Y1201-V1205 HydrophobicContact CD2-CG2 4.19Å; Y1201-V1205 HydrophobicContact CE1-CG2 4.01Å; Y1201-V1205 HydrophobicContact CE2-CG2 3.73Å; Y1201-V1205 WeakPolarHBondContact O-CG2 3.21Å; Y1201-V1205 PolarHBondContact O-N 3.16Å; L1202-V1205 PolarHBondContact O-N 3.05Å; V1205-L1299 HydrophobicContact CG1-CD1 4.13Å; V1205-L1299 HydrophobicContact CG1-CD2 4.26Å; V1205-L1299 HydrophobicContact CG1-CG 4.09Å; V1205-N1303 HydrophobicContact CG1-CB 3.92Å; V1205-L1308 HydrophobicContact CG1-CB 4.2Å; V1205-L1308 HydrophobicContact CG1-CD1 4.23Å
1206	C	60.3	Low	58.1	Low	1 Å²	1	58.3 Å²	58.3	1%	0.007	30%	0.303	C	S	.	.	H	α-helix	trans	-121.9	-14.6	-172.8	-67	0	0	0	0	115.2	L1202 T1218 I1225	L1202-C1206 PolarHBondContact O-N 2.82Å; C1206-T1218 VanDerWaalsContact O-CB 3.26Å; C1206-T1218 WeakPolarHBondContact O-CB 3.41Å; C1206-T1218 VanDerWaalsContact O-CG2 3.28Å; C1206-T1218 WeakPolarHBondContact O-CG2 3.27Å; C1206-I1225 HydrophobicContact CB-CD1 3.85Å; C1206-I1225 WeakPolarHBondContact SG-CD1 3.39Å
1207	G	59.1	Low	57.5	Low	13 Å²	13	55.2 Å²	55.2	13%	0.134	28%	0.284	C	S	.	.			trans	72.8	-177.4	-174.9	0	0	0	0	0	113.5	L1202 L1203 G1209	L1202-G1207 PolarHBondContact O-N 2.77Å; L1203-G1207 VanDerWaalsContact O-CA 3.25Å; L1203-G1207 WeakPolarHBondContact O-CA 3.44Å; L1203-G1207 PolarHBondContact O-N 2.89Å; G1207-G1209 PolarHBondContact O-N 2.99Å; G1207-G1209 VanDerWaalsContact O-N 3.09Å
1208	D	52.4	Low	57.1	Low	78 Å²	78	54.5 Å²	54.5	42%	0.417	28%	0.28	S	S	.	.			trans	-75.8	3.9	-167.9	80.7	-12.4	0	0	0	116	L1203 K1210	L1203-D1208 HydrophobicContact CD2-CB 3.98Å; D1208-K1210 PolarHBondContact O-N 2.88Å; D1208-K1210 PolarHBondContact OD1-N 3.5Å; D1208-K1210 WeakPolarHBondContact OD2-CD 3.35Å; D1208-K1210 VanDerWaalsContact OD2-CE 3.27Å; D1208-K1210 WeakPolarHBondContact OD2-CE 3.16Å; D1208-K1210 IonicContact OD2-NZ 2.78Å; D1208-K1210 PolarHBondContact OD2-NZ 2.7Å
1209	G	48.9	Very low	56.6	Low	17 Å²	17	54.6 Å²	54.6	18%	0.175	28%	0.283	C	S	.	.			trans	62	1.2	173.8	0	0	0	0	0	116.7	G1207	G1207-G1209 PolarHBondContact O-N 2.99Å; G1207-G1209 VanDerWaalsContact O-N 3.09Å
1210	K	49.3	Very low	56.7	Low	122 Å²	122	52.3 Å²	52.3	53%	0.53	27%	0.265	S	S	.	.			trans	-65.9	144.1	-171	-69	-176	-169.8	123.4	0	111.3	D1208 Y1212 S1213	D1208-K1210 PolarHBondContact O-N 2.88Å; D1208-K1210 PolarHBondContact OD1-N 3.5Å; D1208-K1210 WeakPolarHBondContact OD2-CD 3.35Å; D1208-K1210 VanDerWaalsContact OD2-CE 3.27Å; D1208-K1210 WeakPolarHBondContact OD2-CE 3.16Å; D1208-K1210 IonicContact OD2-NZ 2.78Å; D1208-K1210 PolarHBondContact OD2-NZ 2.7Å; K1210-Y1212 PolarHBondContact O-N 3.26Å; K1210-S1213 VanDerWaalsContact O-CB 3.24Å; K1210-S1213 WeakPolarHBondContact O-CB 3.49Å; K1210-S1213 PolarHBondContact O-N 3.18Å; K1210-S1213 PolarHBondContact O-OG 3.48Å
1211	P	41	Very low	56.6	Low	113 Å²	113	47.9 Å²	47.9	73%	0.734	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-11.8	-177.1	27	-36	0	0	0	114.5
1212	Y	38.7	Very low	56.3	Low	221 Å²	221	48.3 Å²	48.3	87%	0.867	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.8	172.1	-60.3	-72.4	0	0	0	113.4	K1210	K1210-Y1212 PolarHBondContact O-N 3.26Å
1213	S	44.8	Very low	56.2	Low	35 Å²	35	55.2 Å²	55.2	25%	0.245	28%	0.276	C	S	.	.	S	Bend	trans	-64.9	139.6	169.3	75	0	0	0	0	109.2	K1210 L1215 C1219	K1210-S1213 VanDerWaalsContact O-CB 3.24Å; K1210-S1213 WeakPolarHBondContact O-CB 3.49Å; K1210-S1213 PolarHBondContact O-N 3.18Å; K1210-S1213 PolarHBondContact O-OG 3.48Å; S1213-L1215 PolarHBondContact O-N 3.11Å; S1213-L1215 VanDerWaalsContact O-N 3.14Å; S1213-C1219 PolarHBondContact OG-SG 3.04Å; S1213-C1219 VanDerWaalsContact OG-SG 3.37Å
1214	T	46	Very low	56.4	Low	50 Å²	50	52.3 Å²	52.3	31%	0.307	26%	0.26	S	S	.	.	S	Bend	trans	-79.4	4.4	-169	-0.2	0	0	0	0	113.2	N1334	T1214-N1334 PolarHBondContact O-ND2 3.33Å
1215	L	51.9	Low	56.5	Low	9 Å²	9	48.9 Å²	48.9	5%	0.047	25%	0.245	C	C	.	.			trans	-104.9	101.4	-171.2	-75.1	171.3	0	0	0	111.1	S1213 F1217 T1218 C1219 M1312 L1330 F1333	S1213-L1215 PolarHBondContact O-N 3.11Å; S1213-L1215 VanDerWaalsContact O-N 3.14Å; L1215-F1217 PolarHBondContact O-N 3.11Å; L1215-T1218 HydrophobicContact CB-CG2 4.21Å; L1215-T1218 WeakPolarHBondContact CB-OG1 3.4Å; L1215-T1218 HydrophobicContact CD1-CG2 3.87Å; L1215-T1218 PolarHBondContact O-N 3.26Å; L1215-T1218 PolarHBondContact O-OG1 2.77Å; L1215-C1219 WeakPolarHBondContact O-CB 3.36Å; L1215-C1219 PolarHBondContact O-N 2.89Å; L1215-C1219 VanDerWaalsContact O-N 3.1Å; L1215-C1219 PolarHBondContact O-SG 3.44Å; L1215-C1219 VanDerWaalsContact O-SG 3.35Å; L1215-M1312 HydrophobicContact CD1-CE 3.46Å; L1215-M1312 VanDerWaalsContact CD1-CE 3.46Å; L1215-L1330 HydrophobicContact CD1-CD2 3.43Å; L1215-L1330 VanDerWaalsContact CD1-CD2 3.43Å; L1215-L1330 HydrophobicContact CD2-CD2 4.35Å; L1215-L1330 WeakPolarHBondContact CD2-O 3.4Å; L1215-L1330 HydrophobicContact CG-CB 4.39Å; L1215-L1330 HydrophobicContact CG-CD2 3.77Å; L1215-F1333 HydrophobicContact CD2-CB 3.81Å; L1215-F1333 HydrophobicContact CD2-CD1 4.17Å; L1215-F1333 HydrophobicContact CD2-CG 4.28Å
1216	R	56.9	Low	56.8	Low	118 Å²	118	52.4 Å²	52.4	45%	0.445	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-27.5	174.8	-70.7	-170.1	-177.8	-173.4	12.1	112.5	F1220 F1259 D1263 N1334	R1216-F1220 PolarHBondContact O-N 3.2Å; R1216-F1259 HydrophobicContact CB-CE2 4.09Å; R1216-D1263 WeakPolarHBondContact CD-OD2 3.32Å; R1216-D1263 IonicContact CZ-OD1 2.7Å; R1216-D1263 IonicContact CZ-OD2 2.98Å; R1216-D1263 IonicContact NE-OD2 2.7Å; R1216-D1263 IonicContact NH1-OD1 3.64Å; R1216-D1263 PolarHBondContact NH1-OD1 3.21Å; R1216-D1263 IonicContact NH1-OD2 3Å; R1216-D1263 PolarHBondContact NH1-OD2 3Å; R1216-N1334 PolarHBondContact N-ND2 2.85Å; R1216-N1334 PolarHBondContact N-OD1 2.94Å
1217	F	57.1	Low	56.7	Low	4 Å²	4	54.5 Å²	54.5	2%	0.018	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-51.3	176.9	-175.2	-93.2	0	0	0	111.8	L1215 C1219 F1220 L1221 L1306 L1308 F1333 N1334 F1337	L1215-F1217 PolarHBondContact O-N 3.11Å; F1217-C1219 VanDerWaalsContact C-N 3.33Å; F1217-C1219 PolarHBondContact O-N 3.41Å; F1217-F1220 HydrophobicContact CB-CE1 4.2Å; F1217-F1220 HydrophobicContact CD2-CD1 4.41Å; F1217-F1220 AromaticContact CD2-CE1 3.31Å; F1217-F1220 HydrophobicContact CD2-CE1 3.31Å; F1217-F1220 AromaticContact CD2-CZ 3.59Å; F1217-F1220 HydrophobicContact CD2-CZ 3.59Å; F1217-F1220 AromaticContact CE2-CE1 3.79Å; F1217-F1220 HydrophobicContact CE2-CE1 3.79Å; F1217-F1220 AromaticContact CE2-CZ 3.53Å; F1217-F1220 HydrophobicContact CE2-CZ 3.53Å; F1217-F1220 AromaticContact CG-CE1 3.8Å; F1217-F1220 HydrophobicContact CG-CE1 3.8Å; F1217-F1220 HydrophobicContact CG-CZ 4.21Å; F1217-F1220 HydrophobicContact CZ-CZ 4.14Å; F1217-F1220 WeakPolarHBondContact O-CD1 3.43Å; F1217-F1220 WeakPolarHBondContact O-CG 3.23Å; F1217-F1220 PolarHBondContact O-N 3.11Å; F1217-L1221 HydrophobicContact CD1-CD1 3.91Å; F1217-L1221 HydrophobicContact CD1-CG 4.35Å; F1217-L1221 HydrophobicContact CE1-CD1 3.39Å; F1217-L1221 HydrophobicContact CE1-CG 4.03Å; F1217-L1221 HydrophobicContact CZ-CD1 4.15Å; F1217-L1221 PolarHBondContact O-N 3.35Å; F1217-L1306 HydrophobicContact CZ-CD1 3.97Å; F1217-L1308 HydrophobicContact CE1-CD2 3.84Å; F1217-L1308 HydrophobicContact CZ-CD2 4.45Å; F1217-F1333 HydrophobicContact CB-CD1 4.13Å; F1217-F1333 HydrophobicContact CB-CE1 3.75Å; F1217-F1333 HydrophobicContact CD1-CD1 4.43Å; F1217-F1333 AromaticContact CD1-CE1 3.47Å; F1217-F1333 HydrophobicContact CD1-CE1 3.47Å; F1217-F1333 VanDerWaalsContact CD1-CE1 3.47Å; F1217-F1333 AromaticContact CD1-CZ 3.92Å; F1217-F1333 HydrophobicContact CD1-CZ 3.92Å; F1217-F1333 AromaticContact CD2-CE1 3.98Å; F1217-F1333 HydrophobicContact CD2-CE1 3.98Å; F1217-F1333 AromaticContact CE1-CE1 3.97Å; F1217-F1333 HydrophobicContact CE1-CE1 3.97Å; F1217-F1333 AromaticContact CE1-CZ 3.95Å; F1217-F1333 HydrophobicContact CE1-CZ 3.95Å; F1217-F1333 HydrophobicContact CE2-CE1 4.46Å; F1217-F1333 HydrophobicContact CG-CD1 4.34Å; F1217-F1333 AromaticContact CG-CE1 3.48Å; F1217-F1333 HydrophobicContact CG-CE1 3.48Å; F1217-F1333 VanDerWaalsContact CG-CE1 3.48Å; F1217-F1333 HydrophobicContact CG-CZ 4.28Å; F1217-F1333 HydrophobicContact CZ-CE1 4.46Å; F1217-F1333 HydrophobicContact CZ-CZ 4.38Å; F1217-N1334 PolarHBondContact N-OD1 3.01Å; F1217-F1337 AromaticContact CD2-CD1 3.61Å; F1217-F1337 HydrophobicContact CD2-CD1 3.61Å; F1217-F1337 HydrophobicContact CD2-CD2 4.22Å; F1217-F1337 AromaticContact CD2-CE1 3.7Å; F1217-F1337 HydrophobicContact CD2-CE1 3.7Å; F1217-F1337 HydrophobicContact CD2-CE2 4.31Å; F1217-F1337 AromaticContact CD2-CG 3.88Å; F1217-F1337 HydrophobicContact CD2-CG 3.88Å; F1217-F1337 HydrophobicContact CD2-CZ 4.07Å; F1217-F1337 HydrophobicContact CE2-CD1 4Å; F1217-F1337 AromaticContact CE2-CD2 3.93Å; F1217-F1337 HydrophobicContact CE2-CD2 3.93Å; F1217-F1337 AromaticContact CE2-CE1 3.77Å; F1217-F1337 HydrophobicContact CE2-CE1 3.77Å; F1217-F1337 AromaticContact CE2-CE2 3.71Å; F1217-F1337 HydrophobicContact CE2-CE2 3.71Å; F1217-F1337 HydrophobicContact CE2-CG 4.08Å; F1217-F1337 AromaticContact CE2-CZ 3.64Å; F1217-F1337 HydrophobicContact CE2-CZ 3.64Å
1218	T	59.7	Low	56.5	Low	10 Å²	10	60 Å²	60	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-69.4	-31.9	178.3	59	0	0	0	0	112.5	C1206 L1215 F1220 L1221 S1222 M1312	C1206-T1218 VanDerWaalsContact O-CB 3.26Å; C1206-T1218 WeakPolarHBondContact O-CB 3.41Å; C1206-T1218 VanDerWaalsContact O-CG2 3.28Å; C1206-T1218 WeakPolarHBondContact O-CG2 3.27Å; L1215-T1218 HydrophobicContact CB-CG2 4.21Å; L1215-T1218 WeakPolarHBondContact CB-OG1 3.4Å; L1215-T1218 HydrophobicContact CD1-CG2 3.87Å; L1215-T1218 PolarHBondContact O-N 3.26Å; L1215-T1218 PolarHBondContact O-OG1 2.77Å; T1218-F1220 PolarHBondContact O-N 2.97Å; T1218-F1220 VanDerWaalsContact O-N 3.14Å; T1218-L1221 PolarHBondContact O-N 3.19Å; T1218-S1222 WeakPolarHBondContact O-CB 3.12Å; T1218-S1222 PolarHBondContact O-N 2.91Å; T1218-S1222 PolarHBondContact O-OG 3.14Å; T1218-M1312 HydrophobicContact CG2-CE 3.61Å
1219	C	58.5	Low	56	Low	31 Å²	31	64 Å²	64	21%	0.209	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-7.3	169.6	-75	0	0	0	0	115.1	S1213 L1215 F1217	S1213-C1219 PolarHBondContact OG-SG 3.04Å; S1213-C1219 VanDerWaalsContact OG-SG 3.37Å; L1215-C1219 WeakPolarHBondContact O-CB 3.36Å; L1215-C1219 PolarHBondContact O-N 2.89Å; L1215-C1219 VanDerWaalsContact O-N 3.1Å; L1215-C1219 PolarHBondContact O-SG 3.44Å; L1215-C1219 VanDerWaalsContact O-SG 3.35Å; F1217-C1219 VanDerWaalsContact C-N 3.33Å; F1217-C1219 PolarHBondContact O-N 3.41Å
1220	F	67	Low	55.3	Low	15 Å²	15	70.7 Å²	70.7	7%	0.066	35%	0.35	C	S	.	.	H	α-helix	trans	-106	-36.2	165.1	86.4	-112.4	0	0	0	112.5	R1216 F1217 T1218 S1222 K1223 L1224 F1252 T1255 L1256 F1259	R1216-F1220 PolarHBondContact O-N 3.2Å; F1217-F1220 HydrophobicContact CB-CE1 4.2Å; F1217-F1220 HydrophobicContact CD2-CD1 4.41Å; F1217-F1220 AromaticContact CD2-CE1 3.31Å; F1217-F1220 HydrophobicContact CD2-CE1 3.31Å; F1217-F1220 AromaticContact CD2-CZ 3.59Å; F1217-F1220 HydrophobicContact CD2-CZ 3.59Å; F1217-F1220 AromaticContact CE2-CE1 3.79Å; F1217-F1220 HydrophobicContact CE2-CE1 3.79Å; F1217-F1220 AromaticContact CE2-CZ 3.53Å; F1217-F1220 HydrophobicContact CE2-CZ 3.53Å; F1217-F1220 AromaticContact CG-CE1 3.8Å; F1217-F1220 HydrophobicContact CG-CE1 3.8Å; F1217-F1220 HydrophobicContact CG-CZ 4.21Å; F1217-F1220 HydrophobicContact CZ-CZ 4.14Å; F1217-F1220 WeakPolarHBondContact O-CD1 3.43Å; F1217-F1220 WeakPolarHBondContact O-CG 3.23Å; F1217-F1220 PolarHBondContact O-N 3.11Å; T1218-F1220 PolarHBondContact O-N 2.97Å; T1218-F1220 VanDerWaalsContact O-N 3.14Å; F1220-S1222 PolarHBondContact O-N 3.18Å; F1220-K1223 WeakPolarHBondContact O-CA 3.22Å; F1220-K1223 WeakPolarHBondContact O-CB 3.43Å; F1220-K1223 PolarHBondContact O-N 3.41Å; F1220-L1224 HydrophobicContact CD2-CD1 4.08Å; F1220-L1224 HydrophobicContact CE2-CD1 4.23Å; F1220-L1224 PolarHBondContact O-N 3.18Å; F1220-F1252 HydrophobicContact CE2-CE2 4.42Å; F1220-T1255 HydrophobicContact CB-CG2 3.97Å; F1220-T1255 HydrophobicContact CD2-CG2 3.5Å; F1220-T1255 VanDerWaalsContact CD2-CG2 3.5Å; F1220-T1255 HydrophobicContact CE2-CG2 4.25Å; F1220-T1255 HydrophobicContact CG-CG2 3.92Å; F1220-L1256 HydrophobicContact CE2-CD2 4.43Å; F1220-L1256 HydrophobicContact CZ-CD2 3.86Å; F1220-F1259 HydrophobicContact CD1-CD2 4.15Å; F1220-F1259 HydrophobicContact CE1-CD2 4.26Å
1221	L	66.3	Low	54.5	Low	2 Å²	2	71.3 Å²	71.3	1%	0.01	36%	0.36	C	S	.	.	H	α-helix	trans	-57.5	-39	171.9	-74.9	-177.4	0	0	0	110.9	F1217 T1218 K1223 L1224 I1225 L1308	F1217-L1221 HydrophobicContact CD1-CD1 3.91Å; F1217-L1221 HydrophobicContact CD1-CG 4.35Å; F1217-L1221 HydrophobicContact CE1-CD1 3.39Å; F1217-L1221 HydrophobicContact CE1-CG 4.03Å; F1217-L1221 HydrophobicContact CZ-CD1 4.15Å; F1217-L1221 PolarHBondContact O-N 3.35Å; T1218-L1221 PolarHBondContact O-N 3.19Å; L1221-K1223 PolarHBondContact O-N 3.28Å; L1221-L1224 HydrophobicContact CD2-CD1 4.36Å; L1221-L1224 PolarHBondContact O-N 3.36Å; L1221-I1225 VanDerWaalsContact O-CG1 3.32Å; L1221-I1225 WeakPolarHBondContact O-CG1 3.24Å; L1221-I1225 PolarHBondContact O-N 3.47Å; L1221-L1308 HydrophobicContact CD1-CD1 4.03Å
1222	S	64.7	Low	54.2	Low	16 Å²	16	73 Å²	73	11%	0.112	36%	0.362	C	S	.	.	H	α-helix	trans	-59.2	-30.1	173	64.5	0	0	0	0	113.3	T1218 F1220 W1226	T1218-S1222 WeakPolarHBondContact O-CB 3.12Å; T1218-S1222 PolarHBondContact O-N 2.91Å; T1218-S1222 PolarHBondContact O-OG 3.14Å; F1220-S1222 PolarHBondContact O-N 3.18Å; S1222-W1226 WeakPolarHBondContact O-CB 3.27Å; S1222-W1226 VanDerWaalsContact O-CE3 3.26Å; S1222-W1226 PolarHBondContact O-N 3.08Å
1223	K	67.1	Low	54	Low	150 Å²	150	70.7 Å²	70.7	65%	0.652	37%	0.365	S	S	*	.	H	α-helix	trans	-78	-21.7	176.2	-61.6	-176.2	178.3	-167.3	0	113.8	F1220 L1221	F1220-K1223 WeakPolarHBondContact O-CA 3.22Å; F1220-K1223 WeakPolarHBondContact O-CB 3.43Å; F1220-K1223 PolarHBondContact O-N 3.41Å; L1221-K1223 PolarHBondContact O-N 3.28Å
1224	L	67.4	Low	53.4	Low	19 Å²	19	76.2 Å²	76.2	10%	0.099	39%	0.39	C	S	.	.	H	α-helix	trans	-84.5	-36.2	173.7	-67.5	168.5	0	0	0	110.8	F1220 L1221 F1247 F1252 T1255	F1220-L1224 HydrophobicContact CD2-CD1 4.08Å; F1220-L1224 HydrophobicContact CE2-CD1 4.23Å; F1220-L1224 PolarHBondContact O-N 3.18Å; L1221-L1224 HydrophobicContact CD2-CD1 4.36Å; L1221-L1224 PolarHBondContact O-N 3.36Å; L1224-F1247 HydrophobicContact CB-CD1 3.74Å; L1224-F1247 HydrophobicContact CB-CE1 3.66Å; L1224-F1247 HydrophobicContact CB-CG 4.38Å; L1224-F1247 HydrophobicContact CB-CZ 4.25Å; L1224-F1252 HydrophobicContact CD1-CD2 3.83Å; L1224-T1255 HydrophobicContact CD1-CG2 4.4Å
1225	I	68.3	Low	52.9	Low	0 Å²	0	79.5 Å²	79.5	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-73.9	-43.9	176.6	-64.4	164	0	0	0	111.1	L1202 C1206 L1221 P1227 P1243 Q1244 F1247 L1299	L1202-I1225 HydrophobicContact CD1-CG2 4.26Å; L1202-I1225 HydrophobicContact CD2-CD1 4.41Å; L1202-I1225 HydrophobicContact CD2-CG2 4.01Å; C1206-I1225 HydrophobicContact CB-CD1 3.85Å; C1206-I1225 WeakPolarHBondContact SG-CD1 3.39Å; L1221-I1225 VanDerWaalsContact O-CG1 3.32Å; L1221-I1225 WeakPolarHBondContact O-CG1 3.24Å; L1221-I1225 PolarHBondContact O-N 3.47Å; I1225-P1227 WeakPolarHBondContact O-CD 3.08Å; I1225-P1243 HydrophobicContact CG2-CB 3.57Å; I1225-P1243 CarbonylContact O-C 3.53Å; I1225-P1243 VanDerWaalsContact O-CA 3.29Å; I1225-P1243 WeakPolarHBondContact O-CA 3.4Å; I1225-Q1244 WeakPolarHBondContact CA-O 3.28Å; I1225-Q1244 PolarHBondContact O-N 3.16Å; I1225-F1247 HydrophobicContact CG1-CE1 3.89Å; I1225-F1247 HydrophobicContact CG1-CZ 3.71Å; I1225-L1299 HydrophobicContact CD1-CD2 3.83Å; I1225-L1299 HydrophobicContact CG1-CD2 4.27Å
1226	W	66.6	Low	51.9	Low	76 Å²	76	87.8 Å²	87.8	29%	0.288	45%	0.453	S	S	.	.	S	Bend	trans	-113.2	77	176.1	-58.9	-76.2	0	0	0	110.1	L1202 S1222 V1228	L1202-W1226 HydrophobicContact CB-CH2 4.47Å; L1202-W1226 HydrophobicContact CB-CZ2 4.41Å; L1202-W1226 HydrophobicContact CD1-CZ2 4.27Å; S1222-W1226 WeakPolarHBondContact O-CB 3.27Å; S1222-W1226 VanDerWaalsContact O-CE3 3.26Å; S1222-W1226 PolarHBondContact O-N 3.08Å; W1226-V1228 PolarHBondContact O-N 3.38Å
1227	P	59.1	Low	50.8	Low	46 Å²	46	86.1 Å²	86.1	30%	0.299	46%	0.459	S	S	.	.			trans	-69	98.6	175.1	29.3	-33.8	0	0	0	109.7	I1225 Q1229 Q1244	I1225-P1227 WeakPolarHBondContact O-CD 3.08Å; P1227-Q1229 PolarHBondContact O-N 3.04Å; P1227-Q1229 VanDerWaalsContact O-N 3.12Å; P1227-Q1244 HydrophobicContact CG-CG 4.44Å
1228	V	54.8	Low	49.9	Very low	127 Å²	127	95.3 Å²	95.3	77%	0.77	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-55.8	118.3	175.4	-179.3	0	0	0	0	109.1	W1226 N1230	W1226-V1228 PolarHBondContact O-N 3.38Å; V1228-N1230 PolarHBondContact O-N 3.42Å
1229	Q	41.3	Very low	48.9	Very low	164 Å²	164	103.5 Å²	103.5	77%	0.766	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-56.7	128.7	174.1	-71.8	-173.9	-0.5	0	0	109.7	P1227 N1231	P1227-Q1229 PolarHBondContact O-N 3.04Å; P1227-Q1229 VanDerWaalsContact O-N 3.12Å; Q1229-N1231 PolarHBondContact O-N 3.02Å; Q1229-N1231 VanDerWaalsContact O-N 3.14Å
1230	N	34.9	Very low	48.2	Very low	156 Å²	156	108.9 Å²	108.9	83%	0.834	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-61.2	117.7	-174	-92.1	-42	0	0	0	111.6	V1228	V1228-N1230 PolarHBondContact O-N 3.42Å
1231	N	32.5	Very low	47.5	Very low	135 Å²	135	110 Å²	110	72%	0.722	58%	0.575	S	S	*	*			trans	20.5	106.4	151.6	-61.7	-25.2	0	0	0	117.3	Q1229	Q1229-N1231 PolarHBondContact O-N 3.02Å; Q1229-N1231 VanDerWaalsContact O-N 3.14Å
1232	N	35.3	Very low	47	Very low	148 Å²	148	114.1 Å²	114.1	79%	0.791	60%	0.604	S	S	*	*			trans	-172.9	104.8	130.5	-90.3	-28.8	0	0	0	111.2	I1234	N1232-I1234 PolarHBondContact O-N 3Å
1233	N	33.5	Very low	47.1	Very low	174 Å²	174	114 Å²	114	93%	0.93	60%	0.603	S	S	*	*			trans	38	47	156.6	-65.9	-4	0	0	0	119.4
1234	I	32.9	Very low	47.3	Very low	150 Å²	150	110.6 Å²	110.6	77%	0.769	59%	0.589	S	S	*	*			trans	-113.5	124.5	164.8	-61.4	178.3	0	0	0	108.6	N1232	N1232-I1234 PolarHBondContact O-N 3Å
1235	T	34.2	Very low	47.6	Very low	119 Å²	119	109.7 Å²	109.7	73%	0.73	59%	0.585	S	S	*	*			trans	-57.5	147.1	175.8	34.8	0	0	0	0	111.1	S1237	T1235-S1237 PolarHBondContact O-N 2.97Å; T1235-S1237 PolarHBondContact O-OG 3.49Å
1236	I	32.5	Very low	47.8	Very low	184 Å²	184	110.9 Å²	110.9	94%	0.944	59%	0.591	S	S	*	*			trans	-58.6	96.1	-178.1	-55.8	167.5	0	0	0	109.6
1237	S	33	Very low	48.1	Very low	82 Å²	82	107.5 Å²	107.5	57%	0.573	58%	0.578	S	S	*	*			trans	-113.4	152.8	171.5	-55.5	0	0	0	0	107.4	T1235 E1239	T1235-S1237 PolarHBondContact O-N 2.97Å; T1235-S1237 PolarHBondContact O-OG 3.49Å; S1237-E1239 PolarHBondContact O-N 3.31Å
1238	E	39.4	Very low	48.7	Very low	197 Å²	197	109.1 Å²	109.1	92%	0.921	58%	0.584	S	S	*	*	S	Bend	trans	-70.1	14.4	-155.2	-64.3	172.6	133.8	0	0	117.5	I1240	E1238-I1240 PolarHBondContact O-N 3.36Å
1239	E	36.8	Very low	49.6	Very low	183 Å²	183	105.7 Å²	105.7	86%	0.855	56%	0.557	S	S	*	*			trans	-77.5	66.4	171.7	-67	-175	178.1	0	0	111.5	S1237 S1241	S1237-E1239 PolarHBondContact O-N 3.31Å; E1239-S1241 PolarHBondContact O-N 3.38Å; E1239-S1241 VanDerWaalsContact O-N 3.14Å
1240	I	44.9	Very low	51.3	Low	143 Å²	143	102.5 Å²	102.5	73%	0.733	55%	0.545	S	S	*	.			trans	-63.6	113.7	163.2	-61.4	174.2	0	0	0	106.9	E1238 S1242	E1238-I1240 PolarHBondContact O-N 3.36Å; I1240-S1242 PolarHBondContact O-N 2.94Å; I1240-S1242 VanDerWaalsContact O-N 3.11Å
1241	S	52.2	Low	53.1	Low	40 Å²	40	97 Å²	97	28%	0.28	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-49.2	118.5	177.2	57	0	0	0	0	110.7	E1239	E1239-S1241 PolarHBondContact O-N 3.38Å; E1239-S1241 VanDerWaalsContact O-N 3.14Å
1242	S	56.6	Low	55.2	Low	87 Å²	87	90.8 Å²	90.8	61%	0.608	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-51.4	131.9	178.8	57.7	0	0	0	0	110.5	I1240	I1240-S1242 PolarHBondContact O-N 2.94Å; I1240-S1242 VanDerWaalsContact O-N 3.11Å
1243	P	66.8	Low	57.3	Low	15 Å²	15	85.8 Å²	85.8	10%	0.097	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-67	139.1	-171	27.2	-33.5	0	0	0	111.9	E1198 L1202 I1225	E1198-P1243 HydrophobicContact CG-CG 3.94Å; E1198-P1243 WeakPolarHBondContact OE1-CG 3.2Å; L1202-P1243 HydrophobicContact CD1-CB 3.43Å; L1202-P1243 VanDerWaalsContact CD1-CB 3.43Å; L1202-P1243 HydrophobicContact CD1-CG 3.36Å; I1225-P1243 HydrophobicContact CG2-CB 3.57Å; I1225-P1243 CarbonylContact O-C 3.53Å; I1225-P1243 VanDerWaalsContact O-CA 3.29Å; I1225-P1243 WeakPolarHBondContact O-CA 3.4Å
1244	Q	70.4	Confident	59.4	Low	77 Å²	77	81.8 Å²	81.8	36%	0.36	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-91.8	125.7	178.3	-64	-175.7	-8.6	0	0	110.1	I1225 P1227 F1247	I1225-Q1244 WeakPolarHBondContact CA-O 3.28Å; I1225-Q1244 PolarHBondContact O-N 3.16Å; P1227-Q1244 HydrophobicContact CG-CG 4.44Å; Q1244-F1247 VanDerWaalsContact O-CE1 3.32Å; Q1244-F1247 WeakPolarHBondContact O-CE1 3.35Å
1245	I	72.9	Confident	61.3	Low	1 Å²	1	76.4 Å²	76.4	1%	0.005	41%	0.408	C	S	.	.	S	Bend	trans	-96.1	-25.2	171	-75.7	-175.3	0	0	0	110.4	W1099 Q1101 A1105 Y1201 L1202 L1299 T1300	W1099-I1245 HydrophobicContact CH2-CD1 3.39Å; W1099-I1245 HydrophobicContact CZ2-CD1 3.22Å; W1099-I1245 HydrophobicContact CZ2-CG1 4.25Å; W1099-I1245 HydrophobicContact CZ3-CD1 4.32Å; Q1101-I1245 HydrophobicContact CB-CB 4.29Å; A1105-I1245 HydrophobicContact CB-CG2 4.43Å; Y1201-I1245 HydrophobicContact CD1-CD1 4.12Å; Y1201-I1245 HydrophobicContact CE1-CD1 4.12Å; L1202-I1245 HydrophobicContact CD2-CD1 4.34Å; L1202-I1245 HydrophobicContact CD2-CG1 4.07Å; I1245-L1299 HydrophobicContact CG2-CB 4.12Å; I1245-L1299 VanDerWaalsContact O-CB 3.29Å; I1245-L1299 WeakPolarHBondContact O-CB 3.39Å; I1245-L1299 PolarHBondContact O-N 3.03Å; I1245-T1300 HydrophobicContact CG2-CG2 4.36Å
1246	I	72.9	Confident	63.3	Low	25 Å²	25	70.7 Å²	70.7	13%	0.128	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.4	177.2	-57	-178.4	0	0	0	109.3	Q1101 L1104 A1105 T1296 P1298	Q1101-I1246 VanDerWaalsContact OE1-N 3.14Å; L1104-I1246 HydrophobicContact CB-CD1 3.27Å; L1104-I1246 HydrophobicContact CD1-CD1 4.42Å; L1104-I1246 HydrophobicContact CG-CD1 4.47Å; A1105-I1246 HydrophobicContact CB-CD1 4.41Å; A1105-I1246 HydrophobicContact CB-CG1 4.48Å; I1246-T1296 HydrophobicContact CG2-CG2 3.96Å; I1246-P1298 HydrophobicContact CG1-CB 4.33Å
1247	F	74.4	Confident	65.6	Low	5 Å²	5	62.5 Å²	62.5	2%	0.022	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	143.7	178.1	-47.3	-53.1	0	0	0	110.7	L1224 I1225 Q1244 T1296 I1297 L1299 L1302	L1224-F1247 HydrophobicContact CB-CD1 3.74Å; L1224-F1247 HydrophobicContact CB-CE1 3.66Å; L1224-F1247 HydrophobicContact CB-CG 4.38Å; L1224-F1247 HydrophobicContact CB-CZ 4.25Å; I1225-F1247 HydrophobicContact CG1-CE1 3.89Å; I1225-F1247 HydrophobicContact CG1-CZ 3.71Å; Q1244-F1247 VanDerWaalsContact O-CE1 3.32Å; Q1244-F1247 WeakPolarHBondContact O-CE1 3.35Å; F1247-T1296 CarbonylContact O-C 3.51Å; F1247-T1296 WeakPolarHBondContact O-CA 3.2Å; F1247-I1297 PolarHBondContact N-O 2.93Å; F1247-I1297 PolarHBondContact O-N 3.39Å; F1247-L1299 HydrophobicContact CE2-CB 3.72Å; F1247-L1299 HydrophobicContact CE2-CD1 3.92Å; F1247-L1299 HydrophobicContact CE2-CG 4.34Å; F1247-L1299 HydrophobicContact CZ-CB 3.92Å; F1247-L1299 HydrophobicContact CZ-CD1 4.13Å; F1247-L1299 HydrophobicContact CZ-CD2 4.4Å; F1247-L1299 HydrophobicContact CZ-CG 4.37Å; F1247-L1302 HydrophobicContact CD2-CD1 4.1Å; F1247-L1302 HydrophobicContact CE2-CD1 4.11Å
1248	D	71	Confident	67.7	Low	80 Å²	80	67.2 Å²	67.2	43%	0.428	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	132.2	161.8	168.6	23.3	0	0	0	109.7	D1250 A1251 F1252	D1248-D1250 VanDerWaalsContact C-N 3.27Å; D1248-D1250 PolarHBondContact O-N 3.4Å; D1248-D1250 PolarHBondContact OD1-N 3.42Å; D1248-A1251 HydrophobicContact CB-CB 4.02Å; D1248-A1251 PolarHBondContact O-N 3.33Å; D1248-A1251 PolarHBondContact OD2-N 3.12Å; D1248-F1252 WeakPolarHBondContact O-CB 3.46Å; D1248-F1252 PolarHBondContact O-N 3.47Å
1249	R	74.4	Confident	69.3	Low	54 Å²	54	58.5 Å²	58.5	20%	0.204	30%	0.295	C	S	.	.	H	α-helix	trans	-55.8	-41.8	177.4	174	179.9	172.4	-153.8	-2.1	111.3	F1252 R1253 L1294 S1295 I1297	R1249-F1252 PolarHBondContact O-N 3.11Å; R1249-R1253 VanDerWaalsContact O-CB 3.23Å; R1249-R1253 WeakPolarHBondContact O-CB 3.37Å; R1249-R1253 PolarHBondContact O-N 2.96Å; R1249-L1294 VanDerWaalsContact CD-O 3.27Å; R1249-L1294 WeakPolarHBondContact CD-O 3.27Å; R1249-S1295 WeakPolarHBondContact CB-O 3.38Å; R1249-S1295 PolarHBondContact N-O 3.06Å; R1249-I1297 HydrophobicContact CB-CD1 4.19Å; R1249-I1297 HydrophobicContact CB-CG1 4.31Å; R1249-I1297 HydrophobicContact CG-CD1 4.29Å
1250	D	75.2	Confident	71	Confident	97 Å²	97	49.8 Å²	49.8	52%	0.519	26%	0.255	S	S	.	.	H	α-helix	trans	-74.3	-39.6	-175.7	-74.7	-19	0	0	0	111.3	D1248 F1252 R1253 E1254	D1248-D1250 VanDerWaalsContact C-N 3.27Å; D1248-D1250 PolarHBondContact O-N 3.4Å; D1248-D1250 PolarHBondContact OD1-N 3.42Å; D1250-F1252 PolarHBondContact O-N 3.01Å; D1250-R1253 PolarHBondContact O-N 3.33Å; D1250-E1254 WeakPolarHBondContact O-CB 3.4Å; D1250-E1254 PolarHBondContact O-N 2.91Å
1251	A	73.3	Confident	72.5	Confident	40 Å²	40	47 Å²	47	33%	0.331	24%	0.239	S	C	.	.	H	α-helix	trans	-60.8	-40.5	170.4	0	0	0	0	0	113	D1248 T1255	D1248-A1251 HydrophobicContact CB-CB 4.02Å; D1248-A1251 PolarHBondContact O-N 3.33Å; D1248-A1251 PolarHBondContact OD2-N 3.12Å; A1251-T1255 WeakPolarHBondContact O-CB 3.45Å; A1251-T1255 PolarHBondContact O-N 3.07Å; A1251-T1255 VanDerWaalsContact O-N 3.11Å; A1251-T1255 PolarHBondContact O-OG1 3.31Å
1252	F	76.5	Confident	73.5	Confident	5 Å²	5	51.6 Å²	51.6	2%	0.022	25%	0.254	C	S	.	.	H	α-helix	trans	-65.1	-45.8	174.3	-179.4	-110.8	0	0	0	111.6	F1220 L1224 D1248 R1249 D1250 T1255 L1256 I1281 I1297 L1302	F1220-F1252 HydrophobicContact CE2-CE2 4.42Å; L1224-F1252 HydrophobicContact CD1-CD2 3.83Å; D1248-F1252 WeakPolarHBondContact O-CB 3.46Å; D1248-F1252 PolarHBondContact O-N 3.47Å; R1249-F1252 PolarHBondContact O-N 3.11Å; D1250-F1252 PolarHBondContact O-N 3.01Å; F1252-T1255 PolarHBondContact O-N 2.83Å; F1252-L1256 HydrophobicContact CD1-CD1 3.93Å; F1252-L1256 HydrophobicContact CE1-CD1 3.43Å; F1252-L1256 VanDerWaalsContact CE1-CD1 3.43Å; F1252-L1256 HydrophobicContact CE1-CG 4.23Å; F1252-L1256 HydrophobicContact CE2-CD1 4.4Å; F1252-L1256 HydrophobicContact CE2-CG 4.41Å; F1252-L1256 HydrophobicContact CZ-CD1 3.7Å; F1252-L1256 HydrophobicContact CZ-CD2 4.46Å; F1252-L1256 HydrophobicContact CZ-CG 4.17Å; F1252-L1256 PolarHBondContact O-N 3.38Å; F1252-I1281 HydrophobicContact CD1-CD1 4.37Å; F1252-I1281 HydrophobicContact CD1-CG1 4.42Å; F1252-I1281 HydrophobicContact CE1-CG1 4.34Å; F1252-I1297 HydrophobicContact CB-CD1 4.36Å; F1252-I1297 HydrophobicContact CD1-CD1 3.63Å; F1252-I1297 HydrophobicContact CE1-CD1 4.22Å; F1252-I1297 HydrophobicContact CG-CD1 4.22Å; F1252-L1302 HydrophobicContact CE2-CD1 3.96Å; F1252-L1302 HydrophobicContact CZ-CD1 4.09Å; F1252-L1302 HydrophobicContact CZ-CD2 4.18Å
1253	R	79.8	Confident	74	Confident	43 Å²	43	48.9 Å²	48.9	16%	0.162	23%	0.232	C	C	.	.	H	α-helix	trans	-58.4	-50.2	177	-176.5	-175.9	-175.3	-73.7	-11.5	112.1	R1249 D1250 T1255 L1256 L1257 N1274 I1277 D1278 I1281	R1249-R1253 VanDerWaalsContact O-CB 3.23Å; R1249-R1253 WeakPolarHBondContact O-CB 3.37Å; R1249-R1253 PolarHBondContact O-N 2.96Å; D1250-R1253 PolarHBondContact O-N 3.33Å; R1253-T1255 VanDerWaalsContact C-N 3.28Å; R1253-T1255 PolarHBondContact O-N 2.76Å; R1253-L1256 PolarHBondContact O-N 3.01Å; R1253-L1257 WeakPolarHBondContact O-CG 3.49Å; R1253-L1257 PolarHBondContact O-N 3.45Å; R1253-N1274 PolarHBondContact NH1-OD1 3.11Å; R1253-N1274 PolarHBondContact NH2-OD1 3.2Å; R1253-I1277 HydrophobicContact CG-CG2 3.96Å; R1253-D1278 IonicContact CZ-OD1 3.18Å; R1253-D1278 IonicContact CZ-OD2 2.85Å; R1253-D1278 IonicContact NE-OD1 2.71Å; R1253-D1278 PolarHBondContact NE-OD1 3.49Å; R1253-D1278 IonicContact NE-OD2 3.64Å; R1253-D1278 IonicContact NH2-OD1 3.44Å; R1253-D1278 PolarHBondContact NH2-OD1 3.1Å; R1253-D1278 IonicContact NH2-OD2 3.86Å; R1253-D1278 PolarHBondContact NH2-OD2 3.49Å; R1253-I1281 HydrophobicContact CB-CD1 3.83Å; R1253-I1281 HydrophobicContact CG-CD1 4Å
1254	E	78.1	Confident	73.9	Confident	91 Å²	91	48.2 Å²	48.2	43%	0.425	23%	0.228	S	C	.	.	H	α-helix	trans	-60	-38	176	-82.6	-63.1	124.8	0	0	112.3	D1250 L1257 R1258	D1250-E1254 WeakPolarHBondContact O-CB 3.4Å; D1250-E1254 PolarHBondContact O-N 2.91Å; E1254-L1257 PolarHBondContact O-N 3.18Å; E1254-R1258 WeakPolarHBondContact O-CG 3.48Å; E1254-R1258 PolarHBondContact O-N 3.4Å; E1254-R1258 VanDerWaalsContact O-N 3.07Å
1255	T	71.8	Confident	73.8	Confident	36 Å²	36	46.6 Å²	46.6	22%	0.221	22%	0.223	C	C	.	.	H	α-helix	trans	-68.3	-41.2	177.5	-59	0	0	0	0	111.7	F1220 L1224 A1251 F1252 R1253 R1258 F1259	F1220-T1255 HydrophobicContact CB-CG2 3.97Å; F1220-T1255 HydrophobicContact CD2-CG2 3.5Å; F1220-T1255 VanDerWaalsContact CD2-CG2 3.5Å; F1220-T1255 HydrophobicContact CE2-CG2 4.25Å; F1220-T1255 HydrophobicContact CG-CG2 3.92Å; L1224-T1255 HydrophobicContact CD1-CG2 4.4Å; A1251-T1255 WeakPolarHBondContact O-CB 3.45Å; A1251-T1255 PolarHBondContact O-N 3.07Å; A1251-T1255 VanDerWaalsContact O-N 3.11Å; A1251-T1255 PolarHBondContact O-OG1 3.31Å; F1252-T1255 PolarHBondContact O-N 2.83Å; R1253-T1255 VanDerWaalsContact C-N 3.28Å; R1253-T1255 PolarHBondContact O-N 2.76Å; T1255-R1258 PolarHBondContact O-N 3.16Å; T1255-F1259 PolarHBondContact O-N 3.11Å; T1255-F1259 VanDerWaalsContact O-N 3.1Å
1256	L	77.4	Confident	73.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-39.1	173.4	-75.4	-178.7	0	0	0	112.7	F1220 F1252 R1253 R1258 F1259 Y1260 I1277 F1280 I1281 F1337	F1220-L1256 HydrophobicContact CE2-CD2 4.43Å; F1220-L1256 HydrophobicContact CZ-CD2 3.86Å; F1252-L1256 HydrophobicContact CD1-CD1 3.93Å; F1252-L1256 HydrophobicContact CE1-CD1 3.43Å; F1252-L1256 VanDerWaalsContact CE1-CD1 3.43Å; F1252-L1256 HydrophobicContact CE1-CG 4.23Å; F1252-L1256 HydrophobicContact CE2-CD1 4.4Å; F1252-L1256 HydrophobicContact CE2-CG 4.41Å; F1252-L1256 HydrophobicContact CZ-CD1 3.7Å; F1252-L1256 HydrophobicContact CZ-CD2 4.46Å; F1252-L1256 HydrophobicContact CZ-CG 4.17Å; F1252-L1256 PolarHBondContact O-N 3.38Å; R1253-L1256 PolarHBondContact O-N 3.01Å; L1256-R1258 PolarHBondContact O-N 3.19Å; L1256-F1259 WeakPolarHBondContact O-CB 3.42Å; L1256-F1259 PolarHBondContact O-N 2.78Å; L1256-F1259 VanDerWaalsContact O-N 3.16Å; L1256-Y1260 PolarHBondContact O-N 2.86Å; L1256-I1277 HydrophobicContact CB-CD1 3.87Å; L1256-I1277 HydrophobicContact CB-CG1 4.13Å; L1256-I1277 HydrophobicContact CB-CG2 3.78Å; L1256-I1277 HydrophobicContact CD1-CG2 3.95Å; L1256-F1280 HydrophobicContact CD1-CD1 3.76Å; L1256-F1280 HydrophobicContact CD1-CE1 3.82Å; L1256-I1281 HydrophobicContact CD1-CG1 4.5Å; L1256-F1337 HydrophobicContact CD2-CE1 4.28Å; L1256-F1337 HydrophobicContact CD2-CZ 3.92Å
1257	L	79.8	Confident	72.6	Confident	12 Å²	12	57.8 Å²	57.8	6%	0.063	28%	0.277	C	S	.	.	H	α-helix	trans	-60.3	-44.9	174.1	-76.1	172.4	0	0	0	111.5	R1253 E1254 F1259 Y1260 E1261 A1273 I1277	R1253-L1257 WeakPolarHBondContact O-CG 3.49Å; R1253-L1257 PolarHBondContact O-N 3.45Å; E1254-L1257 PolarHBondContact O-N 3.18Å; L1257-F1259 VanDerWaalsContact C-N 3.28Å; L1257-F1259 PolarHBondContact O-N 2.87Å; L1257-Y1260 PolarHBondContact O-N 3.28Å; L1257-E1261 WeakPolarHBondContact O-CB 3.43Å; L1257-E1261 WeakPolarHBondContact O-CG 3.15Å; L1257-E1261 PolarHBondContact O-N 3.33Å; L1257-A1273 HydrophobicContact CD2-CB 3.79Å; L1257-I1277 HydrophobicContact CD2-CB 4.24Å; L1257-I1277 HydrophobicContact CD2-CG1 3.81Å; L1257-I1277 HydrophobicContact CG-CG1 4.2Å
1258	R	76.3	Confident	72	Confident	180 Å²	180	59.3 Å²	59.3	68%	0.679	28%	0.283	S	S	*	.	H	α-helix	trans	-61.8	-33.8	174.5	-68.9	173.6	-173.1	-159.3	2.5	112.9	E1254 T1255 L1256 K1262	E1254-R1258 WeakPolarHBondContact O-CG 3.48Å; E1254-R1258 PolarHBondContact O-N 3.4Å; E1254-R1258 VanDerWaalsContact O-N 3.07Å; T1255-R1258 PolarHBondContact O-N 3.16Å; L1256-R1258 PolarHBondContact O-N 3.19Å; R1258-K1262 WeakPolarHBondContact O-CB 3.36Å; R1258-K1262 PolarHBondContact O-N 2.95Å
1259	F	73.7	Confident	71.7	Confident	14 Å²	14	57.9 Å²	57.9	6%	0.061	28%	0.279	C	S	.	.	H	α-helix	trans	-67.9	-47.8	172.9	-176.8	-86.9	0	0	0	111.4	R1216 F1220 T1255 L1256 L1257 E1261 K1262 D1263 F1337 I1338 L1341	R1216-F1259 HydrophobicContact CB-CE2 4.09Å; F1220-F1259 HydrophobicContact CD1-CD2 4.15Å; F1220-F1259 HydrophobicContact CE1-CD2 4.26Å; T1255-F1259 PolarHBondContact O-N 3.11Å; T1255-F1259 VanDerWaalsContact O-N 3.1Å; L1256-F1259 WeakPolarHBondContact O-CB 3.42Å; L1256-F1259 PolarHBondContact O-N 2.78Å; L1256-F1259 VanDerWaalsContact O-N 3.16Å; L1257-F1259 VanDerWaalsContact C-N 3.28Å; L1257-F1259 PolarHBondContact O-N 2.87Å; F1259-E1261 PolarHBondContact O-N 3Å; F1259-K1262 PolarHBondContact O-N 2.8Å; F1259-D1263 HydrophobicContact CE1-CB 4.47Å; F1259-D1263 HydrophobicContact CZ-CB 4.46Å; F1259-D1263 PolarHBondContact O-N 3.04Å; F1259-F1337 HydrophobicContact CD1-CD1 4.18Å; F1259-F1337 AromaticContact CD1-CE1 3.89Å; F1259-F1337 HydrophobicContact CD1-CE1 3.89Å; F1259-F1337 AromaticContact CE1-CD1 3.54Å; F1259-F1337 HydrophobicContact CE1-CD1 3.54Å; F1259-F1337 AromaticContact CE1-CE1 3.74Å; F1259-F1337 HydrophobicContact CE1-CE1 3.74Å; F1259-F1337 AromaticContact CZ-CD1 3.84Å; F1259-F1337 HydrophobicContact CZ-CD1 3.84Å; F1259-F1337 HydrophobicContact CZ-CE1 4.32Å; F1259-I1338 HydrophobicContact CE1-CG1 3.92Å; F1259-I1338 HydrophobicContact CZ-CD1 4.33Å; F1259-I1338 HydrophobicContact CZ-CG1 3.85Å; F1259-L1341 HydrophobicContact CD1-CD1 3.82Å; F1259-L1341 HydrophobicContact CE1-CD1 3.98Å
1260	Y	73.4	Confident	71.3	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-59.2	-46.7	177.1	-175.7	-81.9	0	0	0	111.5	L1256 L1257 K1262 D1263 V1264 V1265 W1268 S1269 A1273 V1276 L1341 A1345	L1256-Y1260 PolarHBondContact O-N 2.86Å; L1257-Y1260 PolarHBondContact O-N 3.28Å; Y1260-K1262 PolarHBondContact O-N 2.81Å; Y1260-D1263 PolarHBondContact O-N 3.4Å; Y1260-V1264 HydrophobicContact CD1-CB 4.37Å; Y1260-V1264 HydrophobicContact CD2-CB 3.62Å; Y1260-V1264 HydrophobicContact CD2-CG1 3.77Å; Y1260-V1264 HydrophobicContact CD2-CG2 3.93Å; Y1260-V1264 HydrophobicContact CE1-CB 4.5Å; Y1260-V1264 HydrophobicContact CE2-CB 3.76Å; Y1260-V1264 HydrophobicContact CE2-CG1 3.38Å; Y1260-V1264 HydrophobicContact CE2-CG2 4.41Å; Y1260-V1264 HydrophobicContact CG-CB 3.94Å; Y1260-V1264 HydrophobicContact CG-CG1 4.49Å; Y1260-V1264 HydrophobicContact CG-CG2 4.38Å; Y1260-V1264 CarbonylContact O-C 3.51Å; Y1260-V1264 WeakPolarHBondContact O-CA 3.44Å; Y1260-V1264 WeakPolarHBondContact O-CB 3.31Å; Y1260-V1264 PolarHBondContact O-N 2.87Å; Y1260-V1265 HydrophobicContact CD1-CG2 3.63Å; Y1260-V1265 HydrophobicContact CE1-CG2 3.54Å; Y1260-V1265 PolarHBondContact O-N 3.02Å; Y1260-W1268 WeakPolarHBondContact OH-CB 2.96Å; Y1260-S1269 PolarHBondContact OH-O 3.12Å; Y1260-A1273 HydrophobicContact CD1-CB 3.33Å; Y1260-A1273 HydrophobicContact CE1-CB 3.46Å; Y1260-A1273 VanDerWaalsContact CE1-CB 3.46Å; Y1260-A1273 HydrophobicContact CG-CB 4.14Å; Y1260-V1276 HydrophobicContact CD2-CG1 4.11Å; Y1260-V1276 HydrophobicContact CE2-CB 4.09Å; Y1260-V1276 HydrophobicContact CE2-CG1 3.85Å; Y1260-V1276 HydrophobicContact CE2-CG2 4.08Å; Y1260-L1341 HydrophobicContact CD2-CB 4.38Å; Y1260-A1345 HydrophobicContact CE2-CB 4.31Å
1261	E	76.8	Confident	70.7	Confident	86 Å²	86	62.2 Å²	62.2	40%	0.402	30%	0.301	S	S	.	.	H	α-helix	trans	-59	-32.7	176.5	-76.6	-162.8	-158.9	0	0	113.8	L1257 F1259 V1265 K1270	L1257-E1261 WeakPolarHBondContact O-CB 3.43Å; L1257-E1261 WeakPolarHBondContact O-CG 3.15Å; L1257-E1261 PolarHBondContact O-N 3.33Å; F1259-E1261 PolarHBondContact O-N 3Å; E1261-V1265 HydrophobicContact CG-CG2 4.49Å; E1261-K1270 VanDerWaalsContact CD-CE 3.42Å; E1261-K1270 HydrophobicContact CG-CD 4.44Å; E1261-K1270 WeakPolarHBondContact OE1-CE 3.21Å; E1261-K1270 IonicContact OE1-NZ 3.64Å; E1261-K1270 PolarHBondContact OE1-NZ 2.88Å; E1261-K1270 IonicContact OE2-NZ 3.73Å; E1261-K1270 PolarHBondContact OE2-NZ 3.21Å
1262	K	71.7	Confident	70.4	Confident	135 Å²	135	61.8 Å²	61.8	59%	0.587	29%	0.292	S	S	*	.	H	α-helix	trans	-82.9	-43.9	-178.2	-172.2	178.9	-176.5	179.7	0	113.1	R1258 F1259 Y1260	R1258-K1262 WeakPolarHBondContact O-CB 3.36Å; R1258-K1262 PolarHBondContact O-N 2.95Å; F1259-K1262 PolarHBondContact O-N 2.8Å; Y1260-K1262 PolarHBondContact O-N 2.81Å
1263	D	66.6	Low	70.2	Confident	31 Å²	31	61.7 Å²	61.7	17%	0.166	29%	0.293	C	S	.	.	H	α-helix	trans	-118.5	-14.5	-164.6	-76.3	-46.7	0	0	0	114.7	R1216 F1259 Y1260 I1338	R1216-D1263 WeakPolarHBondContact CD-OD2 3.32Å; R1216-D1263 IonicContact CZ-OD1 2.7Å; R1216-D1263 IonicContact CZ-OD2 2.98Å; R1216-D1263 IonicContact NE-OD2 2.7Å; R1216-D1263 IonicContact NH1-OD1 3.64Å; R1216-D1263 PolarHBondContact NH1-OD1 3.21Å; R1216-D1263 IonicContact NH1-OD2 3Å; R1216-D1263 PolarHBondContact NH1-OD2 3Å; F1259-D1263 HydrophobicContact CE1-CB 4.47Å; F1259-D1263 HydrophobicContact CZ-CB 4.46Å; F1259-D1263 PolarHBondContact O-N 3.04Å; Y1260-D1263 PolarHBondContact O-N 3.4Å; D1263-I1338 HydrophobicContact CB-CD1 4.01Å; D1263-I1338 HydrophobicContact CB-CG1 4.31Å
1264	V	65.4	Low	70	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-34.8	179.1	-168.6	0	0	0	0	112.8	Y1260 P1266 R1267 W1268 I1338 L1341	Y1260-V1264 HydrophobicContact CD1-CB 4.37Å; Y1260-V1264 HydrophobicContact CD2-CB 3.62Å; Y1260-V1264 HydrophobicContact CD2-CG1 3.77Å; Y1260-V1264 HydrophobicContact CD2-CG2 3.93Å; Y1260-V1264 HydrophobicContact CE1-CB 4.5Å; Y1260-V1264 HydrophobicContact CE2-CB 3.76Å; Y1260-V1264 HydrophobicContact CE2-CG1 3.38Å; Y1260-V1264 HydrophobicContact CE2-CG2 4.41Å; Y1260-V1264 HydrophobicContact CG-CB 3.94Å; Y1260-V1264 HydrophobicContact CG-CG1 4.49Å; Y1260-V1264 HydrophobicContact CG-CG2 4.38Å; Y1260-V1264 CarbonylContact O-C 3.51Å; Y1260-V1264 WeakPolarHBondContact O-CA 3.44Å; Y1260-V1264 WeakPolarHBondContact O-CB 3.31Å; Y1260-V1264 PolarHBondContact O-N 2.87Å; V1264-P1266 VanDerWaalsContact C-N 3.3Å; V1264-R1267 WeakPolarHBondContact O-CA 3.32Å; V1264-R1267 WeakPolarHBondContact O-CB 3.45Å; V1264-R1267 PolarHBondContact O-N 3.48Å; V1264-W1268 PolarHBondContact O-N 3.01Å; V1264-I1338 HydrophobicContact CG2-CG2 4.48Å; V1264-L1341 HydrophobicContact CG2-CB 3.96Å; V1264-L1341 HydrophobicContact CG2-CD1 4.1Å
1265	V	68.9	Low	69.7	Low	43 Å²	43	60.6 Å²	60.6	26%	0.261	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-27.8	175.4	168.8	0	0	0	0	115	Y1260 E1261 R1267 W1268 K1270	Y1260-V1265 HydrophobicContact CD1-CG2 3.63Å; Y1260-V1265 HydrophobicContact CE1-CG2 3.54Å; Y1260-V1265 PolarHBondContact O-N 3.02Å; E1261-V1265 HydrophobicContact CG-CG2 4.49Å; V1265-R1267 PolarHBondContact O-N 2.62Å; V1265-W1268 CarbonylContact C-O 3.56Å; V1265-W1268 VanDerWaalsContact CA-O 3.28Å; V1265-W1268 WeakPolarHBondContact CA-O 3.4Å; V1265-K1270 HydrophobicContact CG1-CB 4.23Å; V1265-K1270 HydrophobicContact CG2-CB 4.07Å
1266	P	60.4	Low	69.5	Low	103 Å²	103	58.9 Å²	58.9	67%	0.669	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-8.6	167.5	-26	36.6	0	0	0	114.9	V1264	V1264-P1266 VanDerWaalsContact C-N 3.3Å
1267	R	60.1	Low	69.3	Low	158 Å²	158	58.9 Å²	58.9	60%	0.596	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	-27.8	-178.9	-54.4	178.9	180	-171.2	-2	113.6	V1264 V1265	V1264-R1267 WeakPolarHBondContact O-CA 3.32Å; V1264-R1267 WeakPolarHBondContact O-CB 3.45Å; V1264-R1267 PolarHBondContact O-N 3.48Å; V1265-R1267 PolarHBondContact O-N 2.62Å
1268	W	61.5	Low	68.8	Low	38 Å²	38	60.4 Å²	60.4	14%	0.144	30%	0.298	C	S	.	.	S	Bend	trans	-136.9	160.9	-175	-71.2	102	0	0	0	112	Y1260 V1264 V1265 M1272 S1342 A1345 G1346 Y1349 T1405	Y1260-W1268 WeakPolarHBondContact OH-CB 2.96Å; V1264-W1268 PolarHBondContact O-N 3.01Å; V1265-W1268 CarbonylContact C-O 3.56Å; V1265-W1268 VanDerWaalsContact CA-O 3.28Å; V1265-W1268 WeakPolarHBondContact CA-O 3.4Å; W1268-M1272 HydrophobicContact CE3-CE 4.04Å; W1268-S1342 PolarHBondContact NE1-O 3.29Å; W1268-A1345 HydrophobicContact CB-CB 4.05Å; W1268-A1345 HydrophobicContact CD2-CB 3.78Å; W1268-A1345 HydrophobicContact CE3-CB 4.33Å; W1268-A1345 HydrophobicContact CG-CB 3.61Å; W1268-G1346 VanDerWaalsContact CH2-CA 3.46Å; W1268-Y1349 HydrophobicContact CZ3-CD1 4.39Å; W1268-Y1349 HydrophobicContact CZ3-CG 4.28Å; W1268-T1405 HydrophobicContact CH2-CG2 3.74Å; W1268-T1405 HydrophobicContact CZ3-CG2 4.37Å
1269	S	63.9	Low	68.3	Low	49 Å²	49	52.7 Å²	52.7	34%	0.343	27%	0.27	S	S	.	.			trans	-65.6	149.1	179.8	74	0	0	0	0	112.2	Y1260 D1271 M1272	Y1260-S1269 PolarHBondContact OH-O 3.12Å; S1269-D1271 VanDerWaalsContact C-N 3.28Å; S1269-M1272 WeakPolarHBondContact OG-CE 3.48Å
1270	K	66.5	Low	68	Low	107 Å²	107	52.1 Å²	52.1	47%	0.465	27%	0.268	S	S	.	.	S	Bend	trans	-66.8	-31.8	174.2	179	167.7	172.4	157	0	111.8	E1261 V1265 M1272 A1273	E1261-K1270 VanDerWaalsContact CD-CE 3.42Å; E1261-K1270 HydrophobicContact CG-CD 4.44Å; E1261-K1270 WeakPolarHBondContact OE1-CE 3.21Å; E1261-K1270 IonicContact OE1-NZ 3.64Å; E1261-K1270 PolarHBondContact OE1-NZ 2.88Å; E1261-K1270 IonicContact OE2-NZ 3.73Å; E1261-K1270 PolarHBondContact OE2-NZ 3.21Å; V1265-K1270 HydrophobicContact CG1-CB 4.23Å; V1265-K1270 HydrophobicContact CG2-CB 4.07Å; K1270-M1272 PolarHBondContact O-N 3.34Å; K1270-A1273 WeakPolarHBondContact O-CB 3.33Å; K1270-A1273 PolarHBondContact O-N 2.86Å
1271	D	62.7	Low	67.7	Low	136 Å²	136	52.2 Å²	52.2	73%	0.727	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.7	-175.1	-44	-53.5	0	0	0	112.9	S1269	S1269-D1271 VanDerWaalsContact C-N 3.28Å
1272	M	67.2	Low	67	Low	30 Å²	30	52.7 Å²	52.7	15%	0.148	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-8.8	176.9	-68.6	-172.5	-78.7	0	0	114	W1268 S1269 K1270 N1274 G1275 V1276 Y1349	W1268-M1272 HydrophobicContact CE3-CE 4.04Å; S1269-M1272 WeakPolarHBondContact OG-CE 3.48Å; K1270-M1272 PolarHBondContact O-N 3.34Å; M1272-N1274 VanDerWaalsContact C-N 3.33Å; M1272-N1274 PolarHBondContact O-N 3.22Å; M1272-G1275 PolarHBondContact O-N 3.16Å; M1272-V1276 WeakPolarHBondContact O-CG2 3.17Å; M1272-V1276 PolarHBondContact O-N 3.05Å; M1272-Y1349 HydrophobicContact CE-CD2 3.68Å; M1272-Y1349 HydrophobicContact CE-CG 4.14Å; M1272-Y1349 VanDerWaalsContact SD-CA 3.56Å; M1272-Y1349 HydrophobicContact SD-CD2 3.9Å; M1272-Y1349 HydrophobicContact SD-CG 4.25Å
1273	A	72.6	Confident	66.5	Low	3 Å²	3	48.7 Å²	48.7	3%	0.025	26%	0.255	C	S	.	.	H	α-helix	trans	-55.6	-45	-174	0	0	0	0	0	112.9	L1257 Y1260 K1270 V1276 I1277	L1257-A1273 HydrophobicContact CD2-CB 3.79Å; Y1260-A1273 HydrophobicContact CD1-CB 3.33Å; Y1260-A1273 HydrophobicContact CE1-CB 3.46Å; Y1260-A1273 VanDerWaalsContact CE1-CB 3.46Å; Y1260-A1273 HydrophobicContact CG-CB 4.14Å; K1270-A1273 WeakPolarHBondContact O-CB 3.33Å; K1270-A1273 PolarHBondContact O-N 2.86Å; A1273-V1276 PolarHBondContact O-N 3.08Å; A1273-I1277 WeakPolarHBondContact O-CG1 3.34Å; A1273-I1277 PolarHBondContact O-N 3.13Å
1274	N	76	Confident	66.2	Low	79 Å²	79	47.4 Å²	47.4	42%	0.422	25%	0.248	S	C	.	.	H	α-helix	trans	-56.5	-59	177.2	-76.3	-54.3	0	0	0	111	R1253 M1272 V1276 I1277 D1278	R1253-N1274 PolarHBondContact NH1-OD1 3.11Å; R1253-N1274 PolarHBondContact NH2-OD1 3.2Å; M1272-N1274 VanDerWaalsContact C-N 3.33Å; M1272-N1274 PolarHBondContact O-N 3.22Å; N1274-V1276 VanDerWaalsContact C-N 3.27Å; N1274-V1276 PolarHBondContact O-N 3.3Å; N1274-I1277 PolarHBondContact O-N 3.29Å; N1274-I1277 VanDerWaalsContact O-N 3.1Å; N1274-D1278 WeakPolarHBondContact O-CB 3.48Å; N1274-D1278 VanDerWaalsContact O-CG 3.22Å; N1274-D1278 PolarHBondContact O-N 2.94Å
1275	G	71.4	Confident	65.8	Low	33 Å²	33	47.4 Å²	47.4	34%	0.34	25%	0.249	S	C	.	.	H	α-helix	trans	-56.5	-38.3	179.8	0	0	0	0	0	113.3	M1272 H1279 L1348	M1272-G1275 PolarHBondContact O-N 3.16Å; G1275-H1279 VanDerWaalsContact O-CB 3.23Å; G1275-H1279 WeakPolarHBondContact O-CB 3.47Å; G1275-H1279 PolarHBondContact O-N 3.29Å; G1275-L1348 WeakPolarHBondContact O-CD1 3.35Å
1276	V	68.2	Low	65.2	Low	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-45.8	177.5	173.4	0	0	0	0	111.9	Y1260 M1272 A1273 N1274 F1280 L1341 L1344 A1345 L1348	Y1260-V1276 HydrophobicContact CD2-CG1 4.11Å; Y1260-V1276 HydrophobicContact CE2-CB 4.09Å; Y1260-V1276 HydrophobicContact CE2-CG1 3.85Å; Y1260-V1276 HydrophobicContact CE2-CG2 4.08Å; M1272-V1276 WeakPolarHBondContact O-CG2 3.17Å; M1272-V1276 PolarHBondContact O-N 3.05Å; A1273-V1276 PolarHBondContact O-N 3.08Å; N1274-V1276 VanDerWaalsContact C-N 3.27Å; N1274-V1276 PolarHBondContact O-N 3.3Å; V1276-F1280 WeakPolarHBondContact O-CB 3.37Å; V1276-F1280 PolarHBondContact O-N 3.41Å; V1276-L1341 HydrophobicContact CG1-CD2 4.06Å; V1276-L1344 HydrophobicContact CG1-CB 3.92Å; V1276-A1345 VanDerWaalsContact CG2-CA 3.46Å; V1276-A1345 HydrophobicContact CG2-CB 3.78Å; V1276-L1348 VanDerWaalsContact CA-CD1 3.47Å; V1276-L1348 HydrophobicContact CB-CD1 4.22Å; V1276-L1348 HydrophobicContact CG2-CD1 3.72Å; V1276-L1348 VanDerWaalsContact N-CD1 3.3Å
1277	I	73	Confident	64.2	Low	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-73.2	-39.7	-179.7	-62.9	-44.9	0	0	0	110.9	R1253 L1256 L1257 A1273 N1274 H1279 F1280 I1281 L1341	R1253-I1277 HydrophobicContact CG-CG2 3.96Å; L1256-I1277 HydrophobicContact CB-CD1 3.87Å; L1256-I1277 HydrophobicContact CB-CG1 4.13Å; L1256-I1277 HydrophobicContact CB-CG2 3.78Å; L1256-I1277 HydrophobicContact CD1-CG2 3.95Å; L1257-I1277 HydrophobicContact CD2-CB 4.24Å; L1257-I1277 HydrophobicContact CD2-CG1 3.81Å; L1257-I1277 HydrophobicContact CG-CG1 4.2Å; A1273-I1277 WeakPolarHBondContact O-CG1 3.34Å; A1273-I1277 PolarHBondContact O-N 3.13Å; N1274-I1277 PolarHBondContact O-N 3.29Å; N1274-I1277 VanDerWaalsContact O-N 3.1Å; I1277-H1279 VanDerWaalsContact C-N 3.33Å; I1277-H1279 PolarHBondContact O-N 3.47Å; I1277-F1280 PolarHBondContact O-N 3.5Å; I1277-I1281 HydrophobicContact CG2-CD1 3.76Å; I1277-I1281 HydrophobicContact CG2-CG1 4.37Å; I1277-I1281 WeakPolarHBondContact O-CB 3.28Å; I1277-I1281 VanDerWaalsContact O-CG1 3.25Å; I1277-I1281 WeakPolarHBondContact O-CG1 3.26Å; I1277-I1281 PolarHBondContact O-N 2.86Å; I1277-L1341 HydrophobicContact CD1-CD2 3.9Å
1278	D	69	Low	63.4	Low	43 Å²	43	42.6 Å²	42.6	23%	0.23	22%	0.224	C	C	.	.	H	α-helix	trans	-61.4	-42.9	176.1	-68.2	-40.7	0	0	0	111	R1253 N1274 I1281 E1282	R1253-D1278 IonicContact CZ-OD1 3.18Å; R1253-D1278 IonicContact CZ-OD2 2.85Å; R1253-D1278 IonicContact NE-OD1 2.71Å; R1253-D1278 PolarHBondContact NE-OD1 3.49Å; R1253-D1278 IonicContact NE-OD2 3.64Å; R1253-D1278 IonicContact NH2-OD1 3.44Å; R1253-D1278 PolarHBondContact NH2-OD1 3.1Å; R1253-D1278 IonicContact NH2-OD2 3.86Å; R1253-D1278 PolarHBondContact NH2-OD2 3.49Å; N1274-D1278 WeakPolarHBondContact O-CB 3.48Å; N1274-D1278 VanDerWaalsContact O-CG 3.22Å; N1274-D1278 PolarHBondContact O-N 2.94Å; D1278-I1281 PolarHBondContact O-N 3.13Å; D1278-E1282 WeakPolarHBondContact O-CG 3.35Å; D1278-E1282 PolarHBondContact O-N 2.94Å
1279	H	64.9	Low	62.4	Low	18 Å²	18	42 Å²	42	8%	0.083	22%	0.224	C	C	.	.	H	α-helix	trans	-67.6	-42.2	175.9	-155.7	63.6	0	0	0	113.1	G1275 I1277 I1281 E1282 D1283 L1348 Q1414	G1275-H1279 VanDerWaalsContact O-CB 3.23Å; G1275-H1279 WeakPolarHBondContact O-CB 3.47Å; G1275-H1279 PolarHBondContact O-N 3.29Å; I1277-H1279 VanDerWaalsContact C-N 3.33Å; I1277-H1279 PolarHBondContact O-N 3.47Å; H1279-I1281 VanDerWaalsContact C-N 3.27Å; H1279-I1281 PolarHBondContact O-N 3.34Å; H1279-E1282 IonicContact ND1-OE2 2.72Å; H1279-E1282 PolarHBondContact O-N 2.91Å; H1279-D1283 IonicContact CD2-OD2 2.78Å; H1279-D1283 IonicContact NE2-OD2 3.12Å; H1279-D1283 PolarHBondContact O-N 2.81Å; H1279-L1348 HydrophobicContact CB-CD1 4.39Å; H1279-Q1414 VanDerWaalsContact CE1-CD 3.47Å; H1279-Q1414 PolarHBondContact CE1-NE2 3.24Å; H1279-Q1414 PolarHBondContact CE1-OE1 2.91Å; H1279-Q1414 PolarHBondContact NE2-NE2 3.48Å; H1279-Q1414 PolarHBondContact NE2-OE1 3.41Å; H1279-Q1414 VanDerWaalsContact NE2-OE1 3.1Å
1280	F	68.9	Low	61.1	Low	3 Å²	3	40 Å²	40	1%	0.013	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-37.5	173.7	175	-101.4	0	0	0	112	L1256 V1276 I1277 V1284 L1306 F1337 L1340 L1344	L1256-F1280 HydrophobicContact CD1-CD1 3.76Å; L1256-F1280 HydrophobicContact CD1-CE1 3.82Å; V1276-F1280 WeakPolarHBondContact O-CB 3.37Å; V1276-F1280 PolarHBondContact O-N 3.41Å; I1277-F1280 PolarHBondContact O-N 3.5Å; F1280-V1284 HydrophobicContact CD2-CG2 4.12Å; F1280-V1284 HydrophobicContact CE1-CG2 4.15Å; F1280-V1284 HydrophobicContact CE2-CG2 3.7Å; F1280-V1284 HydrophobicContact CZ-CG2 3.72Å; F1280-V1284 VanDerWaalsContact O-CB 3.32Å; F1280-V1284 WeakPolarHBondContact O-CB 3.41Å; F1280-V1284 VanDerWaalsContact O-CG2 3.22Å; F1280-V1284 WeakPolarHBondContact O-CG2 3.45Å; F1280-V1284 PolarHBondContact O-N 3.45Å; F1280-L1306 HydrophobicContact CE2-CD2 4.43Å; F1280-L1306 HydrophobicContact CZ-CD2 4.27Å; F1280-F1337 HydrophobicContact CE1-CE2 4.43Å; F1280-F1337 HydrophobicContact CE1-CZ 4.49Å; F1280-F1337 HydrophobicContact CE2-CE2 4.11Å; F1280-F1337 AromaticContact CZ-CE2 3.78Å; F1280-F1337 HydrophobicContact CZ-CE2 3.78Å; F1280-F1337 HydrophobicContact CZ-CZ 4.27Å; F1280-L1340 HydrophobicContact CD2-CD2 4.18Å; F1280-L1340 HydrophobicContact CE2-CD2 3.75Å; F1280-L1344 HydrophobicContact CB-CD1 3.87Å; F1280-L1344 HydrophobicContact CD2-CD1 4.21Å
1281	I	66.1	Low	59.7	Low	2 Å²	2	38.3 Å²	38.3	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-71.3	-40.9	175.5	-69.6	169.7	0	0	0	110.9	F1252 R1253 L1256 I1277 D1278 H1279 D1283 L1285	F1252-I1281 HydrophobicContact CD1-CD1 4.37Å; F1252-I1281 HydrophobicContact CD1-CG1 4.42Å; F1252-I1281 HydrophobicContact CE1-CG1 4.34Å; R1253-I1281 HydrophobicContact CB-CD1 3.83Å; R1253-I1281 HydrophobicContact CG-CD1 4Å; L1256-I1281 HydrophobicContact CD1-CG1 4.5Å; I1277-I1281 HydrophobicContact CG2-CD1 3.76Å; I1277-I1281 HydrophobicContact CG2-CG1 4.37Å; I1277-I1281 WeakPolarHBondContact O-CB 3.28Å; I1277-I1281 VanDerWaalsContact O-CG1 3.25Å; I1277-I1281 WeakPolarHBondContact O-CG1 3.26Å; I1277-I1281 PolarHBondContact O-N 2.86Å; D1278-I1281 PolarHBondContact O-N 3.13Å; H1279-I1281 VanDerWaalsContact C-N 3.27Å; H1279-I1281 PolarHBondContact O-N 3.34Å; I1281-D1283 PolarHBondContact O-N 3.08Å; I1281-L1285 HydrophobicContact CG2-CD1 3.6Å; I1281-L1285 HydrophobicContact CG2-CG 4.19Å; I1281-L1285 VanDerWaalsContact O-CB 3.28Å; I1281-L1285 WeakPolarHBondContact O-CB 3.18Å; I1281-L1285 VanDerWaalsContact O-CG 3.32Å; I1281-L1285 WeakPolarHBondContact O-CG 3.33Å; I1281-L1285 PolarHBondContact O-N 2.72Å
1282	E	61.8	Low	58.8	Low	95 Å²	95	34.1 Å²	34.1	44%	0.444	20%	0.204	S	C	.	.	H	α-helix	trans	-57.1	-46.8	173.6	-80.6	176.3	174.7	0	0	112.3	D1278 H1279 D1286 L1287	D1278-E1282 WeakPolarHBondContact O-CG 3.35Å; D1278-E1282 PolarHBondContact O-N 2.94Å; H1279-E1282 IonicContact ND1-OE2 2.72Å; H1279-E1282 PolarHBondContact O-N 2.91Å; E1282-D1286 WeakPolarHBondContact O-CA 3.34Å; E1282-D1286 PolarHBondContact O-N 2.79Å; E1282-D1286 VanDerWaalsContact O-N 3.12Å; E1282-L1287 HydrophobicContact CG-CB 4.44Å; E1282-L1287 HydrophobicContact CG-CD1 3.86Å; E1282-L1287 PolarHBondContact O-N 3.45Å; E1282-L1287 VanDerWaalsContact O-N 3.09Å
1283	D	60.7	Low	58	Low	52 Å²	52	41 Å²	41	28%	0.278	24%	0.235	S	C	.	.	H	α-helix	trans	-68.5	-45.4	179.2	-74	-20.4	0	0	0	111.9	H1279 I1281 L1285 D1286	H1279-D1283 IonicContact CD2-OD2 2.78Å; H1279-D1283 IonicContact NE2-OD2 3.12Å; H1279-D1283 PolarHBondContact O-N 2.81Å; I1281-D1283 PolarHBondContact O-N 3.08Å; D1283-L1285 PolarHBondContact O-N 3.28Å; D1283-D1286 PolarHBondContact O-N 2.96Å
1284	V	60.5	Low	57.3	Low	3 Å²	3	41.9 Å²	41.9	2%	0.018	24%	0.239	C	C	.	.	H	α-helix	trans	-70.9	-30.6	-177.9	170.1	0	0	0	0	112.6	F1280 H1301 L1302 R1305	F1280-V1284 HydrophobicContact CD2-CG2 4.12Å; F1280-V1284 HydrophobicContact CE1-CG2 4.15Å; F1280-V1284 HydrophobicContact CE2-CG2 3.7Å; F1280-V1284 HydrophobicContact CZ-CG2 3.72Å; F1280-V1284 VanDerWaalsContact O-CB 3.32Å; F1280-V1284 WeakPolarHBondContact O-CB 3.41Å; F1280-V1284 VanDerWaalsContact O-CG2 3.22Å; F1280-V1284 WeakPolarHBondContact O-CG2 3.45Å; F1280-V1284 PolarHBondContact O-N 3.45Å; V1284-H1301 PolarHBondContact O-NE2 3.2Å; V1284-L1302 HydrophobicContact CG1-CD2 3.6Å; V1284-R1305 HydrophobicContact CG1-CB 4.34Å; V1284-R1305 HydrophobicContact CG1-CG 4.49Å
1285	L	57.9	Low	56.7	Low	1 Å²	1	42 Å²	42	1%	0.005	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-1	178.8	-60	-177.1	0	0	0	114.1	I1281 D1283 L1287 N1290 I1297	I1281-L1285 HydrophobicContact CG2-CD1 3.6Å; I1281-L1285 HydrophobicContact CG2-CG 4.19Å; I1281-L1285 VanDerWaalsContact O-CB 3.28Å; I1281-L1285 WeakPolarHBondContact O-CB 3.18Å; I1281-L1285 VanDerWaalsContact O-CG 3.32Å; I1281-L1285 WeakPolarHBondContact O-CG 3.33Å; I1281-L1285 PolarHBondContact O-N 2.72Å; D1283-L1285 PolarHBondContact O-N 3.28Å; L1285-L1287 VanDerWaalsContact C-N 3.29Å; L1285-L1287 HydrophobicContact CB-CD2 4.33Å; L1285-L1287 HydrophobicContact CB-CG 4.1Å; L1285-L1287 PolarHBondContact O-N 3.06Å; L1285-N1290 PolarHBondContact O-ND2 3.11Å; L1285-I1297 HydrophobicContact CD1-CD1 3.98Å; L1285-I1297 HydrophobicContact CD1-CG1 4.02Å; L1285-I1297 HydrophobicContact CD2-CB 4.5Å; L1285-I1297 HydrophobicContact CD2-CD1 4.26Å; L1285-I1297 HydrophobicContact CD2-CG1 3.99Å; L1285-I1297 HydrophobicContact CD2-CG2 3.97Å
1286	D	55.9	Low	56.5	Low	44 Å²	44	42.9 Å²	42.9	24%	0.235	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.2	52.8	-170.9	-87.8	-24.3	0	0	0	111.6	E1282 D1283 Q1288 V1289 N1290 R1305	E1282-D1286 WeakPolarHBondContact O-CA 3.34Å; E1282-D1286 PolarHBondContact O-N 2.79Å; E1282-D1286 VanDerWaalsContact O-N 3.12Å; D1283-D1286 PolarHBondContact O-N 2.96Å; D1286-Q1288 PolarHBondContact O-N 2.93Å; D1286-V1289 HydrophobicContact CB-CB 4.19Å; D1286-V1289 HydrophobicContact CB-CG2 3.99Å; D1286-V1289 WeakPolarHBondContact O-CA 3.14Å; D1286-V1289 WeakPolarHBondContact O-CB 3.25Å; D1286-V1289 PolarHBondContact O-N 3.47Å; D1286-N1290 PolarHBondContact O-N 3.05Å; D1286-N1290 VanDerWaalsContact O-N 3.17Å; D1286-R1305 IonicContact OD2-CZ 3.4Å; D1286-R1305 IonicContact OD2-NH1 2.93Å; D1286-R1305 IonicContact OD2-NH2 3.81Å; D1286-R1305 PolarHBondContact OD2-NH2 3.39Å
1287	L	40.7	Very low	56.6	Low	36 Å²	36	43 Å²	43	19%	0.188	25%	0.246	C	C	.	.	H	α-helix	trans	-58.8	-23.6	-171.3	-81.3	179.4	0	0	0	113.7	E1282 L1285 N1290 G1291	E1282-L1287 HydrophobicContact CG-CB 4.44Å; E1282-L1287 HydrophobicContact CG-CD1 3.86Å; E1282-L1287 PolarHBondContact O-N 3.45Å; E1282-L1287 VanDerWaalsContact O-N 3.09Å; L1285-L1287 VanDerWaalsContact C-N 3.29Å; L1285-L1287 HydrophobicContact CB-CD2 4.33Å; L1285-L1287 HydrophobicContact CB-CG 4.1Å; L1285-L1287 PolarHBondContact O-N 3.06Å; L1287-N1290 PolarHBondContact O-N 3.29Å; L1287-G1291 PolarHBondContact O-N 3.07Å; L1287-G1291 VanDerWaalsContact O-N 3.13Å
1288	Q	42.5	Very low	56.6	Low	123 Å²	123	43 Å²	43	58%	0.575	25%	0.246	S	C	*	.	H	α-helix	trans	-66.1	-34.1	173.1	-64.4	-168.2	21.8	0	0	113.6	D1286	D1286-Q1288 PolarHBondContact O-N 2.93Å
1289	V	40.9	Very low	56.7	Low	24 Å²	24	40.9 Å²	40.9	15%	0.145	24%	0.235	C	C	.	.	H	α-helix	trans	-70.7	-44.8	170.8	175.4	0	0	0	0	109.3	Y1112 L1116 Q1119 D1286	Y1112-V1289 HydrophobicContact CE2-CG1 4.29Å; L1116-V1289 HydrophobicContact CD2-CG1 3.49Å; L1116-V1289 VanDerWaalsContact CD2-CG1 3.49Å; L1116-V1289 HydrophobicContact CG-CG1 4.13Å; Q1119-V1289 PolarHBondContact NE2-O 2.99Å; D1286-V1289 HydrophobicContact CB-CB 4.19Å; D1286-V1289 HydrophobicContact CB-CG2 3.99Å; D1286-V1289 WeakPolarHBondContact O-CA 3.14Å; D1286-V1289 WeakPolarHBondContact O-CB 3.25Å; D1286-V1289 PolarHBondContact O-N 3.47Å
1290	N	36.2	Very low	56.9	Low	9 Å²	9	40.1 Å²	40.1	5%	0.048	23%	0.231	C	C	.	.	H	α-helix	trans	-77.9	-31.2	-164.1	-93.2	-46.1	0	0	0	115.8	Y1112 R1115 L1285 D1286 L1287 S1292 L1294	Y1112-N1290 WeakPolarHBondContact CD2-ND2 3.25Å; Y1112-N1290 VanDerWaalsContact CD2-OD1 3.27Å; Y1112-N1290 WeakPolarHBondContact CD2-OD1 3.13Å; Y1112-N1290 WeakPolarHBondContact CE2-ND2 3.46Å; R1115-N1290 PolarHBondContact NH1-O 3.26Å; L1285-N1290 PolarHBondContact O-ND2 3.11Å; D1286-N1290 PolarHBondContact O-N 3.05Å; D1286-N1290 VanDerWaalsContact O-N 3.17Å; L1287-N1290 PolarHBondContact O-N 3.29Å; N1290-S1292 PolarHBondContact O-N 3.17Å; N1290-L1294 HydrophobicContact CB-CD1 4.14Å
1291	G	37.3	Very low	56.8	Low	70 Å²	70	40 Å²	40	72%	0.722	23%	0.23	S	C	*	.			trans	66.3	-23.2	166.8	0	0	0	0	0	118	L1287	L1287-G1291 PolarHBondContact O-N 3.07Å; L1287-G1291 VanDerWaalsContact O-N 3.13Å
1292	S	43.2	Very low	57	Low	49 Å²	49	40 Å²	40	34%	0.343	23%	0.23	S	C	.	.	S	Bend	trans	-105.2	144.4	168.2	69.5	0	0	0	0	109.6	R1115 N1290 L1294	R1115-S1292 PolarHBondContact NH1-OG 3.37Å; N1290-S1292 PolarHBondContact O-N 3.17Å; S1292-L1294 PolarHBondContact O-N 3.25Å
1293	E	50.8	Low	57.2	Low	175 Å²	175	35.6 Å²	35.6	82%	0.818	21%	0.21	S	C	*	.			trans	-62.2	104	170	-66.3	173.2	176.1	0	0	109.7	S1295	E1293-S1295 PolarHBondContact O-N 3.48Å
1294	L	58.2	Low	57.2	Low	20 Å²	20	34.3 Å²	34.3	11%	0.105	20%	0.203	C	C	.	.			trans	-74.6	114.6	170.6	-68.8	172	0	0	0	108	W1108 R1249 N1290 S1292 T1296	W1108-L1294 HydrophobicContact CZ2-CD1 3.83Å; R1249-L1294 VanDerWaalsContact CD-O 3.27Å; R1249-L1294 WeakPolarHBondContact CD-O 3.27Å; N1290-L1294 HydrophobicContact CB-CD1 4.14Å; S1292-L1294 PolarHBondContact O-N 3.25Å; L1294-T1296 VanDerWaalsContact C-N 3.3Å
1295	S	62.8	Low	57.3	Low	81 Å²	81	35.9 Å²	35.9	57%	0.566	21%	0.209	S	C	*	.			trans	-76.4	-18.7	173.1	51.6	0	0	0	0	112.7	R1249 E1293	R1249-S1295 WeakPolarHBondContact CB-O 3.38Å; R1249-S1295 PolarHBondContact N-O 3.06Å; E1293-S1295 PolarHBondContact O-N 3.48Å
1296	T	67.1	Low	57.5	Low	53 Å²	53	37 Å²	37	33%	0.325	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	144.3	-174.2	54.8	0	0	0	0	113.3	W1108 I1246 F1247 L1294	W1108-T1296 PolarHBondContact NE1-O 3.27Å; I1246-T1296 HydrophobicContact CG2-CG2 3.96Å; F1247-T1296 CarbonylContact O-C 3.51Å; F1247-T1296 WeakPolarHBondContact O-CA 3.2Å; L1294-T1296 VanDerWaalsContact C-N 3.3Å
1297	I	71.2	Confident	57.7	Low	1 Å²	1	38.5 Å²	38.5	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	112.1	-178.2	-54.4	178.5	0	0	0	108.6	F1247 R1249 F1252 L1285 L1302	F1247-I1297 PolarHBondContact N-O 2.93Å; F1247-I1297 PolarHBondContact O-N 3.39Å; R1249-I1297 HydrophobicContact CB-CD1 4.19Å; R1249-I1297 HydrophobicContact CB-CG1 4.31Å; R1249-I1297 HydrophobicContact CG-CD1 4.29Å; F1252-I1297 HydrophobicContact CB-CD1 4.36Å; F1252-I1297 HydrophobicContact CD1-CD1 3.63Å; F1252-I1297 HydrophobicContact CE1-CD1 4.22Å; F1252-I1297 HydrophobicContact CG-CD1 4.22Å; L1285-I1297 HydrophobicContact CD1-CD1 3.98Å; L1285-I1297 HydrophobicContact CD1-CG1 4.02Å; L1285-I1297 HydrophobicContact CD2-CB 4.5Å; L1285-I1297 HydrophobicContact CD2-CD1 4.26Å; L1285-I1297 HydrophobicContact CD2-CG1 3.99Å; L1285-I1297 HydrophobicContact CD2-CG2 3.97Å; I1297-L1302 HydrophobicContact CG2-CD1 3.89Å; I1297-L1302 HydrophobicContact CG2-CD2 3.93Å; I1297-L1302 HydrophobicContact CG2-CG 3.74Å
1298	P	71.3	Confident	58.7	Low	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	139	175.1	31.9	-33.2	0	0	0	111.7	A1105 W1108 I1246 T1300 H1301 L1302	A1105-P1298 HydrophobicContact CB-CB 4.22Å; W1108-P1298 HydrophobicContact CD2-CG 3.56Å; W1108-P1298 HydrophobicContact CE3-CG 3.59Å; W1108-P1298 HydrophobicContact CG-CG 3.99Å; W1108-P1298 HydrophobicContact CH2-CG 4.35Å; W1108-P1298 HydrophobicContact CZ2-CG 4.27Å; W1108-P1298 HydrophobicContact CZ3-CG 4.01Å; I1246-P1298 HydrophobicContact CG1-CB 4.33Å; P1298-T1300 PolarHBondContact O-N 3.44Å; P1298-H1301 HydrophobicContact CG-CB 3.88Å; P1298-H1301 PolarHBondContact O-N 3.06Å; P1298-H1301 VanDerWaalsContact O-N 3.08Å; P1298-L1302 PolarHBondContact O-N 2.88Å
1299	L	72	Confident	59.3	Low	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-58	-31.8	177	177.4	64.6	0	0	0	112.1	L1202 V1205 I1225 I1245 F1247 L1302 N1303	L1202-L1299 HydrophobicContact CD2-CD2 4.03Å; V1205-L1299 HydrophobicContact CG1-CD1 4.13Å; V1205-L1299 HydrophobicContact CG1-CD2 4.26Å; V1205-L1299 HydrophobicContact CG1-CG 4.09Å; I1225-L1299 HydrophobicContact CD1-CD2 3.83Å; I1225-L1299 HydrophobicContact CG1-CD2 4.27Å; I1245-L1299 HydrophobicContact CG2-CB 4.12Å; I1245-L1299 VanDerWaalsContact O-CB 3.29Å; I1245-L1299 WeakPolarHBondContact O-CB 3.39Å; I1245-L1299 PolarHBondContact O-N 3.03Å; F1247-L1299 HydrophobicContact CE2-CB 3.72Å; F1247-L1299 HydrophobicContact CE2-CD1 3.92Å; F1247-L1299 HydrophobicContact CE2-CG 4.34Å; F1247-L1299 HydrophobicContact CZ-CB 3.92Å; F1247-L1299 HydrophobicContact CZ-CD1 4.13Å; F1247-L1299 HydrophobicContact CZ-CD2 4.4Å; F1247-L1299 HydrophobicContact CZ-CG 4.37Å; L1299-L1302 CarbonylContact O-C 3.6Å; L1299-L1302 PolarHBondContact O-N 3Å; L1299-N1303 WeakPolarHBondContact O-CB 3.31Å; L1299-N1303 PolarHBondContact O-N 3.25Å
1300	T	68.3	Low	59.9	Low	1 Å²	1	36.3 Å²	36.3	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-58.5	-45.6	174.1	48.1	0	0	0	0	111.4	H1109 F1179 Y1201 I1245 P1298 N1303 L1304	H1109-T1300 PolarHBondContact CD2-OG1 2.65Å; H1109-T1300 PolarHBondContact NE2-OG1 3.47Å; F1179-T1300 HydrophobicContact CD2-CG2 4.29Å; F1179-T1300 HydrophobicContact CE2-CG2 3.7Å; Y1201-T1300 HydrophobicContact CE1-CG2 4.38Å; Y1201-T1300 WeakPolarHBondContact OH-CG2 3.36Å; I1245-T1300 HydrophobicContact CG2-CG2 4.36Å; P1298-T1300 PolarHBondContact O-N 3.44Å; T1300-N1303 WeakPolarHBondContact O-CB 3.18Å; T1300-N1303 PolarHBondContact O-N 3.35Å; T1300-L1304 WeakPolarHBondContact O-CG 3.35Å; T1300-L1304 PolarHBondContact O-N 2.77Å; T1300-L1304 VanDerWaalsContact O-N 3.11Å
1301	H	68	Low	60.7	Low	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-41.8	174.9	-173.5	79.8	0	0	0	111.9	W1108 Y1112 V1284 P1298 N1303 L1304 R1305	W1108-H1301 HydrophobicContact CH2-CB 3.97Å; W1108-H1301 AromaticContact CH2-CD2 3.91Å; W1108-H1301 AromaticContact CH2-CE1 3.89Å; W1108-H1301 AromaticContact CH2-CG 3.56Å; W1108-H1301 AromaticContact CH2-ND1 3.58Å; W1108-H1301 HydrophobicContact CZ3-CB 3.9Å; W1108-H1301 AromaticContact CZ3-CG 3.8Å; W1108-H1301 AromaticContact CZ3-ND1 3.64Å; Y1112-H1301 AromaticContact CE1-CE1 3.8Å; V1284-H1301 PolarHBondContact O-NE2 3.2Å; P1298-H1301 HydrophobicContact CG-CB 3.88Å; P1298-H1301 PolarHBondContact O-N 3.06Å; P1298-H1301 VanDerWaalsContact O-N 3.08Å; H1301-N1303 VanDerWaalsContact C-N 3.28Å; H1301-N1303 PolarHBondContact O-N 3.27Å; H1301-L1304 PolarHBondContact O-N 2.98Å; H1301-R1305 PolarHBondContact CE1-NE 3.36Å; H1301-R1305 WeakPolarHBondContact O-CG 3.36Å; H1301-R1305 PolarHBondContact O-N 3.21Å
1302	L	69.1	Low	61.3	Low	2 Å²	2	37.4 Å²	37.4	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-37	173.2	-67.3	177	0	0	0	112.4	F1247 F1252 V1284 I1297 P1298 L1299 L1306	F1247-L1302 HydrophobicContact CD2-CD1 4.1Å; F1247-L1302 HydrophobicContact CE2-CD1 4.11Å; F1252-L1302 HydrophobicContact CE2-CD1 3.96Å; F1252-L1302 HydrophobicContact CZ-CD1 4.09Å; F1252-L1302 HydrophobicContact CZ-CD2 4.18Å; V1284-L1302 HydrophobicContact CG1-CD2 3.6Å; I1297-L1302 HydrophobicContact CG2-CD1 3.89Å; I1297-L1302 HydrophobicContact CG2-CD2 3.93Å; I1297-L1302 HydrophobicContact CG2-CG 3.74Å; P1298-L1302 PolarHBondContact O-N 2.88Å; L1299-L1302 CarbonylContact O-C 3.6Å; L1299-L1302 PolarHBondContact O-N 3Å; L1302-L1306 WeakPolarHBondContact O-CB 3.39Å; L1302-L1306 PolarHBondContact O-N 3Å
1303	N	65.9	Low	61.2	Low	3 Å²	3	39 Å²	39	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-47.4	176.7	-178.7	39.9	0	0	0	111.4	E1182 V1205 L1299 T1300 H1301 K1307 L1308 S1309	E1182-N1303 PolarHBondContact OE2-ND2 3.16Å; V1205-N1303 HydrophobicContact CG1-CB 3.92Å; L1299-N1303 WeakPolarHBondContact O-CB 3.31Å; L1299-N1303 PolarHBondContact O-N 3.25Å; T1300-N1303 WeakPolarHBondContact O-CB 3.18Å; T1300-N1303 PolarHBondContact O-N 3.35Å; H1301-N1303 VanDerWaalsContact C-N 3.28Å; H1301-N1303 PolarHBondContact O-N 3.27Å; N1303-K1307 WeakPolarHBondContact O-CA 3.37Å; N1303-K1307 PolarHBondContact O-N 3.48Å; N1303-L1308 PolarHBondContact O-N 3.03Å; N1303-L1308 WeakPolarHBondContact OD1-CB 3.45Å; N1303-L1308 PolarHBondContact OD1-N 2.94Å; N1303-S1309 WeakPolarHBondContact OD1-CB 3.47Å; N1303-S1309 PolarHBondContact OD1-N 3.29Å; N1303-S1309 PolarHBondContact OD1-OG 2.95Å
1304	L	62.5	Low	60.6	Low	25 Å²	25	33 Å²	33	13%	0.131	17%	0.171	C	C	.	.	H	α-helix	trans	-59	-52.9	175.8	-62.1	163.7	0	0	0	111.1	E1178 F1179 T1300 H1301 L1306	E1178-L1304 HydrophobicContact CB-CD2 4.35Å; F1179-L1304 HydrophobicContact CB-CD1 3.77Å; F1179-L1304 HydrophobicContact CB-CD2 4.2Å; T1300-L1304 WeakPolarHBondContact O-CG 3.35Å; T1300-L1304 PolarHBondContact O-N 2.77Å; T1300-L1304 VanDerWaalsContact O-N 3.11Å; H1301-L1304 PolarHBondContact O-N 2.98Å; L1304-L1306 PolarHBondContact O-N 2.65Å
1305	R	61.9	Low	59.7	Low	37 Å²	37	33.1 Å²	33.1	14%	0.14	17%	0.172	C	C	.	.	H	α-helix	trans	-68.9	-36	-173.5	-63.1	-51	-164.8	155.3	19.3	114	Y1112 E1175 V1284 D1286 H1301	Y1112-R1305 PolarHBondContact OH-NH2 3.06Å; E1175-R1305 IonicContact OE1-NH1 2.74Å; E1175-R1305 WeakPolarHBondContact OE2-CD 3.4Å; E1175-R1305 IonicContact OE2-CZ 2.81Å; E1175-R1305 VanDerWaalsContact OE2-CZ 3.3Å; E1175-R1305 IonicContact OE2-NE 3.38Å; E1175-R1305 PolarHBondContact OE2-NE 3.48Å; E1175-R1305 IonicContact OE2-NH1 3.03Å; E1175-R1305 PolarHBondContact OE2-NH1 2.63Å; V1284-R1305 HydrophobicContact CG1-CB 4.34Å; V1284-R1305 HydrophobicContact CG1-CG 4.49Å; D1286-R1305 IonicContact OD2-CZ 3.4Å; D1286-R1305 IonicContact OD2-NH1 2.93Å; D1286-R1305 IonicContact OD2-NH2 3.81Å; D1286-R1305 PolarHBondContact OD2-NH2 3.39Å; H1301-R1305 PolarHBondContact CE1-NE 3.36Å; H1301-R1305 WeakPolarHBondContact O-CG 3.36Å; H1301-R1305 PolarHBondContact O-N 3.21Å
1306	L	62.1	Low	58.6	Low	24 Å²	24	33.6 Å²	33.6	13%	0.126	17%	0.172	C	C	.	.	H	α-helix	trans	-99.4	-6	-178.5	-58.6	177.9	0	0	0	113.5	F1217 F1280 L1302 L1304 L1308	F1217-L1306 HydrophobicContact CZ-CD1 3.97Å; F1280-L1306 HydrophobicContact CE2-CD2 4.43Å; F1280-L1306 HydrophobicContact CZ-CD2 4.27Å; L1302-L1306 WeakPolarHBondContact O-CB 3.39Å; L1302-L1306 PolarHBondContact O-N 3Å; L1304-L1306 PolarHBondContact O-N 2.65Å; L1306-L1308 HydrophobicContact CB-CD2 3.69Å; L1306-L1308 HydrophobicContact CB-CG 3.98Å; L1306-L1308 HydrophobicContact CD1-CD2 4.36Å
1307	K	60.6	Low	57.1	Low	75 Å²	75	36.6 Å²	36.6	33%	0.326	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	53.7	-174.8	-71.1	174.1	155.1	-65.7	0	112	N1303 E1310 R1311	N1303-K1307 WeakPolarHBondContact O-CA 3.37Å; N1303-K1307 PolarHBondContact O-N 3.48Å; K1307-E1310 VanDerWaalsContact CD-OE2 3.29Å; K1307-E1310 WeakPolarHBondContact CD-OE2 3.45Å; K1307-E1310 IonicContact NZ-OE1 2.67Å; K1307-E1310 PolarHBondContact NZ-OE1 3.07Å; K1307-E1310 IonicContact NZ-OE2 3.51Å; K1307-E1310 PolarHBondContact NZ-OE2 2.94Å; K1307-R1311 VanDerWaalsContact O-CG 3.32Å; K1307-R1311 WeakPolarHBondContact O-CG 3.3Å
1308	L	60.3	Low	55.6	Low	10 Å²	10	37.9 Å²	37.9	5%	0.052	19%	0.194	C	C	.	.	H	α-helix	trans	-68.6	-44.7	-174.6	-57.5	177.8	0	0	0	111.4	V1205 F1217 L1221 N1303 L1306 R1311 M1312 F1333	V1205-L1308 HydrophobicContact CG1-CB 4.2Å; V1205-L1308 HydrophobicContact CG1-CD1 4.23Å; F1217-L1308 HydrophobicContact CE1-CD2 3.84Å; F1217-L1308 HydrophobicContact CZ-CD2 4.45Å; L1221-L1308 HydrophobicContact CD1-CD1 4.03Å; N1303-L1308 PolarHBondContact O-N 3.03Å; N1303-L1308 WeakPolarHBondContact OD1-CB 3.45Å; N1303-L1308 PolarHBondContact OD1-N 2.94Å; L1306-L1308 HydrophobicContact CB-CD2 3.69Å; L1306-L1308 HydrophobicContact CB-CG 3.98Å; L1306-L1308 HydrophobicContact CD1-CD2 4.36Å; L1308-R1311 PolarHBondContact O-N 3.13Å; L1308-M1312 PolarHBondContact O-N 3.12Å; L1308-M1312 VanDerWaalsContact O-N 3.16Å; L1308-F1333 HydrophobicContact CD2-CE2 4.28Å; L1308-F1333 HydrophobicContact CD2-CZ 4.05Å
1309	S	56.3	Low	54.2	Low	17 Å²	17	43.7 Å²	43.7	12%	0.119	23%	0.225	C	C	.	.	H	α-helix	trans	-61.6	-47.3	-179.7	61.2	0	0	0	0	113.4	N1303 R1311 M1312 E1313	N1303-S1309 WeakPolarHBondContact OD1-CB 3.47Å; N1303-S1309 PolarHBondContact OD1-N 3.29Å; N1303-S1309 PolarHBondContact OD1-OG 2.95Å; S1309-R1311 PolarHBondContact O-N 3.21Å; S1309-M1312 PolarHBondContact O-N 3.47Å; S1309-E1313 PolarHBondContact O-N 2.91Å
1310	E	53.8	Low	52.8	Low	110 Å²	110	55.3 Å²	55.3	51%	0.514	27%	0.269	S	S	.	.	H	α-helix	trans	-56.5	-37.6	177	-71	-178.4	171.9	0	0	112.2	K1307 M1312	K1307-E1310 VanDerWaalsContact CD-OE2 3.29Å; K1307-E1310 WeakPolarHBondContact CD-OE2 3.45Å; K1307-E1310 IonicContact NZ-OE1 2.67Å; K1307-E1310 PolarHBondContact NZ-OE1 3.07Å; K1307-E1310 IonicContact NZ-OE2 3.51Å; K1307-E1310 PolarHBondContact NZ-OE2 2.94Å; E1310-M1312 VanDerWaalsContact C-N 3.34Å
1311	R	52.2	Low	51.1	Low	81 Å²	81	61.4 Å²	61.4	31%	0.306	30%	0.301	S	S	.	.	H	α-helix	trans	-79.2	-15.7	-180	-62.8	-178.4	-167.6	-153.1	-7.3	113.3	K1307 L1308 S1309 S1314 Y1336	K1307-R1311 VanDerWaalsContact O-CG 3.32Å; K1307-R1311 WeakPolarHBondContact O-CG 3.3Å; L1308-R1311 PolarHBondContact O-N 3.13Å; S1309-R1311 PolarHBondContact O-N 3.21Å; R1311-S1314 PolarHBondContact O-OG 2.93Å; R1311-Y1336 PolarHBondContact NH2-OH 3.4Å
1312	M	48.8	Very low	49.8	Very low	22 Å²	22	67.2 Å²	67.2	11%	0.108	34%	0.341	C	S	.	.	H	α-helix	trans	-94.5	-35.4	172.9	-82.2	-62.1	-173.7	0	0	113	K1204 L1215 T1218 L1308 S1309 E1310 S1314 T1315 V1316	K1204-M1312 WeakPolarHBondContact O-CB 3.35Å; L1215-M1312 HydrophobicContact CD1-CE 3.46Å; L1215-M1312 VanDerWaalsContact CD1-CE 3.46Å; T1218-M1312 HydrophobicContact CG2-CE 3.61Å; L1308-M1312 PolarHBondContact O-N 3.12Å; L1308-M1312 VanDerWaalsContact O-N 3.16Å; S1309-M1312 PolarHBondContact O-N 3.47Å; E1310-M1312 VanDerWaalsContact C-N 3.34Å; M1312-S1314 PolarHBondContact O-N 3.34Å; M1312-T1315 WeakPolarHBondContact O-CA 3.38Å; M1312-T1315 WeakPolarHBondContact O-CB 3.32Å; M1312-T1315 PolarHBondContact O-N 3.09Å; M1312-T1315 PolarHBondContact O-OG1 3.19Å; M1312-T1315 HydrophobicContact SD-CG2 4.47Å; M1312-V1316 PolarHBondContact O-N 2.82Å
1313	E	41.3	Very low	48.7	Very low	82 Å²	82	73.1 Å²	73.1	38%	0.383	37%	0.373	S	S	.	.	H	α-helix	trans	-62.2	-27	175.8	-76.5	-169.6	-174.9	0	0	112.8	K1204 S1309 T1315 L1317	K1204-E1313 WeakPolarHBondContact CE-OE1 3.4Å; K1204-E1313 IonicContact NZ-OE1 2.74Å; K1204-E1313 PolarHBondContact NZ-OE1 2.76Å; S1309-E1313 PolarHBondContact O-N 2.91Å; E1313-T1315 PolarHBondContact O-N 3.43Å; E1313-L1317 PolarHBondContact O-N 2.9Å
1314	S	39.9	Very low	47.9	Very low	49 Å²	49	79.2 Å²	79.2	34%	0.343	40%	0.401	S	S	.	.	H	α-helix	trans	-62.4	-28.4	169.8	72	0	0	0	0	112.9	R1311 M1312 S1318	R1311-S1314 PolarHBondContact O-OG 2.93Å; M1312-S1314 PolarHBondContact O-N 3.34Å; S1314-S1318 PolarHBondContact O-OG 3.36Å
1315	T	39	Very low	46.9	Very low	23 Å²	23	83.8 Å²	83.8	14%	0.141	42%	0.422	C	S	.	.	H	α-helix	trans	-86.1	-38	-177.6	76.7	0	0	0	0	112.9	M1312 E1313 S1318 N1319 L1330	M1312-T1315 WeakPolarHBondContact O-CA 3.38Å; M1312-T1315 WeakPolarHBondContact O-CB 3.32Å; M1312-T1315 PolarHBondContact O-N 3.09Å; M1312-T1315 PolarHBondContact O-OG1 3.19Å; M1312-T1315 HydrophobicContact SD-CG2 4.47Å; E1313-T1315 PolarHBondContact O-N 3.43Å; T1315-S1318 PolarHBondContact O-N 3.27Å; T1315-S1318 PolarHBondContact O-OG 2.92Å; T1315-N1319 PolarHBondContact O-N 3.01Å; T1315-L1330 HydrophobicContact CG2-CD2 4.1Å
1316	V	38.8	Very low	45.9	Very low	91 Å²	91	83.4 Å²	83.4	55%	0.552	42%	0.423	S	S	*	.	H	α-helix	trans	-69.3	-40.8	-179	-179.9	0	0	0	0	110.8	M1312 S1318 N1319	M1312-V1316 PolarHBondContact O-N 2.82Å; V1316-S1318 PolarHBondContact O-N 3.33Å; V1316-N1319 PolarHBondContact O-N 2.92Å
1317	L	36.7	Very low	45	Very low	115 Å²	115	89.4 Å²	89.4	60%	0.602	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-17.9	178.7	-70.8	174.3	0	0	0	113.8	E1313	E1313-L1317 PolarHBondContact O-N 2.9Å
1318	S	39.6	Very low	44.3	Very low	28 Å²	28	88.3 Å²	88.3	20%	0.196	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-2.3	179.4	62	0	0	0	0	114.2	S1314 T1315 V1316 R1320 L1321 N1326	S1314-S1318 PolarHBondContact O-OG 3.36Å; T1315-S1318 PolarHBondContact O-N 3.27Å; T1315-S1318 PolarHBondContact O-OG 2.92Å; V1316-S1318 PolarHBondContact O-N 3.33Å; S1318-R1320 PolarHBondContact O-N 3.27Å; S1318-L1321 PolarHBondContact O-N 3.17Å; S1318-N1326 WeakPolarHBondContact CB-OD1 3.37Å; S1318-N1326 PolarHBondContact O-ND2 2.83Å; S1318-N1326 PolarHBondContact OG-ND2 3.4Å; S1318-N1326 PolarHBondContact OG-OD1 3.18Å
1319	N	40.3	Very low	43.5	Very low	122 Å²	122	90.7 Å²	90.7	65%	0.652	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-6.3	178.1	-81.6	-26.3	0	0	0	115.2	T1315 V1316 L1321	T1315-N1319 PolarHBondContact O-N 3.01Å; V1316-N1319 PolarHBondContact O-N 2.92Å; N1319-L1321 VanDerWaalsContact C-N 3.34Å
1320	R	42.6	Very low	43	Very low	245 Å²	245	91.7 Å²	91.7	93%	0.925	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.8	168.8	-73.5	-165.9	-178.4	-169.8	2.2	114.5	S1318	S1318-R1320 PolarHBondContact O-N 3.27Å
1321	L	34.2	Very low	42.8	Very low	129 Å²	129	90.8 Å²	90.8	68%	0.675	45%	0.45	S	S	*	.	S	Bend	trans	-125	101.1	174.2	-70.7	171.4	0	0	0	109.6	S1318 N1319 D1323	S1318-L1321 PolarHBondContact O-N 3.17Å; N1319-L1321 VanDerWaalsContact C-N 3.34Å; L1321-D1323 PolarHBondContact O-N 3.23Å
1322	S	41	Very low	42.8	Very low	122 Å²	122	90.9 Å²	90.9	85%	0.853	45%	0.454	S	S	*	.			trans	-74.2	62.8	-179.5	55.3	0	0	0	0	112
1323	D	45	Very low	43	Very low	125 Å²	125	91.2 Å²	91.2	67%	0.668	46%	0.455	S	S	*	.	S	Bend	trans	-136.8	156.1	-176.8	-95.2	-51.6	0	0	0	114.3	L1321 H1325 N1326	L1321-D1323 PolarHBondContact O-N 3.23Å; D1323-H1325 PolarHBondContact O-N 3.46Å; D1323-N1326 PolarHBondContact O-N 2.99Å
1324	Q	48.3	Very low	43.9	Very low	132 Å²	132	88.2 Å²	88.2	62%	0.617	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-26.4	-163	-166.1	140.6	-80	0	0	115.8	N1326 R1327 D1328	Q1324-N1326 VanDerWaalsContact C-N 3.32Å; Q1324-N1326 PolarHBondContact O-N 3.38Å; Q1324-R1327 PolarHBondContact O-N 3.19Å; Q1324-D1328 PolarHBondContact O-N 2.88Å
1325	H	42.9	Very low	44.5	Very low	121 Å²	121	88.7 Å²	88.7	56%	0.56	44%	0.442	S	S	*	.	H	α-helix	trans	-53.5	-40.9	-175.5	-169.6	73.1	0	0	0	114	D1323 R1327 D1328 Q1329	D1323-H1325 PolarHBondContact O-N 3.46Å; H1325-R1327 VanDerWaalsContact C-N 3.34Å; H1325-R1327 PolarHBondContact O-N 3.4Å; H1325-D1328 PolarHBondContact O-N 2.69Å; H1325-Q1329 PolarHBondContact CD2-NE2 3.49Å; H1325-Q1329 PolarHBondContact NE2-NE2 3.46Å; H1325-Q1329 PolarHBondContact O-N 3.28Å; H1325-Q1329 VanDerWaalsContact O-N 3.07Å
1326	N	40.5	Very low	45.3	Very low	29 Å²	29	90.1 Å²	90.1	16%	0.155	45%	0.446	C	S	.	.	H	α-helix	trans	-63	-38.5	178.6	-74.1	-17.3	0	0	0	112.3	S1318 D1323 Q1324 D1328 Q1329 L1330	S1318-N1326 WeakPolarHBondContact CB-OD1 3.37Å; S1318-N1326 PolarHBondContact O-ND2 2.83Å; S1318-N1326 PolarHBondContact OG-ND2 3.4Å; S1318-N1326 PolarHBondContact OG-OD1 3.18Å; D1323-N1326 PolarHBondContact O-N 2.99Å; Q1324-N1326 VanDerWaalsContact C-N 3.32Å; Q1324-N1326 PolarHBondContact O-N 3.38Å; N1326-D1328 PolarHBondContact O-N 3.18Å; N1326-Q1329 PolarHBondContact O-N 3.48Å; N1326-L1330 WeakPolarHBondContact O-CB 3.43Å; N1326-L1330 WeakPolarHBondContact O-CD1 3.48Å; N1326-L1330 WeakPolarHBondContact O-CG 3.2Å; N1326-L1330 PolarHBondContact O-N 3.24Å
1327	R	42.4	Very low	46.4	Very low	150 Å²	150	86 Å²	86	57%	0.566	42%	0.42	S	S	*	.	H	α-helix	trans	-69.2	-19	176.3	-71.8	-154.3	-65.8	-167.1	-4.2	113.1	Q1324 H1325 K1331	Q1324-R1327 PolarHBondContact O-N 3.19Å; H1325-R1327 VanDerWaalsContact C-N 3.34Å; H1325-R1327 PolarHBondContact O-N 3.4Å; R1327-K1331 WeakPolarHBondContact O-CE 3.33Å; R1327-K1331 VanDerWaalsContact O-CG 3.3Å; R1327-K1331 WeakPolarHBondContact O-CG 3.38Å; R1327-K1331 PolarHBondContact O-N 3.47Å
1328	D	46.9	Very low	47.5	Very low	52 Å²	52	81.4 Å²	81.4	28%	0.278	40%	0.396	S	S	.	.	H	α-helix	trans	-85.6	-40.4	175.5	-66.9	-34.9	0	0	0	111.4	Q1324 H1325 N1326 L1330 K1331 Q1332	Q1324-D1328 PolarHBondContact O-N 2.88Å; H1325-D1328 PolarHBondContact O-N 2.69Å; N1326-D1328 PolarHBondContact O-N 3.18Å; D1328-L1330 VanDerWaalsContact C-N 3.31Å; D1328-L1330 PolarHBondContact O-N 3.36Å; D1328-K1331 WeakPolarHBondContact O-CB 3.49Å; D1328-K1331 PolarHBondContact O-N 3.18Å; D1328-K1331 VanDerWaalsContact O-N 3.11Å; D1328-K1331 IonicContact OD1-NZ 2.73Å; D1328-K1331 PolarHBondContact OD1-NZ 2.88Å; D1328-Q1332 WeakPolarHBondContact O-CG 3.44Å; D1328-Q1332 PolarHBondContact O-N 2.96Å; D1328-Q1332 VanDerWaalsContact O-N 3.12Å
1329	Q	43.8	Very low	48.3	Very low	60 Å²	60	82.4 Å²	82.4	28%	0.28	40%	0.397	S	S	.	.	H	α-helix	trans	-57.8	-42.3	168.1	-66.8	-171.1	9	0	0	112	H1325 N1326 K1331 Q1332 F1333	H1325-Q1329 PolarHBondContact CD2-NE2 3.49Å; H1325-Q1329 PolarHBondContact NE2-NE2 3.46Å; H1325-Q1329 PolarHBondContact O-N 3.28Å; H1325-Q1329 VanDerWaalsContact O-N 3.07Å; N1326-Q1329 PolarHBondContact O-N 3.48Å; Q1329-K1331 VanDerWaalsContact C-N 3.29Å; Q1329-K1331 PolarHBondContact O-N 3.28Å; Q1329-Q1332 WeakPolarHBondContact O-CB 3.35Å; Q1329-Q1332 PolarHBondContact O-N 2.96Å; Q1329-F1333 PolarHBondContact O-N 3.48Å
1330	L	44.6	Very low	49.2	Very low	37 Å²	37	77 Å²	77	19%	0.194	37%	0.369	C	S	.	.	H	α-helix	trans	-62.7	-32.4	175.9	-69.9	164.1	0	0	0	112.8	L1215 T1315 N1326 D1328	L1215-L1330 HydrophobicContact CD1-CD2 3.43Å; L1215-L1330 VanDerWaalsContact CD1-CD2 3.43Å; L1215-L1330 HydrophobicContact CD2-CD2 4.35Å; L1215-L1330 WeakPolarHBondContact CD2-O 3.4Å; L1215-L1330 HydrophobicContact CG-CB 4.39Å; L1215-L1330 HydrophobicContact CG-CD2 3.77Å; T1315-L1330 HydrophobicContact CG2-CD2 4.1Å; N1326-L1330 WeakPolarHBondContact O-CB 3.43Å; N1326-L1330 WeakPolarHBondContact O-CD1 3.48Å; N1326-L1330 WeakPolarHBondContact O-CG 3.2Å; N1326-L1330 PolarHBondContact O-N 3.24Å; D1328-L1330 VanDerWaalsContact C-N 3.31Å; D1328-L1330 PolarHBondContact O-N 3.36Å
1331	K	51	Low	50.2	Low	91 Å²	91	65.3 Å²	65.3	40%	0.396	33%	0.325	S	S	.	.	H	α-helix	trans	-68.8	-35.9	171.7	-69.8	164.1	-162	161.8	0	111.7	R1327 D1328 Q1329 F1333 N1334 V1335	R1327-K1331 WeakPolarHBondContact O-CE 3.33Å; R1327-K1331 VanDerWaalsContact O-CG 3.3Å; R1327-K1331 WeakPolarHBondContact O-CG 3.38Å; R1327-K1331 PolarHBondContact O-N 3.47Å; D1328-K1331 WeakPolarHBondContact O-CB 3.49Å; D1328-K1331 PolarHBondContact O-N 3.18Å; D1328-K1331 VanDerWaalsContact O-N 3.11Å; D1328-K1331 IonicContact OD1-NZ 2.73Å; D1328-K1331 PolarHBondContact OD1-NZ 2.88Å; Q1329-K1331 VanDerWaalsContact C-N 3.29Å; Q1329-K1331 PolarHBondContact O-N 3.28Å; K1331-F1333 VanDerWaalsContact C-N 3.33Å; K1331-F1333 PolarHBondContact O-N 2.83Å; K1331-N1334 PolarHBondContact O-N 3.45Å; K1331-V1335 WeakPolarHBondContact O-CG2 3.49Å; K1331-V1335 PolarHBondContact O-N 3.01Å; K1331-V1335 VanDerWaalsContact O-N 3.08Å
1332	Q	51.3	Low	51.4	Low	84 Å²	84	59.6 Å²	59.6	39%	0.393	30%	0.295	S	S	.	.	H	α-helix	trans	-59	-41.4	-178	-68	165.8	-7.4	0	0	111.7	D1328 Q1329 N1334 V1335 Y1336 Y1398	D1328-Q1332 WeakPolarHBondContact O-CG 3.44Å; D1328-Q1332 PolarHBondContact O-N 2.96Å; D1328-Q1332 VanDerWaalsContact O-N 3.12Å; Q1329-Q1332 WeakPolarHBondContact O-CB 3.35Å; Q1329-Q1332 PolarHBondContact O-N 2.96Å; Q1332-N1334 PolarHBondContact O-N 2.91Å; Q1332-V1335 PolarHBondContact O-N 3.28Å; Q1332-Y1336 WeakPolarHBondContact O-CB 3.43Å; Q1332-Y1336 PolarHBondContact O-N 3.16Å; Q1332-Y1398 VanDerWaalsContact CG-OH 3.31Å; Q1332-Y1398 WeakPolarHBondContact CG-OH 3.49Å
1333	F	53.8	Low	52.3	Low	29 Å²	29	54.7 Å²	54.7	13%	0.127	26%	0.258	C	S	.	.	H	α-helix	trans	-60.8	-48.3	178.1	-175.1	-81.7	0	0	0	113	L1215 F1217 L1308 Q1329 K1331 V1335 Y1336 F1337	L1215-F1333 HydrophobicContact CD2-CB 3.81Å; L1215-F1333 HydrophobicContact CD2-CD1 4.17Å; L1215-F1333 HydrophobicContact CD2-CG 4.28Å; F1217-F1333 HydrophobicContact CB-CD1 4.13Å; F1217-F1333 HydrophobicContact CB-CE1 3.75Å; F1217-F1333 HydrophobicContact CD1-CD1 4.43Å; F1217-F1333 AromaticContact CD1-CE1 3.47Å; F1217-F1333 HydrophobicContact CD1-CE1 3.47Å; F1217-F1333 VanDerWaalsContact CD1-CE1 3.47Å; F1217-F1333 AromaticContact CD1-CZ 3.92Å; F1217-F1333 HydrophobicContact CD1-CZ 3.92Å; F1217-F1333 AromaticContact CD2-CE1 3.98Å; F1217-F1333 HydrophobicContact CD2-CE1 3.98Å; F1217-F1333 AromaticContact CE1-CE1 3.97Å; F1217-F1333 HydrophobicContact CE1-CE1 3.97Å; F1217-F1333 AromaticContact CE1-CZ 3.95Å; F1217-F1333 HydrophobicContact CE1-CZ 3.95Å; F1217-F1333 HydrophobicContact CE2-CE1 4.46Å; F1217-F1333 HydrophobicContact CG-CD1 4.34Å; F1217-F1333 AromaticContact CG-CE1 3.48Å; F1217-F1333 HydrophobicContact CG-CE1 3.48Å; F1217-F1333 VanDerWaalsContact CG-CE1 3.48Å; F1217-F1333 HydrophobicContact CG-CZ 4.28Å; F1217-F1333 HydrophobicContact CZ-CE1 4.46Å; F1217-F1333 HydrophobicContact CZ-CZ 4.38Å; L1308-F1333 HydrophobicContact CD2-CE2 4.28Å; L1308-F1333 HydrophobicContact CD2-CZ 4.05Å; Q1329-F1333 PolarHBondContact O-N 3.48Å; K1331-F1333 VanDerWaalsContact C-N 3.33Å; K1331-F1333 PolarHBondContact O-N 2.83Å; F1333-V1335 VanDerWaalsContact C-N 3.29Å; F1333-V1335 PolarHBondContact O-N 3.27Å; F1333-Y1336 WeakPolarHBondContact O-CB 3.31Å; F1333-Y1336 PolarHBondContact O-N 3.49Å; F1333-F1337 HydrophobicContact CE1-CB 4.24Å; F1333-F1337 PolarHBondContact O-N 2.96Å
1334	N	58.4	Low	53	Low	19 Å²	19	49 Å²	49	10%	0.102	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-41.9	177.6	-68.2	-34.2	0	0	0	111	T1214 R1216 F1217 K1331 Q1332 Y1336 F1337 I1338	T1214-N1334 PolarHBondContact O-ND2 3.33Å; R1216-N1334 PolarHBondContact N-ND2 2.85Å; R1216-N1334 PolarHBondContact N-OD1 2.94Å; F1217-N1334 PolarHBondContact N-OD1 3.01Å; K1331-N1334 PolarHBondContact O-N 3.45Å; Q1332-N1334 PolarHBondContact O-N 2.91Å; N1334-Y1336 VanDerWaalsContact C-N 3.35Å; N1334-F1337 PolarHBondContact O-N 3.03Å; N1334-I1338 WeakPolarHBondContact O-CB 3.18Å; N1334-I1338 WeakPolarHBondContact O-CD1 3.1Å; N1334-I1338 WeakPolarHBondContact O-CG1 3.48Å; N1334-I1338 PolarHBondContact O-N 3.27Å
1335	V	53.7	Low	53.7	Low	59 Å²	59	42.7 Å²	42.7	36%	0.358	20%	0.198	S	C	.	.	H	α-helix	trans	-62.1	-44.3	178.2	170.3	0	0	0	0	110.5	K1331 Q1332 F1333 I1338 Q1339	K1331-V1335 WeakPolarHBondContact O-CG2 3.49Å; K1331-V1335 PolarHBondContact O-N 3.01Å; K1331-V1335 VanDerWaalsContact O-N 3.08Å; Q1332-V1335 PolarHBondContact O-N 3.28Å; F1333-V1335 VanDerWaalsContact C-N 3.29Å; F1333-V1335 PolarHBondContact O-N 3.27Å; V1335-I1338 PolarHBondContact O-N 3.1Å; V1335-Q1339 HydrophobicContact CG1-CG 4.44Å; V1335-Q1339 WeakPolarHBondContact O-CB 3.47Å; V1335-Q1339 VanDerWaalsContact O-CG 3.23Å; V1335-Q1339 WeakPolarHBondContact O-CG 3.42Å; V1335-Q1339 PolarHBondContact O-N 2.89Å
1336	Y	54.6	Low	54.6	Low	53 Å²	53	37 Å²	37	21%	0.208	17%	0.172	C	C	.	.	H	α-helix	trans	-60.6	-45.1	175.9	-179.5	-79.4	0	0	0	112.3	R1311 Q1332 F1333 N1334 Q1339 L1340 I1494 L1497	R1311-Y1336 PolarHBondContact NH2-OH 3.4Å; Q1332-Y1336 WeakPolarHBondContact O-CB 3.43Å; Q1332-Y1336 PolarHBondContact O-N 3.16Å; F1333-Y1336 WeakPolarHBondContact O-CB 3.31Å; F1333-Y1336 PolarHBondContact O-N 3.49Å; N1334-Y1336 VanDerWaalsContact C-N 3.35Å; Y1336-Q1339 WeakPolarHBondContact O-CB 3.33Å; Y1336-Q1339 PolarHBondContact O-N 3.44Å; Y1336-L1340 PolarHBondContact O-N 3.16Å; Y1336-I1494 HydrophobicContact CD1-CD1 4.15Å; Y1336-I1494 HydrophobicContact CD2-CD1 3.85Å; Y1336-I1494 HydrophobicContact CD2-CG1 4.03Å; Y1336-I1494 HydrophobicContact CE1-CD1 4.06Å; Y1336-I1494 HydrophobicContact CE1-CG1 3.97Å; Y1336-I1494 HydrophobicContact CE2-CD1 3.78Å; Y1336-I1494 HydrophobicContact CE2-CG1 3.42Å; Y1336-I1494 VanDerWaalsContact CE2-CG1 3.42Å; Y1336-I1494 HydrophobicContact CG-CD1 4.04Å; Y1336-L1497 WeakPolarHBondContact OH-CD1 3.35Å
1337	F	62.4	Low	55.6	Low	4 Å²	4	36 Å²	36	2%	0.018	17%	0.167	C	C	.	.	H	α-helix	trans	-68.6	-39	177.8	-171.2	-109.6	0	0	0	112.2	F1217 L1256 F1259 F1280 F1333 N1334 Q1339 L1340 L1341	F1217-F1337 AromaticContact CD2-CD1 3.61Å; F1217-F1337 HydrophobicContact CD2-CD1 3.61Å; F1217-F1337 HydrophobicContact CD2-CD2 4.22Å; F1217-F1337 AromaticContact CD2-CE1 3.7Å; F1217-F1337 HydrophobicContact CD2-CE1 3.7Å; F1217-F1337 HydrophobicContact CD2-CE2 4.31Å; F1217-F1337 AromaticContact CD2-CG 3.88Å; F1217-F1337 HydrophobicContact CD2-CG 3.88Å; F1217-F1337 HydrophobicContact CD2-CZ 4.07Å; F1217-F1337 HydrophobicContact CE2-CD1 4Å; F1217-F1337 AromaticContact CE2-CD2 3.93Å; F1217-F1337 HydrophobicContact CE2-CD2 3.93Å; F1217-F1337 AromaticContact CE2-CE1 3.77Å; F1217-F1337 HydrophobicContact CE2-CE1 3.77Å; F1217-F1337 AromaticContact CE2-CE2 3.71Å; F1217-F1337 HydrophobicContact CE2-CE2 3.71Å; F1217-F1337 HydrophobicContact CE2-CG 4.08Å; F1217-F1337 AromaticContact CE2-CZ 3.64Å; F1217-F1337 HydrophobicContact CE2-CZ 3.64Å; L1256-F1337 HydrophobicContact CD2-CE1 4.28Å; L1256-F1337 HydrophobicContact CD2-CZ 3.92Å; F1259-F1337 HydrophobicContact CD1-CD1 4.18Å; F1259-F1337 AromaticContact CD1-CE1 3.89Å; F1259-F1337 HydrophobicContact CD1-CE1 3.89Å; F1259-F1337 AromaticContact CE1-CD1 3.54Å; F1259-F1337 HydrophobicContact CE1-CD1 3.54Å; F1259-F1337 AromaticContact CE1-CE1 3.74Å; F1259-F1337 HydrophobicContact CE1-CE1 3.74Å; F1259-F1337 AromaticContact CZ-CD1 3.84Å; F1259-F1337 HydrophobicContact CZ-CD1 3.84Å; F1259-F1337 HydrophobicContact CZ-CE1 4.32Å; F1280-F1337 HydrophobicContact CE1-CE2 4.43Å; F1280-F1337 HydrophobicContact CE1-CZ 4.49Å; F1280-F1337 HydrophobicContact CE2-CE2 4.11Å; F1280-F1337 AromaticContact CZ-CE2 3.78Å; F1280-F1337 HydrophobicContact CZ-CE2 3.78Å; F1280-F1337 HydrophobicContact CZ-CZ 4.27Å; F1333-F1337 HydrophobicContact CE1-CB 4.24Å; F1333-F1337 PolarHBondContact O-N 2.96Å; N1334-F1337 PolarHBondContact O-N 3.03Å; F1337-Q1339 VanDerWaalsContact C-N 3.32Å; F1337-Q1339 PolarHBondContact O-N 2.87Å; F1337-L1340 HydrophobicContact CD2-CD2 4.42Å; F1337-L1340 PolarHBondContact O-N 3.37Å; F1337-L1341 HydrophobicContact CD1-CD1 4.15Å; F1337-L1341 HydrophobicContact CE1-CD1 3.62Å; F1337-L1341 HydrophobicContact CE1-CG 4.24Å; F1337-L1341 HydrophobicContact CZ-CD1 4Å; F1337-L1341 HydrophobicContact CZ-CD2 4.42Å; F1337-L1341 HydrophobicContact CZ-CG 4.25Å; F1337-L1341 PolarHBondContact O-N 3.07Å; F1337-L1341 VanDerWaalsContact O-N 3.09Å
1338	I	60.9	Low	56.7	Low	19 Å²	19	30.4 Å²	30.4	10%	0.097	15%	0.148	C	C	.	.	H	α-helix	trans	-64.3	-37.2	172.3	-68.9	165.4	0	0	0	111	F1259 D1263 V1264 N1334 V1335 S1342	F1259-I1338 HydrophobicContact CE1-CG1 3.92Å; F1259-I1338 HydrophobicContact CZ-CD1 4.33Å; F1259-I1338 HydrophobicContact CZ-CG1 3.85Å; D1263-I1338 HydrophobicContact CB-CD1 4.01Å; D1263-I1338 HydrophobicContact CB-CG1 4.31Å; V1264-I1338 HydrophobicContact CG2-CG2 4.48Å; N1334-I1338 WeakPolarHBondContact O-CB 3.18Å; N1334-I1338 WeakPolarHBondContact O-CD1 3.1Å; N1334-I1338 WeakPolarHBondContact O-CG1 3.48Å; N1334-I1338 PolarHBondContact O-N 3.27Å; V1335-I1338 PolarHBondContact O-N 3.1Å; I1338-S1342 VanDerWaalsContact O-CB 3.27Å; I1338-S1342 WeakPolarHBondContact O-CB 3.49Å; I1338-S1342 PolarHBondContact O-N 3.07Å; I1338-S1342 PolarHBondContact O-OG 3.33Å
1339	Q	56.1	Low	57.5	Low	48 Å²	48	30.4 Å²	30.4	22%	0.224	14%	0.144	C	C	.	.	H	α-helix	trans	-63.9	-44.3	173.9	-77.4	166.2	-14.1	0	0	111.6	V1335 Y1336 F1337 S1342 Y1343 I1494	V1335-Q1339 HydrophobicContact CG1-CG 4.44Å; V1335-Q1339 WeakPolarHBondContact O-CB 3.47Å; V1335-Q1339 VanDerWaalsContact O-CG 3.23Å; V1335-Q1339 WeakPolarHBondContact O-CG 3.42Å; V1335-Q1339 PolarHBondContact O-N 2.89Å; Y1336-Q1339 WeakPolarHBondContact O-CB 3.33Å; Y1336-Q1339 PolarHBondContact O-N 3.44Å; F1337-Q1339 VanDerWaalsContact C-N 3.32Å; F1337-Q1339 PolarHBondContact O-N 2.87Å; Q1339-S1342 PolarHBondContact O-N 3.16Å; Q1339-Y1343 WeakPolarHBondContact O-CB 3.47Å; Q1339-Y1343 PolarHBondContact O-N 3.29Å; Q1339-I1494 HydrophobicContact CB-CD1 4.31Å
1340	L	59.1	Low	58.4	Low	9 Å²	9	27.8 Å²	27.8	5%	0.047	13%	0.132	C	C	.	.	H	α-helix	trans	-58	-51.8	176	178.7	65.6	0	0	0	111.7	F1280 Y1336 F1337 S1342 Y1343 L1344 I1494 M1498	F1280-L1340 HydrophobicContact CD2-CD2 4.18Å; F1280-L1340 HydrophobicContact CE2-CD2 3.75Å; Y1336-L1340 PolarHBondContact O-N 3.16Å; F1337-L1340 HydrophobicContact CD2-CD2 4.42Å; F1337-L1340 PolarHBondContact O-N 3.37Å; L1340-S1342 VanDerWaalsContact C-N 3.31Å; L1340-S1342 PolarHBondContact O-N 3.16Å; L1340-Y1343 WeakPolarHBondContact O-CB 3.4Å; L1340-Y1343 PolarHBondContact O-N 3.49Å; L1340-L1344 PolarHBondContact O-N 3.33Å; L1340-I1494 HydrophobicContact CB-CD1 4.38Å; L1340-I1494 HydrophobicContact CD1-CG2 3.62Å; L1340-M1498 HydrophobicContact CD1-CB 4.26Å; L1340-M1498 HydrophobicContact CD1-CG 4.17Å
1341	L	64.1	Low	59.4	Low	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64	-35.1	177.6	-66.2	179	0	0	0	112.5	F1259 Y1260 V1264 V1276 I1277 F1337 Y1343 A1345	F1259-L1341 HydrophobicContact CD1-CD1 3.82Å; F1259-L1341 HydrophobicContact CE1-CD1 3.98Å; Y1260-L1341 HydrophobicContact CD2-CB 4.38Å; V1264-L1341 HydrophobicContact CG2-CB 3.96Å; V1264-L1341 HydrophobicContact CG2-CD1 4.1Å; V1276-L1341 HydrophobicContact CG1-CD2 4.06Å; I1277-L1341 HydrophobicContact CD1-CD2 3.9Å; F1337-L1341 HydrophobicContact CD1-CD1 4.15Å; F1337-L1341 HydrophobicContact CE1-CD1 3.62Å; F1337-L1341 HydrophobicContact CE1-CG 4.24Å; F1337-L1341 HydrophobicContact CZ-CD1 4Å; F1337-L1341 HydrophobicContact CZ-CD2 4.42Å; F1337-L1341 HydrophobicContact CZ-CG 4.25Å; F1337-L1341 PolarHBondContact O-N 3.07Å; F1337-L1341 VanDerWaalsContact O-N 3.09Å; L1341-Y1343 VanDerWaalsContact C-N 3.35Å; L1341-A1345 WeakPolarHBondContact O-CB 3.48Å; L1341-A1345 PolarHBondContact O-N 3.35Å
1342	S	58.8	Low	60.2	Low	8 Å²	8	28.6 Å²	28.6	6%	0.056	13%	0.131	C	C	.	.	H	α-helix	trans	-66.8	-35.1	174.9	-59.7	0	0	0	0	112.4	W1268 I1338 Q1339 L1340 G1346	W1268-S1342 PolarHBondContact NE1-O 3.29Å; I1338-S1342 VanDerWaalsContact O-CB 3.27Å; I1338-S1342 WeakPolarHBondContact O-CB 3.49Å; I1338-S1342 PolarHBondContact O-N 3.07Å; I1338-S1342 PolarHBondContact O-OG 3.33Å; Q1339-S1342 PolarHBondContact O-N 3.16Å; L1340-S1342 VanDerWaalsContact C-N 3.31Å; L1340-S1342 PolarHBondContact O-N 3.16Å; S1342-G1346 PolarHBondContact O-N 2.73Å
1343	Y	58.7	Low	61	Low	19 Å²	19	25.2 Å²	25.2	8%	0.075	12%	0.115	C	C	.	.	H	α-helix	trans	-68.7	-45.5	175.9	166.6	-101.9	0	0	0	111.6	Q1339 L1340 L1341 A1345 G1346 Q1347 A1408 F1495	Q1339-Y1343 WeakPolarHBondContact O-CB 3.47Å; Q1339-Y1343 PolarHBondContact O-N 3.29Å; L1340-Y1343 WeakPolarHBondContact O-CB 3.4Å; L1340-Y1343 PolarHBondContact O-N 3.49Å; L1341-Y1343 VanDerWaalsContact C-N 3.35Å; Y1343-A1345 PolarHBondContact O-N 2.67Å; Y1343-G1346 PolarHBondContact O-N 3.12Å; Y1343-Q1347 PolarHBondContact O-N 2.98Å; Y1343-Q1347 PolarHBondContact OH-NE2 3.06Å; Y1343-A1408 HydrophobicContact CD2-CB 3.99Å; Y1343-A1408 HydrophobicContact CE2-CB 4.26Å; Y1343-F1495 HydrophobicContact CD2-CD1 4.14Å; Y1343-F1495 AromaticContact CD2-CE1 3.56Å; Y1343-F1495 HydrophobicContact CD2-CE1 3.56Å; Y1343-F1495 AromaticContact CE2-CD1 3.54Å; Y1343-F1495 HydrophobicContact CE2-CD1 3.54Å; Y1343-F1495 AromaticContact CE2-CE1 3.44Å; Y1343-F1495 HydrophobicContact CE2-CE1 3.44Å; Y1343-F1495 VanDerWaalsContact CE2-CE1 3.44Å; Y1343-F1495 HydrophobicContact CG-CE1 4.33Å; Y1343-F1495 AromaticContact CZ-CD1 3.86Å
1344	L	60.7	Low	61.7	Low	6 Å²	6	24 Å²	24	3%	0.031	11%	0.11	C	C	.	.	H	α-helix	trans	-62.3	-40.7	175	-67.8	-179.8	0	0	0	111.9	V1276 F1280 L1340 G1346 Q1347 L1348	V1276-L1344 HydrophobicContact CG1-CB 3.92Å; F1280-L1344 HydrophobicContact CB-CD1 3.87Å; F1280-L1344 HydrophobicContact CD2-CD1 4.21Å; L1340-L1344 PolarHBondContact O-N 3.33Å; L1344-G1346 VanDerWaalsContact C-N 3.34Å; L1344-G1346 PolarHBondContact O-N 3.37Å; L1344-Q1347 PolarHBondContact O-N 3.08Å; L1344-L1348 PolarHBondContact O-N 2.93Å
1345	A	63.5	Low	62.2	Low	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.1	-43.3	172.1	0	0	0	0	0	112.3	Y1260 W1268 V1276 L1341 Y1343 Y1349	Y1260-A1345 HydrophobicContact CE2-CB 4.31Å; W1268-A1345 HydrophobicContact CB-CB 4.05Å; W1268-A1345 HydrophobicContact CD2-CB 3.78Å; W1268-A1345 HydrophobicContact CE3-CB 4.33Å; W1268-A1345 HydrophobicContact CG-CB 3.61Å; V1276-A1345 VanDerWaalsContact CG2-CA 3.46Å; V1276-A1345 HydrophobicContact CG2-CB 3.78Å; L1341-A1345 WeakPolarHBondContact O-CB 3.48Å; L1341-A1345 PolarHBondContact O-N 3.35Å; Y1343-A1345 PolarHBondContact O-N 2.67Å; A1345-Y1349 WeakPolarHBondContact O-CB 3.39Å; A1345-Y1349 PolarHBondContact O-N 2.74Å
1346	G	60.4	Low	62.9	Low	1 Å²	1	28.7 Å²	28.7	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-63.7	-39.3	174.4	0	0	0	0	0	113.6	W1268 S1342 Y1343 L1344 I1350	W1268-G1346 VanDerWaalsContact CH2-CA 3.46Å; S1342-G1346 PolarHBondContact O-N 2.73Å; Y1343-G1346 PolarHBondContact O-N 3.12Å; L1344-G1346 VanDerWaalsContact C-N 3.34Å; L1344-G1346 PolarHBondContact O-N 3.37Å; G1346-I1350 WeakPolarHBondContact O-CD1 3.38Å; G1346-I1350 VanDerWaalsContact O-CG1 3.29Å; G1346-I1350 WeakPolarHBondContact O-CG1 3.37Å; G1346-I1350 PolarHBondContact O-N 3.02Å
1347	Q	62.7	Low	63.5	Low	8 Å²	8	30.9 Å²	30.9	4%	0.037	16%	0.158	C	C	.	.	H	α-helix	trans	-63.5	-52.2	174.9	-71.5	-162.1	22.6	0	0	111.5	Y1343 L1344 Y1349 I1350 Q1351 A1408 S1412	Y1343-Q1347 PolarHBondContact O-N 2.98Å; Y1343-Q1347 PolarHBondContact OH-NE2 3.06Å; L1344-Q1347 PolarHBondContact O-N 3.08Å; Q1347-Y1349 VanDerWaalsContact C-N 3.3Å; Q1347-Y1349 PolarHBondContact O-N 3.39Å; Q1347-I1350 PolarHBondContact O-N 3.42Å; Q1347-Q1351 WeakPolarHBondContact O-CG 3.32Å; Q1347-Q1351 PolarHBondContact O-N 3.38Å; Q1347-A1408 HydrophobicContact CG-CB 3.82Å; Q1347-S1412 VanDerWaalsContact CD-CB 3.41Å; Q1347-S1412 VanDerWaalsContact CD-OG 3.25Å; Q1347-S1412 PolarHBondContact OE1-OG 3.48Å
1348	L	64.8	Low	63.7	Low	33 Å²	33	36.4 Å²	36.4	17%	0.173	18%	0.18	C	C	.	.	H	α-helix	trans	-64.1	-35.1	-177.5	-74.3	167.3	0	0	0	112.1	G1275 V1276 H1279 L1344 I1350 Q1351 W1352	G1275-L1348 WeakPolarHBondContact O-CD1 3.35Å; V1276-L1348 VanDerWaalsContact CA-CD1 3.47Å; V1276-L1348 HydrophobicContact CB-CD1 4.22Å; V1276-L1348 HydrophobicContact CG2-CD1 3.72Å; V1276-L1348 VanDerWaalsContact N-CD1 3.3Å; H1279-L1348 HydrophobicContact CB-CD1 4.39Å; L1344-L1348 PolarHBondContact O-N 2.93Å; L1348-I1350 VanDerWaalsContact C-N 3.33Å; L1348-I1350 PolarHBondContact O-N 3.08Å; L1348-Q1351 PolarHBondContact O-N 2.86Å; L1348-W1352 WeakPolarHBondContact O-CB 3.44Å; L1348-W1352 PolarHBondContact O-N 3.4Å
1349	Y	64.1	Low	64.2	Low	52 Å²	52	35.9 Å²	35.9	20%	0.204	18%	0.178	C	C	.	.	H	α-helix	trans	-57.7	-45.2	170.6	-177	-111.5	0	0	0	112	W1268 M1272 A1345 Q1347 N1353 T1405	W1268-Y1349 HydrophobicContact CZ3-CD1 4.39Å; W1268-Y1349 HydrophobicContact CZ3-CG 4.28Å; M1272-Y1349 HydrophobicContact CE-CD2 3.68Å; M1272-Y1349 HydrophobicContact CE-CG 4.14Å; M1272-Y1349 VanDerWaalsContact SD-CA 3.56Å; M1272-Y1349 HydrophobicContact SD-CD2 3.9Å; M1272-Y1349 HydrophobicContact SD-CG 4.25Å; A1345-Y1349 WeakPolarHBondContact O-CB 3.39Å; A1345-Y1349 PolarHBondContact O-N 2.74Å; Q1347-Y1349 VanDerWaalsContact C-N 3.3Å; Q1347-Y1349 PolarHBondContact O-N 3.39Å; Y1349-N1353 WeakPolarHBondContact CD2-ND2 3.26Å; Y1349-N1353 WeakPolarHBondContact CE1-ND2 3.3Å; Y1349-N1353 WeakPolarHBondContact CE2-ND2 3.49Å; Y1349-N1353 WeakPolarHBondContact O-CB 3.46Å; Y1349-N1353 PolarHBondContact O-N 3.28Å; Y1349-N1353 VanDerWaalsContact O-N 3.07Å; Y1349-N1353 PolarHBondContact O-ND2 3.04Å; Y1349-T1405 HydrophobicContact CD1-CG2 4.11Å
1350	I	62.5	Low	64.9	Low	4 Å²	4	34.4 Å²	34.4	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-67.7	-46.9	178.8	-62.9	165.1	0	0	0	110.4	G1346 Q1347 L1348 W1352 N1353 L1354 T1362 L1366 T1405 A1408 A1409 T1415	G1346-I1350 WeakPolarHBondContact O-CD1 3.38Å; G1346-I1350 VanDerWaalsContact O-CG1 3.29Å; G1346-I1350 WeakPolarHBondContact O-CG1 3.37Å; G1346-I1350 PolarHBondContact O-N 3.02Å; Q1347-I1350 PolarHBondContact O-N 3.42Å; L1348-I1350 VanDerWaalsContact C-N 3.33Å; L1348-I1350 PolarHBondContact O-N 3.08Å; I1350-W1352 PolarHBondContact O-N 3.3Å; I1350-N1353 PolarHBondContact O-N 3.09Å; I1350-L1354 HydrophobicContact CG2-CD1 3.95Å; I1350-L1354 HydrophobicContact CG2-CG 4.37Å; I1350-L1354 VanDerWaalsContact O-CG 3.31Å; I1350-L1354 WeakPolarHBondContact O-CG 3.3Å; I1350-L1354 PolarHBondContact O-N 3.41Å; I1350-T1362 HydrophobicContact CG2-CG2 4.26Å; I1350-L1366 HydrophobicContact CG2-CD2 4.37Å; I1350-T1405 WeakPolarHBondContact CD1-O 3.4Å; I1350-A1408 HydrophobicContact CD1-CB 4.47Å; I1350-A1409 HydrophobicContact CD1-CB 4.05Å; I1350-T1415 HydrophobicContact CG2-CG2 3.75Å
1351	Q	65.8	Low	65.4	Low	13 Å²	13	36.9 Å²	36.9	6%	0.061	18%	0.182	C	C	.	.	H	α-helix	trans	-59.3	-47	179	-66.7	-177.9	23.1	0	0	111.4	Q1347 L1348 N1353 L1354 E1355 R1418	Q1347-Q1351 WeakPolarHBondContact O-CG 3.32Å; Q1347-Q1351 PolarHBondContact O-N 3.38Å; L1348-Q1351 PolarHBondContact O-N 2.86Å; Q1351-N1353 VanDerWaalsContact C-N 3.35Å; Q1351-N1353 PolarHBondContact O-N 2.88Å; Q1351-L1354 WeakPolarHBondContact O-CB 3.33Å; Q1351-L1354 PolarHBondContact O-N 3.41Å; Q1351-E1355 PolarHBondContact O-N 3.17Å; Q1351-R1418 HydrophobicContact CG-CG 4.24Å
1352	W	67.3	Low	65.7	Low	133 Å²	133	37.5 Å²	37.5	50%	0.504	19%	0.185	S	C	.	.	H	α-helix	trans	-60.3	-41.2	176.5	-176.9	84.8	0	0	0	112.3	L1348 I1350 L1354 E1355 N1356	L1348-W1352 WeakPolarHBondContact O-CB 3.44Å; L1348-W1352 PolarHBondContact O-N 3.4Å; I1350-W1352 PolarHBondContact O-N 3.3Å; W1352-L1354 VanDerWaalsContact C-N 3.3Å; W1352-L1354 PolarHBondContact O-N 3.02Å; W1352-E1355 PolarHBondContact O-N 3.36Å; W1352-N1356 PolarHBondContact NE1-ND2 3.43Å; W1352-N1356 PolarHBondContact O-N 3.01Å; W1352-N1356 PolarHBondContact O-ND2 2.85Å
1353	N	68.2	Low	66.2	Low	13 Å²	13	37.3 Å²	37.3	7%	0.07	18%	0.184	C	C	.	.	H	α-helix	trans	-72	-21.4	175.7	-73.7	-63	0	0	0	113.7	Y1349 I1350 Q1351 Y1358 S1359 T1362	Y1349-N1353 WeakPolarHBondContact CD2-ND2 3.26Å; Y1349-N1353 WeakPolarHBondContact CE1-ND2 3.3Å; Y1349-N1353 WeakPolarHBondContact CE2-ND2 3.49Å; Y1349-N1353 WeakPolarHBondContact O-CB 3.46Å; Y1349-N1353 PolarHBondContact O-N 3.28Å; Y1349-N1353 VanDerWaalsContact O-N 3.07Å; Y1349-N1353 PolarHBondContact O-ND2 3.04Å; I1350-N1353 PolarHBondContact O-N 3.09Å; Q1351-N1353 VanDerWaalsContact C-N 3.35Å; Q1351-N1353 PolarHBondContact O-N 2.88Å; N1353-Y1358 CarbonylContact O-C 3.52Å; N1353-Y1358 VanDerWaalsContact O-C 3.3Å; N1353-S1359 VanDerWaalsContact O-CA 3.28Å; N1353-S1359 WeakPolarHBondContact O-CA 3.28Å; N1353-S1359 PolarHBondContact O-N 3.36Å; N1353-T1362 HydrophobicContact CB-CG2 4.11Å; N1353-T1362 WeakPolarHBondContact CB-OG1 3.46Å
1354	L	68.5	Low	66.5	Low	3 Å²	3	38.7 Å²	38.7	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-79.6	-26.1	172.9	-71.8	172	0	0	0	113.1	I1350 Q1351 W1352 S1359 T1362 L1363 L1366 T1415 R1418 V1419 L1422	I1350-L1354 HydrophobicContact CG2-CD1 3.95Å; I1350-L1354 HydrophobicContact CG2-CG 4.37Å; I1350-L1354 VanDerWaalsContact O-CG 3.31Å; I1350-L1354 WeakPolarHBondContact O-CG 3.3Å; I1350-L1354 PolarHBondContact O-N 3.41Å; Q1351-L1354 WeakPolarHBondContact O-CB 3.33Å; Q1351-L1354 PolarHBondContact O-N 3.41Å; W1352-L1354 VanDerWaalsContact C-N 3.3Å; W1352-L1354 PolarHBondContact O-N 3.02Å; L1354-S1359 VanDerWaalsContact O-CB 3.25Å; L1354-S1359 WeakPolarHBondContact O-CB 3.5Å; L1354-T1362 HydrophobicContact CD2-CG2 3.91Å; L1354-T1362 HydrophobicContact CG-CG2 4.04Å; L1354-L1363 HydrophobicContact CD2-CD2 3.8Å; L1354-L1363 HydrophobicContact CD2-CG 3.89Å; L1354-L1366 HydrophobicContact CD2-CD1 4.33Å; L1354-T1415 HydrophobicContact CD1-CG2 4.33Å; L1354-R1418 HydrophobicContact CD1-CB 4.39Å; L1354-V1419 HydrophobicContact CD1-CG2 3.92Å; L1354-L1422 HydrophobicContact CB-CD1 4.3Å; L1354-L1422 HydrophobicContact CD2-CD1 3.88Å
1355	E	69.1	Low	66.6	Low	114 Å²	114	39.3 Å²	39.3	53%	0.533	20%	0.2	S	C	.	.	H	α-helix	trans	-81.8	-22	174.4	-69.3	-175.2	148	0	0	113.2	Q1351 W1352 R1418	Q1351-E1355 PolarHBondContact O-N 3.17Å; W1352-E1355 PolarHBondContact O-N 3.36Å; E1355-R1418 IonicContact OE1-CZ 3.92Å; E1355-R1418 IonicContact OE1-NH1 3.21Å; E1355-R1418 PolarHBondContact OE1-NH1 2.92Å; E1355-R1418 IonicContact OE1-NH2 3.12Å; E1355-R1418 PolarHBondContact OE1-NH2 3.31Å
1356	N	69.1	Low	66.6	Low	63 Å²	63	39.6 Å²	39.6	34%	0.337	20%	0.201	S	C	.	.	S	Bend	trans	-97	179.2	-175.2	-78.1	-65.9	0	0	0	113.9	W1352 Y1358 S1359	W1352-N1356 PolarHBondContact NE1-ND2 3.43Å; W1352-N1356 PolarHBondContact O-N 3.01Å; W1352-N1356 PolarHBondContact O-ND2 2.85Å; N1356-Y1358 HydrophobicContact CB-CD2 4.49Å; N1356-Y1358 PolarHBondContact O-N 3.49Å; N1356-S1359 VanDerWaalsContact O-CB 3.29Å; N1356-S1359 WeakPolarHBondContact O-CB 3.44Å; N1356-S1359 PolarHBondContact O-N 3.19Å; N1356-S1359 PolarHBondContact O-OG 3.35Å; N1356-S1359 VanDerWaalsContact O-OG 3.07Å
1357	A	67	Low	66.3	Low	98 Å²	98	40.8 Å²	40.8	81%	0.81	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-16	176.2	0	0	0	0	0	114.6	S1359	A1357-S1359 VanDerWaalsContact C-N 3.3Å
1358	Y	65.2	Low	65.5	Low	121 Å²	121	47 Å²	47	48%	0.475	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	3.1	175.9	-54.6	-64.1	0	0	0	114.2	N1353 N1356 S1360 R1361 T1362	N1353-Y1358 CarbonylContact O-C 3.52Å; N1353-Y1358 VanDerWaalsContact O-C 3.3Å; N1356-Y1358 HydrophobicContact CB-CD2 4.49Å; N1356-Y1358 PolarHBondContact O-N 3.49Å; Y1358-S1360 PolarHBondContact O-N 2.98Å; Y1358-R1361 WeakPolarHBondContact O-CB 3.39Å; Y1358-R1361 PolarHBondContact O-N 3.34Å; Y1358-R1361 VanDerWaalsContact O-N 3.11Å; Y1358-T1362 WeakPolarHBondContact O-CB 3.4Å; Y1358-T1362 PolarHBondContact O-N 3.37Å; Y1358-T1362 PolarHBondContact O-OG1 2.91Å
1359	S	73	Confident	64.4	Low	8 Å²	8	48 Å²	48	6%	0.056	24%	0.236	C	C	.	.	H	α-helix	trans	-56.1	-49	-177.2	51	0	0	0	0	113.3	N1353 L1354 N1356 A1357 R1361 T1362 L1363 I1430	N1353-S1359 VanDerWaalsContact O-CA 3.28Å; N1353-S1359 WeakPolarHBondContact O-CA 3.28Å; N1353-S1359 PolarHBondContact O-N 3.36Å; L1354-S1359 VanDerWaalsContact O-CB 3.25Å; L1354-S1359 WeakPolarHBondContact O-CB 3.5Å; N1356-S1359 VanDerWaalsContact O-CB 3.29Å; N1356-S1359 WeakPolarHBondContact O-CB 3.44Å; N1356-S1359 PolarHBondContact O-N 3.19Å; N1356-S1359 PolarHBondContact O-OG 3.35Å; N1356-S1359 VanDerWaalsContact O-OG 3.07Å; A1357-S1359 VanDerWaalsContact C-N 3.3Å; S1359-R1361 VanDerWaalsContact C-N 3.26Å; S1359-R1361 PolarHBondContact O-N 3.49Å; S1359-T1362 PolarHBondContact O-N 2.9Å; S1359-L1363 WeakPolarHBondContact O-CB 3.3Å; S1359-L1363 WeakPolarHBondContact O-CG 3.15Å; S1359-L1363 PolarHBondContact O-N 3.29Å; S1359-I1430 WeakPolarHBondContact OG-CD1 3.47Å
1360	S	69.5	Low	63.1	Low	16 Å²	16	47 Å²	47	11%	0.112	24%	0.235	C	C	.	.	H	α-helix	trans	-57.5	-37.5	176	-176.7	0	0	0	0	112.8	Y1358 S1364 E1429 K1433	Y1358-S1360 PolarHBondContact O-N 2.98Å; S1360-S1364 PolarHBondContact O-N 2.64Å; S1360-E1429 VanDerWaalsContact OG-CD 3.31Å; S1360-E1429 PolarHBondContact OG-OE2 3.5Å; S1360-K1433 WeakPolarHBondContact O-CD 3.45Å; S1360-K1433 PolarHBondContact O-NZ 3.12Å; S1360-K1433 PolarHBondContact OG-NZ 3.34Å
1361	R	70.5	Confident	61.4	Low	62 Å²	62	55.1 Å²	55.1	23%	0.234	27%	0.266	C	S	.	.	H	α-helix	trans	-72.5	-44.9	176.3	-180	-175.5	168.7	-171	7.3	111.4	D28 Y1358 S1359 L1363 S1364 T1365	D28-R1361 VanDerWaalsContact CG-NH1 3.33Å; D28-R1361 IonicContact OD1-CZ 3.95Å; D28-R1361 IonicContact OD1-NE 3.3Å; D28-R1361 PolarHBondContact OD1-NE 2.74Å; D28-R1361 VanDerWaalsContact OD1-NE 3.16Å; D28-R1361 IonicContact OD1-NH1 3.98Å; D28-R1361 PolarHBondContact OD1-NH1 2.96Å; D28-R1361 IonicContact OD1-NH2 2.75Å; D28-R1361 PolarHBondContact OD1-NH2 3.05Å; D28-R1361 IonicContact OD2-CZ 3.93Å; D28-R1361 IonicContact OD2-NH1 3.51Å; D28-R1361 PolarHBondContact OD2-NH1 2.88Å; D28-R1361 IonicContact OD2-NH2 3.9Å; D28-R1361 PolarHBondContact OD2-NH2 2.84Å; Y1358-R1361 WeakPolarHBondContact O-CB 3.39Å; Y1358-R1361 PolarHBondContact O-N 3.34Å; Y1358-R1361 VanDerWaalsContact O-N 3.11Å; S1359-R1361 VanDerWaalsContact C-N 3.26Å; S1359-R1361 PolarHBondContact O-N 3.49Å; R1361-L1363 PolarHBondContact O-N 3Å; R1361-S1364 CarbonylContact O-C 3.54Å; R1361-S1364 WeakPolarHBondContact O-CA 3.28Å; R1361-S1364 WeakPolarHBondContact O-CB 3.4Å; R1361-S1364 PolarHBondContact O-N 2.91Å; R1361-S1364 PolarHBondContact O-OG 3.49Å; R1361-T1365 PolarHBondContact O-N 2.88Å; R1361-T1365 PolarHBondContact O-OG1 3.3Å
1362	T	69.8	Low	59.8	Low	13 Å²	13	56.6 Å²	56.6	8%	0.08	28%	0.281	C	S	.	.	H	α-helix	trans	-65	-40.2	-178.8	-54.5	0	0	0	0	111.9	I1350 N1353 L1354 Y1358 S1359 S1364 T1365 L1366	I1350-T1362 HydrophobicContact CG2-CG2 4.26Å; N1353-T1362 HydrophobicContact CB-CG2 4.11Å; N1353-T1362 WeakPolarHBondContact CB-OG1 3.46Å; L1354-T1362 HydrophobicContact CD2-CG2 3.91Å; L1354-T1362 HydrophobicContact CG-CG2 4.04Å; Y1358-T1362 WeakPolarHBondContact O-CB 3.4Å; Y1358-T1362 PolarHBondContact O-N 3.37Å; Y1358-T1362 PolarHBondContact O-OG1 2.91Å; S1359-T1362 PolarHBondContact O-N 2.9Å; T1362-S1364 PolarHBondContact O-N 2.89Å; T1362-T1365 PolarHBondContact O-N 3.11Å; T1362-T1365 PolarHBondContact O-OG1 3.15Å; T1362-T1365 VanDerWaalsContact O-OG1 3.1Å; T1362-L1366 HydrophobicContact CG2-CD1 4.37Å; T1362-L1366 WeakPolarHBondContact O-CG 3.1Å; T1362-L1366 PolarHBondContact O-N 3.49Å
1363	L	69.3	Low	58	Low	4 Å²	4	51.1 Å²	51.1	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-60.5	-32	170.2	-71.2	174.2	0	0	0	112.6	L1354 S1359 R1361 L1366 P1367 V1419 L1422 I1430 K1433 A1434 L1437	L1354-L1363 HydrophobicContact CD2-CD2 3.8Å; L1354-L1363 HydrophobicContact CD2-CG 3.89Å; S1359-L1363 WeakPolarHBondContact O-CB 3.3Å; S1359-L1363 WeakPolarHBondContact O-CG 3.15Å; S1359-L1363 PolarHBondContact O-N 3.29Å; R1361-L1363 PolarHBondContact O-N 3Å; L1363-L1366 HydrophobicContact CD2-CD1 4.44Å; L1363-P1367 WeakPolarHBondContact O-CD 3.37Å; L1363-V1419 HydrophobicContact CD2-CG1 4.2Å; L1363-V1419 HydrophobicContact CD2-CG2 4.1Å; L1363-L1422 HydrophobicContact CD1-CD1 3.96Å; L1363-L1422 HydrophobicContact CD2-CD1 4.3Å; L1363-L1422 HydrophobicContact CG-CD1 4.29Å; L1363-I1430 HydrophobicContact CD1-CG2 3.89Å; L1363-K1433 HydrophobicContact CB-CB 4Å; L1363-K1433 HydrophobicContact CD1-CB 4.04Å; L1363-A1434 HydrophobicContact CD1-CB 4.13Å; L1363-A1434 HydrophobicContact CD2-CB 4.48Å; L1363-L1437 HydrophobicContact CD2-CD2 3.73Å
1364	S	66.2	Low	56.3	Low	47 Å²	47	53.1 Å²	53.1	33%	0.329	27%	0.27	S	S	.	.	H	α-helix	trans	-78.3	-27.1	176.9	80.7	0	0	0	0	113.8	S1360 R1361 T1362 P1367 Y1368	S1360-S1364 PolarHBondContact O-N 2.64Å; R1361-S1364 CarbonylContact O-C 3.54Å; R1361-S1364 WeakPolarHBondContact O-CA 3.28Å; R1361-S1364 WeakPolarHBondContact O-CB 3.4Å; R1361-S1364 PolarHBondContact O-N 2.91Å; R1361-S1364 PolarHBondContact O-OG 3.49Å; T1362-S1364 PolarHBondContact O-N 2.89Å; S1364-P1367 WeakPolarHBondContact O-CD 3.43Å; S1364-Y1368 WeakPolarHBondContact O-CD2 3.16Å; S1364-Y1368 WeakPolarHBondContact O-CE2 3.2Å
1365	T	62.7	Low	54.5	Low	20 Å²	20	55.4 Å²	55.4	12%	0.123	29%	0.285	C	S	.	.	H	α-helix	trans	-86.7	-28.4	178.4	54.8	0	0	0	0	113.3	R1361 T1362 P1367 Y1368 F1369	R1361-T1365 PolarHBondContact O-N 2.88Å; R1361-T1365 PolarHBondContact O-OG1 3.3Å; T1362-T1365 PolarHBondContact O-N 3.11Å; T1362-T1365 PolarHBondContact O-OG1 3.15Å; T1362-T1365 VanDerWaalsContact O-OG1 3.1Å; T1365-P1367 VanDerWaalsContact C-N 3.32Å; T1365-Y1368 PolarHBondContact O-N 3.12Å; T1365-F1369 WeakPolarHBondContact O-CD2 3.32Å; T1365-F1369 PolarHBondContact O-N 2.95Å; T1365-F1369 WeakPolarHBondContact OG1-CE2 3.49Å
1366	L	63.2	Low	52.6	Low	5 Å²	5	51.9 Å²	51.9	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-48	-40.1	174.5	-84.1	161.3	0	0	0	114.9	I1350 L1354 T1362 L1363 A1409 V1419 L1437 M1441	I1350-L1366 HydrophobicContact CG2-CD2 4.37Å; L1354-L1366 HydrophobicContact CD2-CD1 4.33Å; T1362-L1366 HydrophobicContact CG2-CD1 4.37Å; T1362-L1366 WeakPolarHBondContact O-CG 3.1Å; T1362-L1366 PolarHBondContact O-N 3.49Å; L1363-L1366 HydrophobicContact CD2-CD1 4.44Å; L1366-A1409 HydrophobicContact CD2-CB 3.62Å; L1366-V1419 HydrophobicContact CD1-CG2 4.46Å; L1366-L1437 HydrophobicContact CB-CD1 4.08Å; L1366-L1437 HydrophobicContact CB-CD2 3.94Å; L1366-L1437 HydrophobicContact CD1-CD2 3.83Å; L1366-L1437 HydrophobicContact CG-CD2 4.49Å; L1366-M1441 VanDerWaalsContact O-CE 3.28Å; L1366-M1441 WeakPolarHBondContact O-CE 3.48Å
1367	P	54.5	Low	50.8	Low	27 Å²	27	51.2 Å²	51.2	18%	0.175	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-43.3	168.5	-27.2	36.1	0	0	0	115.2	L1363 S1364 T1365 T1370 L1437 M1441	L1363-P1367 WeakPolarHBondContact O-CD 3.37Å; S1364-P1367 WeakPolarHBondContact O-CD 3.43Å; T1365-P1367 VanDerWaalsContact C-N 3.32Å; P1367-T1370 PolarHBondContact O-N 2.85Å; P1367-T1370 VanDerWaalsContact O-N 3.16Å; P1367-T1370 PolarHBondContact O-OG1 3.26Å; P1367-L1437 HydrophobicContact CG-CD1 3.66Å; P1367-M1441 HydrophobicContact CB-CE 4.49Å
1368	Y	45.5	Very low	49.1	Very low	139 Å²	139	47.3 Å²	47.3	55%	0.545	23%	0.233	S	C	.	.	H	α-helix	trans	-74.4	-29.8	-175.4	-64.8	-75.6	0	0	0	112.5	S1364 T1365 T1370 R1371	S1364-Y1368 WeakPolarHBondContact O-CD2 3.16Å; S1364-Y1368 WeakPolarHBondContact O-CE2 3.2Å; T1365-Y1368 PolarHBondContact O-N 3.12Å; Y1368-T1370 PolarHBondContact O-N 2.95Å; Y1368-T1370 VanDerWaalsContact O-N 3.12Å; Y1368-R1371 WeakPolarHBondContact O-CB 3.35Å; Y1368-R1371 PolarHBondContact O-N 3.37Å
1369	F	41.1	Very low	47.3	Very low	54 Å²	54	44.5 Å²	44.5	24%	0.237	23%	0.225	C	C	.	.	H	α-helix	trans	-53	-26.4	167.4	-73.9	-35.3	0	0	0	112.4	T1365 R1371 T1405 E1406	T1365-F1369 WeakPolarHBondContact O-CD2 3.32Å; T1365-F1369 PolarHBondContact O-N 2.95Å; T1365-F1369 WeakPolarHBondContact OG1-CE2 3.49Å; F1369-R1371 PolarHBondContact O-N 3.02Å; F1369-R1371 VanDerWaalsContact O-N 3.16Å; F1369-T1405 WeakPolarHBondContact CE1-OG1 3.48Å; F1369-E1406 WeakPolarHBondContact CA-OE1 3.3Å; F1369-E1406 HydrophobicContact CB-CB 3.83Å; F1369-E1406 HydrophobicContact CB-CG 3.53Å; F1369-E1406 HydrophobicContact CD1-CG 3.67Å; F1369-E1406 HydrophobicContact CG-CG 3.84Å; F1369-E1406 VanDerWaalsContact O-CB 3.24Å; F1369-E1406 WeakPolarHBondContact O-CB 3.33Å; F1369-E1406 WeakPolarHBondContact O-CG 3.46Å; F1369-E1406 VanDerWaalsContact O-OE1 3.1Å
1370	T	36	Very low	45.1	Very low	29 Å²	29	47.4 Å²	47.4	18%	0.178	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-67.1	-14.3	173.5	61	0	0	0	0	115.1	P1367 Y1368 A1372 L1373 M1441	P1367-T1370 PolarHBondContact O-N 2.85Å; P1367-T1370 VanDerWaalsContact O-N 3.16Å; P1367-T1370 PolarHBondContact O-OG1 3.26Å; Y1368-T1370 PolarHBondContact O-N 2.95Å; Y1368-T1370 VanDerWaalsContact O-N 3.12Å; T1370-A1372 PolarHBondContact O-N 3.47Å; T1370-L1373 HydrophobicContact CG2-CD1 3.91Å; T1370-L1373 WeakPolarHBondContact O-CB 3.38Å; T1370-L1373 PolarHBondContact O-N 3.12Å; T1370-M1441 HydrophobicContact CG2-CE 3.56Å; T1370-M1441 HydrophobicContact CG2-SD 3.94Å
1371	R	28.2	Very low	43.3	Very low	175 Å²	175	49.3 Å²	49.3	66%	0.66	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-72.1	-22.3	179.8	-78.9	-172.5	176.1	166.2	0.4	114.3	Y1368 F1369 Q1374	Y1368-R1371 WeakPolarHBondContact O-CB 3.35Å; Y1368-R1371 PolarHBondContact O-N 3.37Å; F1369-R1371 PolarHBondContact O-N 3.02Å; F1369-R1371 VanDerWaalsContact O-N 3.16Å; R1371-Q1374 WeakPolarHBondContact O-CB 3.37Å
1372	A	32	Very low	41.3	Very low	45 Å²	45	49.3 Å²	49.3	37%	0.372	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-103.1	14.7	173.6	0	0	0	0	0	113.9	T1370 P1375 E1406	T1370-A1372 PolarHBondContact O-N 3.47Å; A1372-P1375 WeakPolarHBondContact O-CD 3.32Å; A1372-E1406 WeakPolarHBondContact CA-OE2 3.42Å; A1372-E1406 WeakPolarHBondContact CB-OE2 3.27Å
1373	L	29.5	Very low	39.4	Very low	17 Å²	17	50.2 Å²	50.2	9%	0.089	26%	0.26	C	S	.	.	S	Bend	trans	-78.2	-21.4	155.5	-62.4	172.8	0	0	0	112.8	T1370 P1375 I1376 F1377 L1407 C1410	T1370-L1373 HydrophobicContact CG2-CD1 3.91Å; T1370-L1373 WeakPolarHBondContact O-CB 3.38Å; T1370-L1373 PolarHBondContact O-N 3.12Å; L1373-P1375 VanDerWaalsContact C-CD 3.49Å; L1373-I1376 PolarHBondContact O-N 2.72Å; L1373-F1377 HydrophobicContact CB-CD2 3.85Å; L1373-F1377 HydrophobicContact CB-CE2 3.91Å; L1373-F1377 HydrophobicContact CD1-CE2 4.28Å; L1373-F1377 HydrophobicContact CD2-CE2 4.23Å; L1373-F1377 HydrophobicContact CG-CE2 4.37Å; L1373-F1377 WeakPolarHBondContact O-CD2 3.43Å; L1373-F1377 PolarHBondContact O-N 2.67Å; L1373-F1377 VanDerWaalsContact O-N 3.08Å; L1373-L1407 HydrophobicContact CD2-CG 4.37Å; L1373-C1410 VanDerWaalsContact CD1-SG 3.58Å
1374	Q	32.5	Very low	37.6	Very low	56 Å²	56	53.8 Å²	53.8	26%	0.262	29%	0.285	S	S	.	.	H	α-helix	trans	-53.7	-40.3	-179.3	-86.1	-165.5	-89.6	0	0	114.2	E533 R1371 I1376 G1378	E533-Q1374 WeakPolarHBondContact OE1-CB 3.3Å; E533-Q1374 VanDerWaalsContact OE1-CD 3.31Å; E533-Q1374 VanDerWaalsContact OE1-CG 3.27Å; E533-Q1374 WeakPolarHBondContact OE1-CG 3.33Å; E533-Q1374 PolarHBondContact OE1-NE2 3.37Å; E533-Q1374 WeakPolarHBondContact OE2-CB 3.32Å; E533-Q1374 VanDerWaalsContact OE2-CD 3.27Å; E533-Q1374 PolarHBondContact OE2-NE2 3.39Å; R1371-Q1374 WeakPolarHBondContact O-CB 3.37Å; Q1374-I1376 VanDerWaalsContact C-N 3.35Å; Q1374-I1376 PolarHBondContact O-N 2.81Å; Q1374-G1378 VanDerWaalsContact O-CA 3.31Å; Q1374-G1378 WeakPolarHBondContact O-CA 3.32Å; Q1374-G1378 PolarHBondContact O-N 3.45Å
1375	P	30.6	Very low	35.9	Very low	50 Å²	50	58.1 Å²	58.1	33%	0.325	31%	0.305	S	S	.	.	H	α-helix	trans	-59.3	-39.2	172.6	-25.5	35.5	0	0	0	114.1	A1372 L1373 L1379	A1372-P1375 WeakPolarHBondContact O-CD 3.32Å; L1373-P1375 VanDerWaalsContact C-CD 3.49Å; P1375-L1379 WeakPolarHBondContact O-CB 3.36Å; P1375-L1379 PolarHBondContact O-N 2.81Å
1376	I	29.1	Very low	34.4	Very low	40 Å²	40	61.2 Å²	61.2	21%	0.205	32%	0.323	C	S	.	.	H	α-helix	trans	-75.7	-47.5	-175.8	-62.4	169	0	0	0	110.6	L1373 Q1374 N1380 L1400 L1407	L1373-I1376 PolarHBondContact O-N 2.72Å; Q1374-I1376 VanDerWaalsContact C-N 3.35Å; Q1374-I1376 PolarHBondContact O-N 2.81Å; I1376-N1380 PolarHBondContact O-N 3.23Å; I1376-L1400 HydrophobicContact CD1-CD2 4.42Å; I1376-L1400 HydrophobicContact CG1-CD2 3.92Å; I1376-L1407 HydrophobicContact CD1-CD1 3.64Å; I1376-L1407 HydrophobicContact CD1-CD2 4.23Å; I1376-L1407 HydrophobicContact CD1-CG 4.03Å
1377	F	30.2	Very low	32.9	Very low	50 Å²	50	64.2 Å²	64.2	22%	0.219	36%	0.355	C	S	.	.	H	α-helix	trans	-79.8	-32	-179.2	-64.6	-62.1	0	0	0	113	L1373 L1379 N1380 V1381 V1448	L1373-F1377 HydrophobicContact CB-CD2 3.85Å; L1373-F1377 HydrophobicContact CB-CE2 3.91Å; L1373-F1377 HydrophobicContact CD1-CE2 4.28Å; L1373-F1377 HydrophobicContact CD2-CE2 4.23Å; L1373-F1377 HydrophobicContact CG-CE2 4.37Å; L1373-F1377 WeakPolarHBondContact O-CD2 3.43Å; L1373-F1377 PolarHBondContact O-N 2.67Å; L1373-F1377 VanDerWaalsContact O-N 3.08Å; F1377-L1379 VanDerWaalsContact C-N 3.27Å; F1377-L1379 PolarHBondContact O-N 3.03Å; F1377-N1380 PolarHBondContact O-N 2.98Å; F1377-V1381 WeakPolarHBondContact O-CG2 3.4Å; F1377-V1381 PolarHBondContact O-N 3.31Å; F1377-V1448 HydrophobicContact CD1-CG1 3.8Å; F1377-V1448 HydrophobicContact CD2-CG1 4.47Å; F1377-V1448 HydrophobicContact CE1-CG1 3.5Å; F1377-V1448 VanDerWaalsContact CE1-CG1 3.5Å; F1377-V1448 HydrophobicContact CE2-CG1 4.2Å; F1377-V1448 HydrophobicContact CG-CG1 4.29Å; F1377-V1448 HydrophobicContact CZ-CG1 3.73Å
1378	G	32	Very low	31.6	Very low	16 Å²	16	65.4 Å²	65.4	17%	0.165	36%	0.362	C	S	.	.	H	α-helix	trans	-56.9	-42.1	169.4	0	0	0	0	0	111.5	Q1374 L1382	Q1374-G1378 VanDerWaalsContact O-CA 3.31Å; Q1374-G1378 WeakPolarHBondContact O-CA 3.32Å; Q1374-G1378 PolarHBondContact O-N 3.45Å; G1378-L1382 WeakPolarHBondContact O-CB 3.5Å; G1378-L1382 WeakPolarHBondContact O-CD1 3.29Å; G1378-L1382 WeakPolarHBondContact O-CG 3.44Å; G1378-L1382 PolarHBondContact O-N 2.84Å
1379	L	28.8	Very low	31.1	Very low	61 Å²	61	63.1 Å²	63.1	32%	0.319	36%	0.359	S	S	.	.	H	α-helix	trans	-61.8	-47.7	172.3	-94.6	160.2	0	0	0	112.6	P1375 F1377 L1382 L1383 I1396	P1375-L1379 WeakPolarHBondContact O-CB 3.36Å; P1375-L1379 PolarHBondContact O-N 2.81Å; F1377-L1379 VanDerWaalsContact C-N 3.27Å; F1377-L1379 PolarHBondContact O-N 3.03Å; L1379-L1382 PolarHBondContact O-N 3.06Å; L1379-L1383 HydrophobicContact CD2-CD1 4.25Å; L1379-L1383 WeakPolarHBondContact O-CB 3.37Å; L1379-L1383 WeakPolarHBondContact O-CG 3.36Å; L1379-L1383 PolarHBondContact O-N 3.02Å; L1379-I1396 HydrophobicContact CD1-CG2 4.13Å; L1379-I1396 HydrophobicContact CD2-CD1 4.31Å
1380	N	26.2	Very low	30.5	Very low	69 Å²	69	63.8 Å²	63.8	37%	0.369	37%	0.369	S	S	.	.	H	α-helix	trans	-66.9	-38.5	-179.3	-104.8	-18.2	0	0	0	113.7	I1376 F1377 S1384	I1376-N1380 PolarHBondContact O-N 3.23Å; F1377-N1380 PolarHBondContact O-N 2.98Å; N1380-S1384 WeakPolarHBondContact O-CB 3.31Å; N1380-S1384 PolarHBondContact O-N 3.09Å; N1380-S1384 PolarHBondContact O-OG 2.87Å
1381	V	30.8	Very low	30.4	Very low	56 Å²	56	66.6 Å²	66.6	34%	0.339	38%	0.383	S	S	.	.	H	α-helix	trans	-69.4	-43.3	175.1	176.3	0	0	0	0	110.5	F1377 S1384 D1385	F1377-V1381 WeakPolarHBondContact O-CG2 3.4Å; F1377-V1381 PolarHBondContact O-N 3.31Å; V1381-S1384 PolarHBondContact O-N 2.74Å; V1381-S1384 PolarHBondContact O-OG 3.27Å; V1381-D1385 PolarHBondContact O-N 3.28Å; V1381-D1385 VanDerWaalsContact O-N 3.08Å
1382	L	29.9	Very low	30.6	Very low	63 Å²	63	65.5 Å²	65.5	33%	0.33	38%	0.379	S	S	.	.	H	α-helix	trans	-64.2	-41.9	176.2	-77.1	166.4	0	0	0	112.9	L534 G1378 L1379 D1385 V1386	L534-L1382 HydrophobicContact CD1-CD2 4.33Å; G1378-L1382 WeakPolarHBondContact O-CB 3.5Å; G1378-L1382 WeakPolarHBondContact O-CD1 3.29Å; G1378-L1382 WeakPolarHBondContact O-CG 3.44Å; G1378-L1382 PolarHBondContact O-N 2.84Å; L1379-L1382 PolarHBondContact O-N 3.06Å; L1382-D1385 PolarHBondContact O-N 3.45Å; L1382-V1386 VanDerWaalsContact O-CB 3.25Å; L1382-V1386 WeakPolarHBondContact O-CB 3.23Å; L1382-V1386 WeakPolarHBondContact O-CG2 3.35Å; L1382-V1386 PolarHBondContact O-N 3.16Å
1383	L	30.1	Very low	30.4	Very low	32 Å²	32	65.8 Å²	65.8	17%	0.168	37%	0.374	C	S	.	.	H	α-helix	trans	-67.7	-38.6	-179	-70.7	167.8	0	0	0	111.8	L1379 G1387 V1388 L1393	L1379-L1383 HydrophobicContact CD2-CD1 4.25Å; L1379-L1383 WeakPolarHBondContact O-CB 3.37Å; L1379-L1383 WeakPolarHBondContact O-CG 3.36Å; L1379-L1383 PolarHBondContact O-N 3.02Å; L1383-G1387 PolarHBondContact O-N 2.74Å; L1383-G1387 VanDerWaalsContact O-N 3.1Å; L1383-V1388 HydrophobicContact CD2-CB 3.71Å; L1383-V1388 HydrophobicContact CD2-CG1 3.89Å; L1383-V1388 HydrophobicContact CD2-CG2 4.21Å; L1383-V1388 PolarHBondContact O-N 3.12Å; L1383-L1393 HydrophobicContact CD1-CD2 3.88Å; L1383-L1393 HydrophobicContact CD1-CG 4.13Å
1384	S	30.3	Very low	30.4	Very low	79 Å²	79	69.7 Å²	69.7	55%	0.552	39%	0.392	S	S	*	.	H	α-helix	trans	-71	-34.2	177.1	52	0	0	0	0	113.7	N1380 V1381	N1380-S1384 WeakPolarHBondContact O-CB 3.31Å; N1380-S1384 PolarHBondContact O-N 3.09Å; N1380-S1384 PolarHBondContact O-OG 2.87Å; V1381-S1384 PolarHBondContact O-N 2.74Å; V1381-S1384 PolarHBondContact O-OG 3.27Å
1385	D	30.4	Very low	30.3	Very low	138 Å²	138	74.5 Å²	74.5	74%	0.738	42%	0.415	S	S	*	.	H	α-helix	trans	-80.7	-25.6	174.6	-87	-13.7	0	0	0	114.1	V1381 L1382	V1381-D1385 PolarHBondContact O-N 3.28Å; V1381-D1385 VanDerWaalsContact O-N 3.08Å; L1382-D1385 PolarHBondContact O-N 3.45Å
1386	V	32.4	Very low	30.2	Very low	85 Å²	85	75.9 Å²	75.9	52%	0.515	42%	0.419	S	S	.	.	H	α-helix	trans	-89.2	-10.1	178.2	-177.5	0	0	0	0	112.1	L1382 V1388	L1382-V1386 VanDerWaalsContact O-CB 3.25Å; L1382-V1386 WeakPolarHBondContact O-CB 3.23Å; L1382-V1386 WeakPolarHBondContact O-CG2 3.35Å; L1382-V1386 PolarHBondContact O-N 3.16Å; V1386-V1388 VanDerWaalsContact C-N 3.31Å; V1386-V1388 HydrophobicContact CB-CG2 4.19Å; V1386-V1388 HydrophobicContact CG1-CG2 3.81Å; V1386-V1388 PolarHBondContact O-N 3.1Å
1387	G	30.2	Very low	30.2	Very low	67 Å²	67	79.5 Å²	79.5	69%	0.691	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	32.2	177.6	0	0	0	0	0	112.9	L1383	L1383-G1387 PolarHBondContact O-N 2.74Å; L1383-G1387 VanDerWaalsContact O-N 3.1Å
1388	V	27.2	Very low	30	Very low	53 Å²	53	83.6 Å²	83.6	32%	0.321	45%	0.45	S	S	.	.			trans	-83	127.3	174.8	-179.3	0	0	0	0	108.1	L1383 V1386 Y1392	L1383-V1388 HydrophobicContact CD2-CB 3.71Å; L1383-V1388 HydrophobicContact CD2-CG1 3.89Å; L1383-V1388 HydrophobicContact CD2-CG2 4.21Å; L1383-V1388 PolarHBondContact O-N 3.12Å; V1386-V1388 VanDerWaalsContact C-N 3.31Å; V1386-V1388 HydrophobicContact CB-CG2 4.19Å; V1386-V1388 HydrophobicContact CG1-CG2 3.81Å; V1386-V1388 PolarHBondContact O-N 3.1Å; V1388-Y1392 HydrophobicContact CG1-CD2 4.1Å; V1388-Y1392 HydrophobicContact CG1-CG 4.45Å
1389	D	34.9	Very low	29.7	Very low	90 Å²	90	86 Å²	86	48%	0.481	47%	0.474	S	S	.	.			trans	-55.9	123.1	176.8	-177.6	3.5	0	0	0	110.4	N1391 Y1392	D1389-N1391 VanDerWaalsContact CG-ND2 3.26Å; D1389-N1391 PolarHBondContact O-N 3.22Å; D1389-N1391 PolarHBondContact OD1-N 2.85Å; D1389-N1391 PolarHBondContact OD1-ND2 3.1Å; D1389-N1391 VanDerWaalsContact OD1-ND2 3.08Å; D1389-N1391 PolarHBondContact OD2-ND2 2.87Å; D1389-Y1392 PolarHBondContact O-N 3.36Å; D1389-Y1392 VanDerWaalsContact O-N 3.13Å
1390	P	29.7	Very low	29.7	Very low	68 Å²	68	86.4 Å²	86.4	44%	0.442	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-58.6	-11.9	-176.4	21.3	-33.9	0	0	0	114.7	Y1392 L1393	P1390-Y1392 PolarHBondContact O-N 3.21Å; P1390-L1393 HydrophobicContact CB-CD1 4.19Å; P1390-L1393 WeakPolarHBondContact O-CB 3.37Å; P1390-L1393 PolarHBondContact O-N 3.41Å
1391	N	33.3	Very low	29.9	Very low	88 Å²	88	88.3 Å²	88.3	47%	0.471	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-51.9	-23	168.1	-71.1	-40	0	0	0	114.1	D1389 L1393	D1389-N1391 VanDerWaalsContact CG-ND2 3.26Å; D1389-N1391 PolarHBondContact O-N 3.22Å; D1389-N1391 PolarHBondContact OD1-N 2.85Å; D1389-N1391 PolarHBondContact OD1-ND2 3.1Å; D1389-N1391 VanDerWaalsContact OD1-ND2 3.08Å; D1389-N1391 PolarHBondContact OD2-ND2 2.87Å; N1391-L1393 VanDerWaalsContact C-N 3.28Å; N1391-L1393 PolarHBondContact O-N 2.92Å
1392	Y	31.7	Very low	29.9	Very low	152 Å²	152	88.6 Å²	88.6	60%	0.596	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-73	-10.1	174	-89.4	-82.4	0	0	0	115.2	V1388 D1389 P1390 E1394	V1388-Y1392 HydrophobicContact CG1-CD2 4.1Å; V1388-Y1392 HydrophobicContact CG1-CG 4.45Å; D1389-Y1392 PolarHBondContact O-N 3.36Å; D1389-Y1392 VanDerWaalsContact O-N 3.13Å; P1390-Y1392 PolarHBondContact O-N 3.21Å; Y1392-E1394 VanDerWaalsContact C-N 3.34Å; Y1392-E1394 PolarHBondContact O-N 3.24Å
1393	L	27.8	Very low	30	Very low	51 Å²	51	95 Å²	95	27%	0.267	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-67.2	-30.2	179.8	-80.3	161.8	0	0	0	113.5	L1383 P1390 N1391 Q1395 I1396 E1397	L1383-L1393 HydrophobicContact CD1-CD2 3.88Å; L1383-L1393 HydrophobicContact CD1-CG 4.13Å; P1390-L1393 HydrophobicContact CB-CD1 4.19Å; P1390-L1393 WeakPolarHBondContact O-CB 3.37Å; P1390-L1393 PolarHBondContact O-N 3.41Å; N1391-L1393 VanDerWaalsContact C-N 3.28Å; N1391-L1393 PolarHBondContact O-N 2.92Å; L1393-Q1395 PolarHBondContact O-N 3.35Å; L1393-I1396 PolarHBondContact O-N 2.87Å; L1393-E1397 PolarHBondContact O-N 3.33Å
1394	E	29.9	Very low	30.4	Very low	100 Å²	100	94.6 Å²	94.6	47%	0.467	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-56.7	-26.2	-179.7	-70.9	-169.2	162.9	0	0	113.5	Y1392	Y1392-E1394 VanDerWaalsContact C-N 3.34Å; Y1392-E1394 PolarHBondContact O-N 3.24Å
1395	Q	30.3	Very low	30.8	Very low	156 Å²	156	91.5 Å²	91.5	73%	0.729	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-87.3	-15.6	179.7	-65.4	-171.2	0	0	0	113.9	L1393	L1393-Q1395 PolarHBondContact O-N 3.35Å
1396	I	30	Very low	31.2	Very low	80 Å²	80	86.1 Å²	86.1	41%	0.41	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-25	-173.6	-61.4	178.9	0	0	0	112.2	L1379 L1393 Y1398 G1399	L1379-I1396 HydrophobicContact CD1-CG2 4.13Å; L1379-I1396 HydrophobicContact CD2-CD1 4.31Å; L1393-I1396 PolarHBondContact O-N 2.87Å; I1396-Y1398 PolarHBondContact O-N 3Å; I1396-G1399 PolarHBondContact O-N 3.46Å; I1396-G1399 VanDerWaalsContact O-N 3.11Å
1397	E	28.9	Very low	31.3	Very low	115 Å²	115	82.7 Å²	82.7	54%	0.537	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-59.3	-23	-178.3	-73.2	-161.4	138.1	0	0	114.8	L1393 G1399	L1393-E1397 PolarHBondContact O-N 3.33Å; E1397-G1399 PolarHBondContact O-N 2.78Å; E1397-G1399 VanDerWaalsContact O-N 3.17Å
1398	Y	26.4	Very low	31.7	Very low	137 Å²	137	79.6 Å²	79.6	54%	0.537	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-68.1	-9.2	177.1	-75.4	-77.9	0	0	0	114.8	Q1332 I1396	Q1332-Y1398 VanDerWaalsContact CG-OH 3.31Å; Q1332-Y1398 WeakPolarHBondContact CG-OH 3.49Å; I1396-Y1398 PolarHBondContact O-N 3Å
1399	G	25	Very low	32.6	Very low	66 Å²	66	77.3 Å²	77.3	68%	0.68	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-105.5	-6.5	-173.4	0	0	0	0	0	117.1	I1396 E1397 D1401	I1396-G1399 PolarHBondContact O-N 3.46Å; I1396-G1399 VanDerWaalsContact O-N 3.11Å; E1397-G1399 PolarHBondContact O-N 2.78Å; E1397-G1399 VanDerWaalsContact O-N 3.17Å; G1399-D1401 PolarHBondContact O-N 2.98Å
1400	L	29.1	Very low	33.1	Very low	69 Å²	69	73.8 Å²	73.8	36%	0.361	37%	0.368	S	S	.	.			trans	-73.1	113.9	-177.4	-71.8	170.3	0	0	0	111	I1376 M1402	I1376-L1400 HydrophobicContact CD1-CD2 4.42Å; I1376-L1400 HydrophobicContact CG1-CD2 3.92Å; L1400-M1402 VanDerWaalsContact C-N 3.28Å; L1400-M1402 HydrophobicContact CB-CE 3.85Å; L1400-M1402 HydrophobicContact CB-CG 4.38Å; L1400-M1402 HydrophobicContact CB-SD 4.09Å; L1400-M1402 HydrophobicContact CD1-CE 3.76Å; L1400-M1402 HydrophobicContact CG-CE 4.47Å; L1400-M1402 PolarHBondContact O-N 3.45Å
1401	D	30	Very low	33.8	Very low	109 Å²	109	71.7 Å²	71.7	58%	0.583	35%	0.353	S	S	*	.			trans	-73.9	83.2	171.4	-166.4	14.8	0	0	0	109.1	G1399 R1403	G1399-D1401 PolarHBondContact O-N 2.98Å; D1401-R1403 PolarHBondContact O-N 3.38Å; D1401-R1403 WeakPolarHBondContact OD1-CD 3.08Å; D1401-R1403 WeakPolarHBondContact OD1-CG 3.3Å; D1401-R1403 IonicContact OD1-NE 3.82Å; D1401-R1403 PolarHBondContact OD1-NE 3.36Å; D1401-R1403 WeakPolarHBondContact OD2-CD 3.2Å; D1401-R1403 IonicContact OD2-CZ 3.42Å; D1401-R1403 IonicContact OD2-NE 3.69Å; D1401-R1403 PolarHBondContact OD2-NE 2.98Å
1402	M	30.8	Very low	34.9	Very low	63 Å²	63	67.7 Å²	67.7	31%	0.31	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	25.3	-175.8	-62.5	-68.5	-166.6	0	0	114.7	L1400 S1404 L1407	L1400-M1402 VanDerWaalsContact C-N 3.28Å; L1400-M1402 HydrophobicContact CB-CE 3.85Å; L1400-M1402 HydrophobicContact CB-CG 4.38Å; L1400-M1402 HydrophobicContact CB-SD 4.09Å; L1400-M1402 HydrophobicContact CD1-CE 3.76Å; L1400-M1402 HydrophobicContact CG-CE 4.47Å; L1400-M1402 PolarHBondContact O-N 3.45Å; M1402-S1404 PolarHBondContact O-N 2.85Å; M1402-L1407 HydrophobicContact SD-CD1 3.89Å
1403	R	30.9	Very low	36.1	Very low	196 Å²	196	61.7 Å²	61.7	74%	0.74	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.6	168.3	-66.2	174.1	-166.6	-148.9	-6.3	112.6	D1401 T1405	D1401-R1403 PolarHBondContact O-N 3.38Å; D1401-R1403 WeakPolarHBondContact OD1-CD 3.08Å; D1401-R1403 WeakPolarHBondContact OD1-CG 3.3Å; D1401-R1403 IonicContact OD1-NE 3.82Å; D1401-R1403 PolarHBondContact OD1-NE 3.36Å; D1401-R1403 WeakPolarHBondContact OD2-CD 3.2Å; D1401-R1403 IonicContact OD2-CZ 3.42Å; D1401-R1403 IonicContact OD2-NE 3.69Å; D1401-R1403 PolarHBondContact OD2-NE 2.98Å; R1403-T1405 PolarHBondContact O-N 2.97Å
1404	S	39.4	Very low	37.7	Very low	25 Å²	25	62 Å²	62	18%	0.175	31%	0.311	C	S	.	.			trans	-72.3	91.9	179.1	42.9	0	0	0	0	112.3	M1402 E1406 L1407	M1402-S1404 PolarHBondContact O-N 2.85Å; S1404-E1406 WeakPolarHBondContact CB-OE2 3.49Å; S1404-E1406 PolarHBondContact O-N 3.44Å; S1404-L1407 PolarHBondContact O-N 2.98Å; S1404-L1407 VanDerWaalsContact O-N 3.15Å
1405	T	37.8	Very low	39.4	Very low	14 Å²	14	57.3 Å²	57.3	9%	0.086	29%	0.289	C	S	.	.	H	α-helix	trans	-39.4	-28.7	154.7	40.7	0	0	0	0	113.3	W1268 Y1349 I1350 F1369 R1403 L1407 A1408 A1409	W1268-T1405 HydrophobicContact CH2-CG2 3.74Å; W1268-T1405 HydrophobicContact CZ3-CG2 4.37Å; Y1349-T1405 HydrophobicContact CD1-CG2 4.11Å; I1350-T1405 WeakPolarHBondContact CD1-O 3.4Å; F1369-T1405 WeakPolarHBondContact CE1-OG1 3.48Å; R1403-T1405 PolarHBondContact O-N 2.97Å; T1405-L1407 PolarHBondContact O-N 3.42Å; T1405-A1408 WeakPolarHBondContact O-CA 3.43Å; T1405-A1408 VanDerWaalsContact O-CB 3.27Å; T1405-A1408 WeakPolarHBondContact O-CB 3.37Å; T1405-A1408 PolarHBondContact O-N 2.98Å; T1405-A1408 VanDerWaalsContact O-N 3.07Å; T1405-A1409 PolarHBondContact O-N 3.37Å; T1405-A1409 VanDerWaalsContact O-N 3.1Å
1406	E	39.2	Very low	41.2	Very low	24 Å²	24	50 Å²	50	11%	0.112	26%	0.255	C	S	.	.	H	α-helix	trans	-52.2	-44.1	178.1	-31.9	179.7	139.7	0	0	114.4	F1369 A1372 S1404 A1408 A1409 C1410	F1369-E1406 WeakPolarHBondContact CA-OE1 3.3Å; F1369-E1406 HydrophobicContact CB-CB 3.83Å; F1369-E1406 HydrophobicContact CB-CG 3.53Å; F1369-E1406 HydrophobicContact CD1-CG 3.67Å; F1369-E1406 HydrophobicContact CG-CG 3.84Å; F1369-E1406 VanDerWaalsContact O-CB 3.24Å; F1369-E1406 WeakPolarHBondContact O-CB 3.33Å; F1369-E1406 WeakPolarHBondContact O-CG 3.46Å; F1369-E1406 VanDerWaalsContact O-OE1 3.1Å; A1372-E1406 WeakPolarHBondContact CA-OE2 3.42Å; A1372-E1406 WeakPolarHBondContact CB-OE2 3.27Å; S1404-E1406 WeakPolarHBondContact CB-OE2 3.49Å; S1404-E1406 PolarHBondContact O-N 3.44Å; E1406-A1408 VanDerWaalsContact C-N 3.34Å; E1406-A1409 PolarHBondContact O-N 3.09Å; E1406-C1410 PolarHBondContact O-N 3.03Å; E1406-C1410 PolarHBondContact O-SG 3.49Å
1407	L	34.1	Very low	42.9	Very low	13 Å²	13	46.7 Å²	46.7	7%	0.068	24%	0.238	C	C	.	.	H	α-helix	trans	-67.7	-37	175	-100.1	166.2	0	0	0	111.2	L1373 I1376 M1402 S1404 T1405 F1495	L1373-L1407 HydrophobicContact CD2-CG 4.37Å; I1376-L1407 HydrophobicContact CD1-CD1 3.64Å; I1376-L1407 HydrophobicContact CD1-CD2 4.23Å; I1376-L1407 HydrophobicContact CD1-CG 4.03Å; M1402-L1407 HydrophobicContact SD-CD1 3.89Å; S1404-L1407 PolarHBondContact O-N 2.98Å; S1404-L1407 VanDerWaalsContact O-N 3.15Å; T1405-L1407 PolarHBondContact O-N 3.42Å; L1407-F1495 HydrophobicContact CD1-CZ 4.4Å; L1407-F1495 HydrophobicContact CD2-CE1 4.33Å; L1407-F1495 HydrophobicContact CD2-CE2 3.89Å; L1407-F1495 HydrophobicContact CD2-CZ 3.77Å
1408	A	39.9	Very low	45	Very low	3 Å²	3	43.7 Å²	43.7	3%	0.025	22%	0.222	C	C	.	.	H	α-helix	trans	-65.5	-37.2	178.5	0	0	0	0	0	112.2	Y1343 Q1347 I1350 T1405 E1406 S1412	Y1343-A1408 HydrophobicContact CD2-CB 3.99Å; Y1343-A1408 HydrophobicContact CE2-CB 4.26Å; Q1347-A1408 HydrophobicContact CG-CB 3.82Å; I1350-A1408 HydrophobicContact CD1-CB 4.47Å; T1405-A1408 WeakPolarHBondContact O-CA 3.43Å; T1405-A1408 VanDerWaalsContact O-CB 3.27Å; T1405-A1408 WeakPolarHBondContact O-CB 3.37Å; T1405-A1408 PolarHBondContact O-N 2.98Å; T1405-A1408 VanDerWaalsContact O-N 3.07Å; E1406-A1408 VanDerWaalsContact C-N 3.34Å; A1408-S1412 WeakPolarHBondContact O-CB 3.49Å; A1408-S1412 PolarHBondContact O-N 2.92Å
1409	A	45	Very low	47.3	Very low	4 Å²	4	37.2 Å²	37.2	3%	0.033	20%	0.196	C	C	.	.	H	α-helix	trans	-69.2	-46	177.6	0	0	0	0	0	113.5	I1350 L1366 T1405 E1406 H1411 W1416	I1350-A1409 HydrophobicContact CD1-CB 4.05Å; L1366-A1409 HydrophobicContact CD2-CB 3.62Å; T1405-A1409 PolarHBondContact O-N 3.37Å; T1405-A1409 VanDerWaalsContact O-N 3.1Å; E1406-A1409 PolarHBondContact O-N 3.09Å; A1409-H1411 VanDerWaalsContact C-N 3.29Å; A1409-H1411 PolarHBondContact O-N 2.71Å; A1409-W1416 PolarHBondContact O-NE1 3.03Å; A1409-W1416 VanDerWaalsContact O-NE1 3.14Å
1410	C	45.8	Very low	49.8	Very low	16 Å²	16	34 Å²	34	11%	0.108	16%	0.164	C	C	.	.	H	α-helix	trans	-69.5	-25.7	-166.7	-64.7	0	0	0	0	114.1	L1373 E1406	L1373-C1410 VanDerWaalsContact CD1-SG 3.58Å; E1406-C1410 PolarHBondContact O-N 3.03Å; E1406-C1410 PolarHBondContact O-SG 3.49Å
1411	H	45.6	Very low	52.1	Low	24 Å²	24	33.3 Å²	33.3	11%	0.111	16%	0.159	C	C	.	.	H	α-helix	trans	-107.5	-10.8	-178.5	-62.4	-71.1	0	0	0	114.3	A1409 T1413 F1495 P1500	A1409-H1411 VanDerWaalsContact C-N 3.29Å; A1409-H1411 PolarHBondContact O-N 2.71Å; H1411-T1413 PolarHBondContact O-N 3.37Å; H1411-F1495 HydrophobicContact CB-CB 4.13Å; H1411-F1495 HydrophobicContact CB-CD1 4.29Å; H1411-F1495 HydrophobicContact CB-CG 4.47Å; H1411-F1495 AromaticContact CD2-CG 3.85Å; H1411-P1500 WeakPolarHBondContact O-CD 3.5Å
1412	S	55.8	Low	54.4	Low	4 Å²	4	29 Å²	29	3%	0.028	14%	0.136	C	C	.	.			trans	-78.7	114	179.3	-177.1	0	0	0	0	111.9	Q1347 A1408 Q1414 T1415 W1416	Q1347-S1412 VanDerWaalsContact CD-CB 3.41Å; Q1347-S1412 VanDerWaalsContact CD-OG 3.25Å; Q1347-S1412 PolarHBondContact OE1-OG 3.48Å; A1408-S1412 WeakPolarHBondContact O-CB 3.49Å; A1408-S1412 PolarHBondContact O-N 2.92Å; S1412-Q1414 VanDerWaalsContact C-N 3.26Å; S1412-Q1414 PolarHBondContact O-N 2.91Å; S1412-Q1414 PolarHBondContact OG-N 3.24Å; S1412-T1415 WeakPolarHBondContact CB-OG1 3.49Å; S1412-T1415 PolarHBondContact OG-N 2.87Å; S1412-T1415 VanDerWaalsContact OG-N 3.07Å; S1412-T1415 PolarHBondContact OG-OG1 3.41Å; S1412-W1416 PolarHBondContact O-N 3Å
1413	T	56.6	Low	56.2	Low	26 Å²	26	26.6 Å²	26.6	16%	0.16	12%	0.124	C	C	.	.	H	α-helix	trans	-61.6	-38.1	168.6	47.1	0	0	0	0	111.5	H1411 W1416 L1417 P1500 I1525 S1526	H1411-T1413 PolarHBondContact O-N 3.37Å; T1413-W1416 PolarHBondContact O-N 2.81Å; T1413-L1417 PolarHBondContact O-N 3.24Å; T1413-P1500 HydrophobicContact CG2-CB 3.58Å; T1413-P1500 HydrophobicContact CG2-CG 3.83Å; T1413-I1525 HydrophobicContact CG2-CG2 4.17Å; T1413-S1526 WeakPolarHBondContact O-CB 3.19Å
1414	Q	61.5	Low	57.9	Low	58 Å²	58	19.3 Å²	19.3	27%	0.271	11%	0.11	S	C	.	.	H	α-helix	trans	-67	-42.1	-177.9	-61.4	178.8	21.3	0	0	112.4	H1279 S1412 W1416 L1417 R1418	H1279-Q1414 VanDerWaalsContact CE1-CD 3.47Å; H1279-Q1414 PolarHBondContact CE1-NE2 3.24Å; H1279-Q1414 PolarHBondContact CE1-OE1 2.91Å; H1279-Q1414 PolarHBondContact NE2-NE2 3.48Å; H1279-Q1414 PolarHBondContact NE2-OE1 3.41Å; H1279-Q1414 VanDerWaalsContact NE2-OE1 3.1Å; S1412-Q1414 VanDerWaalsContact C-N 3.26Å; S1412-Q1414 PolarHBondContact O-N 2.91Å; S1412-Q1414 PolarHBondContact OG-N 3.24Å; Q1414-W1416 VanDerWaalsContact C-N 3.3Å; Q1414-W1416 PolarHBondContact O-N 3.37Å; Q1414-L1417 WeakPolarHBondContact O-CB 3.36Å; Q1414-L1417 PolarHBondContact O-N 3.44Å; Q1414-L1417 VanDerWaalsContact O-N 3.12Å; Q1414-R1418 WeakPolarHBondContact O-CG 3.28Å; Q1414-R1418 PolarHBondContact O-N 2.97Å
1415	T	64.8	Low	59.6	Low	1 Å²	1	21 Å²	21	1%	0.006	12%	0.117	C	C	.	.	H	α-helix	trans	-59.5	-41.5	175.8	-59.9	0	0	0	0	111.4	I1350 L1354 S1412 R1418 V1419	I1350-T1415 HydrophobicContact CG2-CG2 3.75Å; L1354-T1415 HydrophobicContact CD1-CG2 4.33Å; S1412-T1415 WeakPolarHBondContact CB-OG1 3.49Å; S1412-T1415 PolarHBondContact OG-N 2.87Å; S1412-T1415 VanDerWaalsContact OG-N 3.07Å; S1412-T1415 PolarHBondContact OG-OG1 3.41Å; T1415-R1418 PolarHBondContact O-N 3.47Å; T1415-V1419 WeakPolarHBondContact O-CG2 3.48Å; T1415-V1419 PolarHBondContact O-N 3.28Å
1416	W	68.2	Low	61.2	Low	2 Å²	2	29.6 Å²	29.6	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-68.8	-34.4	175.1	-67.2	118.3	0	0	0	113.1	A1409 S1412 T1413 Q1414 V1419 A1420 L1437 L1438 M1441 I1445 I1523 S1526	A1409-W1416 PolarHBondContact O-NE1 3.03Å; A1409-W1416 VanDerWaalsContact O-NE1 3.14Å; S1412-W1416 PolarHBondContact O-N 3Å; T1413-W1416 PolarHBondContact O-N 2.81Å; Q1414-W1416 VanDerWaalsContact C-N 3.3Å; Q1414-W1416 PolarHBondContact O-N 3.37Å; W1416-V1419 HydrophobicContact CE3-CB 4.36Å; W1416-V1419 HydrophobicContact CE3-CG1 4.49Å; W1416-V1419 HydrophobicContact CE3-CG2 4.37Å; W1416-V1419 PolarHBondContact O-N 3.16Å; W1416-A1420 PolarHBondContact O-N 2.77Å; W1416-L1437 HydrophobicContact CZ3-CD2 4.13Å; W1416-L1437 HydrophobicContact CZ3-CG 4.12Å; W1416-L1438 HydrophobicContact CE3-CD2 4.2Å; W1416-M1441 HydrophobicContact CH2-CB 3.91Å; W1416-M1441 HydrophobicContact CH2-CG 3.82Å; W1416-M1441 HydrophobicContact CZ3-CB 4.37Å; W1416-M1441 HydrophobicContact CZ3-CG 4.41Å; W1416-I1445 HydrophobicContact CZ2-CD1 3.89Å; W1416-I1523 HydrophobicContact CD2-CD1 4.2Å; W1416-I1523 HydrophobicContact CD2-CG1 3.69Å; W1416-I1523 HydrophobicContact CE3-CD1 4.22Å; W1416-I1523 HydrophobicContact CE3-CG1 4.13Å; W1416-I1523 HydrophobicContact CG-CG1 3.89Å; W1416-I1523 HydrophobicContact CH2-CD1 4.42Å; W1416-I1523 HydrophobicContact CZ2-CD1 4.37Å; W1416-I1523 HydrophobicContact CZ2-CG1 4.45Å; W1416-I1523 HydrophobicContact CZ3-CD1 4.33Å; W1416-S1526 WeakPolarHBondContact CB-OG 3.07Å
1417	L	67.1	Low	62.9	Low	12 Å²	12	31.7 Å²	31.7	6%	0.063	17%	0.168	C	C	.	.	H	α-helix	trans	-64.1	-40.2	171.6	-172.9	61.6	0	0	0	111.6	T1413 Q1414 A1420 E1421 Q1533 K1538 A1542	T1413-L1417 PolarHBondContact O-N 3.24Å; Q1414-L1417 WeakPolarHBondContact O-CB 3.36Å; Q1414-L1417 PolarHBondContact O-N 3.44Å; Q1414-L1417 VanDerWaalsContact O-N 3.12Å; L1417-A1420 CarbonylContact O-C 3.59Å; L1417-A1420 WeakPolarHBondContact O-CA 3.48Å; L1417-A1420 WeakPolarHBondContact O-CB 3.29Å; L1417-A1420 PolarHBondContact O-N 3.11Å; L1417-A1420 VanDerWaalsContact O-N 3.13Å; L1417-E1421 WeakPolarHBondContact O-CG 3.33Å; L1417-E1421 PolarHBondContact O-N 3.49Å; L1417-Q1533 HydrophobicContact CD2-CG 4.22Å; L1417-K1538 HydrophobicContact CD2-CD 4.26Å; L1417-A1542 HydrophobicContact CD1-CB 4.3Å
1418	R	73	Confident	65	Low	52 Å²	52	37 Å²	37	20%	0.196	19%	0.192	C	C	.	.	H	α-helix	trans	-65.8	-37.5	172.9	-62.6	-44.3	-161.3	124.3	23.6	112.8	Q1351 L1354 E1355 Q1414 T1415 A1420 E1421 L1422	Q1351-R1418 HydrophobicContact CG-CG 4.24Å; L1354-R1418 HydrophobicContact CD1-CB 4.39Å; E1355-R1418 IonicContact OE1-CZ 3.92Å; E1355-R1418 IonicContact OE1-NH1 3.21Å; E1355-R1418 PolarHBondContact OE1-NH1 2.92Å; E1355-R1418 IonicContact OE1-NH2 3.12Å; E1355-R1418 PolarHBondContact OE1-NH2 3.31Å; Q1414-R1418 WeakPolarHBondContact O-CG 3.28Å; Q1414-R1418 PolarHBondContact O-N 2.97Å; T1415-R1418 PolarHBondContact O-N 3.47Å; R1418-A1420 VanDerWaalsContact C-N 3.27Å; R1418-A1420 PolarHBondContact O-N 3.36Å; R1418-E1421 VanDerWaalsContact CD-CD 3.49Å; R1418-E1421 WeakPolarHBondContact CD-OE1 3.2Å; R1418-E1421 WeakPolarHBondContact CD-OE2 3.44Å; R1418-E1421 IonicContact CZ-OE2 3.97Å; R1418-E1421 IonicContact NE-OE1 3.21Å; R1418-E1421 IonicContact NE-OE2 3.7Å; R1418-E1421 IonicContact NH1-OE1 3.91Å; R1418-E1421 IonicContact NH1-OE2 2.74Å; R1418-E1421 PolarHBondContact NH1-OE2 3.29Å; R1418-E1421 WeakPolarHBondContact O-CB 3.48Å; R1418-E1421 PolarHBondContact O-N 2.96Å; R1418-L1422 PolarHBondContact O-N 3.03Å
1419	V	74.4	Confident	66.8	Low	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-35.2	170.7	171.9	0	0	0	0	111.3	L1354 L1363 L1366 T1415 W1416 L1422 A1434 L1437 L1438	L1354-V1419 HydrophobicContact CD1-CG2 3.92Å; L1363-V1419 HydrophobicContact CD2-CG1 4.2Å; L1363-V1419 HydrophobicContact CD2-CG2 4.1Å; L1366-V1419 HydrophobicContact CD1-CG2 4.46Å; T1415-V1419 WeakPolarHBondContact O-CG2 3.48Å; T1415-V1419 PolarHBondContact O-N 3.28Å; W1416-V1419 HydrophobicContact CE3-CB 4.36Å; W1416-V1419 HydrophobicContact CE3-CG1 4.49Å; W1416-V1419 HydrophobicContact CE3-CG2 4.37Å; W1416-V1419 PolarHBondContact O-N 3.16Å; V1419-L1422 PolarHBondContact O-N 2.85Å; V1419-A1434 HydrophobicContact CG1-CB 4.42Å; V1419-L1437 HydrophobicContact CG1-CD2 4.09Å; V1419-L1437 HydrophobicContact CG2-CD2 4.26Å; V1419-L1438 HydrophobicContact CG1-CD1 4.49Å; V1419-L1438 HydrophobicContact CG1-CD2 4.04Å; V1419-L1438 HydrophobicContact CG1-CG 3.99Å
1420	A	76.6	Confident	68.2	Low	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-71.2	-33.7	173.1	0	0	0	0	0	113.3	W1416 L1417 R1418 L1422 V1423 M1527 A1545	W1416-A1420 PolarHBondContact O-N 2.77Å; L1417-A1420 CarbonylContact O-C 3.59Å; L1417-A1420 WeakPolarHBondContact O-CA 3.48Å; L1417-A1420 WeakPolarHBondContact O-CB 3.29Å; L1417-A1420 PolarHBondContact O-N 3.11Å; L1417-A1420 VanDerWaalsContact O-N 3.13Å; R1418-A1420 VanDerWaalsContact C-N 3.27Å; R1418-A1420 PolarHBondContact O-N 3.36Å; A1420-L1422 PolarHBondContact O-N 3.03Å; A1420-V1423 VanDerWaalsContact O-CB 3.27Å; A1420-V1423 WeakPolarHBondContact O-CB 3.5Å; A1420-V1423 PolarHBondContact O-N 3.46Å; A1420-M1527 HydrophobicContact CB-CE 3.74Å; A1420-M1527 HydrophobicContact CB-SD 3.85Å; A1420-A1545 HydrophobicContact CB-CB 3.5Å
1421	E	78	Confident	69.7	Low	53 Å²	53	42.9 Å²	42.9	25%	0.248	22%	0.218	C	C	.	.	H	α-helix	trans	-60	-29.2	172.3	-72.5	169.7	-161.6	0	0	112.3	L1417 R1418 V1423 K1538 A1541	L1417-E1421 WeakPolarHBondContact O-CG 3.33Å; L1417-E1421 PolarHBondContact O-N 3.49Å; R1418-E1421 VanDerWaalsContact CD-CD 3.49Å; R1418-E1421 WeakPolarHBondContact CD-OE1 3.2Å; R1418-E1421 WeakPolarHBondContact CD-OE2 3.44Å; R1418-E1421 IonicContact CZ-OE2 3.97Å; R1418-E1421 IonicContact NE-OE1 3.21Å; R1418-E1421 IonicContact NE-OE2 3.7Å; R1418-E1421 IonicContact NH1-OE1 3.91Å; R1418-E1421 IonicContact NH1-OE2 2.74Å; R1418-E1421 PolarHBondContact NH1-OE2 3.29Å; R1418-E1421 WeakPolarHBondContact O-CB 3.48Å; R1418-E1421 PolarHBondContact O-N 2.96Å; E1421-V1423 VanDerWaalsContact C-N 3.27Å; E1421-V1423 PolarHBondContact O-N 3.3Å; E1421-K1538 WeakPolarHBondContact OE1-CD 3.46Å; E1421-K1538 WeakPolarHBondContact OE1-CE 3.42Å; E1421-K1538 WeakPolarHBondContact OE1-CG 3.38Å; E1421-K1538 IonicContact OE1-NZ 2.67Å; E1421-A1541 HydrophobicContact CG-CB 4.1Å
1422	L	77.5	Confident	71.2	Confident	20 Å²	20	47.4 Å²	47.4	11%	0.105	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-6.3	174	-61.7	175.6	0	0	0	114	L1354 L1363 R1418 V1419 A1420 G1424 N1425 I1430 A1434	L1354-L1422 HydrophobicContact CB-CD1 4.3Å; L1354-L1422 HydrophobicContact CD2-CD1 3.88Å; L1363-L1422 HydrophobicContact CD1-CD1 3.96Å; L1363-L1422 HydrophobicContact CD2-CD1 4.3Å; L1363-L1422 HydrophobicContact CG-CD1 4.29Å; R1418-L1422 PolarHBondContact O-N 3.03Å; V1419-L1422 PolarHBondContact O-N 2.85Å; A1420-L1422 PolarHBondContact O-N 3.03Å; L1422-G1424 PolarHBondContact O-N 3.3Å; L1422-N1425 WeakPolarHBondContact O-CB 3.49Å; L1422-N1425 PolarHBondContact O-N 3.5Å; L1422-I1430 HydrophobicContact CB-CG2 4.06Å; L1422-I1430 HydrophobicContact CD1-CG2 4.28Å; L1422-I1430 HydrophobicContact CD2-CG2 4.15Å; L1422-I1430 HydrophobicContact CG-CG2 4.4Å; L1422-A1434 HydrophobicContact CB-CB 4.22Å
1423	V	68.8	Low	72.2	Confident	11 Å²	11	49.2 Å²	49.2	7%	0.067	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	113.6	177.2	177.1	0	0	0	0	110.7	A1420 E1421 A1434 I1435 L1438 K1544 I1548	A1420-V1423 VanDerWaalsContact O-CB 3.27Å; A1420-V1423 WeakPolarHBondContact O-CB 3.5Å; A1420-V1423 PolarHBondContact O-N 3.46Å; E1421-V1423 VanDerWaalsContact C-N 3.27Å; E1421-V1423 PolarHBondContact O-N 3.3Å; V1423-A1434 HydrophobicContact CG2-CB 4.22Å; V1423-I1435 HydrophobicContact CG1-CG1 4.39Å; V1423-L1438 HydrophobicContact CG2-CD1 3.84Å; V1423-K1544 HydrophobicContact CG1-CB 4.09Å; V1423-I1548 HydrophobicContact CG1-CD1 3.45Å; V1423-I1548 VanDerWaalsContact CG1-CD1 3.45Å; V1423-I1548 HydrophobicContact CG2-CD1 4.32Å
1424	G	67.9	Low	73.2	Confident	43 Å²	43	48 Å²	48	44%	0.443	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	21.7	-171.1	0	0	0	0	0	113.9	L1422 N1431	L1422-G1424 PolarHBondContact O-N 3.3Å; G1424-N1431 PolarHBondContact N-OD1 2.89Å
1425	N	74.5	Confident	73.9	Confident	60 Å²	60	47.5 Å²	47.5	32%	0.321	24%	0.236	S	C	.	.			trans	-58.4	151.9	163.5	-164.4	-18.6	0	0	0	110.3	L1422 D1427 I1430	L1422-N1425 WeakPolarHBondContact O-CB 3.49Å; L1422-N1425 PolarHBondContact O-N 3.5Å; N1425-D1427 PolarHBondContact O-N 2.93Å; N1425-I1430 HydrophobicContact CB-CG2 4.32Å
1426	H	72	Confident	74.5	Confident	196 Å²	196	53.1 Å²	53.1	91%	0.907	26%	0.264	S	S	*	.	S	Bend	trans	-65.5	-27.8	178.6	-66.9	-63.9	0	0	0	112.9	E1428	H1426-E1428 PolarHBondContact O-N 3Å
1427	D	74.9	Confident	74.8	Confident	67 Å²	67	53.1 Å²	53.1	36%	0.358	26%	0.264	S	S	.	.			trans	-74.2	113.9	170.8	-175.1	-34	0	0	0	110.2	N1425 E1429 I1430 N1431	N1425-D1427 PolarHBondContact O-N 2.93Å; D1427-E1429 VanDerWaalsContact C-N 3.29Å; D1427-E1429 PolarHBondContact O-N 3.3Å; D1427-E1429 WeakPolarHBondContact OD1-CA 3.43Å; D1427-E1429 VanDerWaalsContact OD1-CB 3.31Å; D1427-E1429 WeakPolarHBondContact OD1-CB 3.4Å; D1427-E1429 PolarHBondContact OD1-N 2.98Å; D1427-I1430 HydrophobicContact CB-CB 4.06Å; D1427-I1430 HydrophobicContact CB-CD1 3.77Å; D1427-I1430 HydrophobicContact CB-CG1 4.03Å; D1427-I1430 PolarHBondContact O-N 2.74Å; D1427-I1430 PolarHBondContact OD1-N 3.15Å; D1427-I1430 VanDerWaalsContact OD1-N 3.14Å; D1427-I1430 WeakPolarHBondContact OD2-CD1 3.4Å; D1427-N1431 WeakPolarHBondContact O-CB 3.43Å; D1427-N1431 PolarHBondContact O-N 3.05Å
1428	E	77.8	Confident	75.2	Confident	125 Å²	125	52.5 Å²	52.5	58%	0.584	26%	0.261	S	S	*	.	H	α-helix	trans	-65.6	-30.3	-178.5	-158.3	-168	176.8	0	0	112.7	H1426 K1432	H1426-E1428 PolarHBondContact O-N 3Å; E1428-K1432 HydrophobicContact CG-CD 4.27Å; E1428-K1432 WeakPolarHBondContact O-CB 3.33Å; E1428-K1432 VanDerWaalsContact O-CG 3.23Å; E1428-K1432 WeakPolarHBondContact O-CG 3.26Å; E1428-K1432 PolarHBondContact O-N 3.1Å; E1428-K1432 WeakPolarHBondContact OE1-CE 3.32Å; E1428-K1432 IonicContact OE1-NZ 3.66Å; E1428-K1432 PolarHBondContact OE1-NZ 2.7Å; E1428-K1432 IonicContact OE2-NZ 2.7Å; E1428-K1432 PolarHBondContact OE2-NZ 3.49Å
1429	E	76.9	Confident	75.2	Confident	98 Å²	98	53.5 Å²	53.5	46%	0.458	27%	0.267	S	S	.	.	H	α-helix	trans	-71.6	-48.1	178.5	-160.2	-157.7	-169.5	0	0	110.7	S1360 D1427 N1431 K1432 K1433	S1360-E1429 VanDerWaalsContact OG-CD 3.31Å; S1360-E1429 PolarHBondContact OG-OE2 3.5Å; D1427-E1429 VanDerWaalsContact C-N 3.29Å; D1427-E1429 PolarHBondContact O-N 3.3Å; D1427-E1429 WeakPolarHBondContact OD1-CA 3.43Å; D1427-E1429 VanDerWaalsContact OD1-CB 3.31Å; D1427-E1429 WeakPolarHBondContact OD1-CB 3.4Å; D1427-E1429 PolarHBondContact OD1-N 2.98Å; E1429-N1431 VanDerWaalsContact C-N 3.34Å; E1429-N1431 PolarHBondContact O-N 2.83Å; E1429-K1432 PolarHBondContact O-N 3.28Å; E1429-K1433 HydrophobicContact CG-CD 4.35Å; E1429-K1433 WeakPolarHBondContact O-CB 3.37Å; E1429-K1433 WeakPolarHBondContact O-CG 3.25Å; E1429-K1433 PolarHBondContact O-N 3.39Å; E1429-K1433 WeakPolarHBondContact OE1-CE 3.33Å; E1429-K1433 IonicContact OE1-NZ 3.93Å; E1429-K1433 PolarHBondContact OE1-NZ 2.8Å; E1429-K1433 IonicContact OE2-NZ 2.64Å; E1429-K1433 PolarHBondContact OE2-NZ 2.83Å
1430	I	75	Confident	74.9	Confident	11 Å²	11	55.6 Å²	55.6	6%	0.056	28%	0.281	C	S	.	.	H	α-helix	trans	-58.2	-48.3	175.9	-67.5	172.8	0	0	0	110	S1359 L1363 L1422 N1425 D1427 K1433 A1434	S1359-I1430 WeakPolarHBondContact OG-CD1 3.47Å; L1363-I1430 HydrophobicContact CD1-CG2 3.89Å; L1422-I1430 HydrophobicContact CB-CG2 4.06Å; L1422-I1430 HydrophobicContact CD1-CG2 4.28Å; L1422-I1430 HydrophobicContact CD2-CG2 4.15Å; L1422-I1430 HydrophobicContact CG-CG2 4.4Å; N1425-I1430 HydrophobicContact CB-CG2 4.32Å; D1427-I1430 HydrophobicContact CB-CB 4.06Å; D1427-I1430 HydrophobicContact CB-CD1 3.77Å; D1427-I1430 HydrophobicContact CB-CG1 4.03Å; D1427-I1430 PolarHBondContact O-N 2.74Å; D1427-I1430 PolarHBondContact OD1-N 3.15Å; D1427-I1430 VanDerWaalsContact OD1-N 3.14Å; D1427-I1430 WeakPolarHBondContact OD2-CD1 3.4Å; I1430-K1433 PolarHBondContact O-N 2.91Å; I1430-A1434 WeakPolarHBondContact O-CB 3.28Å; I1430-A1434 PolarHBondContact O-N 3.37Å
1431	N	76.1	Confident	74.4	Confident	37 Å²	37	55.8 Å²	55.8	20%	0.198	28%	0.282	C	S	.	.	H	α-helix	trans	-60.1	-48.3	179.7	-175.6	29.6	0	0	0	111.8	G1424 D1427 E1429 K1433 A1434 I1435	G1424-N1431 PolarHBondContact N-OD1 2.89Å; D1427-N1431 WeakPolarHBondContact O-CB 3.43Å; D1427-N1431 PolarHBondContact O-N 3.05Å; E1429-N1431 VanDerWaalsContact C-N 3.34Å; E1429-N1431 PolarHBondContact O-N 2.83Å; N1431-K1433 PolarHBondContact O-N 3.13Å; N1431-A1434 PolarHBondContact O-N 3.09Å; N1431-I1435 VanDerWaalsContact O-CG1 3.26Å; N1431-I1435 WeakPolarHBondContact O-CG1 3.45Å; N1431-I1435 PolarHBondContact O-N 3.49Å; N1431-I1435 WeakPolarHBondContact OD1-CD1 3.5Å
1432	K	77	Confident	73.9	Confident	119 Å²	119	54 Å²	54	52%	0.517	27%	0.274	S	S	.	.	H	α-helix	trans	-59.8	-43.8	176	-77.4	170.3	-178.2	164.2	0	112.1	E1428 E1429 M1436	E1428-K1432 HydrophobicContact CG-CD 4.27Å; E1428-K1432 WeakPolarHBondContact O-CB 3.33Å; E1428-K1432 VanDerWaalsContact O-CG 3.23Å; E1428-K1432 WeakPolarHBondContact O-CG 3.26Å; E1428-K1432 PolarHBondContact O-N 3.1Å; E1428-K1432 WeakPolarHBondContact OE1-CE 3.32Å; E1428-K1432 IonicContact OE1-NZ 3.66Å; E1428-K1432 PolarHBondContact OE1-NZ 2.7Å; E1428-K1432 IonicContact OE2-NZ 2.7Å; E1428-K1432 PolarHBondContact OE2-NZ 3.49Å; E1429-K1432 PolarHBondContact O-N 3.28Å; K1432-M1436 WeakPolarHBondContact O-CB 3.08Å; K1432-M1436 PolarHBondContact O-N 2.83Å
1433	K	77.4	Confident	73.1	Confident	43 Å²	43	57.6 Å²	57.6	19%	0.187	29%	0.291	C	S	.	.	H	α-helix	trans	-64.1	-43.5	178.2	-75	177.8	-177.4	172.1	0	112.1	S1360 L1363 E1429 I1430 N1431 M1436 L1437	S1360-K1433 WeakPolarHBondContact O-CD 3.45Å; S1360-K1433 PolarHBondContact O-NZ 3.12Å; S1360-K1433 PolarHBondContact OG-NZ 3.34Å; L1363-K1433 HydrophobicContact CB-CB 4Å; L1363-K1433 HydrophobicContact CD1-CB 4.04Å; E1429-K1433 HydrophobicContact CG-CD 4.35Å; E1429-K1433 WeakPolarHBondContact O-CB 3.37Å; E1429-K1433 WeakPolarHBondContact O-CG 3.25Å; E1429-K1433 PolarHBondContact O-N 3.39Å; E1429-K1433 WeakPolarHBondContact OE1-CE 3.33Å; E1429-K1433 IonicContact OE1-NZ 3.93Å; E1429-K1433 PolarHBondContact OE1-NZ 2.8Å; E1429-K1433 IonicContact OE2-NZ 2.64Å; E1429-K1433 PolarHBondContact OE2-NZ 2.83Å; I1430-K1433 PolarHBondContact O-N 2.91Å; N1431-K1433 PolarHBondContact O-N 3.13Å; K1433-M1436 PolarHBondContact O-N 2.91Å; K1433-L1437 VanDerWaalsContact O-CB 3.27Å; K1433-L1437 WeakPolarHBondContact O-CB 3.24Å; K1433-L1437 PolarHBondContact O-N 2.81Å
1434	A	78.9	Confident	72.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-62	-46.4	177.2	0	0	0	0	0	112.1	L1363 V1419 L1422 V1423 I1430 N1431 M1436 L1437 L1438	L1363-A1434 HydrophobicContact CD1-CB 4.13Å; L1363-A1434 HydrophobicContact CD2-CB 4.48Å; V1419-A1434 HydrophobicContact CG1-CB 4.42Å; L1422-A1434 HydrophobicContact CB-CB 4.22Å; V1423-A1434 HydrophobicContact CG2-CB 4.22Å; I1430-A1434 WeakPolarHBondContact O-CB 3.28Å; I1430-A1434 PolarHBondContact O-N 3.37Å; N1431-A1434 PolarHBondContact O-N 3.09Å; A1434-M1436 PolarHBondContact O-N 3.33Å; A1434-L1437 PolarHBondContact O-N 3.2Å; A1434-L1438 WeakPolarHBondContact O-CG 3.49Å; A1434-L1438 PolarHBondContact O-N 2.86Å
1435	I	76.2	Confident	71.9	Confident	47 Å²	47	60.2 Å²	60.2	24%	0.241	29%	0.29	C	S	.	.	H	α-helix	trans	-60.3	-46.1	176.4	-65.3	167.4	0	0	0	111.1	V1423 N1431 K1439 I1548	V1423-I1435 HydrophobicContact CG1-CG1 4.39Å; N1431-I1435 VanDerWaalsContact O-CG1 3.26Å; N1431-I1435 WeakPolarHBondContact O-CG1 3.45Å; N1431-I1435 PolarHBondContact O-N 3.49Å; N1431-I1435 WeakPolarHBondContact OD1-CD1 3.5Å; I1435-K1439 WeakPolarHBondContact O-CG 3.29Å; I1435-K1439 PolarHBondContact O-N 3.32Å; I1435-I1548 HydrophobicContact CG1-CD1 3.87Å; I1435-I1548 HydrophobicContact CG2-CG2 4.09Å
1436	M	76.3	Confident	70.9	Confident	120 Å²	120	60.1 Å²	60.1	59%	0.591	29%	0.285	S	S	*	.	H	α-helix	trans	-64.4	-39.4	178	-176.4	-175.3	75.9	0	0	112	K1432 K1433 A1434 S1440	K1432-M1436 WeakPolarHBondContact O-CB 3.08Å; K1432-M1436 PolarHBondContact O-N 2.83Å; K1433-M1436 PolarHBondContact O-N 2.91Å; A1434-M1436 PolarHBondContact O-N 3.33Å; M1436-S1440 VanDerWaalsContact O-CB 3.3Å; M1436-S1440 WeakPolarHBondContact O-CB 3.41Å; M1436-S1440 PolarHBondContact O-N 2.76Å; M1436-S1440 PolarHBondContact O-OG 2.88Å
1437	L	75.2	Confident	69.9	Low	1 Å²	1	56.6 Å²	56.6	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-63.6	-50.2	178.5	-174.7	65.3	0	0	0	111.1	L1363 L1366 P1367 W1416 V1419 K1433 A1434 K1439 S1440 M1441	L1363-L1437 HydrophobicContact CD2-CD2 3.73Å; L1366-L1437 HydrophobicContact CB-CD1 4.08Å; L1366-L1437 HydrophobicContact CB-CD2 3.94Å; L1366-L1437 HydrophobicContact CD1-CD2 3.83Å; L1366-L1437 HydrophobicContact CG-CD2 4.49Å; P1367-L1437 HydrophobicContact CG-CD1 3.66Å; W1416-L1437 HydrophobicContact CZ3-CD2 4.13Å; W1416-L1437 HydrophobicContact CZ3-CG 4.12Å; V1419-L1437 HydrophobicContact CG1-CD2 4.09Å; V1419-L1437 HydrophobicContact CG2-CD2 4.26Å; K1433-L1437 VanDerWaalsContact O-CB 3.27Å; K1433-L1437 WeakPolarHBondContact O-CB 3.24Å; K1433-L1437 PolarHBondContact O-N 2.81Å; A1434-L1437 PolarHBondContact O-N 3.2Å; L1437-K1439 PolarHBondContact O-N 2.84Å; L1437-S1440 PolarHBondContact O-N 3.03Å; L1437-S1440 PolarHBondContact O-OG 2.81Å; L1437-M1441 HydrophobicContact CD1-CE 3.85Å; L1437-M1441 HydrophobicContact CD1-CG 3.73Å; L1437-M1441 HydrophobicContact CG-CG 4.25Å; L1437-M1441 VanDerWaalsContact O-CB 3.28Å; L1437-M1441 WeakPolarHBondContact O-CB 3.32Å; L1437-M1441 VanDerWaalsContact O-CG 3.31Å; L1437-M1441 WeakPolarHBondContact O-CG 3.3Å; L1437-M1441 PolarHBondContact O-N 2.84Å
1438	L	74.6	Confident	68.5	Low	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-57.6	-47.1	178.7	-72	170.1	0	0	0	112	W1416 V1419 V1423 A1434 N1442 I1523 A1545	W1416-L1438 HydrophobicContact CE3-CD2 4.2Å; V1419-L1438 HydrophobicContact CG1-CD1 4.49Å; V1419-L1438 HydrophobicContact CG1-CD2 4.04Å; V1419-L1438 HydrophobicContact CG1-CG 3.99Å; V1423-L1438 HydrophobicContact CG2-CD1 3.84Å; A1434-L1438 WeakPolarHBondContact O-CG 3.49Å; A1434-L1438 PolarHBondContact O-N 2.86Å; L1438-N1442 WeakPolarHBondContact O-CB 3.36Å; L1438-N1442 PolarHBondContact O-N 2.97Å; L1438-I1523 HydrophobicContact CD2-CG2 4.16Å; L1438-A1545 HydrophobicContact CD1-CB 3.88Å
1439	K	73.6	Confident	67	Low	73 Å²	73	50.8 Å²	50.8	32%	0.317	24%	0.241	S	C	.	.	H	α-helix	trans	-63.6	-48.1	177.9	-67.9	-170.3	-177	-169.9	0	112.4	I1435 L1437 I1548	I1435-K1439 WeakPolarHBondContact O-CG 3.29Å; I1435-K1439 PolarHBondContact O-N 3.32Å; L1437-K1439 PolarHBondContact O-N 2.84Å; K1439-I1548 HydrophobicContact CD-CG2 4.34Å; K1439-I1548 VanDerWaalsContact CE-CG2 3.47Å; K1439-I1548 HydrophobicContact CG-CG2 3.89Å
1440	S	67.3	Low	65.5	Low	43 Å²	43	49.2 Å²	49.2	30%	0.301	23%	0.233	S	C	.	.	H	α-helix	trans	-71.5	-29.9	-176.1	62.6	0	0	0	0	113.6	M1436 L1437 K1444	M1436-S1440 VanDerWaalsContact O-CB 3.3Å; M1436-S1440 WeakPolarHBondContact O-CB 3.41Å; M1436-S1440 PolarHBondContact O-N 2.76Å; M1436-S1440 PolarHBondContact O-OG 2.88Å; L1437-S1440 PolarHBondContact O-N 3.03Å; L1437-S1440 PolarHBondContact O-OG 2.81Å; S1440-K1444 WeakPolarHBondContact O-CG 3.5Å
1441	M	67	Low	63.9	Low	4 Å²	4	54.7 Å²	54.7	2%	0.02	26%	0.258	C	S	.	.	H	α-helix	trans	-83.9	-31.9	178.5	-68.8	-64.3	-156.5	0	0	113.1	L1366 P1367 T1370 W1416 L1437 E1443 K1444 I1445 I1523	L1366-M1441 VanDerWaalsContact O-CE 3.28Å; L1366-M1441 WeakPolarHBondContact O-CE 3.48Å; P1367-M1441 HydrophobicContact CB-CE 4.49Å; T1370-M1441 HydrophobicContact CG2-CE 3.56Å; T1370-M1441 HydrophobicContact CG2-SD 3.94Å; W1416-M1441 HydrophobicContact CH2-CB 3.91Å; W1416-M1441 HydrophobicContact CH2-CG 3.82Å; W1416-M1441 HydrophobicContact CZ3-CB 4.37Å; W1416-M1441 HydrophobicContact CZ3-CG 4.41Å; L1437-M1441 HydrophobicContact CD1-CE 3.85Å; L1437-M1441 HydrophobicContact CD1-CG 3.73Å; L1437-M1441 HydrophobicContact CG-CG 4.25Å; L1437-M1441 VanDerWaalsContact O-CB 3.28Å; L1437-M1441 WeakPolarHBondContact O-CB 3.32Å; L1437-M1441 VanDerWaalsContact O-CG 3.31Å; L1437-M1441 WeakPolarHBondContact O-CG 3.3Å; L1437-M1441 PolarHBondContact O-N 2.84Å; M1441-E1443 VanDerWaalsContact C-N 3.32Å; M1441-E1443 PolarHBondContact O-N 2.95Å; M1441-K1444 PolarHBondContact O-N 3.1Å; M1441-K1444 HydrophobicContact SD-CD 3.92Å; M1441-I1445 HydrophobicContact CB-CD1 4.25Å; M1441-I1445 WeakPolarHBondContact O-CB 3.27Å; M1441-I1445 VanDerWaalsContact O-CG1 3.27Å; M1441-I1445 WeakPolarHBondContact O-CG1 3.44Å; M1441-I1445 PolarHBondContact O-N 2.91Å; M1441-I1523 HydrophobicContact CB-CD1 3.77Å
1442	N	66.5	Low	62.1	Low	15 Å²	15	55.9 Å²	55.9	8%	0.08	27%	0.265	C	S	.	.	H	α-helix	trans	-56.5	-47.9	174.8	-177	57.2	0	0	0	111.5	L1438 Y1446 S1521 I1523 W1524 L1549	L1438-N1442 WeakPolarHBondContact O-CB 3.36Å; L1438-N1442 PolarHBondContact O-N 2.97Å; N1442-Y1446 WeakPolarHBondContact O-CB 3.32Å; N1442-Y1446 PolarHBondContact O-N 3.4Å; N1442-S1521 PolarHBondContact OD1-OG 3.06Å; N1442-I1523 HydrophobicContact CB-CD1 4.46Å; N1442-W1524 PolarHBondContact OD1-NE1 3.06Å; N1442-L1549 HydrophobicContact CB-CD2 3.79Å
1443	E	61.7	Low	60.3	Low	97 Å²	97	51 Å²	51	45%	0.453	24%	0.244	S	C	.	.	H	α-helix	trans	-57.5	-49.4	174.3	-81.6	-68.9	146.4	0	0	113.2	M1441 K1447	M1441-E1443 VanDerWaalsContact C-N 3.32Å; M1441-E1443 PolarHBondContact O-N 2.95Å; E1443-K1447 WeakPolarHBondContact O-CG 3.49Å; E1443-K1447 PolarHBondContact O-N 2.93Å
1444	K	56.9	Low	58.4	Low	94 Å²	94	52.7 Å²	52.7	41%	0.409	26%	0.255	S	S	.	.	H	α-helix	trans	-64.6	-48.2	-178.1	-73.4	175.4	174.8	-174.8	0	112	S1440 M1441 K1447 V1448	S1440-K1444 WeakPolarHBondContact O-CG 3.5Å; M1441-K1444 PolarHBondContact O-N 3.1Å; M1441-K1444 HydrophobicContact SD-CD 3.92Å; K1444-K1447 PolarHBondContact O-N 3.18Å; K1444-V1448 WeakPolarHBondContact O-CG2 3.38Å; K1444-V1448 PolarHBondContact O-N 2.83Å
1445	I	54.3	Low	56.3	Low	15 Å²	15	54.9 Å²	54.9	8%	0.077	27%	0.271	C	S	.	.	H	α-helix	trans	-69.8	-39.3	-177.1	-62	174.8	0	0	0	110	W1416 M1441 K1447 V1448 F1449 P1522 I1523	W1416-I1445 HydrophobicContact CZ2-CD1 3.89Å; M1441-I1445 HydrophobicContact CB-CD1 4.25Å; M1441-I1445 WeakPolarHBondContact O-CB 3.27Å; M1441-I1445 VanDerWaalsContact O-CG1 3.27Å; M1441-I1445 WeakPolarHBondContact O-CG1 3.44Å; M1441-I1445 PolarHBondContact O-N 2.91Å; I1445-K1447 PolarHBondContact O-N 3.23Å; I1445-V1448 PolarHBondContact O-N 2.7Å; I1445-F1449 HydrophobicContact CG2-CD2 3.66Å; I1445-F1449 HydrophobicContact CG2-CE2 3.84Å; I1445-F1449 WeakPolarHBondContact O-CD2 3.47Å; I1445-F1449 PolarHBondContact O-N 3.41Å; I1445-P1522 HydrophobicContact CG2-CG 4.41Å; I1445-I1523 HydrophobicContact CD1-CD1 3.85Å; I1445-I1523 HydrophobicContact CD1-CG1 4.17Å
1446	Y	54.2	Low	54.1	Low	57 Å²	57	57.6 Å²	57.6	22%	0.224	28%	0.281	C	S	.	.	H	α-helix	trans	-57.7	-48.2	174.9	-179.3	-103.8	0	0	0	112.1	N1442 V1448 F1449 Q1450 S1519	N1442-Y1446 WeakPolarHBondContact O-CB 3.32Å; N1442-Y1446 PolarHBondContact O-N 3.4Å; Y1446-V1448 VanDerWaalsContact C-N 3.33Å; Y1446-V1448 PolarHBondContact O-N 3.19Å; Y1446-F1449 PolarHBondContact O-N 3.47Å; Y1446-Q1450 WeakPolarHBondContact O-CB 3.33Å; Y1446-Q1450 PolarHBondContact O-N 2.83Å; Y1446-S1519 WeakPolarHBondContact CD2-O 3.36Å; Y1446-S1519 WeakPolarHBondContact CE2-O 3.28Å
1447	K	50.5	Low	51.9	Low	122 Å²	122	56.3 Å²	56.3	53%	0.53	27%	0.274	S	S	.	.	H	α-helix	trans	-57.6	-43.3	176.9	-71.7	174.5	-176.9	-174.8	0	112.4	E1443 K1444 I1445 Q1450 H1451	E1443-K1447 WeakPolarHBondContact O-CG 3.49Å; E1443-K1447 PolarHBondContact O-N 2.93Å; K1444-K1447 PolarHBondContact O-N 3.18Å; I1445-K1447 PolarHBondContact O-N 3.23Å; K1447-Q1450 PolarHBondContact O-N 3.09Å; K1447-H1451 PolarHBondContact O-CD2 3.09Å; K1447-H1451 PolarHBondContact O-N 3.07Å
1448	V	45.6	Very low	49.9	Very low	47 Å²	47	64.6 Å²	64.6	29%	0.285	31%	0.31	S	S	.	.	H	α-helix	trans	-64.6	-44.4	176.8	173.5	0	0	0	0	111.7	F1377 K1444 I1445 Y1446 Q1450 H1451 L1452	F1377-V1448 HydrophobicContact CD1-CG1 3.8Å; F1377-V1448 HydrophobicContact CD2-CG1 4.47Å; F1377-V1448 HydrophobicContact CE1-CG1 3.5Å; F1377-V1448 VanDerWaalsContact CE1-CG1 3.5Å; F1377-V1448 HydrophobicContact CE2-CG1 4.2Å; F1377-V1448 HydrophobicContact CG-CG1 4.29Å; F1377-V1448 HydrophobicContact CZ-CG1 3.73Å; K1444-V1448 WeakPolarHBondContact O-CG2 3.38Å; K1444-V1448 PolarHBondContact O-N 2.83Å; I1445-V1448 PolarHBondContact O-N 2.7Å; Y1446-V1448 VanDerWaalsContact C-N 3.33Å; Y1446-V1448 PolarHBondContact O-N 3.19Å; V1448-Q1450 PolarHBondContact O-N 2.93Å; V1448-H1451 PolarHBondContact O-N 3.37Å; V1448-L1452 PolarHBondContact O-N 3.29Å
1449	F	45.3	Very low	47.8	Very low	23 Å²	23	70.7 Å²	70.7	10%	0.101	34%	0.342	C	S	.	.	H	α-helix	trans	-67.2	-33.4	177.6	-92.7	-98.5	0	0	0	113	I1445 Y1446 L1452 T1453 P1522	I1445-F1449 HydrophobicContact CG2-CD2 3.66Å; I1445-F1449 HydrophobicContact CG2-CE2 3.84Å; I1445-F1449 WeakPolarHBondContact O-CD2 3.47Å; I1445-F1449 PolarHBondContact O-N 3.41Å; Y1446-F1449 PolarHBondContact O-N 3.47Å; F1449-L1452 PolarHBondContact O-N 3.19Å; F1449-T1453 WeakPolarHBondContact O-CB 3.25Å; F1449-T1453 PolarHBondContact O-N 3.21Å; F1449-T1453 PolarHBondContact O-OG1 3.49Å; F1449-P1522 HydrophobicContact CE1-CG 4.46Å; F1449-P1522 VanDerWaalsContact CE2-CD 3.41Å; F1449-P1522 HydrophobicContact CE2-CG 3.64Å; F1449-P1522 HydrophobicContact CZ-CG 3.55Å
1450	Q	46.3	Very low	45.6	Very low	66 Å²	66	73.9 Å²	73.9	31%	0.308	36%	0.357	S	S	.	.	H	α-helix	trans	-64	-41	176	-163.1	177.4	25.3	0	0	111.4	Y1446 K1447 V1448 T1453 N1454	Y1446-Q1450 WeakPolarHBondContact O-CB 3.33Å; Y1446-Q1450 PolarHBondContact O-N 2.83Å; K1447-Q1450 PolarHBondContact O-N 3.09Å; V1448-Q1450 PolarHBondContact O-N 2.93Å; Q1450-T1453 PolarHBondContact O-N 3.29Å; Q1450-N1454 WeakPolarHBondContact O-CB 3.31Å; Q1450-N1454 PolarHBondContact O-N 2.82Å; Q1450-N1454 PolarHBondContact O-ND2 3.05Å; Q1450-N1454 PolarHBondContact O-OD1 3.45Å
1451	H	41.2	Very low	43.8	Very low	125 Å²	125	78.5 Å²	78.5	58%	0.579	38%	0.378	S	S	*	.	H	α-helix	trans	-60.8	-44.1	172.8	-84.2	-79.2	0	0	0	112.7	K1447 V1448 T1453 N1454 S1455	K1447-H1451 PolarHBondContact O-CD2 3.09Å; K1447-H1451 PolarHBondContact O-N 3.07Å; V1448-H1451 PolarHBondContact O-N 3.37Å; H1451-T1453 VanDerWaalsContact C-N 3.3Å; H1451-T1453 PolarHBondContact O-N 2.96Å; H1451-N1454 PolarHBondContact O-N 3.11Å; H1451-S1455 PolarHBondContact O-N 2.89Å; H1451-S1455 PolarHBondContact O-OG 2.71Å
1452	L	38.5	Very low	41.9	Very low	63 Å²	63	82.8 Å²	82.8	33%	0.33	41%	0.408	S	S	.	.	H	α-helix	trans	-63.7	-31.8	175.2	-101.2	151.6	0	0	0	113.3	V1448 F1449 S1455 K1456	V1448-L1452 PolarHBondContact O-N 3.29Å; F1449-L1452 PolarHBondContact O-N 3.19Å; L1452-S1455 PolarHBondContact O-OG 3.02Å; L1452-K1456 PolarHBondContact O-N 3.41Å
1453	T	38.3	Very low	39.9	Very low	15 Å²	15	85.8 Å²	85.8	9%	0.092	43%	0.431	C	S	.	.	H	α-helix	trans	-80.1	-38	178.6	-61.3	0	0	0	0	111.8	F1449 Q1450 H1451 K1456 Q1457 S1518	F1449-T1453 WeakPolarHBondContact O-CB 3.25Å; F1449-T1453 PolarHBondContact O-N 3.21Å; F1449-T1453 PolarHBondContact O-OG1 3.49Å; Q1450-T1453 PolarHBondContact O-N 3.29Å; H1451-T1453 VanDerWaalsContact C-N 3.3Å; H1451-T1453 PolarHBondContact O-N 2.96Å; T1453-K1456 VanDerWaalsContact O-CB 3.25Å; T1453-K1456 WeakPolarHBondContact O-CB 3.42Å; T1453-K1456 PolarHBondContact O-N 2.99Å; T1453-Q1457 PolarHBondContact O-N 3.48Å; T1453-S1518 WeakPolarHBondContact CG2-OG 2.97Å; T1453-S1518 PolarHBondContact OG1-O 2.81Å
1454	N	38.7	Very low	38.2	Very low	79 Å²	79	88 Å²	88	42%	0.422	45%	0.445	S	S	.	.	H	α-helix	trans	-67.6	-36	176.3	-68.7	-10.3	0	0	0	112	Q1450 H1451 K1456 Q1457 K1458	Q1450-N1454 WeakPolarHBondContact O-CB 3.31Å; Q1450-N1454 PolarHBondContact O-N 2.82Å; Q1450-N1454 PolarHBondContact O-ND2 3.05Å; Q1450-N1454 PolarHBondContact O-OD1 3.45Å; H1451-N1454 PolarHBondContact O-N 3.11Å; N1454-K1456 VanDerWaalsContact C-N 3.35Å; N1454-Q1457 PolarHBondContact O-N 2.86Å; N1454-K1458 PolarHBondContact O-N 3.39Å; N1454-K1458 VanDerWaalsContact O-N 3.16Å
1455	S	34.5	Very low	36.9	Very low	47 Å²	47	88.5 Å²	88.5	33%	0.329	46%	0.456	S	S	.	.	H	α-helix	trans	-66.3	-37.4	172.4	65.6	0	0	0	0	111.9	H1451 L1452 Q1457 K1458 L1459	H1451-S1455 PolarHBondContact O-N 2.89Å; H1451-S1455 PolarHBondContact O-OG 2.71Å; L1452-S1455 PolarHBondContact O-OG 3.02Å; S1455-Q1457 PolarHBondContact O-N 3.27Å; S1455-K1458 PolarHBondContact O-N 2.96Å; S1455-L1459 PolarHBondContact O-N 3.29Å
1456	K	29.2	Very low	35.7	Very low	103 Å²	103	93.6 Å²	93.6	45%	0.448	48%	0.48	S	S	.	.	H	α-helix	trans	-57.9	-44.5	171.3	-116.8	-178.7	-178.9	179.2	0	112.9	L1452 T1453 N1454 L1459 H1460	L1452-K1456 PolarHBondContact O-N 3.41Å; T1453-K1456 VanDerWaalsContact O-CB 3.25Å; T1453-K1456 WeakPolarHBondContact O-CB 3.42Å; T1453-K1456 PolarHBondContact O-N 2.99Å; N1454-K1456 VanDerWaalsContact C-N 3.35Å; K1456-L1459 PolarHBondContact O-N 2.94Å; K1456-H1460 PolarHBondContact O-N 2.91Å
1457	Q	31.6	Very low	34.5	Very low	94 Å²	94	99.2 Å²	99.2	44%	0.439	51%	0.51	S	S	.	.	H	α-helix	trans	-65.6	-40.6	177.7	-74.5	-175.6	-12.8	0	0	112.2	T1453 N1454 S1455 L1459 H1460 L1461	T1453-Q1457 PolarHBondContact O-N 3.48Å; N1454-Q1457 PolarHBondContact O-N 2.86Å; S1455-Q1457 PolarHBondContact O-N 3.27Å; Q1457-L1459 VanDerWaalsContact C-N 3.3Å; Q1457-L1459 PolarHBondContact O-N 3.44Å; Q1457-H1460 PolarHBondContact O-N 3.01Å; Q1457-L1461 WeakPolarHBondContact O-CG 3.4Å; Q1457-L1461 PolarHBondContact O-N 2.94Å
1458	K	33.2	Very low	33.4	Very low	175 Å²	175	99 Å²	99	76%	0.761	51%	0.514	S	S	*	.	H	α-helix	trans	-60.8	-36	172.7	-91.1	-177.5	173.1	178.4	0	113.3	N1454 S1455	N1454-K1458 PolarHBondContact O-N 3.39Å; N1454-K1458 VanDerWaalsContact O-N 3.16Å; S1455-K1458 PolarHBondContact O-N 2.96Å
1459	L	29.7	Very low	32.5	Very low	128 Å²	128	105.6 Å²	105.6	67%	0.67	54%	0.542	S	S	*	.	H	α-helix	trans	-75	-36.4	176.5	-79.2	162.7	0	0	0	113	S1455 K1456 Q1457 S1462	S1455-L1459 PolarHBondContact O-N 3.29Å; K1456-L1459 PolarHBondContact O-N 2.94Å; Q1457-L1459 VanDerWaalsContact C-N 3.3Å; Q1457-L1459 PolarHBondContact O-N 3.44Å; L1459-S1462 PolarHBondContact O-OG 3.41Å
1460	H	27.4	Very low	31.7	Very low	140 Å²	140	107.7 Å²	107.7	65%	0.648	57%	0.57	S	S	*	*	H	α-helix	trans	-72.7	-27.9	176.4	-98.9	-78.6	0	0	0	113.6	K1456 Q1457 S1462 S1463	K1456-H1460 PolarHBondContact O-N 2.91Å; Q1457-H1460 PolarHBondContact O-N 3.01Å; H1460-S1462 PolarHBondContact O-N 3.43Å; H1460-S1462 VanDerWaalsContact O-N 3.14Å; H1460-S1463 WeakPolarHBondContact O-CB 3.37Å; H1460-S1463 PolarHBondContact O-N 3.45Å; H1460-S1463 PolarHBondContact O-OG 2.8Å; H1460-S1463 VanDerWaalsContact O-OG 3.12Å
1461	L	28.4	Very low	31	Very low	139 Å²	139	109.8 Å²	109.8	73%	0.728	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-1.6	176.1	-79.2	165	0	0	0	114.5	Q1457 S1463	Q1457-L1461 WeakPolarHBondContact O-CG 3.4Å; Q1457-L1461 PolarHBondContact O-N 2.94Å; L1461-S1463 VanDerWaalsContact C-N 3.3Å
1462	S	28.2	Very low	30.6	Very low	95 Å²	95	110.5 Å²	110.5	66%	0.664	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	15.1	169.6	83.5	0	0	0	0	113.6	L1459 H1460	L1459-S1462 PolarHBondContact O-OG 3.41Å; H1460-S1462 PolarHBondContact O-N 3.43Å; H1460-S1462 VanDerWaalsContact O-N 3.14Å
1463	S	24.6	Very low	30.6	Very low	78 Å²	78	114.9 Å²	114.9	55%	0.545	62%	0.619	S	S	.	*			trans	-96.7	34.5	-177.7	78.4	0	0	0	0	115	H1460 L1461 V1465	H1460-S1463 WeakPolarHBondContact O-CB 3.37Å; H1460-S1463 PolarHBondContact O-N 3.45Å; H1460-S1463 PolarHBondContact O-OG 2.8Å; H1460-S1463 VanDerWaalsContact O-OG 3.12Å; L1461-S1463 VanDerWaalsContact C-N 3.3Å; S1463-V1465 PolarHBondContact O-N 2.99Å
1464	D	26.5	Very low	30.4	Very low	142 Å²	142	121.9 Å²	121.9	76%	0.759	65%	0.651	S	S	*	*			trans	-73.1	43.8	171.7	-75.2	-24.6	0	0	0	112.7
1465	V	28.9	Very low	30.3	Very low	105 Å²	105	122.1 Å²	122.1	64%	0.636	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-92.6	-1.5	-175.3	-178.5	0	0	0	0	112.1	S1463 M1467	S1463-V1465 PolarHBondContact O-N 2.99Å; V1465-M1467 VanDerWaalsContact C-N 3.3Å; V1465-M1467 PolarHBondContact O-N 2.85Å
1466	Q	28.9	Very low	30.2	Very low	123 Å²	123	126.2 Å²	126.2	58%	0.575	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-75.5	-9.4	179.7	-90.2	-176.3	-28.6	0	0	115.2
1467	M	29.7	Very low	30.5	Very low	175 Å²	175	127 Å²	127	86%	0.862	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-94	9.3	-177.2	-70.7	-62.2	-67.3	0	0	115.5	V1465	V1465-M1467 VanDerWaalsContact C-N 3.3Å; V1465-M1467 PolarHBondContact O-N 2.85Å
1468	L	27.1	Very low	30.4	Very low	118 Å²	118	130.1 Å²	130.1	62%	0.618	69%	0.687	S	S	*	*			trans	-120.4	26.3	-173.7	-74.6	171.2	0	0	0	115.9	G1470	L1468-G1470 PolarHBondContact O-N 2.67Å
1469	Q	26.2	Very low	30.2	Very low	184 Å²	184	127.6 Å²	127.6	86%	0.86	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	21.8	169.7	-76.8	-170.4	-17.9	0	0	114.2
1470	G	28.9	Very low	30.3	Very low	67 Å²	67	128 Å²	128	69%	0.691	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	6	-161.3	0	0	0	0	0	118	L1468	L1468-G1470 PolarHBondContact O-N 2.67Å
1471	T	31.4	Very low	30.5	Very low	111 Å²	111	126.1 Å²	126.1	68%	0.681	67%	0.67	S	S	*	*			trans	-146.5	105.8	175.7	43.7	0	0	0	0	112.7
1472	N	33	Very low	30.5	Very low	139 Å²	139	124.1 Å²	124.1	74%	0.743	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	152.5	172	-70.7	-28.7	0	0	0	111.8
1473	N	38.9	Very low	30.6	Very low	155 Å²	155	127.1 Å²	127.1	83%	0.829	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	99.4	1.2	166.9	-54.5	-9.7	0	0	0	120.2
1474	H	34.1	Very low	30.9	Very low	163 Å²	163	130.8 Å²	130.8	76%	0.755	67%	0.667	S	S	*	*	S	Bend	trans	-121.6	5.5	166.4	-81	-44.5	0	0	0	116.2	N1476	H1474-N1476 VanDerWaalsContact C-N 3.3Å; H1474-N1476 PolarHBondContact O-N 2.83Å
1475	I	35.7	Very low	31	Very low	83 Å²	83	129.3 Å²	129.3	43%	0.426	66%	0.659	S	S	.	*	H	α-helix	trans	-60.9	-33.7	-178.6	-65	172.4	0	0	0	112.9	N1477 Y1478 H1479	I1475-N1477 PolarHBondContact O-N 3.4Å; I1475-Y1478 PolarHBondContact O-N 3.47Å; I1475-H1479 PolarHBondContact O-N 3.49Å
1476	N	33.7	Very low	30.8	Very low	133 Å²	133	127.4 Å²	127.4	71%	0.711	65%	0.65	S	S	*	*	H	α-helix	trans	-63.5	-34.4	-173.2	-71.8	-4.3	0	0	0	114.2	H1474 Q1480	H1474-N1476 VanDerWaalsContact C-N 3.3Å; H1474-N1476 PolarHBondContact O-N 2.83Å; N1476-Q1480 WeakPolarHBondContact O-CG 3.29Å
1477	N	34.6	Very low	30.7	Very low	119 Å²	119	129.6 Å²	129.6	64%	0.636	65%	0.653	S	S	*	*	H	α-helix	trans	-78.4	-34.9	176.7	-75.8	-3.8	0	0	0	111.9	I1475 Q1480 L1481	I1475-N1477 PolarHBondContact O-N 3.4Å; N1477-Q1480 PolarHBondContact O-N 3.13Å; N1477-L1481 PolarHBondContact O-N 2.98Å; N1477-L1481 VanDerWaalsContact O-N 3.11Å
1478	Y	29.2	Very low	30.5	Very low	161 Å²	161	125.8 Å²	125.8	63%	0.631	64%	0.636	S	S	*	*	H	α-helix	trans	-71.3	-37.5	-179.7	-123.2	-83.2	0	0	0	112.4	I1475 Q1480 L1481 I1482	I1475-Y1478 PolarHBondContact O-N 3.47Å; Y1478-Q1480 VanDerWaalsContact C-N 3.33Å; Y1478-Q1480 PolarHBondContact O-N 3.44Å; Y1478-L1481 PolarHBondContact O-N 3.48Å; Y1478-I1482 HydrophobicContact CD1-CD1 4.11Å; Y1478-I1482 HydrophobicContact CD1-CG1 4.41Å; Y1478-I1482 WeakPolarHBondContact O-CG1 3.39Å; Y1478-I1482 PolarHBondContact O-N 3.01Å
1479	H	28.6	Very low	30.4	Very low	121 Å²	121	125.1 Å²	125.1	56%	0.56	64%	0.637	S	S	*	*	H	α-helix	trans	-66	-31.6	172.7	-87.6	-29.3	0	0	0	113.4	I1475 K1483	I1475-H1479 PolarHBondContact O-N 3.49Å; H1479-K1483 WeakPolarHBondContact O-CB 3.2Å; H1479-K1483 PolarHBondContact O-N 2.98Å
1480	Q	32.8	Very low	30.4	Very low	138 Å²	138	120.5 Å²	120.5	65%	0.645	62%	0.621	S	S	*	*	H	α-helix	trans	-70	-36.9	172.4	-72.3	-171.4	9.7	0	0	112.4	N1476 N1477 Y1478 K1484	N1476-Q1480 WeakPolarHBondContact O-CG 3.29Å; N1477-Q1480 PolarHBondContact O-N 3.13Å; Y1478-Q1480 VanDerWaalsContact C-N 3.33Å; Y1478-Q1480 PolarHBondContact O-N 3.44Å; Q1480-K1484 PolarHBondContact O-N 2.69Å
1481	L	30.4	Very low	30.2	Very low	100 Å²	100	121.6 Å²	121.6	52%	0.524	62%	0.616	S	S	.	*	H	α-helix	trans	-67.7	-43.4	175.9	-146.5	83.2	0	0	0	111.7	N1477 Y1478 K1484 N1485	N1477-L1481 PolarHBondContact O-N 2.98Å; N1477-L1481 VanDerWaalsContact O-N 3.11Å; Y1478-L1481 PolarHBondContact O-N 3.48Å; L1481-K1484 PolarHBondContact O-N 2.99Å; L1481-N1485 PolarHBondContact O-N 2.88Å
1482	I	29.8	Very low	30	Very low	96 Å²	96	123.7 Å²	123.7	49%	0.492	61%	0.612	S	S	.	*	H	α-helix	trans	-65.3	-40.1	176.1	-66.1	172.3	0	0	0	110.9	Y1478 K1484 N1485 S1486	Y1478-I1482 HydrophobicContact CD1-CD1 4.11Å; Y1478-I1482 HydrophobicContact CD1-CG1 4.41Å; Y1478-I1482 WeakPolarHBondContact O-CG1 3.39Å; Y1478-I1482 PolarHBondContact O-N 3.01Å; I1482-K1484 VanDerWaalsContact C-N 3.29Å; I1482-K1484 PolarHBondContact O-N 3.33Å; I1482-N1485 PolarHBondContact O-N 3.47Å; I1482-S1486 VanDerWaalsContact O-CB 3.28Å; I1482-S1486 WeakPolarHBondContact O-CB 3.28Å; I1482-S1486 PolarHBondContact O-N 2.91Å; I1482-S1486 PolarHBondContact O-OG 3.46Å
1483	K	29.9	Very low	29.7	Very low	158 Å²	158	120.1 Å²	120.1	69%	0.687	60%	0.596	S	S	*	*	H	α-helix	trans	-65.9	-25.8	173.5	-87	-171.5	171.9	-176	0	114.1	H1479	H1479-K1483 WeakPolarHBondContact O-CB 3.2Å; H1479-K1483 PolarHBondContact O-N 2.98Å
1484	K	30.7	Very low	29.4	Very low	156 Å²	156	113.4 Å²	113.4	68%	0.678	56%	0.56	S	S	*	*	H	α-helix	trans	-73.9	-46.5	170.1	-81.7	-173.4	172.8	-177.2	0	111.2	Q1480 L1481 I1482 R1487	Q1480-K1484 PolarHBondContact O-N 2.69Å; L1481-K1484 PolarHBondContact O-N 2.99Å; I1482-K1484 VanDerWaalsContact C-N 3.29Å; I1482-K1484 PolarHBondContact O-N 3.33Å; K1484-R1487 PolarHBondContact O-N 3Å
1485	N	27.6	Very low	29.2	Very low	111 Å²	111	107.6 Å²	107.6	59%	0.594	53%	0.532	S	S	*	.	H	α-helix	trans	-74.5	-26.2	-178.3	-69	4.9	0	0	0	113.2	L1481 I1482 R1487 N1488	L1481-N1485 PolarHBondContact O-N 2.88Å; I1482-N1485 PolarHBondContact O-N 3.47Å; N1485-R1487 PolarHBondContact O-N 2.85Å; N1485-N1488 CarbonylContact O-C 3.54Å; N1485-N1488 PolarHBondContact O-N 3.39Å; N1485-N1488 VanDerWaalsContact O-N 3.1Å
1486	S	26.3	Very low	28.8	Very low	64 Å²	64	106.7 Å²	106.7	45%	0.448	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-75	-9.8	174.6	75.5	0	0	0	0	113.9	I1482 T1489	I1482-S1486 VanDerWaalsContact O-CB 3.28Å; I1482-S1486 WeakPolarHBondContact O-CB 3.28Å; I1482-S1486 PolarHBondContact O-N 2.91Å; I1482-S1486 PolarHBondContact O-OG 3.46Å; S1486-T1489 WeakPolarHBondContact O-CG2 3.27Å
1487	R	26.5	Very low	28.5	Very low	170 Å²	170	104.1 Å²	104.1	64%	0.642	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-81	-20.8	166.3	-75.6	-177.7	169.6	-172.6	-5.9	112.1	K1484 N1485 T1489	K1484-R1487 PolarHBondContact O-N 3Å; N1485-R1487 PolarHBondContact O-N 2.85Å; R1487-T1489 VanDerWaalsContact C-N 3.29Å; R1487-T1489 PolarHBondContact O-N 2.98Å
1488	N	25.8	Very low	28.3	Very low	94 Å²	94	101.6 Å²	101.6	50%	0.503	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-96.4	38.3	170.3	-68.6	27.2	0	0	0	110.9	N1485 V1490	N1485-N1488 CarbonylContact O-C 3.54Å; N1485-N1488 PolarHBondContact O-N 3.39Å; N1485-N1488 VanDerWaalsContact O-N 3.1Å; N1488-V1490 PolarHBondContact O-N 3.33Å
1489	T	25.1	Very low	28.3	Very low	105 Å²	105	94.3 Å²	94.3	64%	0.644	47%	0.469	S	S	*	.			trans	-58.1	107.2	161.4	42.3	0	0	0	0	107.8	S1486 R1487	S1486-T1489 WeakPolarHBondContact O-CG2 3.27Å; R1487-T1489 VanDerWaalsContact C-N 3.29Å; R1487-T1489 PolarHBondContact O-N 2.98Å
1490	V	25.9	Very low	28.3	Very low	87 Å²	87	89.5 Å²	89.5	53%	0.527	45%	0.449	S	S	.	.			trans	-35.1	113.6	177.5	176.8	0	0	0	0	108.6	N1488 R1492	N1488-V1490 PolarHBondContact O-N 3.33Å; V1490-R1492 PolarHBondContact O-N 2.85Å
1491	P	25.2	Very low	28.3	Very low	90 Å²	90	84.9 Å²	84.9	58%	0.584	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-53.4	117.5	-173.1	-28.3	34.8	0	0	0	108.7	P1493	P1491-P1493 VanDerWaalsContact O-CD 3.25Å; P1491-P1493 WeakPolarHBondContact O-CD 3.5Å
1492	R	26	Very low	28.4	Very low	155 Å²	155	82.1 Å²	82.1	59%	0.585	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-56.6	121.4	174	-67.8	-175	-175.9	-178.8	4.2	105.5	V1490 I1494	V1490-R1492 PolarHBondContact O-N 2.85Å; R1492-I1494 PolarHBondContact O-N 2.83Å
1493	P	26.9	Very low	28.4	Very low	64 Å²	64	79.8 Å²	79.8	42%	0.416	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-51.8	146.2	178.5	-28.7	36	0	0	0	109.7	P1491 F1495 Y1496	P1491-P1493 VanDerWaalsContact O-CD 3.25Å; P1491-P1493 WeakPolarHBondContact O-CD 3.5Å; P1493-F1495 HydrophobicContact CB-CD2 3.65Å; P1493-F1495 HydrophobicContact CB-CE2 4.21Å; P1493-F1495 PolarHBondContact O-N 2.69Å; P1493-Y1496 PolarHBondContact O-N 3.45Å
1494	I	32.3	Very low	28.4	Very low	14 Å²	14	72.8 Å²	72.8	7%	0.072	37%	0.373	C	S	.	.	H	α-helix	trans	-44.1	-33.7	-178.7	-72.1	165.8	0	0	0	111.9	Y1336 Q1339 L1340 R1492 Y1496 L1497 M1498	Y1336-I1494 HydrophobicContact CD1-CD1 4.15Å; Y1336-I1494 HydrophobicContact CD2-CD1 3.85Å; Y1336-I1494 HydrophobicContact CD2-CG1 4.03Å; Y1336-I1494 HydrophobicContact CE1-CD1 4.06Å; Y1336-I1494 HydrophobicContact CE1-CG1 3.97Å; Y1336-I1494 HydrophobicContact CE2-CD1 3.78Å; Y1336-I1494 HydrophobicContact CE2-CG1 3.42Å; Y1336-I1494 VanDerWaalsContact CE2-CG1 3.42Å; Y1336-I1494 HydrophobicContact CG-CD1 4.04Å; Q1339-I1494 HydrophobicContact CB-CD1 4.31Å; L1340-I1494 HydrophobicContact CB-CD1 4.38Å; L1340-I1494 HydrophobicContact CD1-CG2 3.62Å; R1492-I1494 PolarHBondContact O-N 2.83Å; I1494-Y1496 PolarHBondContact O-N 3.02Å; I1494-L1497 PolarHBondContact O-N 3.38Å; I1494-M1498 HydrophobicContact CG2-CB 4.4Å; I1494-M1498 PolarHBondContact O-N 2.81Å
1495	F	29.6	Very low	28.4	Very low	40 Å²	40	68 Å²	68	18%	0.175	35%	0.353	C	S	.	.	H	α-helix	trans	-56.4	-7.6	174.5	-42.6	-57.9	0	0	0	116.6	Y1343 L1407 H1411 P1493 G1499	Y1343-F1495 HydrophobicContact CD2-CD1 4.14Å; Y1343-F1495 AromaticContact CD2-CE1 3.56Å; Y1343-F1495 HydrophobicContact CD2-CE1 3.56Å; Y1343-F1495 AromaticContact CE2-CD1 3.54Å; Y1343-F1495 HydrophobicContact CE2-CD1 3.54Å; Y1343-F1495 AromaticContact CE2-CE1 3.44Å; Y1343-F1495 HydrophobicContact CE2-CE1 3.44Å; Y1343-F1495 VanDerWaalsContact CE2-CE1 3.44Å; Y1343-F1495 HydrophobicContact CG-CE1 4.33Å; Y1343-F1495 AromaticContact CZ-CD1 3.86Å; L1407-F1495 HydrophobicContact CD1-CZ 4.4Å; L1407-F1495 HydrophobicContact CD2-CE1 4.33Å; L1407-F1495 HydrophobicContact CD2-CE2 3.89Å; L1407-F1495 HydrophobicContact CD2-CZ 3.77Å; H1411-F1495 HydrophobicContact CB-CB 4.13Å; H1411-F1495 HydrophobicContact CB-CD1 4.29Å; H1411-F1495 HydrophobicContact CB-CG 4.47Å; H1411-F1495 AromaticContact CD2-CG 3.85Å; P1493-F1495 HydrophobicContact CB-CD2 3.65Å; P1493-F1495 HydrophobicContact CB-CE2 4.21Å; P1493-F1495 PolarHBondContact O-N 2.69Å; F1495-G1499 WeakPolarHBondContact O-CA 3.49Å; F1495-G1499 PolarHBondContact O-N 2.99Å
1496	Y	27.9	Very low	28.5	Very low	65 Å²	65	67.4 Å²	67.4	26%	0.255	34%	0.343	S	S	.	.	H	α-helix	trans	-106	-32.9	166	-78.5	-79.2	0	0	0	113.1	P1493 I1494 I1502	P1493-Y1496 PolarHBondContact O-N 3.45Å; I1494-Y1496 PolarHBondContact O-N 3.02Å; Y1496-I1502 WeakPolarHBondContact O-CD1 3.37Å; Y1496-I1502 WeakPolarHBondContact O-CG1 3.13Å
1497	L	27.7	Very low	28.6	Very low	79 Å²	79	64.6 Å²	64.6	41%	0.414	32%	0.323	S	S	.	.	H	α-helix	trans	-74.6	-28.6	176.8	-77.8	163.6	0	0	0	112.7	Y1336 I1494 I1502	Y1336-L1497 WeakPolarHBondContact OH-CD1 3.35Å; I1494-L1497 PolarHBondContact O-N 3.38Å; L1497-I1502 HydrophobicContact CD2-CD1 4.3Å
1498	M	29.7	Very low	28.8	Very low	65 Å²	65	57.9 Å²	57.9	32%	0.32	30%	0.3	S	S	.	.	S	Bend	trans	-137.1	14.4	-180	-68	-77.9	143.3	0	0	112.5	L1340 I1494	L1340-M1498 HydrophobicContact CD1-CB 4.26Å; L1340-M1498 HydrophobicContact CD1-CG 4.17Å; I1494-M1498 HydrophobicContact CG2-CB 4.4Å; I1494-M1498 PolarHBondContact O-N 2.81Å
1499	G	29.6	Very low	29.3	Very low	9 Å²	9	58 Å²	58	9%	0.093	30%	0.3	C	S	.	.	S	Bend	trans	-103.9	-172.2	162.1	0	0	0	0	0	110.2	F1495 P1501	F1495-G1499 WeakPolarHBondContact O-CA 3.49Å; F1495-G1499 PolarHBondContact O-N 2.99Å; G1499-P1501 WeakPolarHBondContact O-CA 3.3Å
1500	P	29.6	Very low	29.5	Very low	19 Å²	19	59.8 Å²	59.8	12%	0.123	30%	0.299	C	S	.	.	S	Bend	trans	-47.8	109.2	-156.7	-17.9	27.7	0	0	0	110	H1411 T1413 I1502 P1522 I1525	H1411-P1500 WeakPolarHBondContact O-CD 3.5Å; T1413-P1500 HydrophobicContact CG2-CB 3.58Å; T1413-P1500 HydrophobicContact CG2-CG 3.83Å; P1500-I1502 PolarHBondContact O-N 3.03Å; P1500-P1522 HydrophobicContact CG-CB 4.02Å; P1500-P1522 HydrophobicContact CG-CG 4.24Å; P1500-I1525 HydrophobicContact CB-CB 4.29Å; P1500-I1525 HydrophobicContact CB-CD1 3.91Å; P1500-I1525 HydrophobicContact CB-CG2 3.82Å
1501	P	32	Very low	29.9	Very low	42 Å²	42	59.7 Å²	59.7	27%	0.273	30%	0.296	S	S	.	.			trans	-57.5	139.6	-140.6	12.5	-28.6	0	0	0	111.7	G1499 H1503 I1504	G1499-P1501 WeakPolarHBondContact O-CA 3.3Å; P1501-H1503 HydrophobicContact CB-CB 3.97Å; P1501-H1503 VanDerWaalsContact CB-CD2 3.5Å; P1501-H1503 WeakPolarHBondContact CB-CD2 3.43Å; P1501-H1503 CarbonylContact O-C 3.56Å; P1501-H1503 PolarHBondContact O-N 2.82Å; P1501-I1504 HydrophobicContact CG-CD1 3.84Å; P1501-I1504 HydrophobicContact CG-CG1 4.12Å; P1501-I1504 PolarHBondContact O-N 3.42Å
1502	I	32.1	Very low	30.2	Very low	42 Å²	42	60.3 Å²	60.3	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-46.8	-30.4	171.3	-79.8	158.7	0	0	0	110.6	Y1496 L1497 P1500 I1504 Q1505 Y1506	Y1496-I1502 WeakPolarHBondContact O-CD1 3.37Å; Y1496-I1502 WeakPolarHBondContact O-CG1 3.13Å; L1497-I1502 HydrophobicContact CD2-CD1 4.3Å; P1500-I1502 PolarHBondContact O-N 3.03Å; I1502-I1504 PolarHBondContact O-N 3.47Å; I1502-Q1505 PolarHBondContact O-N 2.83Å; I1502-Y1506 WeakPolarHBondContact O-CB 3.38Å; I1502-Y1506 PolarHBondContact O-N 3.3Å
1503	H	31.3	Very low	30.5	Very low	46 Å²	46	55 Å²	55	21%	0.213	28%	0.284	C	S	.	.	H	α-helix	trans	-46.9	-48.9	168.9	-49.2	-45.3	0	0	0	113.9	L1171 E1175 P1501 Y1506 C1507	L1171-H1503 WeakPolarHBondContact CB-ND1 3.44Å; L1171-H1503 HydrophobicContact CD1-CB 3.68Å; E1175-H1503 IonicContact OE1-CE1 3.79Å; P1501-H1503 HydrophobicContact CB-CB 3.97Å; P1501-H1503 VanDerWaalsContact CB-CD2 3.5Å; P1501-H1503 WeakPolarHBondContact CB-CD2 3.43Å; P1501-H1503 CarbonylContact O-C 3.56Å; P1501-H1503 PolarHBondContact O-N 2.82Å; H1503-Y1506 PolarHBondContact O-N 2.49Å; H1503-C1507 VanDerWaalsContact O-CB 3.26Å; H1503-C1507 WeakPolarHBondContact O-CB 3.33Å; H1503-C1507 PolarHBondContact O-N 3.24Å; H1503-C1507 PolarHBondContact O-SG 3.24Å
1504	I	29.8	Very low	30.8	Very low	11 Å²	11	60.9 Å²	60.9	6%	0.056	30%	0.303	C	S	.	.	H	α-helix	trans	-64.4	-44.4	177.7	-67.2	167.1	0	0	0	111.4	W1168 P1501 I1502 Y1506 L1508 I1525 C1529	W1168-I1504 HydrophobicContact CZ2-CD1 3.88Å; W1168-I1504 HydrophobicContact CZ2-CG1 3.88Å; W1168-I1504 VanDerWaalsContact NE1-CG1 3.28Å; P1501-I1504 HydrophobicContact CG-CD1 3.84Å; P1501-I1504 HydrophobicContact CG-CG1 4.12Å; P1501-I1504 PolarHBondContact O-N 3.42Å; I1502-I1504 PolarHBondContact O-N 3.47Å; I1504-Y1506 VanDerWaalsContact C-N 3.33Å; I1504-Y1506 PolarHBondContact O-N 2.59Å; I1504-L1508 HydrophobicContact CG2-CD1 3.57Å; I1504-L1508 HydrophobicContact CG2-CG 4.21Å; I1504-L1508 WeakPolarHBondContact O-CB 3.4Å; I1504-L1508 WeakPolarHBondContact O-CG 3.48Å; I1504-L1508 PolarHBondContact O-N 2.86Å; I1504-I1525 HydrophobicContact CD1-CG2 3.49Å; I1504-I1525 VanDerWaalsContact CD1-CG2 3.49Å; I1504-I1525 HydrophobicContact CG2-CG2 4.25Å; I1504-C1529 WeakPolarHBondContact CD1-SG 3.3Å
1505	Q	29.4	Very low	30.9	Very low	57 Å²	57	65.1 Å²	65.1	27%	0.266	32%	0.323	S	S	.	.	H	α-helix	trans	-67.8	-34	179.3	-174.8	162.4	59.1	0	0	111.9	I1502 N1509	I1502-Q1505 PolarHBondContact O-N 2.83Å; Q1505-N1509 WeakPolarHBondContact O-CB 3.3Å; Q1505-N1509 PolarHBondContact O-N 2.86Å; Q1505-N1509 PolarHBondContact O-ND2 3.24Å
1506	Y	29.7	Very low	31.4	Very low	98 Å²	98	68.3 Å²	68.3	38%	0.384	34%	0.342	S	S	.	.	H	α-helix	trans	-72.2	-47.7	175.2	-170.8	-97.1	0	0	0	111.9	L1171 I1502 H1503 I1504 K1510	L1171-Y1506 HydrophobicContact CD1-CD1 4.15Å; L1171-Y1506 HydrophobicContact CD2-CD1 3.73Å; L1171-Y1506 HydrophobicContact CD2-CE1 4.34Å; L1171-Y1506 HydrophobicContact CD2-CG 4.05Å; L1171-Y1506 HydrophobicContact CG-CD1 4.12Å; I1502-Y1506 WeakPolarHBondContact O-CB 3.38Å; I1502-Y1506 PolarHBondContact O-N 3.3Å; H1503-Y1506 PolarHBondContact O-N 2.49Å; I1504-Y1506 VanDerWaalsContact C-N 3.33Å; I1504-Y1506 PolarHBondContact O-N 2.59Å; Y1506-K1510 HydrophobicContact CE1-CD 4.3Å; Y1506-K1510 PolarHBondContact O-N 3.14Å
1507	C	28.4	Very low	31.9	Very low	4 Å²	4	66.1 Å²	66.1	3%	0.027	33%	0.334	C	S	.	.	H	α-helix	trans	-61.2	-49.8	178.7	-67.6	0	0	0	0	112.4	A1167 L1171 H1503 K1510 N1511	A1167-C1507 HydrophobicContact CB-CB 3.75Å; A1167-C1507 VanDerWaalsContact CB-SG 3.59Å; A1167-C1507 PolarHBondContact O-SG 3.43Å; L1171-C1507 WeakPolarHBondContact CD1-SG 3.43Å; H1503-C1507 VanDerWaalsContact O-CB 3.26Å; H1503-C1507 WeakPolarHBondContact O-CB 3.33Å; H1503-C1507 PolarHBondContact O-N 3.24Å; H1503-C1507 PolarHBondContact O-SG 3.24Å; C1507-K1510 PolarHBondContact O-N 2.95Å; C1507-N1511 WeakPolarHBondContact O-CB 3.27Å; C1507-N1511 PolarHBondContact O-N 2.99Å
1508	L	31.6	Very low	32.3	Very low	30 Å²	30	63.5 Å²	63.5	16%	0.157	32%	0.322	C	S	.	.	H	α-helix	trans	-73.1	-30.1	-175.8	-64.2	178.9	0	0	0	113	I1504 K1510 I1513 L1517	I1504-L1508 HydrophobicContact CG2-CD1 3.57Å; I1504-L1508 HydrophobicContact CG2-CG 4.21Å; I1504-L1508 WeakPolarHBondContact O-CB 3.4Å; I1504-L1508 WeakPolarHBondContact O-CG 3.48Å; I1504-L1508 PolarHBondContact O-N 2.86Å; L1508-K1510 VanDerWaalsContact C-N 3.26Å; L1508-K1510 PolarHBondContact O-N 2.79Å; L1508-I1513 HydrophobicContact CD2-CD1 4.25Å; L1508-L1517 HydrophobicContact CB-CD1 3.85Å; L1508-L1517 HydrophobicContact CB-CD2 3.82Å; L1508-L1517 HydrophobicContact CB-CG 4.46Å; L1508-L1517 HydrophobicContact CD1-CD2 3.5Å; L1508-L1517 VanDerWaalsContact CD1-CD2 3.5Å; L1508-L1517 HydrophobicContact CG-CD2 4.3Å
1509	N	34.9	Very low	32.9	Very low	95 Å²	95	61.1 Å²	61.1	51%	0.508	31%	0.312	S	S	.	.	H	α-helix	trans	-66.2	-27.9	170.8	-80	-7.3	0	0	0	112.6	Q1505	Q1505-N1509 WeakPolarHBondContact O-CB 3.3Å; Q1505-N1509 PolarHBondContact O-N 2.86Å; Q1505-N1509 PolarHBondContact O-ND2 3.24Å
1510	K	31.2	Very low	33.7	Very low	143 Å²	143	61.5 Å²	61.5	62%	0.622	31%	0.312	S	S	*	.	H	α-helix	trans	-93.3	-41.1	-176.6	-146.7	176	-174.7	-179.2	0	112.5	Y1506 C1507 L1508 C1512	Y1506-K1510 HydrophobicContact CE1-CD 4.3Å; Y1506-K1510 PolarHBondContact O-N 3.14Å; C1507-K1510 PolarHBondContact O-N 2.95Å; L1508-K1510 VanDerWaalsContact C-N 3.26Å; L1508-K1510 PolarHBondContact O-N 2.79Å; K1510-C1512 PolarHBondContact O-N 2.53Å
1511	N	32.5	Very low	34.9	Very low	85 Å²	85	60.6 Å²	60.6	46%	0.455	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	71.2	-173	-66.8	-3.6	0	0	0	112.3	C1507	C1507-N1511 WeakPolarHBondContact O-CB 3.27Å; C1507-N1511 PolarHBondContact O-N 2.99Å
1512	C	32.4	Very low	36.1	Very low	104 Å²	104	58.7 Å²	58.7	70%	0.703	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	5.4	164	-54.5	0	0	0	0	120.2	K1510	K1510-C1512 PolarHBondContact O-N 2.53Å
1513	I	31.2	Very low	37.7	Very low	44 Å²	44	56.7 Å²	56.7	23%	0.226	28%	0.284	C	S	.	.			trans	-107.6	82.3	172.2	-46.6	175.7	0	0	0	110.9	L1508 Q1515 L1517 T1585	L1508-I1513 HydrophobicContact CD2-CD1 4.25Å; I1513-Q1515 HydrophobicContact CG2-CB 4.24Å; I1513-Q1515 PolarHBondContact O-N 3.41Å; I1513-L1517 HydrophobicContact CB-CD1 3.44Å; I1513-L1517 VanDerWaalsContact CB-CD1 3.44Å; I1513-L1517 HydrophobicContact CD1-CD1 3.9Å; I1513-L1517 HydrophobicContact CG1-CD1 4.23Å; I1513-L1517 HydrophobicContact CG2-CD1 3.38Å; I1513-L1517 HydrophobicContact CG2-CG 4.44Å; I1513-T1585 HydrophobicContact CD1-CG2 4.11Å
1514	K	33.6	Very low	39.1	Very low	186 Å²	186	55 Å²	55	81%	0.809	28%	0.276	S	S	*	.			trans	-63.9	-0.5	172.7	-78	-175	174.5	178.4	0	114.4
1515	Q	34.7	Very low	40.3	Very low	104 Å²	104	55.9 Å²	55.9	49%	0.486	28%	0.28	S	S	.	.	S	Bend	trans	-97	130.8	177.9	-67.4	-177.3	-10.2	0	0	110.3	I1513 L1517	I1513-Q1515 HydrophobicContact CG2-CB 4.24Å; I1513-Q1515 PolarHBondContact O-N 3.41Å; Q1515-L1517 PolarHBondContact O-N 3.08Å
1516	N	39.5	Very low	41.8	Very low	107 Å²	107	53.2 Å²	53.2	57%	0.572	27%	0.267	S	S	*	.			trans	-48.8	87.1	-172.1	-71.6	-54.8	0	0	0	115.3	S1518 S1519	N1516-S1518 PolarHBondContact O-N 2.78Å; N1516-S1518 VanDerWaalsContact O-N 3.1Å; N1516-S1519 PolarHBondContact O-N 2.82Å; N1516-S1519 VanDerWaalsContact O-N 3.16Å; N1516-S1519 PolarHBondContact O-OG 2.82Å
1517	L	38.2	Very low	43.6	Very low	18 Å²	18	48.5 Å²	48.5	9%	0.094	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-64.5	-9.3	174.8	-97.1	119.5	0	0	0	114.6	L1508 I1513 Q1515 S1519 L1520	L1508-L1517 HydrophobicContact CB-CD1 3.85Å; L1508-L1517 HydrophobicContact CB-CD2 3.82Å; L1508-L1517 HydrophobicContact CB-CG 4.46Å; L1508-L1517 HydrophobicContact CD1-CD2 3.5Å; L1508-L1517 VanDerWaalsContact CD1-CD2 3.5Å; L1508-L1517 HydrophobicContact CG-CD2 4.3Å; I1513-L1517 HydrophobicContact CB-CD1 3.44Å; I1513-L1517 VanDerWaalsContact CB-CD1 3.44Å; I1513-L1517 HydrophobicContact CD1-CD1 3.9Å; I1513-L1517 HydrophobicContact CG1-CD1 4.23Å; I1513-L1517 HydrophobicContact CG2-CD1 3.38Å; I1513-L1517 HydrophobicContact CG2-CG 4.44Å; Q1515-L1517 PolarHBondContact O-N 3.08Å; L1517-S1519 PolarHBondContact O-N 2.87Å; L1517-S1519 VanDerWaalsContact O-N 3.07Å; L1517-L1520 HydrophobicContact CD2-CD1 3.4Å; L1517-L1520 VanDerWaalsContact CD2-CD1 3.4Å; L1517-L1520 HydrophobicContact CG-CD1 3.9Å; L1517-L1520 PolarHBondContact O-N 2.92Å
1518	S	36.2	Very low	45.1	Very low	24 Å²	24	49.8 Å²	49.8	17%	0.168	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-56	-17	166.4	41.7	0	0	0	0	113.6	T1453 N1516	T1453-S1518 WeakPolarHBondContact CG2-OG 2.97Å; T1453-S1518 PolarHBondContact OG1-O 2.81Å; N1516-S1518 PolarHBondContact O-N 2.78Å; N1516-S1518 VanDerWaalsContact O-N 3.1Å
1519	S	42.5	Very low	46.3	Very low	16 Å²	16	49.1 Å²	49.1	11%	0.112	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-80.1	-12.1	174.2	60.4	0	0	0	0	115.6	Y1446 N1516 L1517	Y1446-S1519 WeakPolarHBondContact CD2-O 3.36Å; Y1446-S1519 WeakPolarHBondContact CE2-O 3.28Å; N1516-S1519 PolarHBondContact O-N 2.82Å; N1516-S1519 VanDerWaalsContact O-N 3.16Å; N1516-S1519 PolarHBondContact O-OG 2.82Å; L1517-S1519 PolarHBondContact O-N 2.87Å; L1517-S1519 VanDerWaalsContact O-N 3.07Å
1520	L	46.7	Very low	47.5	Very low	16 Å²	16	44.6 Å²	44.6	8%	0.084	23%	0.229	C	C	.	.			trans	-80.4	127.5	-174.4	-94.8	158.8	0	0	0	113.1	L1517 W1524 I1581	L1517-L1520 HydrophobicContact CD2-CD1 3.4Å; L1517-L1520 VanDerWaalsContact CD2-CD1 3.4Å; L1517-L1520 HydrophobicContact CG-CD1 3.9Å; L1517-L1520 PolarHBondContact O-N 2.92Å; L1520-W1524 HydrophobicContact CD2-CB 3.39Å; L1520-W1524 HydrophobicContact CD2-CD2 4.28Å; L1520-W1524 HydrophobicContact CD2-CG 3.69Å; L1520-I1581 HydrophobicContact CD1-CD1 4.2Å; L1520-I1581 HydrophobicContact CD1-CG1 3.78Å; L1520-I1581 HydrophobicContact CD2-CD1 3.67Å; L1520-I1581 HydrophobicContact CD2-CG1 3.81Å; L1520-I1581 HydrophobicContact CG-CD1 4.46Å; L1520-I1581 HydrophobicContact CG-CG1 4.13Å
1521	S	56.1	Low	48.7	Very low	1 Å²	1	38.4 Å²	38.4	1%	0.007	20%	0.202	C	C	.	.			trans	-75.9	149.2	-179.2	83.1	0	0	0	0	111.7	N1442 I1523 W1524 I1525	N1442-S1521 PolarHBondContact OD1-OG 3.06Å; S1521-I1523 PolarHBondContact O-N 2.79Å; S1521-W1524 PolarHBondContact O-N 2.75Å; S1521-I1525 PolarHBondContact O-N 2.79Å
1522	P	56.8	Low	49.6	Very low	1 Å²	1	36.3 Å²	36.3	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-48.3	-28.7	173.6	-32.7	34.6	0	0	0	115.5	I1445 F1449 P1500 I1525 S1526	I1445-P1522 HydrophobicContact CG2-CG 4.41Å; F1449-P1522 HydrophobicContact CE1-CG 4.46Å; F1449-P1522 VanDerWaalsContact CE2-CD 3.41Å; F1449-P1522 HydrophobicContact CE2-CG 3.64Å; F1449-P1522 HydrophobicContact CZ-CG 3.55Å; P1500-P1522 HydrophobicContact CG-CB 4.02Å; P1500-P1522 HydrophobicContact CG-CG 4.24Å; P1522-I1525 PolarHBondContact O-N 2.8Å; P1522-S1526 WeakPolarHBondContact O-CB 3.04Å; P1522-S1526 PolarHBondContact O-N 3.27Å; P1522-S1526 PolarHBondContact O-OG 2.89Å
1523	I	64.3	Low	50.8	Low	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64	-48.9	174.9	-65.8	175.9	0	0	0	110.4	W1416 L1438 M1441 N1442 I1445 S1521 I1525 S1526 M1527 L1549	W1416-I1523 HydrophobicContact CD2-CD1 4.2Å; W1416-I1523 HydrophobicContact CD2-CG1 3.69Å; W1416-I1523 HydrophobicContact CE3-CD1 4.22Å; W1416-I1523 HydrophobicContact CE3-CG1 4.13Å; W1416-I1523 HydrophobicContact CG-CG1 3.89Å; W1416-I1523 HydrophobicContact CH2-CD1 4.42Å; W1416-I1523 HydrophobicContact CZ2-CD1 4.37Å; W1416-I1523 HydrophobicContact CZ2-CG1 4.45Å; W1416-I1523 HydrophobicContact CZ3-CD1 4.33Å; L1438-I1523 HydrophobicContact CD2-CG2 4.16Å; M1441-I1523 HydrophobicContact CB-CD1 3.77Å; N1442-I1523 HydrophobicContact CB-CD1 4.46Å; I1445-I1523 HydrophobicContact CD1-CD1 3.85Å; I1445-I1523 HydrophobicContact CD1-CG1 4.17Å; S1521-I1523 PolarHBondContact O-N 2.79Å; I1523-I1525 VanDerWaalsContact C-N 3.34Å; I1523-I1525 PolarHBondContact O-N 3.19Å; I1523-S1526 PolarHBondContact O-N 3.06Å; I1523-S1526 PolarHBondContact O-OG 2.76Å; I1523-M1527 WeakPolarHBondContact O-CG 3.48Å; I1523-M1527 PolarHBondContact O-N 2.91Å; I1523-L1549 HydrophobicContact CG2-CD1 3.73Å; I1523-L1549 HydrophobicContact CG2-CD2 4.13Å
1524	W	60.6	Low	51.8	Low	12 Å²	12	39.9 Å²	39.9	5%	0.045	19%	0.192	C	C	.	.	H	α-helix	trans	-63.6	-41	177.2	-74.6	86.7	0	0	0	112.2	N1442 L1520 S1521 S1526 M1527 I1528 L1546 L1549 I1550 I1581 I1586	N1442-W1524 PolarHBondContact OD1-NE1 3.06Å; L1520-W1524 HydrophobicContact CD2-CB 3.39Å; L1520-W1524 HydrophobicContact CD2-CD2 4.28Å; L1520-W1524 HydrophobicContact CD2-CG 3.69Å; S1521-W1524 PolarHBondContact O-N 2.75Å; W1524-S1526 VanDerWaalsContact C-N 3.29Å; W1524-S1526 PolarHBondContact O-N 2.73Å; W1524-M1527 PolarHBondContact O-N 3.48Å; W1524-M1527 VanDerWaalsContact O-N 3.15Å; W1524-I1528 WeakPolarHBondContact O-CG1 3.44Å; W1524-I1528 PolarHBondContact O-N 3.29Å; W1524-L1546 HydrophobicContact CE3-CD1 3.79Å; W1524-L1546 HydrophobicContact CZ3-CD1 3.71Å; W1524-L1546 HydrophobicContact CZ3-CG 4.42Å; W1524-L1549 HydrophobicContact CD2-CD1 4.46Å; W1524-L1549 HydrophobicContact CH2-CB 4.14Å; W1524-L1549 HydrophobicContact CZ2-CB 3.8Å; W1524-I1550 HydrophobicContact CH2-CG1 3.74Å; W1524-I1550 HydrophobicContact CZ3-CG1 4.16Å; W1524-I1581 HydrophobicContact CD2-CD1 4.33Å; W1524-I1581 HydrophobicContact CE3-CD1 3.72Å; W1524-I1581 HydrophobicContact CZ3-CD1 4Å; W1524-I1586 HydrophobicContact CH2-CD1 4.09Å; W1524-I1586 HydrophobicContact CZ3-CD1 3.74Å
1525	I	56.2	Low	53	Low	28 Å²	28	33.2 Å²	33.2	14%	0.144	17%	0.169	C	C	.	.	H	α-helix	trans	-59.1	-43.7	175.9	-56.7	173.6	0	0	0	110.1	T1413 P1500 I1504 S1521 P1522 I1523 M1527 I1528 C1529	T1413-I1525 HydrophobicContact CG2-CG2 4.17Å; P1500-I1525 HydrophobicContact CB-CB 4.29Å; P1500-I1525 HydrophobicContact CB-CD1 3.91Å; P1500-I1525 HydrophobicContact CB-CG2 3.82Å; I1504-I1525 HydrophobicContact CD1-CG2 3.49Å; I1504-I1525 VanDerWaalsContact CD1-CG2 3.49Å; I1504-I1525 HydrophobicContact CG2-CG2 4.25Å; S1521-I1525 PolarHBondContact O-N 2.79Å; P1522-I1525 PolarHBondContact O-N 2.8Å; I1523-I1525 VanDerWaalsContact C-N 3.34Å; I1523-I1525 PolarHBondContact O-N 3.19Å; I1525-M1527 VanDerWaalsContact C-N 3.34Å; I1525-M1527 PolarHBondContact O-N 3.33Å; I1525-I1528 PolarHBondContact O-N 2.85Å; I1525-C1529 PolarHBondContact O-N 2.97Å; I1525-C1529 PolarHBondContact O-SG 3.32Å
1526	S	61.2	Low	54.4	Low	1 Å²	1	30.6 Å²	30.6	1%	0.007	16%	0.162	C	C	.	.	H	α-helix	trans	-63	-35.8	176.5	72	0	0	0	0	114.1	T1413 W1416 P1522 I1523 W1524 G1530	T1413-S1526 WeakPolarHBondContact O-CB 3.19Å; W1416-S1526 WeakPolarHBondContact CB-OG 3.07Å; P1522-S1526 WeakPolarHBondContact O-CB 3.04Å; P1522-S1526 PolarHBondContact O-N 3.27Å; P1522-S1526 PolarHBondContact O-OG 2.89Å; I1523-S1526 PolarHBondContact O-N 3.06Å; I1523-S1526 PolarHBondContact O-OG 2.76Å; W1524-S1526 VanDerWaalsContact C-N 3.29Å; W1524-S1526 PolarHBondContact O-N 2.73Å; S1526-G1530 PolarHBondContact O-N 3.29Å
1527	M	67.6	Low	55.7	Low	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.9	-43.8	175.7	-62.5	-53	100	0	0	110.3	A1420 I1523 W1524 I1525 G1530 L1531 A1545 L1546 L1549	A1420-M1527 HydrophobicContact CB-CE 3.74Å; A1420-M1527 HydrophobicContact CB-SD 3.85Å; I1523-M1527 WeakPolarHBondContact O-CG 3.48Å; I1523-M1527 PolarHBondContact O-N 2.91Å; W1524-M1527 PolarHBondContact O-N 3.48Å; W1524-M1527 VanDerWaalsContact O-N 3.15Å; I1525-M1527 VanDerWaalsContact C-N 3.34Å; I1525-M1527 PolarHBondContact O-N 3.33Å; M1527-G1530 WeakPolarHBondContact O-CA 3.35Å; M1527-G1530 PolarHBondContact O-N 3.25Å; M1527-G1530 VanDerWaalsContact O-N 3.08Å; M1527-L1531 WeakPolarHBondContact O-CG 3.49Å; M1527-L1531 PolarHBondContact O-N 3.2Å; M1527-L1531 VanDerWaalsContact O-N 3.09Å; M1527-A1545 HydrophobicContact SD-CB 3.32Å; M1527-A1545 WeakPolarHBondContact SD-CB 3.37Å; M1527-L1546 HydrophobicContact CB-CD1 3.97Å; M1527-L1549 HydrophobicContact CG-CD1 3.86Å
1528	I	58.5	Low	57.1	Low	31 Å²	31	33.4 Å²	33.4	16%	0.159	17%	0.173	C	C	.	.	H	α-helix	trans	-60.1	-48.9	176	-64.4	164.5	0	0	0	110.7	W1524 I1525 G1530 L1531	W1524-I1528 WeakPolarHBondContact O-CG1 3.44Å; W1524-I1528 PolarHBondContact O-N 3.29Å; I1525-I1528 PolarHBondContact O-N 2.85Å; I1528-G1530 PolarHBondContact O-N 3.14Å; I1528-L1531 WeakPolarHBondContact O-CB 3.49Å; I1528-L1531 PolarHBondContact O-N 3.44Å; I1528-L1531 VanDerWaalsContact O-N 3.09Å
1529	C	58.3	Low	58.4	Low	16 Å²	16	33.4 Å²	33.4	11%	0.108	17%	0.17	C	C	.	.	H	α-helix	trans	-58.1	-33.2	173.7	-65.5	0	0	0	0	113.1	I1504 I1525 Q1533	I1504-C1529 WeakPolarHBondContact CD1-SG 3.3Å; I1525-C1529 PolarHBondContact O-N 2.97Å; I1525-C1529 PolarHBondContact O-SG 3.32Å; C1529-Q1533 PolarHBondContact O-NE2 3.26Å
1530	G	59.2	Low	59.6	Low	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-67.3	-33.6	176.6	0	0	0	0	0	113.6	S1526 M1527 I1528 E1532 Q1533 R1539	S1526-G1530 PolarHBondContact O-N 3.29Å; M1527-G1530 WeakPolarHBondContact O-CA 3.35Å; M1527-G1530 PolarHBondContact O-N 3.25Å; M1527-G1530 VanDerWaalsContact O-N 3.08Å; I1528-G1530 PolarHBondContact O-N 3.14Å; G1530-E1532 PolarHBondContact O-N 2.99Å; G1530-Q1533 PolarHBondContact O-N 3.01Å; G1530-R1539 WeakPolarHBondContact O-CA 3.48Å; G1530-R1539 VanDerWaalsContact O-CG 3.27Å; G1530-R1539 WeakPolarHBondContact O-CG 3.4Å
1531	L	56.9	Low	60.9	Low	12 Å²	12	33.7 Å²	33.7	6%	0.063	17%	0.17	C	C	.	.	H	α-helix	trans	-67.6	-20.6	178.8	-64.3	175.2	0	0	0	113.7	M1527 I1528 R1539 A1542 L1543 L1589 I1593	M1527-L1531 WeakPolarHBondContact O-CG 3.49Å; M1527-L1531 PolarHBondContact O-N 3.2Å; M1527-L1531 VanDerWaalsContact O-N 3.09Å; I1528-L1531 WeakPolarHBondContact O-CB 3.49Å; I1528-L1531 PolarHBondContact O-N 3.44Å; I1528-L1531 VanDerWaalsContact O-N 3.09Å; L1531-R1539 VanDerWaalsContact O-CD 3.23Å; L1531-R1539 WeakPolarHBondContact O-CD 3.39Å; L1531-R1539 WeakPolarHBondContact O-CG 2.68Å; L1531-R1539 PolarHBondContact O-NE 3.4Å; L1531-A1542 HydrophobicContact CD2-CB 3.99Å; L1531-A1542 HydrophobicContact CG-CB 4.3Å; L1531-L1543 HydrophobicContact CD2-CB 4.37Å; L1531-L1543 HydrophobicContact CD2-CD1 4.46Å; L1531-L1543 HydrophobicContact CD2-CD2 3.43Å; L1531-L1543 VanDerWaalsContact CD2-CD2 3.43Å; L1531-L1543 HydrophobicContact CD2-CG 3.42Å; L1531-L1543 VanDerWaalsContact CD2-CG 3.42Å; L1531-L1589 HydrophobicContact CD1-CD2 3.96Å; L1531-I1593 HydrophobicContact CB-CD1 4.43Å; L1531-I1593 HydrophobicContact CD1-CD1 3.94Å; L1531-I1593 HydrophobicContact CD2-CD1 4.44Å
1532	E	50.9	Low	61.6	Low	41 Å²	41	33.6 Å²	33.6	19%	0.192	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	5.4	-178.2	-61.3	-167.3	126	0	0	114.3	V1164 H1165 G1530	V1164-E1532 WeakPolarHBondContact CA-OE1 3.11Å; V1164-E1532 WeakPolarHBondContact CB-OE1 3.4Å; V1164-E1532 WeakPolarHBondContact CB-OE2 3.41Å; V1164-E1532 WeakPolarHBondContact CG2-OE1 3.47Å; V1164-E1532 PolarHBondContact N-OE1 2.94Å; H1165-E1532 IonicContact CD2-OE2 3.44Å; H1165-E1532 PolarHBondContact NE2-O 3.05Å; G1530-E1532 PolarHBondContact O-N 2.99Å
1533	Q	57.9	Low	62.1	Low	31 Å²	31	33.6 Å²	33.6	15%	0.145	17%	0.17	C	C	.	.			trans	-66.4	134.2	175.9	-70.5	-63.9	-61.3	0	0	111.3	L1417 C1529 G1530 S1535 K1538 R1539	L1417-Q1533 HydrophobicContact CD2-CG 4.22Å; C1529-Q1533 PolarHBondContact O-NE2 3.26Å; G1530-Q1533 PolarHBondContact O-N 3.01Å; Q1533-S1535 PolarHBondContact O-N 3.22Å; Q1533-K1538 HydrophobicContact CB-CB 3.92Å; Q1533-K1538 HydrophobicContact CB-CD 4.41Å; Q1533-K1538 HydrophobicContact CG-CB 4.11Å; Q1533-K1538 HydrophobicContact CG-CD 4.17Å; Q1533-R1539 HydrophobicContact CB-CG 4.28Å; Q1533-R1539 WeakPolarHBondContact O-CD 3.25Å; Q1533-R1539 WeakPolarHBondContact O-CG 3.33Å
1534	K	51.6	Low	62.6	Low	192 Å²	192	37.2 Å²	37.2	84%	0.835	19%	0.186	S	C	*	.	S	Bend	trans	-56	-20	178.2	-69.4	176.6	-179.8	167.5	0	114.4
1535	S	59.3	Low	63.3	Low	47 Å²	47	36.7 Å²	36.7	33%	0.329	18%	0.184	S	C	.	.	S	Bend	trans	-88.9	120.4	177.8	48.7	0	0	0	0	112.5	Q1533 I1537 K1538 R1539	Q1533-S1535 PolarHBondContact O-N 3.22Å; S1535-I1537 PolarHBondContact O-N 3.37Å; S1535-K1538 PolarHBondContact O-N 3.03Å; S1535-K1538 VanDerWaalsContact O-N 3.17Å; S1535-K1538 WeakPolarHBondContact OG-CG 3.5Å; S1535-R1539 PolarHBondContact O-N 3.37Å
1536	S	64.1	Low	64	Low	48 Å²	48	35.6 Å²	35.6	34%	0.336	18%	0.178	S	C	.	.	H	α-helix	trans	-54.5	-37.7	177	51	0	0	0	0	113.4	K1538 R1539 I1540 D1599	S1536-K1538 PolarHBondContact O-N 3.47Å; S1536-R1539 PolarHBondContact O-N 3.24Å; S1536-I1540 WeakPolarHBondContact O-CB 3.46Å; S1536-I1540 VanDerWaalsContact O-CG1 3.27Å; S1536-I1540 WeakPolarHBondContact O-CG1 3.2Å; S1536-I1540 PolarHBondContact O-N 3.06Å; S1536-D1599 WeakPolarHBondContact CB-OD2 3.38Å
1537	I	67.4	Low	64.5	Low	131 Å²	131	36.3 Å²	36.3	67%	0.672	18%	0.182	S	C	*	.	H	α-helix	trans	-56.4	-48.4	178.4	-60	173.5	0	0	0	111.3	S1535 I1540 A1541	S1535-I1537 PolarHBondContact O-N 3.37Å; I1537-I1540 PolarHBondContact O-N 3.49Å; I1537-A1541 WeakPolarHBondContact O-CB 3.32Å; I1537-A1541 PolarHBondContact O-N 3.33Å
1538	K	66	Low	64.7	Low	53 Å²	53	37.2 Å²	37.2	23%	0.23	19%	0.187	C	C	.	.	H	α-helix	trans	-67.5	-38.1	179.6	-64.9	-164.8	178.3	-173.7	0	111.9	L1417 E1421 Q1533 S1535 S1536 A1541 A1542	L1417-K1538 HydrophobicContact CD2-CD 4.26Å; E1421-K1538 WeakPolarHBondContact OE1-CD 3.46Å; E1421-K1538 WeakPolarHBondContact OE1-CE 3.42Å; E1421-K1538 WeakPolarHBondContact OE1-CG 3.38Å; E1421-K1538 IonicContact OE1-NZ 2.67Å; Q1533-K1538 HydrophobicContact CB-CB 3.92Å; Q1533-K1538 HydrophobicContact CB-CD 4.41Å; Q1533-K1538 HydrophobicContact CG-CB 4.11Å; Q1533-K1538 HydrophobicContact CG-CD 4.17Å; S1535-K1538 PolarHBondContact O-N 3.03Å; S1535-K1538 VanDerWaalsContact O-N 3.17Å; S1535-K1538 WeakPolarHBondContact OG-CG 3.5Å; S1536-K1538 PolarHBondContact O-N 3.47Å; K1538-A1541 PolarHBondContact O-N 3.02Å; K1538-A1542 WeakPolarHBondContact O-CB 3.42Å; K1538-A1542 PolarHBondContact O-N 2.96Å
1539	R	64.8	Low	65.3	Low	25 Å²	25	35.7 Å²	35.7	9%	0.094	18%	0.179	C	C	.	.	H	α-helix	trans	-65.2	-42.1	176.5	-65.8	-178.1	48.6	-123.6	-30.9	112.4	G1530 L1531 Q1533 S1535 S1536 A1542 L1543 D1597 V1602	G1530-R1539 WeakPolarHBondContact O-CA 3.48Å; G1530-R1539 VanDerWaalsContact O-CG 3.27Å; G1530-R1539 WeakPolarHBondContact O-CG 3.4Å; L1531-R1539 VanDerWaalsContact O-CD 3.23Å; L1531-R1539 WeakPolarHBondContact O-CD 3.39Å; L1531-R1539 WeakPolarHBondContact O-CG 2.68Å; L1531-R1539 PolarHBondContact O-NE 3.4Å; Q1533-R1539 HydrophobicContact CB-CG 4.28Å; Q1533-R1539 WeakPolarHBondContact O-CD 3.25Å; Q1533-R1539 WeakPolarHBondContact O-CG 3.33Å; S1535-R1539 PolarHBondContact O-N 3.37Å; S1536-R1539 PolarHBondContact O-N 3.24Å; R1539-A1542 PolarHBondContact O-N 2.86Å; R1539-L1543 PolarHBondContact O-N 3.44Å; R1539-D1597 IonicContact CZ-OD1 2.98Å; R1539-D1597 VanDerWaalsContact CZ-OD1 3.27Å; R1539-D1597 IonicContact CZ-OD2 3.19Å; R1539-D1597 IonicContact NH1-OD1 3.48Å; R1539-D1597 PolarHBondContact NH1-OD1 3.22Å; R1539-D1597 IonicContact NH1-OD2 2.69Å; R1539-D1597 PolarHBondContact NH1-OD2 2.86Å; R1539-D1597 IonicContact NH2-OD1 2.65Å; R1539-D1597 PolarHBondContact NH2-OD1 3.36Å; R1539-D1597 IonicContact NH2-OD2 2.88Å; R1539-D1597 PolarHBondContact NH2-OD2 2.91Å; R1539-V1602 HydrophobicContact CB-CG2 4.47Å
1540	I	68	Low	65.7	Low	31 Å²	31	35.3 Å²	35.3	16%	0.159	18%	0.176	C	C	.	.	H	α-helix	trans	-65	-43.1	174.4	-69.2	167	0	0	0	110.9	S1536 I1537 L1543 K1544 L1601 V1602 L1605	S1536-I1540 WeakPolarHBondContact O-CB 3.46Å; S1536-I1540 VanDerWaalsContact O-CG1 3.27Å; S1536-I1540 WeakPolarHBondContact O-CG1 3.2Å; S1536-I1540 PolarHBondContact O-N 3.06Å; I1537-I1540 PolarHBondContact O-N 3.49Å; I1540-L1543 PolarHBondContact O-N 2.85Å; I1540-K1544 HydrophobicContact CG2-CD 4.48Å; I1540-K1544 WeakPolarHBondContact O-CG 3.46Å; I1540-K1544 PolarHBondContact O-N 3.5Å; I1540-L1601 HydrophobicContact CD1-CB 4.12Å; I1540-L1601 HydrophobicContact CD1-CD1 4.34Å; I1540-V1602 HydrophobicContact CD1-CG2 4.37Å; I1540-V1602 HydrophobicContact CG1-CG2 3.67Å; I1540-L1605 HydrophobicContact CG2-CD1 4.03Å
1541	A	72.6	Confident	66	Low	6 Å²	6	37.5 Å²	37.5	5%	0.05	19%	0.186	C	C	.	.	H	α-helix	trans	-60	-46.2	175.5	0	0	0	0	0	112	E1421 I1537 K1538 L1543 K1544 A1545	E1421-A1541 HydrophobicContact CG-CB 4.1Å; I1537-A1541 WeakPolarHBondContact O-CB 3.32Å; I1537-A1541 PolarHBondContact O-N 3.33Å; K1538-A1541 PolarHBondContact O-N 3.02Å; A1541-L1543 PolarHBondContact O-N 3.5Å; A1541-K1544 PolarHBondContact O-N 3.41Å; A1541-A1545 PolarHBondContact O-N 3.34Å
1542	A	70.6	Confident	66.6	Low	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-43.7	175.9	0	0	0	0	0	112.5	L1417 L1531 K1538 R1539 A1545 L1546	L1417-A1542 HydrophobicContact CD1-CB 4.3Å; L1531-A1542 HydrophobicContact CD2-CB 3.99Å; L1531-A1542 HydrophobicContact CG-CB 4.3Å; K1538-A1542 WeakPolarHBondContact O-CB 3.42Å; K1538-A1542 PolarHBondContact O-N 2.96Å; R1539-A1542 PolarHBondContact O-N 2.86Å; A1542-A1545 PolarHBondContact O-N 2.94Å; A1542-L1546 VanDerWaalsContact O-CB 3.3Å; A1542-L1546 WeakPolarHBondContact O-CB 3.45Å; A1542-L1546 PolarHBondContact O-N 3.45Å
1543	L	69.1	Low	67.2	Low	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.7	-43.6	174.8	-75.8	171.7	0	0	0	112.8	L1531 R1539 I1540 A1541 A1545 L1546 T1547 L1590 V1602 L1605 I1609	L1531-L1543 HydrophobicContact CD2-CB 4.37Å; L1531-L1543 HydrophobicContact CD2-CD1 4.46Å; L1531-L1543 HydrophobicContact CD2-CD2 3.43Å; L1531-L1543 VanDerWaalsContact CD2-CD2 3.43Å; L1531-L1543 HydrophobicContact CD2-CG 3.42Å; L1531-L1543 VanDerWaalsContact CD2-CG 3.42Å; R1539-L1543 PolarHBondContact O-N 3.44Å; I1540-L1543 PolarHBondContact O-N 2.85Å; A1541-L1543 PolarHBondContact O-N 3.5Å; L1543-A1545 PolarHBondContact O-N 3.22Å; L1543-L1546 PolarHBondContact O-N 2.93Å; L1543-T1547 PolarHBondContact O-N 3Å; L1543-T1547 PolarHBondContact O-OG1 2.89Å; L1543-L1590 HydrophobicContact CD2-CD2 3.86Å; L1543-V1602 HydrophobicContact CD1-CB 4.24Å; L1543-V1602 HydrophobicContact CD1-CG1 3.51Å; L1543-L1605 HydrophobicContact CB-CD2 4.19Å; L1543-L1605 HydrophobicContact CD1-CB 4.3Å; L1543-I1609 HydrophobicContact CB-CD1 4.26Å; L1543-I1609 HydrophobicContact CD2-CD1 4.04Å
1544	K	74.4	Confident	67.2	Low	77 Å²	77	38.2 Å²	38.2	34%	0.335	19%	0.193	S	C	.	.	H	α-helix	trans	-60	-46.9	176.7	-72.4	174.9	179.6	178	0	111.4	V1423 I1540 A1541 T1547 I1548 L1605	V1423-K1544 HydrophobicContact CG1-CB 4.09Å; I1540-K1544 HydrophobicContact CG2-CD 4.48Å; I1540-K1544 WeakPolarHBondContact O-CG 3.46Å; I1540-K1544 PolarHBondContact O-N 3.5Å; A1541-K1544 PolarHBondContact O-N 3.41Å; K1544-T1547 VanDerWaalsContact O-CB 3.29Å; K1544-T1547 WeakPolarHBondContact O-CB 3.47Å; K1544-T1547 PolarHBondContact O-N 2.98Å; K1544-I1548 WeakPolarHBondContact O-CD1 3.3Å; K1544-I1548 WeakPolarHBondContact O-CG1 3.45Å; K1544-I1548 PolarHBondContact O-N 3.09Å; K1544-L1605 HydrophobicContact CG-CD1 4.15Å
1545	A	75.1	Confident	67.5	Low	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.1	-37.6	179	0	0	0	0	0	112.8	A1420 L1438 M1527 A1541 A1542 L1543 T1547 I1548 L1549	A1420-A1545 HydrophobicContact CB-CB 3.5Å; L1438-A1545 HydrophobicContact CD1-CB 3.88Å; M1527-A1545 HydrophobicContact SD-CB 3.32Å; M1527-A1545 WeakPolarHBondContact SD-CB 3.37Å; A1541-A1545 PolarHBondContact O-N 3.34Å; A1542-A1545 PolarHBondContact O-N 2.94Å; L1543-A1545 PolarHBondContact O-N 3.22Å; A1545-T1547 VanDerWaalsContact C-N 3.31Å; A1545-T1547 PolarHBondContact O-N 3.48Å; A1545-I1548 WeakPolarHBondContact O-CB 3.45Å; A1545-I1548 PolarHBondContact O-N 3.39Å; A1545-L1549 WeakPolarHBondContact O-CG 3.47Å; A1545-L1549 PolarHBondContact O-N 2.9Å
1546	L	71.1	Confident	67.4	Low	5 Å²	5	30.8 Å²	30.8	3%	0.026	17%	0.17	C	C	.	.	H	α-helix	trans	-58.2	-43.5	170.8	-165.4	85.9	0	0	0	111.4	W1524 M1527 A1542 L1543 I1548 L1549 I1550 L1590	W1524-L1546 HydrophobicContact CE3-CD1 3.79Å; W1524-L1546 HydrophobicContact CZ3-CD1 3.71Å; W1524-L1546 HydrophobicContact CZ3-CG 4.42Å; M1527-L1546 HydrophobicContact CB-CD1 3.97Å; A1542-L1546 VanDerWaalsContact O-CB 3.3Å; A1542-L1546 WeakPolarHBondContact O-CB 3.45Å; A1542-L1546 PolarHBondContact O-N 3.45Å; L1543-L1546 PolarHBondContact O-N 2.93Å; L1546-I1548 VanDerWaalsContact C-N 3.3Å; L1546-I1548 PolarHBondContact O-N 3.37Å; L1546-L1549 PolarHBondContact O-N 3.38Å; L1546-I1550 HydrophobicContact CD2-CD1 3.97Å; L1546-I1550 HydrophobicContact CG-CD1 3.86Å; L1546-I1550 VanDerWaalsContact O-CG1 3.31Å; L1546-I1550 WeakPolarHBondContact O-CG1 3.21Å; L1546-I1550 PolarHBondContact O-N 3.33Å; L1546-L1590 HydrophobicContact CD2-CD2 4.32Å
1547	T	71.5	Confident	66.8	Low	16 Å²	16	31.1 Å²	31.1	10%	0.098	17%	0.17	C	C	.	.	H	α-helix	trans	-55.1	-46.6	175.1	-47.6	0	0	0	0	111.2	L1543 K1544 A1545 L1549 I1550 E1551 I1609	L1543-T1547 PolarHBondContact O-N 3Å; L1543-T1547 PolarHBondContact O-OG1 2.89Å; K1544-T1547 VanDerWaalsContact O-CB 3.29Å; K1544-T1547 WeakPolarHBondContact O-CB 3.47Å; K1544-T1547 PolarHBondContact O-N 2.98Å; A1545-T1547 VanDerWaalsContact C-N 3.31Å; A1545-T1547 PolarHBondContact O-N 3.48Å; T1547-L1549 VanDerWaalsContact C-N 3.34Å; T1547-L1549 PolarHBondContact O-N 3.02Å; T1547-I1550 PolarHBondContact O-N 3.34Å; T1547-E1551 WeakPolarHBondContact O-CB 3.49Å; T1547-E1551 WeakPolarHBondContact O-CG 3.34Å; T1547-E1551 PolarHBondContact O-N 3.2Å; T1547-I1609 HydrophobicContact CG2-CG1 4.2Å; T1547-I1609 WeakPolarHBondContact OG1-CD1 3.41Å; T1547-I1609 VanDerWaalsContact OG1-CG1 3.26Å; T1547-I1609 WeakPolarHBondContact OG1-CG1 3.33Å
1548	I	72.2	Confident	65.7	Low	19 Å²	19	27.3 Å²	27.3	10%	0.097	15%	0.151	C	C	.	.	H	α-helix	trans	-63.6	-38.4	-179.6	-71.5	158.5	0	0	0	112	V1423 I1435 K1439 K1544 A1545 L1546 S1552	V1423-I1548 HydrophobicContact CG1-CD1 3.45Å; V1423-I1548 VanDerWaalsContact CG1-CD1 3.45Å; V1423-I1548 HydrophobicContact CG2-CD1 4.32Å; I1435-I1548 HydrophobicContact CG1-CD1 3.87Å; I1435-I1548 HydrophobicContact CG2-CG2 4.09Å; K1439-I1548 HydrophobicContact CD-CG2 4.34Å; K1439-I1548 VanDerWaalsContact CE-CG2 3.47Å; K1439-I1548 HydrophobicContact CG-CG2 3.89Å; K1544-I1548 WeakPolarHBondContact O-CD1 3.3Å; K1544-I1548 WeakPolarHBondContact O-CG1 3.45Å; K1544-I1548 PolarHBondContact O-N 3.09Å; A1545-I1548 WeakPolarHBondContact O-CB 3.45Å; A1545-I1548 PolarHBondContact O-N 3.39Å; L1546-I1548 VanDerWaalsContact C-N 3.3Å; L1546-I1548 PolarHBondContact O-N 3.37Å; I1548-S1552 WeakPolarHBondContact O-CB 3.4Å; I1548-S1552 PolarHBondContact O-N 3.1Å
1549	L	70.6	Confident	64.7	Low	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-69.6	-47	178.1	-66.8	168.3	0	0	0	111.3	N1442 I1523 W1524 M1527 A1545 L1546 T1547 S1552 Q1553	N1442-L1549 HydrophobicContact CB-CD2 3.79Å; I1523-L1549 HydrophobicContact CG2-CD1 3.73Å; I1523-L1549 HydrophobicContact CG2-CD2 4.13Å; W1524-L1549 HydrophobicContact CD2-CD1 4.46Å; W1524-L1549 HydrophobicContact CH2-CB 4.14Å; W1524-L1549 HydrophobicContact CZ2-CB 3.8Å; M1527-L1549 HydrophobicContact CG-CD1 3.86Å; A1545-L1549 WeakPolarHBondContact O-CG 3.47Å; A1545-L1549 PolarHBondContact O-N 2.9Å; L1546-L1549 PolarHBondContact O-N 3.38Å; T1547-L1549 VanDerWaalsContact C-N 3.34Å; T1547-L1549 PolarHBondContact O-N 3.02Å; L1549-S1552 WeakPolarHBondContact O-CB 3.44Å; L1549-S1552 PolarHBondContact O-N 3.04Å; L1549-S1552 VanDerWaalsContact O-N 3.12Å; L1549-Q1553 PolarHBondContact O-N 2.76Å
1550	I	65.8	Low	63.5	Low	7 Å²	7	34.7 Å²	34.7	4%	0.036	19%	0.191	C	C	.	.	H	α-helix	trans	-59.5	-48.4	176.1	-66.6	164.5	0	0	0	110.5	W1524 L1546 T1547 S1552 Q1553 I1554 I1586 I1609 I1613	W1524-I1550 HydrophobicContact CH2-CG1 3.74Å; W1524-I1550 HydrophobicContact CZ3-CG1 4.16Å; L1546-I1550 HydrophobicContact CD2-CD1 3.97Å; L1546-I1550 HydrophobicContact CG-CD1 3.86Å; L1546-I1550 VanDerWaalsContact O-CG1 3.31Å; L1546-I1550 WeakPolarHBondContact O-CG1 3.21Å; L1546-I1550 PolarHBondContact O-N 3.33Å; T1547-I1550 PolarHBondContact O-N 3.34Å; I1550-S1552 PolarHBondContact O-N 3.06Å; I1550-Q1553 PolarHBondContact O-N 2.88Å; I1550-I1554 HydrophobicContact CG2-CD1 3.67Å; I1550-I1554 HydrophobicContact CG2-CG1 4.43Å; I1550-I1554 WeakPolarHBondContact O-CG1 3.15Å; I1550-I1554 PolarHBondContact O-N 3.11Å; I1550-I1586 HydrophobicContact CD1-CG2 3.81Å; I1550-I1586 HydrophobicContact CG1-CD1 4.47Å; I1550-I1609 HydrophobicContact CD1-CG2 4.28Å; I1550-I1613 HydrophobicContact CD1-CD1 4.29Å; I1550-I1613 HydrophobicContact CG2-CD1 4.15Å; I1550-I1613 HydrophobicContact CG2-CG1 4.05Å
1551	E	67.1	Low	61.9	Low	47 Å²	47	36.9 Å²	36.9	22%	0.22	21%	0.206	C	C	.	.	H	α-helix	trans	-60.2	-34.9	175.9	-76.7	-178	178.9	0	0	112.5	T1547 S1555 R1612	T1547-E1551 WeakPolarHBondContact O-CB 3.49Å; T1547-E1551 WeakPolarHBondContact O-CG 3.34Å; T1547-E1551 PolarHBondContact O-N 3.2Å; E1551-S1555 VanDerWaalsContact O-CB 3.25Å; E1551-S1555 WeakPolarHBondContact O-CB 3.37Å; E1551-S1555 PolarHBondContact O-N 3.03Å; E1551-S1555 PolarHBondContact O-OG 2.85Å; E1551-R1612 IonicContact OE1-CZ 3.98Å; E1551-R1612 IonicContact OE1-NH1 3.09Å; E1551-R1612 PolarHBondContact OE1-NH1 2.78Å
1552	S	67.8	Low	60.3	Low	27 Å²	27	43.4 Å²	43.4	19%	0.189	24%	0.235	C	C	.	.	H	α-helix	trans	-69	-43.9	176.5	-161.3	0	0	0	0	112	I1548 L1549 I1550 S1555 G1556	I1548-S1552 WeakPolarHBondContact O-CB 3.4Å; I1548-S1552 PolarHBondContact O-N 3.1Å; L1549-S1552 WeakPolarHBondContact O-CB 3.44Å; L1549-S1552 PolarHBondContact O-N 3.04Å; L1549-S1552 VanDerWaalsContact O-N 3.12Å; I1550-S1552 PolarHBondContact O-N 3.06Å; S1552-S1555 PolarHBondContact O-N 2.96Å; S1552-G1556 PolarHBondContact O-N 3.29Å; S1552-G1556 VanDerWaalsContact O-N 3.12Å
1553	Q	63.7	Low	58.9	Low	50 Å²	50	49.2 Å²	49.2	23%	0.234	27%	0.266	C	S	.	.	H	α-helix	trans	-65.1	-47.6	179.3	-172.8	174.6	-16.6	0	0	111.3	L1549 I1550 S1555 G1556 T1557 D1579	L1549-Q1553 PolarHBondContact O-N 2.76Å; I1550-Q1553 PolarHBondContact O-N 2.88Å; Q1553-S1555 VanDerWaalsContact C-N 3.3Å; Q1553-S1555 PolarHBondContact O-N 3.39Å; Q1553-G1556 WeakPolarHBondContact O-CA 3.32Å; Q1553-G1556 PolarHBondContact O-N 3.33Å; Q1553-T1557 PolarHBondContact O-N 2.97Å; Q1553-T1557 VanDerWaalsContact O-N 3.12Å; Q1553-D1579 PolarHBondContact NE2-OD1 2.84Å
1554	I	59.4	Low	57.1	Low	21 Å²	21	53.1 Å²	53.1	11%	0.108	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-38.3	175.5	-63.7	169.1	0	0	0	111.2	I1550 G1556 T1557 I1558	I1550-I1554 HydrophobicContact CG2-CD1 3.67Å; I1550-I1554 HydrophobicContact CG2-CG1 4.43Å; I1550-I1554 WeakPolarHBondContact O-CG1 3.15Å; I1550-I1554 PolarHBondContact O-N 3.11Å; I1554-G1556 PolarHBondContact O-N 3.43Å; I1554-T1557 PolarHBondContact O-N 3.47Å; I1554-T1557 PolarHBondContact O-OG1 3.31Å; I1554-I1558 HydrophobicContact CG2-CD1 3.96Å; I1554-I1558 WeakPolarHBondContact O-CG1 3.26Å; I1554-I1558 PolarHBondContact O-N 2.83Å
1555	S	56.7	Low	55.2	Low	50 Å²	50	54.8 Å²	54.8	35%	0.35	30%	0.3	S	S	.	.	H	α-helix	trans	-68.6	-19.6	175.8	-57.4	0	0	0	0	113.2	E1551 S1552 Q1553 K1559	E1551-S1555 VanDerWaalsContact O-CB 3.25Å; E1551-S1555 WeakPolarHBondContact O-CB 3.37Å; E1551-S1555 PolarHBondContact O-N 3.03Å; E1551-S1555 PolarHBondContact O-OG 2.85Å; S1552-S1555 PolarHBondContact O-N 2.96Å; Q1553-S1555 VanDerWaalsContact C-N 3.3Å; Q1553-S1555 PolarHBondContact O-N 3.39Å; S1555-K1559 WeakPolarHBondContact O-CG 3.19Å
1556	G	57.5	Low	53.4	Low	33 Å²	33	60.2 Å²	60.2	34%	0.34	33%	0.333	S	S	.	.	H	α-helix	trans	-76.4	-47.4	171.1	0	0	0	0	0	112.3	S1552 Q1553 I1554 I1558 K1559 T1560	S1552-G1556 PolarHBondContact O-N 3.29Å; S1552-G1556 VanDerWaalsContact O-N 3.12Å; Q1553-G1556 WeakPolarHBondContact O-CA 3.32Å; Q1553-G1556 PolarHBondContact O-N 3.33Å; I1554-G1556 PolarHBondContact O-N 3.43Å; G1556-I1558 PolarHBondContact O-N 3.1Å; G1556-K1559 PolarHBondContact O-N 2.93Å; G1556-T1560 PolarHBondContact O-N 3.41Å
1557	T	51.4	Low	51.3	Low	55 Å²	55	66.1 Å²	66.1	34%	0.337	36%	0.364	S	S	.	.	H	α-helix	trans	-66.7	-33.7	-178.2	55	0	0	0	0	113.3	Q1553 I1554 K1559 T1560 T1561	Q1553-T1557 PolarHBondContact O-N 2.97Å; Q1553-T1557 VanDerWaalsContact O-N 3.12Å; I1554-T1557 PolarHBondContact O-N 3.47Å; I1554-T1557 PolarHBondContact O-OG1 3.31Å; T1557-K1559 VanDerWaalsContact C-N 3.32Å; T1557-K1559 PolarHBondContact O-N 3.23Å; T1557-T1560 PolarHBondContact O-N 3.36Å; T1557-T1560 PolarHBondContact O-OG1 3.4Å; T1557-T1561 PolarHBondContact O-N 2.89Å; T1557-T1561 VanDerWaalsContact O-N 3.09Å; T1557-T1561 PolarHBondContact O-OG1 2.93Å
1558	I	44.2	Very low	49.1	Very low	52 Å²	52	71.9 Å²	71.9	27%	0.267	40%	0.395	S	S	.	.	H	α-helix	trans	-62.8	-38.4	173.8	-66.9	165.4	0	0	0	111.5	I1554 G1556 T1561 Q1562 E1620	I1554-I1558 HydrophobicContact CG2-CD1 3.96Å; I1554-I1558 WeakPolarHBondContact O-CG1 3.26Å; I1554-I1558 PolarHBondContact O-N 2.83Å; G1556-I1558 PolarHBondContact O-N 3.1Å; I1558-T1561 WeakPolarHBondContact CA-OG1 3.42Å; I1558-T1561 PolarHBondContact O-OG1 2.71Å; I1558-T1561 VanDerWaalsContact O-OG1 3.12Å; I1558-Q1562 WeakPolarHBondContact O-CG 3.39Å; I1558-Q1562 PolarHBondContact O-N 2.82Å; I1558-Q1562 VanDerWaalsContact O-N 3.08Å; I1558-E1620 WeakPolarHBondContact CG1-OE1 2.75Å
1559	K	45.4	Very low	47.2	Very low	149 Å²	149	80.2 Å²	80.2	65%	0.648	43%	0.43	S	S	*	.	H	α-helix	trans	-69.8	-33.6	-179.9	-72.8	178.3	178.6	-178.8	0	112.7	S1555 G1556 T1557	S1555-K1559 WeakPolarHBondContact O-CG 3.19Å; G1556-K1559 PolarHBondContact O-N 2.93Å; T1557-K1559 VanDerWaalsContact C-N 3.32Å; T1557-K1559 PolarHBondContact O-N 3.23Å
1560	T	39.1	Very low	45	Very low	83 Å²	83	87.6 Å²	87.6	51%	0.509	47%	0.47	S	S	.	.	H	α-helix	trans	-76.1	-37.9	176.7	52.6	0	0	0	0	111.8	G1556 T1557 N1563 N1564	G1556-T1560 PolarHBondContact O-N 3.41Å; T1557-T1560 PolarHBondContact O-N 3.36Å; T1557-T1560 PolarHBondContact O-OG1 3.4Å; T1560-N1563 PolarHBondContact O-N 2.89Å; T1560-N1564 VanDerWaalsContact O-CG 3.24Å; T1560-N1564 PolarHBondContact O-N 3.05Å; T1560-N1564 PolarHBondContact O-ND2 2.78Å
1561	T	35.3	Very low	43	Very low	78 Å²	78	91.6 Å²	91.6	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-43.5	174.8	31.6	0	0	0	0	112.9	T1557 I1558 N1563 N1564 N1565	T1557-T1561 PolarHBondContact O-N 2.89Å; T1557-T1561 VanDerWaalsContact O-N 3.09Å; T1557-T1561 PolarHBondContact O-OG1 2.93Å; I1558-T1561 WeakPolarHBondContact CA-OG1 3.42Å; I1558-T1561 PolarHBondContact O-OG1 2.71Å; I1558-T1561 VanDerWaalsContact O-OG1 3.12Å; T1561-N1563 VanDerWaalsContact C-N 3.29Å; T1561-N1563 PolarHBondContact O-N 3.18Å; T1561-N1564 PolarHBondContact O-N 2.8Å; T1561-N1564 VanDerWaalsContact O-N 3.09Å; T1561-N1565 PolarHBondContact O-N 2.91Å
1562	Q	39.2	Very low	41	Very low	143 Å²	143	101 Å²	101	67%	0.668	53%	0.531	S	S	*	.	H	α-helix	trans	-60.3	-36.1	177.7	-77	-172.4	-10.5	0	0	113.5	I1558 N1564	I1558-Q1562 WeakPolarHBondContact O-CG 3.39Å; I1558-Q1562 PolarHBondContact O-N 2.82Å; I1558-Q1562 VanDerWaalsContact O-N 3.08Å; Q1562-N1564 VanDerWaalsContact C-N 3.35Å
1563	N	39.7	Very low	39	Very low	122 Å²	122	108 Å²	108	65%	0.652	57%	0.565	S	S	*	*	H	α-helix	trans	-73.4	-23	176.4	-83.5	-12.1	0	0	0	113.7	T1560 T1561 T1566	T1560-N1563 PolarHBondContact O-N 2.89Å; T1561-N1563 VanDerWaalsContact C-N 3.29Å; T1561-N1563 PolarHBondContact O-N 3.18Å; N1563-T1566 PolarHBondContact O-OG1 2.82Å
1564	N	32.6	Very low	37.1	Very low	82 Å²	82	117 Å²	117	44%	0.439	60%	0.599	S	S	.	*	H	α-helix	trans	-82.2	-25.8	-176.7	-73	-14.2	0	0	0	113	T1560 T1561 Q1562 T1566 N1567	T1560-N1564 VanDerWaalsContact O-CG 3.24Å; T1560-N1564 PolarHBondContact O-N 3.05Å; T1560-N1564 PolarHBondContact O-ND2 2.78Å; T1561-N1564 PolarHBondContact O-N 2.8Å; T1561-N1564 VanDerWaalsContact O-N 3.09Å; Q1562-N1564 VanDerWaalsContact C-N 3.35Å; N1564-T1566 PolarHBondContact O-N 3.02Å; N1564-N1567 PolarHBondContact O-N 2.86Å
1565	N	34.2	Very low	35.6	Very low	111 Å²	111	119 Å²	119	59%	0.594	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-15.3	-176.9	-79.7	-0.3	0	0	0	114.7	T1561	T1561-N1565 PolarHBondContact O-N 2.91Å
1566	T	36.4	Very low	34.2	Very low	115 Å²	115	124.4 Å²	124.4	71%	0.706	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-14.2	174.1	39.9	0	0	0	0	114.4	N1563 N1564	N1563-T1566 PolarHBondContact O-OG1 2.82Å; N1564-T1566 PolarHBondContact O-N 3.02Å
1567	N	27.2	Very low	32.8	Very low	128 Å²	128	128.9 Å²	128.9	68%	0.684	67%	0.67	S	S	*	*	S	Bend	trans	-120.6	57.4	-178.3	-79.8	-28	0	0	0	111.9	N1564 K1569	N1564-N1567 PolarHBondContact O-N 2.86Å; N1567-K1569 PolarHBondContact O-N 2.98Å
1568	N	25.9	Very low	31.6	Very low	137 Å²	137	130.7 Å²	130.7	73%	0.733	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	88.3	-170.7	-153.4	-12.1	0	0	0	112.5
1569	K	31.9	Very low	31.2	Very low	194 Å²	194	132.4 Å²	132.4	84%	0.843	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-172.7	-20.4	144.5	-104.2	159.6	-170.8	179.4	0	117.1	N1567	N1567-K1569 PolarHBondContact O-N 2.98Å
1570	N	25.5	Very low	31	Very low	156 Å²	156	126.4 Å²	126.4	83%	0.834	67%	0.671	S	S	*	*	S	Bend	trans	-104.7	2.6	-171.4	-73.8	4.2	0	0	0	116.5
1571	C	22.8	Very low	31.1	Very low	91 Å²	91	123.7 Å²	123.7	62%	0.615	65%	0.653	S	S	*	*			trans	-109.3	47.6	-172.4	-68.2	0	0	0	0	115.1
1572	R	25.9	Very low	31.7	Very low	245 Å²	245	121.8 Å²	121.8	93%	0.925	64%	0.642	S	S	*	*	S	Bend	trans	-98.8	0.9	173.9	-97.4	-172.1	179	-175.3	0.8	116.3
1573	L	25	Very low	32.1	Very low	173 Å²	173	116.8 Å²	116.8	91%	0.906	62%	0.619	S	S	*	*	S	Bend	trans	-110.1	6.9	-176.2	-81.3	168.3	0	0	0	116.1
1574	Y	24.2	Very low	32.3	Very low	240 Å²	240	114.6 Å²	114.6	94%	0.941	61%	0.614	S	S	*	*	S	Bend	trans	-110.9	23.4	173.8	-95.5	-77.6	0	0	0	113.7
1575	G	27.1	Very low	33.2	Very low	62 Å²	62	112.8 Å²	112.8	64%	0.639	61%	0.606	S	S	*	*	S	Bend	trans	-86.3	-37.4	-168.8	0	0	0	0	0	117.7
1576	N	27.8	Very low	34.1	Very low	164 Å²	164	108 Å²	108	88%	0.877	58%	0.58	S	S	*	*	S	Bend	trans	-125.9	15.6	-150.7	-79.6	8.5	0	0	0	117.6
1577	T	27.5	Very low	35.1	Very low	127 Å²	127	104.1 Å²	104.1	78%	0.779	56%	0.555	S	S	*	*	S	Bend	trans	-138.1	133.4	171.2	50.7	0	0	0	0	112.2
1578	T	27.1	Very low	36.3	Very low	92 Å²	92	103.3 Å²	103.3	56%	0.564	55%	0.547	S	S	*	.			trans	83.8	44.5	175.7	73.6	0	0	0	0	119.3
1579	D	34.9	Very low	37.7	Very low	89 Å²	89	99.9 Å²	99.9	48%	0.476	53%	0.528	S	S	.	.			trans	-80.6	104.7	139.5	-90.5	-40.6	0	0	0	107.8	Q1553 I1581	Q1553-D1579 PolarHBondContact NE2-OD1 2.84Å; D1579-I1581 CarbonylContact O-C 3.57Å; D1579-I1581 PolarHBondContact O-N 3.45Å
1580	G	41.4	Very low	39.1	Very low	23 Å²	23	90.7 Å²	90.7	24%	0.237	49%	0.488	C	S	.	.	S	Bend	trans	-62.7	-12.3	-163.3	0	0	0	0	0	116.9
1581	I	42.7	Very low	40.8	Very low	25 Å²	25	86.9 Å²	86.9	13%	0.128	47%	0.468	C	S	.	.	S	Bend	trans	-136.1	127.8	155.1	-54.4	163	0	0	0	105.7	L1520 W1524 D1579 N1583 T1585 I1586	L1520-I1581 HydrophobicContact CD1-CD1 4.2Å; L1520-I1581 HydrophobicContact CD1-CG1 3.78Å; L1520-I1581 HydrophobicContact CD2-CD1 3.67Å; L1520-I1581 HydrophobicContact CD2-CG1 3.81Å; L1520-I1581 HydrophobicContact CG-CD1 4.46Å; L1520-I1581 HydrophobicContact CG-CG1 4.13Å; W1524-I1581 HydrophobicContact CD2-CD1 4.33Å; W1524-I1581 HydrophobicContact CE3-CD1 3.72Å; W1524-I1581 HydrophobicContact CZ3-CD1 4Å; D1579-I1581 CarbonylContact O-C 3.57Å; D1579-I1581 PolarHBondContact O-N 3.45Å; I1581-N1583 PolarHBondContact O-N 3.32Å; I1581-T1585 HydrophobicContact CG2-CG2 4.22Å; I1581-I1586 HydrophobicContact CB-CD1 3.98Å; I1581-I1586 HydrophobicContact CB-CG1 4.22Å; I1581-I1586 HydrophobicContact CD1-CD1 3.91Å; I1581-I1586 HydrophobicContact CD1-CG1 4.07Å; I1581-I1586 HydrophobicContact CG2-CD1 4.04Å; I1581-I1586 HydrophobicContact CG2-CG1 3.73Å
1582	T	46	Very low	42.3	Very low	39 Å²	39	85.8 Å²	85.8	24%	0.239	46%	0.456	C	S	.	.			trans	-60.4	134.1	168.7	54.4	0	0	0	0	109	S1584 T1585	T1582-S1584 VanDerWaalsContact CB-OG 3.24Å; T1582-S1584 WeakPolarHBondContact CB-OG 3.4Å; T1582-S1584 PolarHBondContact O-N 2.96Å; T1582-S1584 PolarHBondContact OG1-OG 3.24Å; T1582-T1585 PolarHBondContact O-N 3.05Å; T1582-T1585 PolarHBondContact OG1-OG1 3.27Å; T1582-T1585 VanDerWaalsContact OG1-OG1 3.05Å
1583	N	48.6	Very low	43.9	Very low	37 Å²	37	75.1 Å²	75.1	20%	0.198	42%	0.417	C	S	.	.	H	α-helix	trans	-54.1	-25.3	179.8	-72.6	-54	0	0	0	112.4	I1581 L1587 F1617	I1581-N1583 PolarHBondContact O-N 3.32Å; N1583-L1587 WeakPolarHBondContact O-CB 3.43Å; N1583-L1587 WeakPolarHBondContact O-CD1 3.45Å; N1583-L1587 VanDerWaalsContact O-CG 3.22Å; N1583-L1587 WeakPolarHBondContact O-CG 3.2Å; N1583-L1587 PolarHBondContact O-N 3.31Å; N1583-F1617 HydrophobicContact CB-CE2 4.08Å; N1583-F1617 HydrophobicContact CB-CZ 3.88Å
1584	S	44.3	Very low	45.7	Very low	76 Å²	76	69.6 Å²	69.6	53%	0.531	39%	0.387	S	S	.	.	H	α-helix	trans	-58.3	-42.1	168.3	36.3	0	0	0	0	115	T1582 L1587 Q1588	T1582-S1584 VanDerWaalsContact CB-OG 3.24Å; T1582-S1584 WeakPolarHBondContact CB-OG 3.4Å; T1582-S1584 PolarHBondContact O-N 2.96Å; T1582-S1584 PolarHBondContact OG1-OG 3.24Å; S1584-L1587 PolarHBondContact O-N 2.89Å; S1584-Q1588 WeakPolarHBondContact O-CB 3.22Å; S1584-Q1588 PolarHBondContact O-N 2.79Å
1585	T	50.5	Low	47.3	Very low	44 Å²	44	61.2 Å²	61.2	27%	0.27	36%	0.363	S	S	.	.	H	α-helix	trans	-70.2	-38.3	179.6	-49.3	0	0	0	0	111.5	I1513 I1581 T1582 Q1588 L1589	I1513-T1585 HydrophobicContact CD1-CG2 4.11Å; I1581-T1585 HydrophobicContact CG2-CG2 4.22Å; T1582-T1585 PolarHBondContact O-N 3.05Å; T1582-T1585 PolarHBondContact OG1-OG1 3.27Å; T1582-T1585 VanDerWaalsContact OG1-OG1 3.05Å; T1585-Q1588 PolarHBondContact O-N 2.82Å; T1585-L1589 PolarHBondContact O-N 2.83Å
1586	I	54.4	Low	48.5	Very low	10 Å²	10	62.6 Å²	62.6	5%	0.051	36%	0.356	C	S	.	.	H	α-helix	trans	-64.4	-45.3	172	-72.5	164.7	0	0	0	110.3	W1524 I1550 I1581 Q1588 L1589 L1590 I1613	W1524-I1586 HydrophobicContact CH2-CD1 4.09Å; W1524-I1586 HydrophobicContact CZ3-CD1 3.74Å; I1550-I1586 HydrophobicContact CD1-CG2 3.81Å; I1550-I1586 HydrophobicContact CG1-CD1 4.47Å; I1581-I1586 HydrophobicContact CB-CD1 3.98Å; I1581-I1586 HydrophobicContact CB-CG1 4.22Å; I1581-I1586 HydrophobicContact CD1-CD1 3.91Å; I1581-I1586 HydrophobicContact CD1-CG1 4.07Å; I1581-I1586 HydrophobicContact CG2-CD1 4.04Å; I1581-I1586 HydrophobicContact CG2-CG1 3.73Å; I1586-Q1588 VanDerWaalsContact C-N 3.31Å; I1586-Q1588 PolarHBondContact O-N 3.16Å; I1586-L1589 PolarHBondContact O-N 3.18Å; I1586-L1590 HydrophobicContact CG2-CD1 3.67Å; I1586-L1590 HydrophobicContact CG2-CG 4.25Å; I1586-L1590 WeakPolarHBondContact O-CB 3.37Å; I1586-L1590 VanDerWaalsContact O-CG 3.27Å; I1586-L1590 WeakPolarHBondContact O-CG 3.35Å; I1586-L1590 PolarHBondContact O-N 3.17Å; I1586-I1613 HydrophobicContact CG2-CD1 4.46Å
1587	L	56	Low	49.9	Very low	35 Å²	35	56.3 Å²	56.3	18%	0.183	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-38.6	176.8	-77.1	167.5	0	0	0	112	N1583 S1584 L1590 N1591 I1610 I1613	N1583-L1587 WeakPolarHBondContact O-CB 3.43Å; N1583-L1587 WeakPolarHBondContact O-CD1 3.45Å; N1583-L1587 VanDerWaalsContact O-CG 3.22Å; N1583-L1587 WeakPolarHBondContact O-CG 3.2Å; N1583-L1587 PolarHBondContact O-N 3.31Å; S1584-L1587 PolarHBondContact O-N 2.89Å; L1587-L1590 PolarHBondContact O-N 2.84Å; L1587-N1591 WeakPolarHBondContact O-CB 3.41Å; L1587-N1591 PolarHBondContact O-N 2.98Å; L1587-N1591 PolarHBondContact O-ND2 3.43Å; L1587-N1591 VanDerWaalsContact O-ND2 3.15Å; L1587-I1610 HydrophobicContact CD2-CB 4.43Å; L1587-I1610 HydrophobicContact CD2-CG1 4.28Å; L1587-I1610 HydrophobicContact CD2-CG2 4.13Å; L1587-I1613 HydrophobicContact CD1-CG2 4.14Å; L1587-I1613 HydrophobicContact CD2-CB 4.26Å; L1587-I1613 HydrophobicContact CD2-CD1 4.22Å; L1587-I1613 HydrophobicContact CD2-CG2 4.01Å; L1587-I1613 HydrophobicContact CG-CG2 4.26Å
1588	Q	53.6	Low	51.6	Low	110 Å²	110	55.7 Å²	55.7	51%	0.514	32%	0.323	S	S	.	.	H	α-helix	trans	-63.3	-52.3	175.3	-172.1	170.7	-2.3	0	0	111.2	S1584 T1585 I1586 L1590 N1591 D1592	S1584-Q1588 WeakPolarHBondContact O-CB 3.22Å; S1584-Q1588 PolarHBondContact O-N 2.79Å; T1585-Q1588 PolarHBondContact O-N 2.82Å; I1586-Q1588 VanDerWaalsContact C-N 3.31Å; I1586-Q1588 PolarHBondContact O-N 3.16Å; Q1588-L1590 VanDerWaalsContact C-N 3.29Å; Q1588-L1590 PolarHBondContact O-N 2.83Å; Q1588-N1591 WeakPolarHBondContact O-CB 3.45Å; Q1588-N1591 PolarHBondContact O-N 3.07Å; Q1588-D1592 PolarHBondContact O-N 3.49Å
1589	L	55.2	Low	53.3	Low	66 Å²	66	52.5 Å²	52.5	35%	0.346	30%	0.303	S	S	.	.	H	α-helix	trans	-56	-42.5	175.9	-172.9	76.9	0	0	0	112.2	L1531 T1585 I1586 D1592 I1593	L1531-L1589 HydrophobicContact CD1-CD2 3.96Å; T1585-L1589 PolarHBondContact O-N 2.83Å; I1586-L1589 PolarHBondContact O-N 3.18Å; L1589-D1592 PolarHBondContact O-N 3Å; L1589-I1593 HydrophobicContact CG-CD1 4.21Å; L1589-I1593 VanDerWaalsContact O-CG1 3.29Å; L1589-I1593 WeakPolarHBondContact O-CG1 3.37Å; L1589-I1593 PolarHBondContact O-N 2.99Å
1590	L	61.7	Low	54.9	Low	0 Å²	0	52.4 Å²	52.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.7	-35.2	177.6	-70.9	171.6	0	0	0	112.6	L1543 L1546 I1586 L1587 Q1588 H1594 A1606 I1609 I1610 I1613	L1543-L1590 HydrophobicContact CD2-CD2 3.86Å; L1546-L1590 HydrophobicContact CD2-CD2 4.32Å; I1586-L1590 HydrophobicContact CG2-CD1 3.67Å; I1586-L1590 HydrophobicContact CG2-CG 4.25Å; I1586-L1590 WeakPolarHBondContact O-CB 3.37Å; I1586-L1590 VanDerWaalsContact O-CG 3.27Å; I1586-L1590 WeakPolarHBondContact O-CG 3.35Å; I1586-L1590 PolarHBondContact O-N 3.17Å; L1587-L1590 PolarHBondContact O-N 2.84Å; Q1588-L1590 VanDerWaalsContact C-N 3.29Å; Q1588-L1590 PolarHBondContact O-N 2.83Å; L1590-H1594 VanDerWaalsContact O-CB 3.29Å; L1590-H1594 WeakPolarHBondContact O-CB 3.41Å; L1590-H1594 PolarHBondContact O-N 2.97Å; L1590-A1606 HydrophobicContact CD2-CB 4.31Å; L1590-I1609 HydrophobicContact CD1-CB 4.16Å; L1590-I1609 HydrophobicContact CD1-CG2 3.52Å; L1590-I1609 HydrophobicContact CD2-CD1 4.37Å; L1590-I1610 HydrophobicContact CB-CD1 3.94Å; L1590-I1610 HydrophobicContact CB-CG1 3.76Å; L1590-I1610 HydrophobicContact CD1-CG1 4.33Å; L1590-I1613 HydrophobicContact CD1-CD1 4.17Å
1591	N	59.8	Low	56.2	Low	76 Å²	76	56.7 Å²	56.7	41%	0.406	32%	0.324	S	S	.	.	H	α-helix	trans	-66.9	-39.5	173.6	-74.1	-27.1	0	0	0	111.3	L1587 Q1588 H1594 S1595 I1610	L1587-N1591 WeakPolarHBondContact O-CB 3.41Å; L1587-N1591 PolarHBondContact O-N 2.98Å; L1587-N1591 PolarHBondContact O-ND2 3.43Å; L1587-N1591 VanDerWaalsContact O-ND2 3.15Å; Q1588-N1591 WeakPolarHBondContact O-CB 3.45Å; Q1588-N1591 PolarHBondContact O-N 3.07Å; N1591-H1594 PolarHBondContact O-N 2.91Å; N1591-S1595 WeakPolarHBondContact O-CB 3.38Å; N1591-S1595 PolarHBondContact O-N 3.09Å; N1591-S1595 PolarHBondContact O-OG 3.32Å; N1591-I1610 VanDerWaalsContact OD1-CD1 3.28Å; N1591-I1610 WeakPolarHBondContact OD1-CD1 3.43Å
1592	D	54.7	Low	57.3	Low	68 Å²	68	55.5 Å²	55.5	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-66.4	-39.8	176.6	-66.1	-33.8	0	0	0	111.4	Q1588 L1589 S1595 N1596	Q1588-D1592 PolarHBondContact O-N 3.49Å; L1589-D1592 PolarHBondContact O-N 3Å; D1592-S1595 PolarHBondContact O-OG 3.04Å; D1592-S1595 VanDerWaalsContact O-OG 3.14Å; D1592-N1596 WeakPolarHBondContact O-CB 3.32Å; D1592-N1596 PolarHBondContact O-N 2.86Å; D1592-N1596 PolarHBondContact O-ND2 3.39Å; D1592-N1596 VanDerWaalsContact O-ND2 3.12Å
1593	I	59.3	Low	58.4	Low	21 Å²	21	56.3 Å²	56.3	11%	0.108	32%	0.318	C	S	.	.	H	α-helix	trans	-66.1	-42.5	170.7	-66.6	165.1	0	0	0	110.7	L1531 L1589 S1595 D1597 V1602 A1606	L1531-I1593 HydrophobicContact CB-CD1 4.43Å; L1531-I1593 HydrophobicContact CD1-CD1 3.94Å; L1531-I1593 HydrophobicContact CD2-CD1 4.44Å; L1589-I1593 HydrophobicContact CG-CD1 4.21Å; L1589-I1593 VanDerWaalsContact O-CG1 3.29Å; L1589-I1593 WeakPolarHBondContact O-CG1 3.37Å; L1589-I1593 PolarHBondContact O-N 2.99Å; I1593-S1595 VanDerWaalsContact C-N 3.29Å; I1593-S1595 PolarHBondContact O-N 3.35Å; I1593-D1597 VanDerWaalsContact O-CB 3.23Å; I1593-D1597 WeakPolarHBondContact O-CB 3.39Å; I1593-D1597 PolarHBondContact O-N 3.32Å; I1593-V1602 HydrophobicContact CG2-CG1 3.51Å; I1593-A1606 HydrophobicContact CG2-CB 4.04Å
1594	H	63.3	Low	59.6	Low	58 Å²	58	58.8 Å²	58.8	27%	0.269	33%	0.331	S	S	.	.	H	α-helix	trans	-64.9	-31.4	179.3	-176	55.3	0	0	0	113	L1590 N1591 K1603 A1606 I1610	L1590-H1594 VanDerWaalsContact O-CB 3.29Å; L1590-H1594 WeakPolarHBondContact O-CB 3.41Å; L1590-H1594 PolarHBondContact O-N 2.97Å; N1591-H1594 PolarHBondContact O-N 2.91Å; H1594-K1603 PolarHBondContact ND1-O 3.42Å; H1594-K1603 WeakPolarHBondContact O-CE 3.41Å; H1594-A1606 HydrophobicContact CB-CB 4.35Å; H1594-I1610 HydrophobicContact CB-CD1 4.21Å
1595	S	57.4	Low	60.8	Low	64 Å²	64	56.7 Å²	56.7	45%	0.448	31%	0.314	S	S	.	.	H	α-helix	trans	-86.5	-51.9	179.6	54.6	0	0	0	0	113	N1591 D1592 I1593 K1603	N1591-S1595 WeakPolarHBondContact O-CB 3.38Å; N1591-S1595 PolarHBondContact O-N 3.09Å; N1591-S1595 PolarHBondContact O-OG 3.32Å; D1592-S1595 PolarHBondContact O-OG 3.04Å; D1592-S1595 VanDerWaalsContact O-OG 3.14Å; I1593-S1595 VanDerWaalsContact C-N 3.29Å; I1593-S1595 PolarHBondContact O-N 3.35Å; S1595-K1603 WeakPolarHBondContact O-CE 3.46Å; S1595-K1603 PolarHBondContact O-NZ 3.38Å
1596	N	52.4	Low	61.7	Low	91 Å²	91	54.6 Å²	54.6	49%	0.487	30%	0.301	S	S	.	.	H	α-helix	trans	-90.9	-18.5	-163.4	-59.5	-52.2	0	0	0	114.6	D1592	D1592-N1596 WeakPolarHBondContact O-CB 3.32Å; D1592-N1596 PolarHBondContact O-N 2.86Å; D1592-N1596 PolarHBondContact O-ND2 3.39Å; D1592-N1596 VanDerWaalsContact O-ND2 3.12Å
1597	D	58.2	Low	62.6	Low	31 Å²	31	60.5 Å²	60.5	17%	0.166	32%	0.322	C	S	.	.			trans	-72.5	153.1	-167.7	-149.4	-94.4	0	0	0	115.8	R1539 I1593 D1599 K1603	R1539-D1597 IonicContact CZ-OD1 2.98Å; R1539-D1597 VanDerWaalsContact CZ-OD1 3.27Å; R1539-D1597 IonicContact CZ-OD2 3.19Å; R1539-D1597 IonicContact NH1-OD1 3.48Å; R1539-D1597 PolarHBondContact NH1-OD1 3.22Å; R1539-D1597 IonicContact NH1-OD2 2.69Å; R1539-D1597 PolarHBondContact NH1-OD2 2.86Å; R1539-D1597 IonicContact NH2-OD1 2.65Å; R1539-D1597 PolarHBondContact NH2-OD1 3.36Å; R1539-D1597 IonicContact NH2-OD2 2.88Å; R1539-D1597 PolarHBondContact NH2-OD2 2.91Å; I1593-D1597 VanDerWaalsContact O-CB 3.23Å; I1593-D1597 WeakPolarHBondContact O-CB 3.39Å; I1593-D1597 PolarHBondContact O-N 3.32Å; D1597-D1599 PolarHBondContact OD1-N 3.47Å; D1597-K1603 HydrophobicContact CB-CG 4.06Å; D1597-K1603 WeakPolarHBondContact O-CD 3.33Å; D1597-K1603 WeakPolarHBondContact O-CE 3.46Å; D1597-K1603 PolarHBondContact O-NZ 3.27Å
1598	S	61.4	Low	63.5	Low	114 Å²	114	64 Å²	64	80%	0.797	34%	0.338	S	S	*	.	S	Bend	trans	-83.6	-24.2	177.7	56.5	0	0	0	0	113.8
1599	D	63.8	Low	64.3	Low	26 Å²	26	59 Å²	59	14%	0.139	32%	0.315	C	S	.	.			trans	-89.8	117.5	-176.7	-169.7	-36.9	0	0	0	111.8	S1536 D1597 L1601 V1602 K1603	S1536-D1599 WeakPolarHBondContact CB-OD2 3.38Å; D1597-D1599 PolarHBondContact OD1-N 3.47Å; D1599-L1601 VanDerWaalsContact C-N 3.3Å; D1599-L1601 PolarHBondContact O-N 3.03Å; D1599-L1601 WeakPolarHBondContact OD1-CA 3.33Å; D1599-L1601 VanDerWaalsContact OD1-CB 3.3Å; D1599-L1601 WeakPolarHBondContact OD1-CB 3.44Å; D1599-L1601 PolarHBondContact OD1-N 3.36Å; D1599-V1602 HydrophobicContact CB-CB 4.09Å; D1599-V1602 HydrophobicContact CB-CG2 3.85Å; D1599-V1602 PolarHBondContact O-N 3.27Å; D1599-V1602 PolarHBondContact OD1-N 2.86Å; D1599-K1603 PolarHBondContact O-N 2.84Å
1600	P	69.2	Low	65	Low	87 Å²	87	56.8 Å²	56.8	57%	0.565	30%	0.303	S	S	*	.	H	α-helix	trans	-67	-27	-179.8	28.6	-35.5	0	0	0	113.5	N1604	P1600-N1604 WeakPolarHBondContact O-CB 3.42Å; P1600-N1604 PolarHBondContact O-N 2.93Å; P1600-N1604 PolarHBondContact O-ND2 3.2Å; P1600-N1604 VanDerWaalsContact O-ND2 3.13Å
1601	L	68.6	Low	65.5	Low	113 Å²	113	60.7 Å²	60.7	59%	0.592	32%	0.324	S	S	*	.	H	α-helix	trans	-68.8	-43.4	175.6	-65.9	175.1	0	0	0	110.4	I1540 D1599 N1604 L1605	I1540-L1601 HydrophobicContact CD1-CB 4.12Å; I1540-L1601 HydrophobicContact CD1-CD1 4.34Å; D1599-L1601 VanDerWaalsContact C-N 3.3Å; D1599-L1601 PolarHBondContact O-N 3.03Å; D1599-L1601 WeakPolarHBondContact OD1-CA 3.33Å; D1599-L1601 VanDerWaalsContact OD1-CB 3.3Å; D1599-L1601 WeakPolarHBondContact OD1-CB 3.44Å; D1599-L1601 PolarHBondContact OD1-N 3.36Å; L1601-N1604 PolarHBondContact O-N 3.41Å; L1601-L1605 WeakPolarHBondContact O-CB 3.33Å; L1601-L1605 PolarHBondContact O-N 2.87Å
1602	V	66.1	Low	65.9	Low	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.3	-49.2	174.5	172.9	0	0	0	0	110.1	R1539 I1540 L1543 I1593 D1599 N1604 L1605 A1606	R1539-V1602 HydrophobicContact CB-CG2 4.47Å; I1540-V1602 HydrophobicContact CD1-CG2 4.37Å; I1540-V1602 HydrophobicContact CG1-CG2 3.67Å; L1543-V1602 HydrophobicContact CD1-CB 4.24Å; L1543-V1602 HydrophobicContact CD1-CG1 3.51Å; I1593-V1602 HydrophobicContact CG2-CG1 3.51Å; D1599-V1602 HydrophobicContact CB-CB 4.09Å; D1599-V1602 HydrophobicContact CB-CG2 3.85Å; D1599-V1602 PolarHBondContact O-N 3.27Å; D1599-V1602 PolarHBondContact OD1-N 2.86Å; V1602-N1604 VanDerWaalsContact C-N 3.29Å; V1602-N1604 PolarHBondContact O-N 2.86Å; V1602-L1605 PolarHBondContact O-N 3.01Å; V1602-L1605 VanDerWaalsContact O-N 3.14Å; V1602-A1606 WeakPolarHBondContact O-CB 3.28Å; V1602-A1606 PolarHBondContact O-N 3.46Å
1603	K	69	Low	66.3	Low	56 Å²	56	60.3 Å²	60.3	24%	0.243	31%	0.312	C	S	.	.	H	α-helix	trans	-54.9	-44.2	177.1	-75.8	-178.9	144.1	163.2	0	112.2	H1594 S1595 D1597 D1599 R1607	H1594-K1603 PolarHBondContact ND1-O 3.42Å; H1594-K1603 WeakPolarHBondContact O-CE 3.41Å; S1595-K1603 WeakPolarHBondContact O-CE 3.46Å; S1595-K1603 PolarHBondContact O-NZ 3.38Å; D1597-K1603 HydrophobicContact CB-CG 4.06Å; D1597-K1603 WeakPolarHBondContact O-CD 3.33Å; D1597-K1603 WeakPolarHBondContact O-CE 3.46Å; D1597-K1603 PolarHBondContact O-NZ 3.27Å; D1599-K1603 PolarHBondContact O-N 2.84Å; K1603-R1607 WeakPolarHBondContact O-CB 3.32Å; K1603-R1607 PolarHBondContact O-N 3.37Å; K1603-R1607 VanDerWaalsContact O-N 3.07Å
1604	N	73.9	Confident	66.7	Low	88 Å²	88	62.2 Å²	62.2	47%	0.471	32%	0.324	S	S	.	.	H	α-helix	trans	-68	-38.6	178	-74.5	-28.4	0	0	0	112.9	P1600 L1601 V1602 R1607 Q1608	P1600-N1604 WeakPolarHBondContact O-CB 3.42Å; P1600-N1604 PolarHBondContact O-N 2.93Å; P1600-N1604 PolarHBondContact O-ND2 3.2Å; P1600-N1604 VanDerWaalsContact O-ND2 3.13Å; L1601-N1604 PolarHBondContact O-N 3.41Å; V1602-N1604 VanDerWaalsContact C-N 3.29Å; V1602-N1604 PolarHBondContact O-N 2.86Å; N1604-R1607 PolarHBondContact O-N 3.29Å; N1604-Q1608 WeakPolarHBondContact O-CG 3.41Å; N1604-Q1608 PolarHBondContact O-N 2.73Å
1605	L	68.9	Low	66.8	Low	33 Å²	33	63.3 Å²	63.3	17%	0.173	34%	0.335	C	S	.	.	H	α-helix	trans	-70	-43	178.9	-138.6	165.4	0	0	0	110.9	I1540 L1543 K1544 L1601 V1602 R1607 Q1608 I1609	I1540-L1605 HydrophobicContact CG2-CD1 4.03Å; L1543-L1605 HydrophobicContact CB-CD2 4.19Å; L1543-L1605 HydrophobicContact CD1-CB 4.3Å; K1544-L1605 HydrophobicContact CG-CD1 4.15Å; L1601-L1605 WeakPolarHBondContact O-CB 3.33Å; L1601-L1605 PolarHBondContact O-N 2.87Å; V1602-L1605 PolarHBondContact O-N 3.01Å; V1602-L1605 VanDerWaalsContact O-N 3.14Å; L1605-R1607 VanDerWaalsContact C-N 3.32Å; L1605-R1607 PolarHBondContact O-N 3.46Å; L1605-Q1608 PolarHBondContact O-N 3.26Å; L1605-I1609 HydrophobicContact CD2-CD1 3.91Å; L1605-I1609 HydrophobicContact CD2-CG1 4.25Å; L1605-I1609 VanDerWaalsContact O-CG1 3.29Å; L1605-I1609 WeakPolarHBondContact O-CG1 3.43Å; L1605-I1609 PolarHBondContact O-N 3.15Å
1606	A	70.1	Confident	66.8	Low	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-56.6	-45.2	172	0	0	0	0	0	111.7	L1590 I1593 H1594 V1602 Q1608 I1609 I1610	L1590-A1606 HydrophobicContact CD2-CB 4.31Å; I1593-A1606 HydrophobicContact CG2-CB 4.04Å; H1594-A1606 HydrophobicContact CB-CB 4.35Å; V1602-A1606 WeakPolarHBondContact O-CB 3.28Å; V1602-A1606 PolarHBondContact O-N 3.46Å; A1606-Q1608 PolarHBondContact O-N 3.23Å; A1606-I1609 WeakPolarHBondContact O-CB 3.4Å; A1606-I1609 PolarHBondContact O-N 3.23Å; A1606-I1610 WeakPolarHBondContact O-CD1 3.34Å; A1606-I1610 WeakPolarHBondContact O-CG1 3.42Å; A1606-I1610 PolarHBondContact O-N 2.95Å
1607	R	73.2	Confident	66.9	Low	133 Å²	133	64.5 Å²	64.5	50%	0.502	33%	0.326	S	S	.	.	H	α-helix	trans	-59	-46.7	174.6	-173.4	173.6	177.6	158.2	2.6	112.9	K1603 N1604 L1605 I1609 I1610 D1611	K1603-R1607 WeakPolarHBondContact O-CB 3.32Å; K1603-R1607 PolarHBondContact O-N 3.37Å; K1603-R1607 VanDerWaalsContact O-N 3.07Å; N1604-R1607 PolarHBondContact O-N 3.29Å; L1605-R1607 VanDerWaalsContact C-N 3.32Å; L1605-R1607 PolarHBondContact O-N 3.46Å; R1607-I1609 PolarHBondContact O-N 3.47Å; R1607-I1610 PolarHBondContact O-N 2.87Å; R1607-D1611 IonicContact NE-OD2 2.68Å; R1607-D1611 WeakPolarHBondContact O-CB 3.41Å; R1607-D1611 PolarHBondContact O-N 3.2Å
1608	Q	73.7	Confident	66.6	Low	109 Å²	109	67.5 Å²	67.5	51%	0.509	34%	0.342	S	S	.	.	H	α-helix	trans	-60.4	-33.5	177	-72.5	175.3	26	0	0	112.6	N1604 L1605 A1606 R1612	N1604-Q1608 WeakPolarHBondContact O-CG 3.41Å; N1604-Q1608 PolarHBondContact O-N 2.73Å; L1605-Q1608 PolarHBondContact O-N 3.26Å; A1606-Q1608 PolarHBondContact O-N 3.23Å; Q1608-R1612 WeakPolarHBondContact O-CB 3.47Å; Q1608-R1612 VanDerWaalsContact O-CG 3.31Å; Q1608-R1612 WeakPolarHBondContact O-CG 3.36Å; Q1608-R1612 PolarHBondContact O-N 3.26Å
1609	I	69.6	Low	66.1	Low	5 Å²	5	66.7 Å²	66.7	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-70.2	-46.6	175.5	-61.4	163	0	0	0	110.3	L1543 T1547 I1550 L1590 L1605 A1606 R1607 D1611 R1612 I1613	L1543-I1609 HydrophobicContact CB-CD1 4.26Å; L1543-I1609 HydrophobicContact CD2-CD1 4.04Å; T1547-I1609 HydrophobicContact CG2-CG1 4.2Å; T1547-I1609 WeakPolarHBondContact OG1-CD1 3.41Å; T1547-I1609 VanDerWaalsContact OG1-CG1 3.26Å; T1547-I1609 WeakPolarHBondContact OG1-CG1 3.33Å; I1550-I1609 HydrophobicContact CD1-CG2 4.28Å; L1590-I1609 HydrophobicContact CD1-CB 4.16Å; L1590-I1609 HydrophobicContact CD1-CG2 3.52Å; L1590-I1609 HydrophobicContact CD2-CD1 4.37Å; L1605-I1609 HydrophobicContact CD2-CD1 3.91Å; L1605-I1609 HydrophobicContact CD2-CG1 4.25Å; L1605-I1609 VanDerWaalsContact O-CG1 3.29Å; L1605-I1609 WeakPolarHBondContact O-CG1 3.43Å; L1605-I1609 PolarHBondContact O-N 3.15Å; A1606-I1609 WeakPolarHBondContact O-CB 3.4Å; A1606-I1609 PolarHBondContact O-N 3.23Å; R1607-I1609 PolarHBondContact O-N 3.47Å; I1609-D1611 PolarHBondContact O-N 3.4Å; I1609-R1612 PolarHBondContact O-N 3.26Å; I1609-I1613 HydrophobicContact CG2-CD1 3.77Å; I1609-I1613 HydrophobicContact CG2-CG1 4.43Å; I1609-I1613 VanDerWaalsContact O-CG1 3.29Å; I1609-I1613 WeakPolarHBondContact O-CG1 3.41Å; I1609-I1613 PolarHBondContact O-N 2.88Å
1610	I	69.8	Low	64.9	Low	20 Å²	20	69.6 Å²	69.6	10%	0.103	35%	0.345	C	S	.	.	H	α-helix	trans	-55.8	-51.8	174.8	-65.9	156.1	0	0	0	110	L1587 L1590 N1591 H1594 A1606 R1607 R1612 I1613 T1614	L1587-I1610 HydrophobicContact CD2-CB 4.43Å; L1587-I1610 HydrophobicContact CD2-CG1 4.28Å; L1587-I1610 HydrophobicContact CD2-CG2 4.13Å; L1590-I1610 HydrophobicContact CB-CD1 3.94Å; L1590-I1610 HydrophobicContact CB-CG1 3.76Å; L1590-I1610 HydrophobicContact CD1-CG1 4.33Å; N1591-I1610 VanDerWaalsContact OD1-CD1 3.28Å; N1591-I1610 WeakPolarHBondContact OD1-CD1 3.43Å; H1594-I1610 HydrophobicContact CB-CD1 4.21Å; A1606-I1610 WeakPolarHBondContact O-CD1 3.34Å; A1606-I1610 WeakPolarHBondContact O-CG1 3.42Å; A1606-I1610 PolarHBondContact O-N 2.95Å; R1607-I1610 PolarHBondContact O-N 2.87Å; I1610-R1612 VanDerWaalsContact C-N 3.33Å; I1610-R1612 PolarHBondContact O-N 3.21Å; I1610-I1613 PolarHBondContact O-N 3.32Å; I1610-I1613 VanDerWaalsContact O-N 3.17Å; I1610-T1614 WeakPolarHBondContact O-CB 3.25Å; I1610-T1614 PolarHBondContact O-N 3.1Å; I1610-T1614 PolarHBondContact O-OG1 3.35Å; I1610-T1614 VanDerWaalsContact O-OG1 3.06Å
1611	D	72.5	Confident	63.3	Low	82 Å²	82	68.9 Å²	68.9	44%	0.439	34%	0.342	S	S	.	.	H	α-helix	trans	-59.5	-40.9	179.6	-69.3	-27.2	0	0	0	111.8	R1607 I1609 T1615	R1607-D1611 IonicContact NE-OD2 2.68Å; R1607-D1611 WeakPolarHBondContact O-CB 3.41Å; R1607-D1611 PolarHBondContact O-N 3.2Å; I1609-D1611 PolarHBondContact O-N 3.4Å; D1611-T1615 WeakPolarHBondContact O-CB 3.37Å; D1611-T1615 VanDerWaalsContact O-CG2 3.28Å; D1611-T1615 WeakPolarHBondContact O-CG2 3.32Å; D1611-T1615 PolarHBondContact O-N 3.2Å; D1611-T1615 PolarHBondContact O-OG1 3.1Å
1612	R	68.1	Low	61.6	Low	131 Å²	131	71.1 Å²	71.1	49%	0.494	35%	0.349	S	S	.	.	H	α-helix	trans	-65.1	-40.6	175.3	-81.3	-176	-172	-164.6	7.2	113.3	E1551 Q1608 I1609 I1610 T1615 R1616	E1551-R1612 IonicContact OE1-CZ 3.98Å; E1551-R1612 IonicContact OE1-NH1 3.09Å; E1551-R1612 PolarHBondContact OE1-NH1 2.78Å; Q1608-R1612 WeakPolarHBondContact O-CB 3.47Å; Q1608-R1612 VanDerWaalsContact O-CG 3.31Å; Q1608-R1612 WeakPolarHBondContact O-CG 3.36Å; Q1608-R1612 PolarHBondContact O-N 3.26Å; I1609-R1612 PolarHBondContact O-N 3.26Å; I1610-R1612 VanDerWaalsContact C-N 3.33Å; I1610-R1612 PolarHBondContact O-N 3.21Å; R1612-T1615 WeakPolarHBondContact CA-OG1 3.19Å; R1612-T1615 PolarHBondContact O-OG1 2.87Å; R1612-R1616 PolarHBondContact O-N 2.81Å
1613	I	63.8	Low	60.1	Low	5 Å²	5	78.6 Å²	78.6	3%	0.026	39%	0.389	C	S	.	.	H	α-helix	trans	-65.9	-51.1	177.3	-68.2	166.3	0	0	0	109.2	I1550 I1586 L1587 L1590 I1609 I1610 T1615 R1616 F1617	I1550-I1613 HydrophobicContact CD1-CD1 4.29Å; I1550-I1613 HydrophobicContact CG2-CD1 4.15Å; I1550-I1613 HydrophobicContact CG2-CG1 4.05Å; I1586-I1613 HydrophobicContact CG2-CD1 4.46Å; L1587-I1613 HydrophobicContact CD1-CG2 4.14Å; L1587-I1613 HydrophobicContact CD2-CB 4.26Å; L1587-I1613 HydrophobicContact CD2-CD1 4.22Å; L1587-I1613 HydrophobicContact CD2-CG2 4.01Å; L1587-I1613 HydrophobicContact CG-CG2 4.26Å; L1590-I1613 HydrophobicContact CD1-CD1 4.17Å; I1609-I1613 HydrophobicContact CG2-CD1 3.77Å; I1609-I1613 HydrophobicContact CG2-CG1 4.43Å; I1609-I1613 VanDerWaalsContact O-CG1 3.29Å; I1609-I1613 WeakPolarHBondContact O-CG1 3.41Å; I1609-I1613 PolarHBondContact O-N 2.88Å; I1610-I1613 PolarHBondContact O-N 3.32Å; I1610-I1613 VanDerWaalsContact O-N 3.17Å; I1613-T1615 PolarHBondContact O-N 2.85Å; I1613-R1616 PolarHBondContact O-N 2.57Å; I1613-F1617 HydrophobicContact CG2-CD2 3.75Å; I1613-F1617 HydrophobicContact CG2-CE2 3.56Å; I1613-F1617 WeakPolarHBondContact O-CD2 3.37Å; I1613-F1617 PolarHBondContact O-N 2.92Å; I1613-F1617 VanDerWaalsContact O-N 3.12Å
1614	T	67.3	Low	58.2	Low	60 Å²	60	82 Å²	82	37%	0.368	41%	0.406	S	S	.	.	H	α-helix	trans	-63.9	-41.6	-177.6	-57.4	0	0	0	0	112.8	I1610 R1616 F1617 N1618	I1610-T1614 WeakPolarHBondContact O-CB 3.25Å; I1610-T1614 PolarHBondContact O-N 3.1Å; I1610-T1614 PolarHBondContact O-OG1 3.35Å; I1610-T1614 VanDerWaalsContact O-OG1 3.06Å; T1614-R1616 PolarHBondContact O-N 2.83Å; T1614-F1617 PolarHBondContact O-N 3.31Å; T1614-N1618 PolarHBondContact O-N 3.08Å; T1614-N1618 VanDerWaalsContact O-N 3.12Å; T1614-N1618 PolarHBondContact O-ND2 3.09Å
1615	T	65.3	Low	56.1	Low	81 Å²	81	86.5 Å²	86.5	50%	0.497	42%	0.424	S	S	.	.	H	α-helix	trans	-63.7	-37.6	177	46.5	0	0	0	0	112.7	D1611 R1612 I1613 N1618 T1619	D1611-T1615 WeakPolarHBondContact O-CB 3.37Å; D1611-T1615 VanDerWaalsContact O-CG2 3.28Å; D1611-T1615 WeakPolarHBondContact O-CG2 3.32Å; D1611-T1615 PolarHBondContact O-N 3.2Å; D1611-T1615 PolarHBondContact O-OG1 3.1Å; R1612-T1615 WeakPolarHBondContact CA-OG1 3.19Å; R1612-T1615 PolarHBondContact O-OG1 2.87Å; I1613-T1615 PolarHBondContact O-N 2.85Å; T1615-N1618 PolarHBondContact O-N 3.48Å; T1615-T1619 PolarHBondContact O-N 2.78Å
1616	R	57.2	Low	54.2	Low	92 Å²	92	90 Å²	90	35%	0.347	44%	0.442	S	S	.	.	H	α-helix	trans	-68.8	-42.6	175.6	-74.6	-167	179.8	-159.4	4.1	113.1	R1612 I1613 T1614 N1618 T1619 E1620	R1612-R1616 PolarHBondContact O-N 2.81Å; I1613-R1616 PolarHBondContact O-N 2.57Å; T1614-R1616 PolarHBondContact O-N 2.83Å; R1616-N1618 PolarHBondContact O-N 2.78Å; R1616-T1619 WeakPolarHBondContact CA-OG1 3.46Å; R1616-T1619 PolarHBondContact O-N 3.1Å; R1616-T1619 PolarHBondContact O-OG1 3.26Å; R1616-E1620 PolarHBondContact O-N 3.01Å; R1616-E1620 VanDerWaalsContact O-N 3.13Å
1617	F	54.9	Low	52.3	Low	88 Å²	88	94.8 Å²	94.8	39%	0.386	47%	0.471	S	S	.	.	H	α-helix	trans	-55.1	-41.7	172.6	-86.6	-63.7	0	0	0	112.2	N1583 I1613 T1614 T1619 E1620 S1621	N1583-F1617 HydrophobicContact CB-CE2 4.08Å; N1583-F1617 HydrophobicContact CB-CZ 3.88Å; I1613-F1617 HydrophobicContact CG2-CD2 3.75Å; I1613-F1617 HydrophobicContact CG2-CE2 3.56Å; I1613-F1617 WeakPolarHBondContact O-CD2 3.37Å; I1613-F1617 PolarHBondContact O-N 2.92Å; I1613-F1617 VanDerWaalsContact O-N 3.12Å; T1614-F1617 PolarHBondContact O-N 3.31Å; F1617-T1619 PolarHBondContact O-N 3.38Å; F1617-E1620 PolarHBondContact O-N 3.41Å; F1617-S1621 PolarHBondContact O-N 2.88Å
1618	N	52.3	Low	50.5	Low	94 Å²	94	97.1 Å²	97.1	50%	0.503	49%	0.485	S	S	.	.	H	α-helix	trans	-63.1	-40.3	176.8	-69.6	-23.4	0	0	0	112.1	T1614 T1615 R1616 S1621 H1622	T1614-N1618 PolarHBondContact O-N 3.08Å; T1614-N1618 VanDerWaalsContact O-N 3.12Å; T1614-N1618 PolarHBondContact O-ND2 3.09Å; T1615-N1618 PolarHBondContact O-N 3.48Å; R1616-N1618 PolarHBondContact O-N 2.78Å; N1618-S1621 PolarHBondContact O-N 3.24Å; N1618-S1621 PolarHBondContact O-OG 3.06Å; N1618-H1622 PolarHBondContact O-CD2 3.33Å
1619	T	51.6	Low	48.5	Very low	97 Å²	97	95.7 Å²	95.7	60%	0.595	49%	0.485	S	S	*	.	H	α-helix	trans	-67.6	-33	178.1	52.6	0	0	0	0	114.2	T1615 R1616 F1617	T1615-T1619 PolarHBondContact O-N 2.78Å; R1616-T1619 WeakPolarHBondContact CA-OG1 3.46Å; R1616-T1619 PolarHBondContact O-N 3.1Å; R1616-T1619 PolarHBondContact O-OG1 3.26Å; F1617-T1619 PolarHBondContact O-N 3.38Å
1620	E	38.9	Very low	46.7	Very low	88 Å²	88	99.6 Å²	99.6	41%	0.411	51%	0.509	S	S	.	.	H	α-helix	trans	-71.2	-32.9	176.8	-70.5	177.3	163.8	0	0	112	I1558 R1616 F1617 H1622	I1558-E1620 WeakPolarHBondContact CG1-OE1 2.75Å; R1616-E1620 PolarHBondContact O-N 3.01Å; R1616-E1620 VanDerWaalsContact O-N 3.13Å; F1617-E1620 PolarHBondContact O-N 3.41Å; E1620-H1622 PolarHBondContact O-N 3.2Å; E1620-H1622 VanDerWaalsContact O-N 3.09Å
1621	S	35.5	Very low	44.8	Very low	71 Å²	71	108.2 Å²	108.2	50%	0.497	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-12.3	-176.4	76.5	0	0	0	0	115.8	F1617 N1618	F1617-S1621 PolarHBondContact O-N 2.88Å; N1618-S1621 PolarHBondContact O-N 3.24Å; N1618-S1621 PolarHBondContact O-OG 3.06Å
1622	H	32.8	Very low	42.8	Very low	161 Å²	161	110.1 Å²	110.1	75%	0.745	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-13.7	-175.1	-86.1	-67.2	0	0	0	115.2	N1618 E1620	N1618-H1622 PolarHBondContact O-CD2 3.33Å; E1620-H1622 PolarHBondContact O-N 3.2Å; E1620-H1622 VanDerWaalsContact O-N 3.09Å
1623	N	33.8	Very low	41	Very low	156 Å²	156	108.9 Å²	108.9	83%	0.834	55%	0.553	S	S	*	*	S	Bend	trans	-100.3	-0.9	-173.3	-86.2	-12.9	0	0	0	116
1624	E	28.7	Very low	39.3	Very low	127 Å²	127	116 Å²	116	59%	0.593	58%	0.583	S	S	*	*	S	Bend	trans	-129.3	130.3	171.7	-67.6	-162.4	144.3	0	0	112.2	I1626	E1624-I1626 HydrophobicContact CB-CD1 4.47Å; E1624-I1626 HydrophobicContact CB-CG1 4.19Å; E1624-I1626 PolarHBondContact O-N 3.01Å
1625	Q	29.7	Very low	37.5	Very low	184 Å²	184	116.8 Å²	116.8	86%	0.86	59%	0.588	S	S	*	*			trans	-74.4	54.9	177.2	-70.4	-173.8	-10	0	0	113	T1627	Q1625-T1627 PolarHBondContact O-N 2.89Å; Q1625-T1627 VanDerWaalsContact O-N 3.1Å
1626	I	29.6	Very low	36	Very low	105 Å²	105	116.8 Å²	116.8	54%	0.538	58%	0.584	S	S	.	*			trans	-86.6	67.9	169.6	-51.8	-178.4	0	0	0	108.3	E1624 K1628 P1629	E1624-I1626 HydrophobicContact CB-CD1 4.47Å; E1624-I1626 HydrophobicContact CB-CG1 4.19Å; E1624-I1626 PolarHBondContact O-N 3.01Å; I1626-K1628 PolarHBondContact O-N 3.35Å; I1626-P1629 HydrophobicContact CG2-CG 4.36Å; I1626-P1629 VanDerWaalsContact O-CD 3.31Å; I1626-P1629 WeakPolarHBondContact O-CD 3.2Å
1627	T	31.1	Very low	34.6	Very low	102 Å²	102	121.1 Å²	121.1	63%	0.626	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	24.8	-168.1	46.3	0	0	0	0	115.8	Q1625	Q1625-T1627 PolarHBondContact O-N 2.89Å; Q1625-T1627 VanDerWaalsContact O-N 3.1Å
1628	K	33.5	Very low	33.4	Very low	182 Å²	182	120.6 Å²	120.6	79%	0.791	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-45	-178.7	-70.7	-169.5	176.1	-177.2	0	115.9	I1626	I1626-K1628 PolarHBondContact O-N 3.35Å
1629	P	33.4	Very low	32.6	Very low	78 Å²	78	123.4 Å²	123.4	51%	0.506	61%	0.613	S	S	.	*	H	α-helix	trans	-69.8	-40.3	177.3	-18.1	32.4	0	0	0	112.7	I1626 R1631 L1632 L1633	I1626-P1629 HydrophobicContact CG2-CG 4.36Å; I1626-P1629 VanDerWaalsContact O-CD 3.31Å; I1626-P1629 WeakPolarHBondContact O-CD 3.2Å; P1629-R1631 VanDerWaalsContact C-N 3.3Å; P1629-R1631 PolarHBondContact O-N 3.11Å; P1629-L1632 PolarHBondContact O-N 3.03Å; P1629-L1632 VanDerWaalsContact O-N 3.1Å; P1629-L1633 PolarHBondContact O-N 3.47Å; P1629-L1633 VanDerWaalsContact O-N 3.12Å
1630	T	30.4	Very low	31.7	Very low	87 Å²	87	125.9 Å²	125.9	53%	0.534	62%	0.616	S	S	.	*	H	α-helix	trans	-66.7	-28.5	-175.1	-7.5	0	0	0	0	112.9	K1634	T1630-K1634 WeakPolarHBondContact O-CB 3.28Å; T1630-K1634 PolarHBondContact O-N 2.97Å
1631	R	29.7	Very low	31.4	Very low	202 Å²	202	124.2 Å²	124.2	76%	0.762	61%	0.614	S	S	*	*	H	α-helix	trans	-68.8	-38.2	172.9	-107.2	-176.3	176	-179.6	-0.4	111.8	P1629 T1635	P1629-R1631 VanDerWaalsContact C-N 3.3Å; P1629-R1631 PolarHBondContact O-N 3.11Å; R1631-T1635 WeakPolarHBondContact O-CB 3.42Å; R1631-T1635 PolarHBondContact O-N 2.74Å; R1631-T1635 PolarHBondContact O-OG1 3.24Å
1632	L	31.5	Very low	31.5	Very low	122 Å²	122	125.5 Å²	125.5	64%	0.639	62%	0.618	S	S	*	*	H	α-helix	trans	-66.1	-50.2	176.5	-138.4	92.5	0	0	0	110.6	P1629 K1634 T1635 I1636	P1629-L1632 PolarHBondContact O-N 3.03Å; P1629-L1632 VanDerWaalsContact O-N 3.1Å; L1632-K1634 PolarHBondContact O-N 2.81Å; L1632-T1635 WeakPolarHBondContact O-CB 3.4Å; L1632-T1635 PolarHBondContact O-N 3.32Å; L1632-T1635 VanDerWaalsContact O-N 3.15Å; L1632-I1636 HydrophobicContact CD2-CD1 4.48Å; L1632-I1636 WeakPolarHBondContact O-CG1 3.49Å; L1632-I1636 PolarHBondContact O-N 3.5Å
1633	L	30	Very low	31.7	Very low	105 Å²	105	120.9 Å²	120.9	55%	0.55	61%	0.608	S	S	.	*	H	α-helix	trans	-61.5	-42.6	177.6	-90.7	159.8	0	0	0	112.6	P1629 T1635 I1636 W1637	P1629-L1633 PolarHBondContact O-N 3.47Å; P1629-L1633 VanDerWaalsContact O-N 3.12Å; L1633-T1635 VanDerWaalsContact C-N 3.31Å; L1633-T1635 PolarHBondContact O-N 3.23Å; L1633-I1636 PolarHBondContact O-N 3.12Å; L1633-W1637 WeakPolarHBondContact O-CB 3.3Å; L1633-W1637 PolarHBondContact O-N 2.58Å
1634	K	28.9	Very low	31.7	Very low	154 Å²	154	121.3 Å²	121.3	67%	0.67	61%	0.605	S	S	*	*	H	α-helix	trans	-67.8	-30.7	176	-160.9	169.4	-171.3	174.7	0	112.2	T1630 L1632 T1638	T1630-K1634 WeakPolarHBondContact O-CB 3.28Å; T1630-K1634 PolarHBondContact O-N 2.97Å; L1632-K1634 PolarHBondContact O-N 2.81Å; K1634-T1638 WeakPolarHBondContact O-CB 3.46Å; K1634-T1638 WeakPolarHBondContact O-CG2 3.29Å; K1634-T1638 PolarHBondContact O-N 2.61Å; K1634-T1638 PolarHBondContact O-OG1 3.38Å
1635	T	29.7	Very low	31.8	Very low	76 Å²	76	122 Å²	122	47%	0.466	61%	0.613	S	S	.	*	H	α-helix	trans	-70.2	-41.4	173.5	-55	0	0	0	0	111.7	R1631 L1632 L1633 T1638 K1639	R1631-T1635 WeakPolarHBondContact O-CB 3.42Å; R1631-T1635 PolarHBondContact O-N 2.74Å; R1631-T1635 PolarHBondContact O-OG1 3.24Å; L1632-T1635 WeakPolarHBondContact O-CB 3.4Å; L1632-T1635 PolarHBondContact O-N 3.32Å; L1632-T1635 VanDerWaalsContact O-N 3.15Å; L1633-T1635 VanDerWaalsContact C-N 3.31Å; L1633-T1635 PolarHBondContact O-N 3.23Å; T1635-T1638 WeakPolarHBondContact CA-OG1 3.31Å; T1635-T1638 PolarHBondContact O-OG1 3Å; T1635-T1638 VanDerWaalsContact O-OG1 3.05Å; T1635-K1639 WeakPolarHBondContact O-CG 3.28Å; T1635-K1639 PolarHBondContact O-N 3.38Å
1636	I	33	Very low	31.7	Very low	82 Å²	82	120.1 Å²	120.1	42%	0.421	61%	0.608	S	S	.	*	H	α-helix	trans	-62.2	-48.3	173.2	-67.6	162.6	0	0	0	109.6	L1632 L1633 K1639 F1640	L1632-I1636 HydrophobicContact CD2-CD1 4.48Å; L1632-I1636 WeakPolarHBondContact O-CG1 3.49Å; L1632-I1636 PolarHBondContact O-N 3.5Å; L1633-I1636 PolarHBondContact O-N 3.12Å; I1636-K1639 WeakPolarHBondContact O-CB 3.43Å; I1636-K1639 PolarHBondContact O-N 2.68Å; I1636-F1640 HydrophobicContact CG2-CD2 3.92Å; I1636-F1640 HydrophobicContact CG2-CE2 4.02Å; I1636-F1640 WeakPolarHBondContact O-CD2 3.07Å; I1636-F1640 PolarHBondContact O-N 2.96Å
1637	W	28.4	Very low	31.7	Very low	183 Å²	183	120.4 Å²	120.4	69%	0.693	62%	0.617	S	S	*	*	H	α-helix	trans	-66.6	-39.8	-180	-146.7	-56.6	0	0	0	112.6	L1633 K1639 F1640 S1641	L1633-W1637 WeakPolarHBondContact O-CB 3.3Å; L1633-W1637 PolarHBondContact O-N 2.58Å; W1637-K1639 VanDerWaalsContact C-N 3.3Å; W1637-K1639 PolarHBondContact O-N 2.97Å; W1637-F1640 PolarHBondContact O-N 2.81Å; W1637-S1641 PolarHBondContact O-N 3.21Å; W1637-S1641 PolarHBondContact O-OG 3.39Å
1638	T	29.4	Very low	31.6	Very low	77 Å²	77	120.9 Å²	120.9	47%	0.472	62%	0.624	S	S	.	*	H	α-helix	trans	-63.6	-36.2	172.9	47.9	0	0	0	0	111.9	K1634 T1635 T1642	K1634-T1638 WeakPolarHBondContact O-CB 3.46Å; K1634-T1638 WeakPolarHBondContact O-CG2 3.29Å; K1634-T1638 PolarHBondContact O-N 2.61Å; K1634-T1638 PolarHBondContact O-OG1 3.38Å; T1635-T1638 WeakPolarHBondContact CA-OG1 3.31Å; T1635-T1638 PolarHBondContact O-OG1 3Å; T1635-T1638 VanDerWaalsContact O-OG1 3.05Å; T1638-T1642 WeakPolarHBondContact O-CB 3.43Å; T1638-T1642 WeakPolarHBondContact O-CG2 3.48Å; T1638-T1642 PolarHBondContact O-N 3.43Å; T1638-T1642 PolarHBondContact O-OG1 3.47Å
1639	K	35.3	Very low	31.4	Very low	152 Å²	152	121.4 Å²	121.4	66%	0.661	63%	0.626	S	S	*	*	H	α-helix	trans	-63.1	-41.2	172.6	-80.6	-173.4	173.1	-171.8	0	112.1	T1635 I1636 W1637 T1642 A1643	T1635-K1639 WeakPolarHBondContact O-CG 3.28Å; T1635-K1639 PolarHBondContact O-N 3.38Å; I1636-K1639 WeakPolarHBondContact O-CB 3.43Å; I1636-K1639 PolarHBondContact O-N 2.68Å; W1637-K1639 VanDerWaalsContact C-N 3.3Å; W1637-K1639 PolarHBondContact O-N 2.97Å; K1639-T1642 PolarHBondContact O-OG1 3.3Å; K1639-T1642 VanDerWaalsContact O-OG1 3.07Å; K1639-A1643 PolarHBondContact O-N 2.87Å
1640	F	31.6	Very low	31.4	Very low	150 Å²	150	123.8 Å²	123.8	66%	0.658	64%	0.642	S	S	*	*	H	α-helix	trans	-67.7	-48.4	175.6	-88.2	-76.5	0	0	0	112.7	I1636 W1637 T1642 A1643	I1636-F1640 HydrophobicContact CG2-CD2 3.92Å; I1636-F1640 HydrophobicContact CG2-CE2 4.02Å; I1636-F1640 WeakPolarHBondContact O-CD2 3.07Å; I1636-F1640 PolarHBondContact O-N 2.96Å; W1637-F1640 PolarHBondContact O-N 2.81Å; F1640-T1642 VanDerWaalsContact C-N 3.33Å; F1640-T1642 PolarHBondContact O-N 3.12Å; F1640-A1643 VanDerWaalsContact O-CB 3.3Å; F1640-A1643 WeakPolarHBondContact O-CB 3.15Å; F1640-A1643 PolarHBondContact O-N 3.23Å
1641	S	33.3	Very low	31.5	Very low	53 Å²	53	124.1 Å²	124.1	37%	0.371	65%	0.648	S	S	.	*	H	α-helix	trans	-71.1	-22.4	179.8	-64.1	0	0	0	0	114.1	W1637 A1643	W1637-S1641 PolarHBondContact O-N 3.21Å; W1637-S1641 PolarHBondContact O-OG 3.39Å; S1641-A1643 VanDerWaalsContact C-N 3.28Å
1642	T	38.4	Very low	31.3	Very low	97 Å²	97	124.2 Å²	124.2	60%	0.595	65%	0.65	S	S	*	*	H	α-helix	trans	-74.1	-18.8	167.3	50.7	0	0	0	0	113.3	T1638 K1639 F1640	T1638-T1642 WeakPolarHBondContact O-CB 3.43Å; T1638-T1642 WeakPolarHBondContact O-CG2 3.48Å; T1638-T1642 PolarHBondContact O-N 3.43Å; T1638-T1642 PolarHBondContact O-OG1 3.47Å; K1639-T1642 PolarHBondContact O-OG1 3.3Å; K1639-T1642 VanDerWaalsContact O-OG1 3.07Å; F1640-T1642 VanDerWaalsContact C-N 3.33Å; F1640-T1642 PolarHBondContact O-N 3.12Å
1643	A	37.1	Very low	31.2	Very low	64 Å²	64	125.7 Å²	125.7	53%	0.529	66%	0.657	S	S	.	*	H	α-helix	trans	-78.5	-24.7	178.2	0	0	0	0	0	113.2	K1639 F1640 S1641 N1645	K1639-A1643 PolarHBondContact O-N 2.87Å; F1640-A1643 VanDerWaalsContact O-CB 3.3Å; F1640-A1643 WeakPolarHBondContact O-CB 3.15Å; F1640-A1643 PolarHBondContact O-N 3.23Å; S1641-A1643 VanDerWaalsContact C-N 3.28Å; A1643-N1645 VanDerWaalsContact C-N 3.32Å; A1643-N1645 PolarHBondContact O-N 3.42Å
1644	E	32.5	Very low	31.3	Very low	165 Å²	165	130.5 Å²	130.5	77%	0.771	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-15.4	-179.5	-70.9	-174.6	134.4	0	0	114.4
1645	N	32	Very low	31.4	Very low	143 Å²	143	131.5 Å²	131.5	77%	0.765	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	19.8	-176.4	-81.7	-36.4	0	0	0	114.7	A1643 P1647	A1643-N1645 VanDerWaalsContact C-N 3.32Å; A1643-N1645 PolarHBondContact O-N 3.42Å; N1645-P1647 WeakPolarHBondContact O-CD 3.07Å
1646	L	26.9	Very low	31.2	Very low	144 Å²	144	142.2 Å²	142.2	75%	0.754	71%	0.712	S	S	*	*			trans	-101.6	104.3	174	-90.4	154.3	0	0	0	110.6
1647	P	30.6	Very low	31.1	Very low	111 Å²	111	145.2 Å²	145.2	72%	0.721	73%	0.727	S	S	*	*			trans	-72.5	145.4	-170.9	28.7	-35.1	0	0	0	113.1	N1645 K1649	N1645-P1647 WeakPolarHBondContact O-CD 3.07Å; P1647-K1649 PolarHBondContact O-N 3.4Å
1648	S	28.8	Very low	31.2	Very low	112 Å²	112	143.2 Å²	143.2	78%	0.783	73%	0.729	S	S	*	*			trans	-24.5	106.2	172	46	0	0	0	0	117
1649	K	27.8	Very low	31.3	Very low	192 Å²	192	146.9 Å²	146.9	84%	0.835	74%	0.743	S	S	*	*			trans	-155.2	84.3	151.2	-112.3	167.9	-171.5	-179.4	0	111.6	P1647 S1651	P1647-K1649 PolarHBondContact O-N 3.4Å; K1649-S1651 PolarHBondContact O-N 3.46Å
1650	P	34.6	Very low	31.1	Very low	129 Å²	129	146.6 Å²	146.6	84%	0.838	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	102.1	177.3	31.5	-31.9	0	0	0	110.6
1651	S	31.9	Very low	31	Very low	94 Å²	94	146.4 Å²	146.4	66%	0.657	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169.3	-27	163.7	43.7	0	0	0	0	113.9	K1649 I1653	K1649-S1651 PolarHBondContact O-N 3.46Å; S1651-I1653 PolarHBondContact O-N 2.61Å
1652	Y	26.3	Very low	30.9	Very low	204 Å²	204	152.6 Å²	152.6	80%	0.8	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	4	-166.4	-124.9	-87.5	0	0	0	117.5
1653	I	28	Very low	30.4	Very low	152 Å²	152	156.6 Å²	156.6	78%	0.779	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-17.2	176.1	-65.3	178.9	0	0	0	112	S1651 Q1655	S1651-I1653 PolarHBondContact O-N 2.61Å; I1653-Q1655 PolarHBondContact O-N 3.18Å
1654	F	32.7	Very low	29.8	Very low	206 Å²	206	163.7 Å²	163.7	90%	0.904	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	23.2	-178.4	-117.4	-76.2	0	0	0	114.9
1655	Q	31.3	Very low	29.6	Very low	175 Å²	175	163.6 Å²	163.6	82%	0.818	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.5	21.3	179.2	-140.6	174.8	18.3	0	0	114	I1653	I1653-Q1655 PolarHBondContact O-N 3.18Å
1656	R	24.4	Very low	29.4	Very low	301 Å²	301	165.5 Å²	165.5	100%	1.136	82%	0.82	S	S	*	*			trans	-136.3	0	163.3	-99.6	-170.7	174.7	-177.8	-1	109.5

Retrieved 1,656 of 1,656 residues in 2535.9 ms (Link to these results)

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