A0A5K4FC43_SCHMA Loading...

BEACH domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FC43, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,064 aa.

						>A0A5K4FC43_SCHMA|A0A5K4FC43
MKKRRVWKFQMSSLNSQLNHHNHTPQSNNFLSDLKKAELAHLWRSCFDNHRSILQNNIHCRVSKTTNCKAILDKFMDVLSNPQNLNFVKCNCTYDQNELMMDYDVVGVSLYDVIKYSPGRLQNHNTLLFLTFQAIHAITQLHKINLPHSGMTLDNIFVDEKFNIFLGPPKAIDFLSNIMTNELKEEENTAEIDIAMCNSSKLSTMTTNWVLHKVTNYDYLMFLNELAGRHKGDPSNSAILPWITNFDTPFGQLRDLTKSKYHLCKGEDQLNANFATSLCNHTISKRPGWTLGTHNVEGHYDVRSHHQDFMKLCNELGTCSISNVDSNLVCSIVDEYISNDNGKENTNYTFSPHHLLDIMPDLAYYTYMARKTPLSLLTQFVRPVYQPQEFPTTIARLYESTPDECIPEFFTDPSVFSSIHPDMADLGLPSWCSSPEEFIKYHSKLLESDEVSSNLHHWIDLNFGYKLLGSAAVSAKNVHLELAGDQTALRRTGVVCLFSTPHPQRICSKKLSKYFGATLPDIFQMDVNPPTSKHNSVSMEMHANNSPNEVSLRKNHPTLTKSISSSKVNHTPKLPTGDRDSCLKNKIWLPDDYDPLELINMHQNLCKFLHIETHIQDLNDPESIQLSKLNTYDNDFDNLFKIDLESLACLIVELSLFSIVNYVEVNNWSHGERVNFARLQARLHWDKIPNCLHDAINSVLYPFDQNLIGEQFHERFLPTVDIFLHLICEFPPYIFDLLYIRDRLININSNQSFQQLQSFSPYIPKTCLFSAFFPSNHQSELYNLVNLSTVHIPIDIIRLLYPHIQSAVYANPNWFVNILNSTKMLELFSTIGGLEFIRSHLLPLIIYLYEPEQLKRMSSDISPRIPLALLYSRLFLRRLLAYLNVNTFLVHILPYITFSLIGGSINALSDENIVWHQRSYAGLTNEQIDSKNSNTNQNTPESLSRNLELNDESLLYDQSENISAHCDLLFYKQDIMNVDEIGIDLRSLINDEEFQFLEDSKSLSTFTCVKSSEEECDDVSRKSLHSCPSDATPAPPLHSSSSISHNCNVSQSSHDSLTEDKCVCGEPKKVSFSNNTSSNDTNISNCSNMNSIPPITAAMDSLDWLARRIGPVMTIKYIVKYLLTTLTLCYEGKTQLSVNMVNNISSEKCLQFSLQINNRSLIGDRSAFSVVRCLVQLVQIYGVSIVIDVYLPYVIKTITSIINNLNPVLSESINNNNNLNQTNNYCMNPLESVTNNEVNASTISFNFNYHYLARLVGVLTLLYQIVIYIPDNELVELLQESIIQDILIKAVQMSGRLDISFPGGVIGRRAILYKFINVVYIIGLRVGFELTRTQLTSIFQIFFALFDRVINTAATKSILTDNFLFGGNNNDRCQQRCAGDPELQVTSTSQVTNVEENAQKSNLTNIFTELIETFDCDLARMAYISFCHLAGGTYIDDCLYNTQSIQKLINQLISSESNDTMKQSCSDESNKTTITSTDAAVNIQDVQLSNRSKIDFEASLFASSALCNDCNFHLRGAWRQVICEIFETSFHQSASIPKYHGIQVAAFTGHINKINCITHLNTENCFITTSRDKTVQLWSLTDTYNSGQHSISISHKITNNSNNVNNSNKSLPIDSSNHVVARLVYRAHRKSVIAAHYLEPYRLVASVDGCLIFWDPWMGKTVKSNNQSENSSWQNLTAMNCSAVPYGAVICSDQSGFVHLIDPRAVCSGRTGSLRFHSGANLASFLLNKERSKFETPISESIKHTSYNTKSCSPLFYNQSTMDISITNIMMNITNQFQPYHLSMNSFTNVNSNSSISSLLNANTNMAGLLNCLTTSRNGYYLLCGFTTGIITALDLRMGQVIHIWREYQDSVVDIIPHLLDGFISCNDRNLSFINPTISQSNQNSLSTSYSELEHFNYLPNKPTISLKPKSIRIPSTLQNITCLTKYQENPIFCANSLPLSYPLPSTSRFPIFGSGSGGGGTNNVTTNPDKSTSSSIINETTTTPLSSATTVSQPYYNNNSGTILATYSYPFNNKDINNINENFYTLGRISSYFLRGSVSVINSLSENNLLLIGSDTGALSLLY
					

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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	50.9	Low	53.3	Low	186 Å²	186	108.5 Å²	108.5	92%	0.916	49%	0.49	S	S	*	.				0	152.5	0	-83.9	-173.1	173.3	0	0	108.9	V105	M1-V105 PolarHBondContact N-O 2.9Å; M1-V105 WeakPolarHBondContact O-CB 3.38Å; M1-V105 WeakPolarHBondContact O-CG2 3.24Å; M1-V105 PolarHBondContact O-N 2.92Å
2	K	57.9	Low	52	Low	139 Å²	139	107.6 Å²	107.6	60%	0.604	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	125.3	169.2	-70.9	-168.7	174	-163.5	0	111.3	Y103 D104	K2-Y103 WeakPolarHBondContact CA-O 3.39Å; K2-D104 WeakPolarHBondContact CE-OD1 3.35Å; K2-D104 WeakPolarHBondContact CE-OD2 3.46Å; K2-D104 WeakPolarHBondContact CG-OD1 3.32Å; K2-D104 IonicContact NZ-OD2 3.39Å; K2-D104 PolarHBondContact NZ-OD2 2.97Å
3	K	61.8	Low	50.8	Low	75 Å²	75	105.8 Å²	105.8	33%	0.326	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	146.6	166.7	-76.7	-172.3	178.4	-176	0	108.7	Y103 V105	K3-Y103 HydrophobicContact CB-CD2 4.4Å; K3-Y103 HydrophobicContact CB-CE1 3.97Å; K3-Y103 HydrophobicContact CB-CE2 3.77Å; K3-Y103 HydrophobicContact CD-CE2 4.29Å; K3-Y103 PolarHBondContact N-O 3.13Å; K3-Y103 WeakPolarHBondContact O-CD1 3.26Å; K3-Y103 PolarHBondContact O-N 3.16Å; K3-V105 HydrophobicContact CB-CG2 4.36Å; K3-V105 HydrophobicContact CD-CG2 4Å; K3-V105 HydrophobicContact CG-CG2 3.99Å
4	R	64	Low	49.6	Very low	138 Å²	138	101.9 Å²	101.9	52%	0.521	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	130.7	177	-179.2	172.4	-73.9	-167.9	-3.9	109.8	V6 M101 D102	R4-V6 HydrophobicContact CG-CG2 3.97Å; R4-M101 CarbonylContact C-O 3.59Å; R4-M101 VanDerWaalsContact CA-O 3.29Å; R4-M101 WeakPolarHBondContact CA-O 3.07Å; R4-D102 VanDerWaalsContact CB-OD1 3.27Å; R4-D102 WeakPolarHBondContact CB-OD1 3.26Å; R4-D102 VanDerWaalsContact CG-OD1 3.32Å; R4-D102 WeakPolarHBondContact CG-OD1 3.37Å; R4-D102 IonicContact CZ-OD1 3.6Å; R4-D102 IonicContact CZ-OD2 2.83Å; R4-D102 IonicContact NE-OD1 3.62Å; R4-D102 PolarHBondContact NE-OD1 3.31Å; R4-D102 IonicContact NE-OD2 3.34Å; R4-D102 IonicContact NH2-OD1 2.71Å; R4-D102 PolarHBondContact NH2-OD1 3.43Å; R4-D102 IonicContact NH2-OD2 2.74Å; R4-D102 PolarHBondContact NH2-OD2 2.89Å
5	R	63.2	Low	48.5	Very low	55 Å²	55	104.1 Å²	104.1	21%	0.208	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	151.4	161.3	-75.2	-167.1	-171.4	146.8	15	109.7	M100 M101 N155 P168 P169	R5-M100 VanDerWaalsContact O-CA 3.31Å; R5-M100 WeakPolarHBondContact O-CA 3.19Å; R5-M101 PolarHBondContact N-O 2.79Å; R5-M101 PolarHBondContact O-N 3.06Å; R5-N155 PolarHBondContact NH2-OD1 3.48Å; R5-P168 PolarHBondContact NH1-O 3.31Å; R5-P169 PolarHBondContact NH1-O 2.86Å
6	V	59.2	Low	47.9	Very low	65 Å²	65	103.4 Å²	103.4	39%	0.394	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	123.3	-177.5	-175.8	0	0	0	0	109.3	R4 E98 L99 M100	R4-V6 HydrophobicContact CG-CG2 3.97Å; V6-E98 HydrophobicContact CG1-CB 4.12Å; V6-E98 WeakPolarHBondContact CG1-OE2 3.45Å; V6-L99 WeakPolarHBondContact CA-O 3.43Å; V6-M100 HydrophobicContact CB-CG 4.4Å; V6-M100 HydrophobicContact CG1-CG 4.05Å; V6-M100 HydrophobicContact CG2-CG 3.87Å; V6-M100 HydrophobicContact CG2-SD 4.06Å
7	W	55.1	Low	47.1	Very low	25 Å²	25	107 Å²	107	10%	0.095	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	141.4	175.7	-67.7	-54.9	0	0	0	111.3	E98 L99 M101 I172 D173	W7-E98 VanDerWaalsContact O-CA 3.22Å; W7-E98 WeakPolarHBondContact O-CA 3.35Å; W7-L99 HydrophobicContact CE3-CB 4.34Å; W7-L99 HydrophobicContact CE3-CD2 3.72Å; W7-L99 HydrophobicContact CE3-CG 3.83Å; W7-L99 HydrophobicContact CZ3-CD2 3.9Å; W7-L99 HydrophobicContact CZ3-CG 4.26Å; W7-L99 PolarHBondContact N-O 2.99Å; W7-L99 PolarHBondContact O-N 2.87Å; W7-L99 VanDerWaalsContact O-N 3.09Å; W7-M101 HydrophobicContact CE3-CE 4.49Å; W7-M101 HydrophobicContact CH2-CE 3.24Å; W7-M101 HydrophobicContact CH2-SD 3.97Å; W7-M101 HydrophobicContact CZ2-CE 3.99Å; W7-M101 HydrophobicContact CZ3-CE 3.54Å; W7-M101 HydrophobicContact CZ3-CG 4.36Å; W7-M101 HydrophobicContact CZ3-SD 3.75Å; W7-I172 HydrophobicContact CD2-CG2 3.81Å; W7-I172 HydrophobicContact CE3-CG2 4.14Å; W7-I172 HydrophobicContact CG-CG2 4.24Å; W7-I172 HydrophobicContact CH2-CB 4.16Å; W7-I172 HydrophobicContact CH2-CD1 3.36Å; W7-I172 HydrophobicContact CH2-CG1 4.34Å; W7-I172 HydrophobicContact CH2-CG2 4.23Å; W7-I172 HydrophobicContact CZ2-CB 3.82Å; W7-I172 HydrophobicContact CZ2-CD1 3.94Å; W7-I172 HydrophobicContact CZ2-CG1 4.47Å; W7-I172 HydrophobicContact CZ2-CG2 3.92Å; W7-I172 HydrophobicContact CZ3-CD1 3.74Å; W7-I172 HydrophobicContact CZ3-CG2 4.34Å; W7-D173 PolarHBondContact NE1-OD1 2.86Å
8	K	46.4	Very low	46.4	Very low	150 Å²	150	108.2 Å²	108.2	65%	0.652	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.7	-175.1	-85.1	171.7	170.1	176.7	0	111.6	E98	K8-E98 WeakPolarHBondContact CE-OE1 3.48Å; K8-E98 HydrophobicContact CG-CG 3.9Å; K8-E98 IonicContact NZ-OE1 3.48Å; K8-E98 PolarHBondContact NZ-OE1 2.93Å
9	F	48.3	Very low	45.6	Very low	93 Å²	93	109.7 Å²	109.7	41%	0.408	55%	0.551	S	S	.	*			trans	-110.7	142.6	176.3	-55.6	-79.8	0	0	0	111.3	N97	F9-N97 PolarHBondContact N-O 3.02Å
10	Q	39.9	Very low	45.1	Very low	185 Å²	185	112.6 Å²	112.6	86%	0.864	56%	0.563	S	S	*	*			trans	-100.2	124.9	-175.1	-153.9	176.2	34.1	0	0	111.3
11	M	39.2	Very low	44.5	Very low	82 Å²	82	116.3 Å²	116.3	40%	0.404	58%	0.578	S	S	.	*			trans	-113.6	54.5	-163.4	-138.3	-64.3	-165.3	0	0	112	L14 L42	M11-L14 HydrophobicContact CE-CB 4.03Å; M11-L14 HydrophobicContact CE-CD2 3.74Å; M11-L14 HydrophobicContact SD-CB 3.87Å; M11-L42 HydrophobicContact CE-CD1 4.13Å
12	S	37.9	Very low	43.5	Very low	98 Å²	98	114.8 Å²	114.8	69%	0.685	57%	0.574	S	S	*	*			trans	-97.4	-18.8	-170.1	49.5	0	0	0	0	115.4
13	S	37	Very low	42.5	Very low	84 Å²	84	117.4 Å²	117.4	59%	0.587	59%	0.588	S	S	*	*	S	Bend	trans	-94.4	-20.3	-170.3	51.8	0	0	0	0	115.6
14	L	34.1	Very low	41.1	Very low	51 Å²	51	120 Å²	120	27%	0.267	61%	0.61	S	S	.	*	G	3₁₀ helix	trans	-89.4	-14.6	-163.7	-138.8	72.8	0	0	0	116.3	M11 S16 L18 L42	M11-L14 HydrophobicContact CE-CB 4.03Å; M11-L14 HydrophobicContact CE-CD2 3.74Å; M11-L14 HydrophobicContact SD-CB 3.87Å; L14-S16 PolarHBondContact O-N 2.78Å; L14-L18 HydrophobicContact CD2-CD1 3.95Å; L14-L18 HydrophobicContact CG-CD1 4.32Å; L14-L42 HydrophobicContact CD1-CD2 3.75Å; L14-L42 HydrophobicContact CD2-CD2 4.02Å; L14-L42 HydrophobicContact CD2-CG 4.42Å; L14-L42 HydrophobicContact CG-CD2 4.41Å
15	N	33.2	Very low	40.1	Very low	135 Å²	135	118.6 Å²	118.6	72%	0.722	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-69.2	-2.7	-174.5	-80.4	-27.7	0	0	0	115
16	S	38.8	Very low	38.6	Very low	93 Å²	93	124.7 Å²	124.7	65%	0.65	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-93.4	-22.7	-177.8	57.7	0	0	0	0	114.6	L14	L14-S16 PolarHBondContact O-N 2.78Å
17	Q	33.2	Very low	37.3	Very low	165 Å²	165	125.3 Å²	125.3	77%	0.771	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	-15.6	-169.7	-70	-172.1	-16.9	0	0	115.3	N19	Q17-N19 PolarHBondContact O-N 3.44Å
18	L	34.4	Very low	36.3	Very low	128 Å²	128	131.5 Å²	131.5	67%	0.67	69%	0.692	S	S	*	*			trans	-88	2.3	-173.5	-79.8	162.3	0	0	0	115.7	L14 H20	L14-L18 HydrophobicContact CD2-CD1 3.95Å; L14-L18 HydrophobicContact CG-CD1 4.32Å; L18-H20 PolarHBondContact O-N 3.16Å
19	N	32.6	Very low	36.1	Very low	137 Å²	137	130.6 Å²	130.6	73%	0.733	69%	0.694	S	S	*	*			trans	-78.2	8.7	-176.8	-84.4	-39.7	0	0	0	115.4	Q17	Q17-N19 PolarHBondContact O-N 3.44Å
20	H	35.1	Very low	35.5	Very low	167 Å²	167	132.8 Å²	132.8	77%	0.773	70%	0.704	S	S	*	*	S	Bend	trans	-131.4	73.9	179.5	-77.5	-5.2	0	0	0	112.4	L18	L18-H20 PolarHBondContact O-N 3.16Å
21	H	33.1	Very low	35.2	Very low	191 Å²	191	129.5 Å²	129.5	88%	0.884	69%	0.691	S	S	*	*				-174.6	106.3	129.8	-95.4	-59.7	0	0	0	111.2
22	N	29.5	Very low	35.4	Very low	155 Å²	155	129.1 Å²	129.1	83%	0.829	70%	0.697	S	S	*	*			trans	-89.7	119.8	168.6	-78.6	-42.2	0	0	0	110.1
23	H	36.1	Very low	35.5	Very low	194 Å²	194	129.3 Å²	129.3	90%	0.898	69%	0.69	S	S	*	*			trans	-177.9	148.4	134.9	-94.4	-63.2	0	0	0	110.3
24	T	33.8	Very low	35.5	Very low	130 Å²	130	128.7 Å²	128.7	80%	0.798	68%	0.68	S	S	*	*			trans	-134.2	176.9	-174.6	63.3	0	0	0	0	108.9
25	P	42	Very low	36	Very low	108 Å²	108	131.8 Å²	131.8	70%	0.701	69%	0.691	S	S	*	*			cis	-140.2	-167	8	30.9	-5.1	0	0	0	116.2
26	Q	30.7	Very low	36.6	Very low	183 Å²	183	132.2 Å²	132.2	86%	0.855	69%	0.687	S	S	*	*			trans	91.6	85.7	158.3	-54.5	-169.5	0.4	0	0	120.6
27	S	33.4	Very low	37.1	Very low	77 Å²	77	130.4 Å²	130.4	54%	0.538	68%	0.677	S	S	.	*				-174.2	135.4	116.9	49.9	0	0	0	0	111.2	N29 F30	S27-N29 PolarHBondContact O-N 3.47Å; S27-F30 PolarHBondContact O-N 3.26Å
28	N	34.2	Very low	37.7	Very low	156 Å²	156	127.2 Å²	127.2	83%	0.834	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-18.3	-166.1	-77.1	1.4	0	0	0	115.5	F30 L31	N28-F30 VanDerWaalsContact C-N 3.26Å; N28-F30 PolarHBondContact O-N 3.21Å; N28-L31 PolarHBondContact O-N 3.03Å
29	N	42.1	Very low	38.2	Very low	131 Å²	131	125.1 Å²	125.1	70%	0.701	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-23.9	175.5	-69.8	13.8	0	0	0	112.2	S27 L31 S32	S27-N29 PolarHBondContact O-N 3.47Å; N29-L31 PolarHBondContact O-N 3.32Å; N29-L31 VanDerWaalsContact O-N 3.17Å; N29-S32 PolarHBondContact O-N 3.26Å; N29-S32 PolarHBondContact O-OG 3.25Å; N29-S32 VanDerWaalsContact O-OG 3.07Å
30	F	36.1	Very low	39	Very low	139 Å²	139	121.1 Å²	121.1	61%	0.61	64%	0.637	S	S	*	*	H	α-helix	trans	-62.7	-23.1	178.8	-113.5	-84.4	0	0	0	112.8	S27 N28 L34	S27-F30 PolarHBondContact O-N 3.26Å; N28-F30 VanDerWaalsContact C-N 3.26Å; N28-F30 PolarHBondContact O-N 3.21Å; F30-L34 HydrophobicContact CD1-CD1 4.22Å; F30-L34 HydrophobicContact CD1-CG 4.28Å; F30-L34 WeakPolarHBondContact O-CA 3.21Å; F30-L34 WeakPolarHBondContact O-CB 3.46Å; F30-L34 WeakPolarHBondContact O-CD1 3.45Å; F30-L34 VanDerWaalsContact O-CG 3.3Å; F30-L34 WeakPolarHBondContact O-CG 3.39Å; F30-L34 PolarHBondContact O-N 3.16Å
31	L	32.6	Very low	39.6	Very low	115 Å²	115	119.6 Å²	119.6	60%	0.602	63%	0.63	S	S	*	*	H	α-helix	trans	-77.3	-29.9	-174.4	-146.7	80.7	0	0	0	113.8	N28 N29 K35	N28-L31 PolarHBondContact O-N 3.03Å; N29-L31 PolarHBondContact O-N 3.32Å; N29-L31 VanDerWaalsContact O-N 3.17Å; L31-K35 WeakPolarHBondContact O-CG 3.37Å; L31-K35 PolarHBondContact O-N 2.86Å; L31-K35 VanDerWaalsContact O-N 3.12Å
32	S	42.8	Very low	40	Very low	75 Å²	75	112.4 Å²	112.4	52%	0.524	60%	0.598	S	S	.	*	H	α-helix	trans	-76	-39.7	174.1	45	0	0	0	0	111.8	N29 K35 K36	N29-S32 PolarHBondContact O-N 3.26Å; N29-S32 PolarHBondContact O-OG 3.25Å; N29-S32 VanDerWaalsContact O-OG 3.07Å; S32-K35 PolarHBondContact O-N 3.02Å; S32-K36 PolarHBondContact O-N 2.81Å
33	D	41.5	Very low	40.7	Very low	101 Å²	101	111.2 Å²	111.2	54%	0.54	58%	0.582	S	S	.	*	H	α-helix	trans	-78.3	-29.8	178	-68.6	-29.7	0	0	0	112	K36 A37	D33-K36 PolarHBondContact O-N 2.88Å; D33-A37 WeakPolarHBondContact O-CB 3.39Å; D33-A37 PolarHBondContact O-N 3.11Å
34	L	36.3	Very low	41.1	Very low	71 Å²	71	109.6 Å²	109.6	37%	0.372	57%	0.568	S	S	.	*	H	α-helix	trans	-58.9	-51.4	163	-90.1	161	0	0	0	110.3	F30 K36 A37 E38	F30-L34 HydrophobicContact CD1-CD1 4.22Å; F30-L34 HydrophobicContact CD1-CG 4.28Å; F30-L34 WeakPolarHBondContact O-CA 3.21Å; F30-L34 WeakPolarHBondContact O-CB 3.46Å; F30-L34 WeakPolarHBondContact O-CD1 3.45Å; F30-L34 VanDerWaalsContact O-CG 3.3Å; F30-L34 WeakPolarHBondContact O-CG 3.39Å; F30-L34 PolarHBondContact O-N 3.16Å; L34-K36 VanDerWaalsContact C-N 3.29Å; L34-K36 PolarHBondContact O-N 2.95Å; L34-A37 CarbonylContact O-C 2.96Å; L34-A37 PolarHBondContact O-N 2.93Å; L34-E38 HydrophobicContact CD2-CG 4.47Å; L34-E38 VanDerWaalsContact O-CB 3.25Å; L34-E38 WeakPolarHBondContact O-CB 3.43Å; L34-E38 VanDerWaalsContact O-CG 3.24Å; L34-E38 WeakPolarHBondContact O-CG 3.47Å; L34-E38 PolarHBondContact O-N 2.76Å
35	K	44.4	Very low	41.5	Very low	116 Å²	116	105.6 Å²	105.6	50%	0.504	55%	0.545	S	S	.	.	H	α-helix	trans	-60.3	-36.5	179.1	-77.8	-176.6	175.3	-168.3	0	113.5	L31 S32 L39	L31-K35 WeakPolarHBondContact O-CG 3.37Å; L31-K35 PolarHBondContact O-N 2.86Å; L31-K35 VanDerWaalsContact O-N 3.12Å; S32-K35 PolarHBondContact O-N 3.02Å; K35-L39 WeakPolarHBondContact O-CB 3.43Å; K35-L39 PolarHBondContact O-N 3.43Å
36	K	46.6	Very low	41.4	Very low	145 Å²	145	103.5 Å²	103.5	63%	0.63	53%	0.532	S	S	*	.	H	α-helix	trans	-67.7	-40.5	170.9	-83.6	-172.6	172.7	-176.7	0	112.7	S32 D33 L34 A40	S32-K36 PolarHBondContact O-N 2.81Å; D33-K36 PolarHBondContact O-N 2.88Å; L34-K36 VanDerWaalsContact C-N 3.29Å; L34-K36 PolarHBondContact O-N 2.95Å; K36-A40 WeakPolarHBondContact O-CB 3.43Å; K36-A40 PolarHBondContact O-N 2.93Å
37	A	49.1	Very low	42	Very low	55 Å²	55	99.8 Å²	99.8	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-72.5	-38.1	179.5	0	0	0	0	0	112.4	D33 L34 A40 H41	D33-A37 WeakPolarHBondContact O-CB 3.39Å; D33-A37 PolarHBondContact O-N 3.11Å; L34-A37 CarbonylContact O-C 2.96Å; L34-A37 PolarHBondContact O-N 2.93Å; A37-A40 CarbonylContact O-C 3.51Å; A37-A40 PolarHBondContact O-N 2.96Å; A37-H41 WeakPolarHBondContact O-CB 3.38Å; A37-H41 PolarHBondContact O-N 3.19Å
38	E	45.5	Very low	42.5	Very low	97 Å²	97	99.4 Å²	99.4	45%	0.453	51%	0.505	S	S	.	.	H	α-helix	trans	-66	-45.9	174.1	-73.2	171.1	158.4	0	0	110.4	L34 H41 L42	L34-E38 HydrophobicContact CD2-CG 4.47Å; L34-E38 VanDerWaalsContact O-CB 3.25Å; L34-E38 WeakPolarHBondContact O-CB 3.43Å; L34-E38 VanDerWaalsContact O-CG 3.24Å; L34-E38 WeakPolarHBondContact O-CG 3.47Å; L34-E38 PolarHBondContact O-N 2.76Å; E38-H41 CarbonylContact O-C 3.57Å; E38-H41 PolarHBondContact O-N 3.42Å; E38-L42 VanDerWaalsContact O-CB 3.27Å; E38-L42 WeakPolarHBondContact O-CB 3.26Å; E38-L42 WeakPolarHBondContact O-CD1 3.42Å; E38-L42 VanDerWaalsContact O-CG 3.32Å; E38-L42 WeakPolarHBondContact O-CG 3.2Å; E38-L42 PolarHBondContact O-N 2.61Å
39	L	45.3	Very low	42.8	Very low	85 Å²	85	97.4 Å²	97.4	45%	0.445	50%	0.495	S	S	.	.	H	α-helix	trans	-63.7	-42.5	171.6	-94.5	165	0	0	0	111.8	K35 H41 L42 W43	K35-L39 WeakPolarHBondContact O-CB 3.43Å; K35-L39 PolarHBondContact O-N 3.43Å; L39-H41 VanDerWaalsContact C-N 3.28Å; L39-H41 PolarHBondContact O-N 2.85Å; L39-L42 PolarHBondContact O-N 3.47Å; L39-W43 WeakPolarHBondContact O-CB 3.44Å; L39-W43 PolarHBondContact O-N 3.11Å
40	A	49	Very low	42.7	Very low	52 Å²	52	94.6 Å²	94.6	43%	0.43	48%	0.477	S	S	.	.	H	α-helix	trans	-63.4	-34	174.3	0	0	0	0	0	112.4	K36 A37 R44	K36-A40 WeakPolarHBondContact O-CB 3.43Å; K36-A40 PolarHBondContact O-N 2.93Å; A37-A40 CarbonylContact O-C 3.51Å; A37-A40 PolarHBondContact O-N 2.96Å; A40-R44 WeakPolarHBondContact O-CB 3.33Å; A40-R44 PolarHBondContact O-N 3.16Å
41	H	47.1	Very low	42.7	Very low	136 Å²	136	93 Å²	93	63%	0.63	47%	0.467	S	S	*	.	H	α-helix	trans	-79.6	-30.5	178	-165.6	-45.8	0	0	0	112	A37 E38 L39 S45	A37-H41 WeakPolarHBondContact O-CB 3.38Å; A37-H41 PolarHBondContact O-N 3.19Å; E38-H41 CarbonylContact O-C 3.57Å; E38-H41 PolarHBondContact O-N 3.42Å; L39-H41 VanDerWaalsContact C-N 3.28Å; L39-H41 PolarHBondContact O-N 2.85Å; H41-S45 WeakPolarHBondContact O-CA 3.45Å; H41-S45 WeakPolarHBondContact O-CB 3.35Å; H41-S45 PolarHBondContact O-N 2.73Å
42	L	42	Very low	42.9	Very low	39 Å²	39	90.8 Å²	90.8	20%	0.204	46%	0.462	C	S	.	.	H	α-helix	trans	-66.9	-51.3	169.8	-85.1	159.2	0	0	0	110.3	M11 L14 E38 L39 R44 S45 C46	M11-L42 HydrophobicContact CE-CD1 4.13Å; L14-L42 HydrophobicContact CD1-CD2 3.75Å; L14-L42 HydrophobicContact CD2-CD2 4.02Å; L14-L42 HydrophobicContact CD2-CG 4.42Å; L14-L42 HydrophobicContact CG-CD2 4.41Å; E38-L42 VanDerWaalsContact O-CB 3.27Å; E38-L42 WeakPolarHBondContact O-CB 3.26Å; E38-L42 WeakPolarHBondContact O-CD1 3.42Å; E38-L42 VanDerWaalsContact O-CG 3.32Å; E38-L42 WeakPolarHBondContact O-CG 3.2Å; E38-L42 PolarHBondContact O-N 2.61Å; L39-L42 PolarHBondContact O-N 3.47Å; L42-R44 VanDerWaalsContact C-N 3.35Å; L42-R44 PolarHBondContact O-N 3.18Å; L42-S45 PolarHBondContact O-N 3.1Å; L42-C46 PolarHBondContact O-N 2.82Å; L42-C46 PolarHBondContact O-SG 2.83Å; L42-C46 VanDerWaalsContact O-SG 3.33Å
43	W	43.9	Very low	42.6	Very low	131 Å²	131	90.9 Å²	90.9	50%	0.496	46%	0.455	S	S	.	.	H	α-helix	trans	-61.3	-45.5	177.7	-144.8	67.5	0	0	0	110.7	L39 C46 F47 L175	L39-W43 WeakPolarHBondContact O-CB 3.44Å; L39-W43 PolarHBondContact O-N 3.11Å; W43-C46 PolarHBondContact O-N 2.81Å; W43-F47 VanDerWaalsContact O-CB 3.3Å; W43-F47 WeakPolarHBondContact O-CB 3.29Å; W43-F47 PolarHBondContact O-N 3.47Å; W43-L175 HydrophobicContact CZ2-CD1 4.04Å
44	R	45	Very low	42.2	Very low	159 Å²	159	89.1 Å²	89.1	60%	0.6	45%	0.446	S	S	*	.	H	α-helix	trans	-64	-37.2	174	-169.9	175.4	-160.3	153	7.3	112.9	A40 L42 F47 D48	A40-R44 WeakPolarHBondContact O-CB 3.33Å; A40-R44 PolarHBondContact O-N 3.16Å; L42-R44 VanDerWaalsContact C-N 3.35Å; L42-R44 PolarHBondContact O-N 3.18Å; R44-F47 PolarHBondContact O-N 2.81Å; R44-D48 VanDerWaalsContact O-CB 3.29Å; R44-D48 WeakPolarHBondContact O-CB 3.49Å; R44-D48 PolarHBondContact O-N 2.85Å
45	S	42.5	Very low	42.1	Very low	47 Å²	47	90.7 Å²	90.7	33%	0.329	45%	0.451	S	S	.	.	H	α-helix	trans	-71.2	-38.5	176.7	-178.5	0	0	0	0	112.5	H41 L42 F47 N49	H41-S45 WeakPolarHBondContact O-CA 3.45Å; H41-S45 WeakPolarHBondContact O-CB 3.35Å; H41-S45 PolarHBondContact O-N 2.73Å; L42-S45 PolarHBondContact O-N 3.1Å; S45-F47 VanDerWaalsContact C-N 3.33Å; S45-N49 VanDerWaalsContact O-CB 3.27Å; S45-N49 WeakPolarHBondContact O-CB 3.41Å; S45-N49 PolarHBondContact O-N 3.34Å; S45-N49 PolarHBondContact O-ND2 3.36Å
46	C	40.3	Very low	41.6	Very low	63 Å²	63	91.4 Å²	91.4	43%	0.426	46%	0.46	S	S	.	.	H	α-helix	trans	-65.4	-40.7	172.7	-66.4	0	0	0	0	110.7	L42 W43 N49 H50	L42-C46 PolarHBondContact O-N 2.82Å; L42-C46 PolarHBondContact O-SG 2.83Å; L42-C46 VanDerWaalsContact O-SG 3.33Å; W43-C46 PolarHBondContact O-N 2.81Å; C46-N49 PolarHBondContact O-N 3.29Å; C46-H50 PolarHBondContact O-N 3.25Å
47	F	42.8	Very low	40.8	Very low	105 Å²	105	90.7 Å²	90.7	46%	0.461	46%	0.463	S	S	.	.	H	α-helix	trans	-67.4	-42.6	176.6	-158.9	-87.7	0	0	0	112.5	W43 R44 S45 N49 R51 L54	W43-F47 VanDerWaalsContact O-CB 3.3Å; W43-F47 WeakPolarHBondContact O-CB 3.29Å; W43-F47 PolarHBondContact O-N 3.47Å; R44-F47 PolarHBondContact O-N 2.81Å; S45-F47 VanDerWaalsContact C-N 3.33Å; F47-N49 VanDerWaalsContact C-N 3.28Å; F47-N49 PolarHBondContact O-N 2.92Å; F47-R51 WeakPolarHBondContact O-CA 3.12Å; F47-R51 WeakPolarHBondContact O-CB 3.5Å; F47-R51 PolarHBondContact O-N 3.3Å; F47-L54 HydrophobicContact CE1-CD1 4.45Å; F47-L54 HydrophobicContact CE2-CD1 3.91Å; F47-L54 HydrophobicContact CZ-CD1 3.84Å
48	D	43.9	Very low	39.7	Very low	69 Å²	69	90.6 Å²	90.6	37%	0.369	46%	0.455	S	S	.	.	H	α-helix	trans	-68.8	-22.8	174.2	-84.3	-50.6	0	0	0	112.4	R44 R51	R44-D48 VanDerWaalsContact O-CB 3.29Å; R44-D48 WeakPolarHBondContact O-CB 3.49Å; R44-D48 PolarHBondContact O-N 2.85Å; D48-R51 WeakPolarHBondContact O-CB 3.43Å; D48-R51 WeakPolarHBondContact OD1-CD 3.3Å; D48-R51 IonicContact OD1-CZ 2.79Å; D48-R51 IonicContact OD1-NE 2.79Å; D48-R51 IonicContact OD1-NH1 3.23Å; D48-R51 PolarHBondContact OD1-NH1 2.85Å
49	N	40.2	Very low	38.9	Very low	114 Å²	114	93 Å²	93	61%	0.61	47%	0.465	S	S	*	.	H	α-helix	trans	-80.3	-42.9	174.7	-75.9	-18.3	0	0	0	113.3	S45 C46 F47 R51	S45-N49 VanDerWaalsContact O-CB 3.27Å; S45-N49 WeakPolarHBondContact O-CB 3.41Å; S45-N49 PolarHBondContact O-N 3.34Å; S45-N49 PolarHBondContact O-ND2 3.36Å; C46-N49 PolarHBondContact O-N 3.29Å; F47-N49 VanDerWaalsContact C-N 3.28Å; F47-N49 PolarHBondContact O-N 2.92Å; N49-R51 PolarHBondContact O-N 2.85Å
50	H	39.5	Very low	38.2	Very low	73 Å²	73	91.1 Å²	91.1	34%	0.338	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	5	172.4	-73.9	-98.5	0	0	0	112.9	C46 S52 I53 L54 E182	C46-H50 PolarHBondContact O-N 3.25Å; H50-S52 VanDerWaalsContact C-N 3.26Å; H50-S52 PolarHBondContact O-N 3.36Å; H50-I53 WeakPolarHBondContact O-CB 3.41Å; H50-I53 PolarHBondContact O-N 2.9Å; H50-L54 PolarHBondContact O-N 3.05Å; H50-E182 IonicContact CE1-OE1 3.33Å; H50-E182 IonicContact ND1-OE1 3.14Å; H50-E182 PolarHBondContact ND1-OE1 2.83Å
51	R	37.2	Very low	37.1	Very low	105 Å²	105	97.2 Å²	97.2	40%	0.396	47%	0.471	S	S	.	.	H	α-helix	trans	-56.3	-35.4	-179.7	-174.2	178.1	177.6	132.2	11.5	113.6	F47 D48 N49 I53 Q55	F47-R51 WeakPolarHBondContact O-CA 3.12Å; F47-R51 WeakPolarHBondContact O-CB 3.5Å; F47-R51 PolarHBondContact O-N 3.3Å; D48-R51 WeakPolarHBondContact O-CB 3.43Å; D48-R51 WeakPolarHBondContact OD1-CD 3.3Å; D48-R51 IonicContact OD1-CZ 2.79Å; D48-R51 IonicContact OD1-NE 2.79Å; D48-R51 IonicContact OD1-NH1 3.23Å; D48-R51 PolarHBondContact OD1-NH1 2.85Å; N49-R51 PolarHBondContact O-N 2.85Å; R51-I53 VanDerWaalsContact C-N 3.27Å; R51-I53 PolarHBondContact O-N 3.38Å; R51-Q55 HydrophobicContact CG-CG 3.96Å; R51-Q55 VanDerWaalsContact CG-OE1 3.24Å; R51-Q55 WeakPolarHBondContact O-CB 3.49Å; R51-Q55 VanDerWaalsContact O-CG 3.22Å; R51-Q55 WeakPolarHBondContact O-CG 3.16Å; R51-Q55 PolarHBondContact O-N 3.48Å
52	S	36.4	Very low	36.4	Very low	69 Å²	69	95.6 Å²	95.6	48%	0.483	47%	0.471	S	S	.	.	H	α-helix	trans	-63.6	-32.5	175.9	46.1	0	0	0	0	112.7	H50 N56	H50-S52 VanDerWaalsContact C-N 3.26Å; H50-S52 PolarHBondContact O-N 3.36Å; S52-N56 VanDerWaalsContact O-CB 3.27Å; S52-N56 WeakPolarHBondContact O-CB 3.38Å; S52-N56 PolarHBondContact O-N 2.59Å; S52-N56 PolarHBondContact O-OD1 3.4Å
53	I	36.1	Very low	35.9	Very low	77 Å²	77	97.2 Å²	97.2	40%	0.395	49%	0.485	S	S	.	.	H	α-helix	trans	-78.6	-41.3	-178.2	-63.1	164.3	0	0	0	109.7	H50 R51 N57 E182	H50-I53 WeakPolarHBondContact O-CB 3.41Å; H50-I53 PolarHBondContact O-N 2.9Å; R51-I53 VanDerWaalsContact C-N 3.27Å; R51-I53 PolarHBondContact O-N 3.38Å; I53-N57 PolarHBondContact O-N 3.35Å; I53-E182 WeakPolarHBondContact CD1-OE1 3.35Å
54	L	33.4	Very low	35.4	Very low	64 Å²	64	99.9 Å²	99.9	34%	0.335	50%	0.5	S	S	.	.	H	α-helix	trans	-70.4	-35.8	171.8	-70.5	170	0	0	0	113	F47 H50 I58	F47-L54 HydrophobicContact CE1-CD1 4.45Å; F47-L54 HydrophobicContact CE2-CD1 3.91Å; F47-L54 HydrophobicContact CZ-CD1 3.84Å; H50-L54 PolarHBondContact O-N 3.05Å; L54-I58 HydrophobicContact CD2-CD1 3.98Å; L54-I58 WeakPolarHBondContact O-CA 3.31Å; L54-I58 WeakPolarHBondContact O-CB 3.49Å; L54-I58 WeakPolarHBondContact O-CD1 3.25Å; L54-I58 PolarHBondContact O-N 3.41Å
55	Q	34.7	Very low	34.8	Very low	103 Å²	103	98.4 Å²	98.4	48%	0.481	51%	0.509	S	S	.	.	H	α-helix	trans	-77.4	-22.7	178.5	-72.6	-162.5	-93	0	0	114	R51	R51-Q55 HydrophobicContact CG-CG 3.96Å; R51-Q55 VanDerWaalsContact CG-OE1 3.24Å; R51-Q55 WeakPolarHBondContact O-CB 3.49Å; R51-Q55 VanDerWaalsContact O-CG 3.22Å; R51-Q55 WeakPolarHBondContact O-CG 3.16Å; R51-Q55 PolarHBondContact O-N 3.48Å
56	N	32.7	Very low	34.4	Very low	131 Å²	131	99.6 Å²	99.6	70%	0.701	51%	0.514	S	S	*	.	H	α-helix	trans	-77.5	-27.6	173.3	-75.2	5.1	0	0	0	112.2	S52	S52-N56 VanDerWaalsContact O-CB 3.27Å; S52-N56 WeakPolarHBondContact O-CB 3.38Å; S52-N56 PolarHBondContact O-N 2.59Å; S52-N56 PolarHBondContact O-OD1 3.4Å
57	N	29.5	Very low	34.7	Very low	130 Å²	130	101 Å²	101	70%	0.695	52%	0.518	S	S	*	.	H	α-helix	trans	-106.8	-14.1	-177.8	-70.4	17.9	0	0	0	114.3	I53	I53-N57 PolarHBondContact O-N 3.35Å
58	I	27.4	Very low	34.6	Very low	53 Å²	53	99.2 Å²	99.2	27%	0.272	52%	0.517	S	S	.	.			trans	-131.4	109.8	175.4	-58.4	94.6	0	0	0	110.9	L54 C60 D635	L54-I58 HydrophobicContact CD2-CD1 3.98Å; L54-I58 WeakPolarHBondContact O-CA 3.31Å; L54-I58 WeakPolarHBondContact O-CB 3.49Å; L54-I58 WeakPolarHBondContact O-CD1 3.25Å; L54-I58 PolarHBondContact O-N 3.41Å; I58-C60 HydrophobicContact CG2-CB 3.9Å; I58-C60 PolarHBondContact O-N 3.33Å; I58-D635 WeakPolarHBondContact CD1-OD1 3.47Å; I58-D635 WeakPolarHBondContact CG1-OD1 3.47Å
59	H	27.5	Very low	34.5	Very low	147 Å²	147	102.8 Å²	102.8	68%	0.681	53%	0.53	S	S	*	.			trans	-82	49.5	-177.7	-121.8	-69.1	0	0	0	113.7
60	C	30.6	Very low	34.9	Very low	47 Å²	47	98.8 Å²	98.8	32%	0.318	51%	0.513	S	S	.	.			trans	-103.4	112.9	-177.9	-170	0	0	0	0	112.9	I58 V62	I58-C60 HydrophobicContact CG2-CB 3.9Å; I58-C60 PolarHBondContact O-N 3.33Å; C60-V62 HydrophobicContact CB-CG2 4.46Å; C60-V62 PolarHBondContact O-N 2.93Å
61	R	27.3	Very low	35.4	Very low	179 Å²	179	97.3 Å²	97.3	68%	0.675	51%	0.507	S	S	*	.			trans	-72.4	68.6	172.2	-88.4	-176.1	170.6	166	-2.3	111	S63 D620 E622	R61-S63 PolarHBondContact O-N 2.86Å; R61-D620 IonicContact NH1-OD2 3.85Å; R61-D620 PolarHBondContact NH1-OD2 3.36Å; R61-E622 PolarHBondContact NH2-O 3.24Å
62	V	31.6	Very low	36	Very low	103 Å²	103	96.2 Å²	96.2	62%	0.624	51%	0.508	S	S	*	.			trans	-58.2	120.6	174.9	179.6	0	0	0	0	110.3	C60 K64	C60-V62 HydrophobicContact CB-CG2 4.46Å; C60-V62 PolarHBondContact O-N 2.93Å; V62-K64 PolarHBondContact O-N 3.43Å
63	S	32	Very low	36.9	Very low	72 Å²	72	96.3 Å²	96.3	50%	0.503	50%	0.503	S	S	.	.			trans	-61.5	134.3	177.2	57.1	0	0	0	0	111	R61 T65 T66	R61-S63 PolarHBondContact O-N 2.86Å; S63-T65 PolarHBondContact O-N 3.13Å; S63-T66 PolarHBondContact OG-OG1 3.25Å
64	K	32.8	Very low	38	Very low	187 Å²	187	97.1 Å²	97.1	81%	0.813	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	4.9	-162.6	-70.5	-179.3	176	174.2	0	117.1	V62	V62-K64 PolarHBondContact O-N 3.43Å
65	T	31.8	Very low	39.4	Very low	128 Å²	128	95.2 Å²	95.2	79%	0.785	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.9	-9	-165.5	43	0	0	0	0	116.2	S63	S63-T65 PolarHBondContact O-N 3.13Å
66	T	35.4	Very low	40.6	Very low	72 Å²	72	92.3 Å²	92.3	44%	0.442	48%	0.48	S	S	.	.	S	Bend	trans	-125.3	120.6	-167.5	36.6	0	0	0	0	116.2	S63	S63-T66 PolarHBondContact OG-OG1 3.25Å
67	N	45.9	Very low	42.1	Very low	92 Å²	92	91.3 Å²	91.3	49%	0.492	48%	0.475	S	S	.	.	S	Bend		93.3	-5.5	129.6	-61.3	5.1	0	0	0	123.7	K69 A70 I71	N67-K69 VanDerWaalsContact C-N 3.26Å; N67-K69 PolarHBondContact O-N 3.45Å; N67-A70 HydrophobicContact CB-CB 3.86Å; N67-A70 CarbonylContact O-C 3.47Å; N67-A70 PolarHBondContact O-N 2.83Å; N67-A70 VanDerWaalsContact O-N 3.15Å; N67-A70 VanDerWaalsContact OD1-CB 3.3Å; N67-A70 WeakPolarHBondContact OD1-CB 3.43Å; N67-I71 WeakPolarHBondContact O-CB 3.39Å; N67-I71 VanDerWaalsContact O-CG1 3.27Å; N67-I71 WeakPolarHBondContact O-CG1 3.15Å; N67-I71 PolarHBondContact O-N 2.83Å
68	C	41.1	Very low	43.6	Very low	68 Å²	68	86.3 Å²	86.3	46%	0.459	45%	0.449	S	S	.	.	H	α-helix	trans	-60.1	-41.8	161	-75	0	0	0	0	111.1	I71 L72	C68-I71 PolarHBondContact O-N 3.04Å; C68-L72 PolarHBondContact O-N 3.21Å
69	K	41.9	Very low	45.2	Very low	145 Å²	145	84 Å²	84	63%	0.63	44%	0.437	S	S	*	.	H	α-helix	trans	-63.5	-43.7	170	-168.4	-162.4	167.5	-165.4	0	111.9	N67 I71 L72 D73	N67-K69 VanDerWaalsContact C-N 3.26Å; N67-K69 PolarHBondContact O-N 3.45Å; K69-I71 VanDerWaalsContact C-N 3.27Å; K69-I71 PolarHBondContact O-N 3.11Å; K69-L72 CarbonylContact O-C 3.58Å; K69-L72 WeakPolarHBondContact O-CB 3.47Å; K69-L72 PolarHBondContact O-N 2.79Å; K69-L72 VanDerWaalsContact O-N 3.15Å; K69-D73 VanDerWaalsContact CE-OD2 3.31Å; K69-D73 WeakPolarHBondContact CE-OD2 3.15Å; K69-D73 IonicContact NZ-OD2 3.34Å; K69-D73 VanDerWaalsContact O-CG 3.31Å; K69-D73 PolarHBondContact O-N 2.89Å
70	A	49.3	Very low	46.6	Very low	30 Å²	30	79.7 Å²	79.7	25%	0.248	42%	0.423	C	S	.	.	H	α-helix	trans	-71.5	-19.6	-178.2	0	0	0	0	0	113.7	N67 K74	N67-A70 HydrophobicContact CB-CB 3.86Å; N67-A70 CarbonylContact O-C 3.47Å; N67-A70 PolarHBondContact O-N 2.83Å; N67-A70 VanDerWaalsContact O-N 3.15Å; N67-A70 VanDerWaalsContact OD1-CB 3.3Å; N67-A70 WeakPolarHBondContact OD1-CB 3.43Å; A70-K74 WeakPolarHBondContact O-CB 3.43Å; A70-K74 VanDerWaalsContact O-CG 3.3Å; A70-K74 WeakPolarHBondContact O-CG 3.46Å; A70-K74 PolarHBondContact O-N 2.89Å
71	I	48.5	Very low	47.9	Very low	41 Å²	41	82.3 Å²	82.3	21%	0.21	43%	0.434	C	S	.	.	H	α-helix	trans	-75.2	-40	169.7	-71.6	166.5	0	0	0	109.9	N67 C68 K69 F75 L146 F636	N67-I71 WeakPolarHBondContact O-CB 3.39Å; N67-I71 VanDerWaalsContact O-CG1 3.27Å; N67-I71 WeakPolarHBondContact O-CG1 3.15Å; N67-I71 PolarHBondContact O-N 2.83Å; C68-I71 PolarHBondContact O-N 3.04Å; K69-I71 VanDerWaalsContact C-N 3.27Å; K69-I71 PolarHBondContact O-N 3.11Å; I71-F75 WeakPolarHBondContact O-CB 3.2Å; I71-F75 PolarHBondContact O-N 2.74Å; I71-L146 HydrophobicContact CG2-CD2 4.17Å; I71-F636 HydrophobicContact CB-CZ 4.44Å; I71-F636 HydrophobicContact CD1-CD2 4.49Å; I71-F636 HydrophobicContact CD1-CE1 3.9Å; I71-F636 HydrophobicContact CD1-CE2 3.78Å; I71-F636 HydrophobicContact CD1-CZ 3.46Å; I71-F636 VanDerWaalsContact CD1-CZ 3.46Å; I71-F636 HydrophobicContact CG1-CZ 4.49Å; I71-F636 HydrophobicContact CG2-CE1 3.8Å; I71-F636 HydrophobicContact CG2-CZ 3.91Å
72	L	50.4	Low	49.3	Very low	83 Å²	83	75.4 Å²	75.4	44%	0.435	41%	0.412	S	S	.	.	H	α-helix	trans	-62.9	-46.4	169.5	-169.9	72.3	0	0	0	111.3	C68 K69 F75 M76	C68-L72 PolarHBondContact O-N 3.21Å; K69-L72 CarbonylContact O-C 3.58Å; K69-L72 WeakPolarHBondContact O-CB 3.47Å; K69-L72 PolarHBondContact O-N 2.79Å; K69-L72 VanDerWaalsContact O-N 3.15Å; L72-F75 PolarHBondContact O-N 3.21Å; L72-M76 WeakPolarHBondContact O-CG 3.45Å; L72-M76 PolarHBondContact O-N 2.77Å
73	D	55.4	Low	50.2	Low	70 Å²	70	77.6 Å²	77.6	37%	0.374	42%	0.416	S	S	.	.	H	α-helix	trans	-61.6	-46.4	176.6	-63.6	-35.8	0	0	0	110.4	K69 F75 M76 D77	K69-D73 VanDerWaalsContact CE-OD2 3.31Å; K69-D73 WeakPolarHBondContact CE-OD2 3.15Å; K69-D73 IonicContact NZ-OD2 3.34Å; K69-D73 VanDerWaalsContact O-CG 3.31Å; K69-D73 PolarHBondContact O-N 2.89Å; D73-F75 VanDerWaalsContact C-N 3.34Å; D73-F75 PolarHBondContact O-N 3.04Å; D73-M76 CarbonylContact O-C 3.56Å; D73-M76 PolarHBondContact O-N 3.29Å; D73-D77 PolarHBondContact O-N 2.88Å
74	K	59	Low	51.2	Low	94 Å²	94	82.1 Å²	82.1	41%	0.409	44%	0.435	S	S	.	.	H	α-helix	trans	-54.6	-44.8	170.9	-90.9	-176.2	166	-166.5	0	112.5	A70 M76 D77 V78 I144 L146	A70-K74 WeakPolarHBondContact O-CB 3.43Å; A70-K74 VanDerWaalsContact O-CG 3.3Å; A70-K74 WeakPolarHBondContact O-CG 3.46Å; A70-K74 PolarHBondContact O-N 2.89Å; K74-M76 VanDerWaalsContact C-N 3.3Å; K74-M76 PolarHBondContact O-N 2.81Å; K74-D77 PolarHBondContact O-N 3.08Å; K74-V78 WeakPolarHBondContact O-CG2 3.42Å; K74-V78 PolarHBondContact O-N 2.77Å; K74-I144 PolarHBondContact NZ-O 2.97Å; K74-I144 VanDerWaalsContact NZ-O 3.16Å; K74-L146 HydrophobicContact CB-CD2 4.16Å; K74-L146 HydrophobicContact CD-CD2 4.49Å
75	F	62.2	Low	52.4	Low	25 Å²	25	74.6 Å²	74.6	11%	0.11	40%	0.403	C	S	.	.	H	α-helix	trans	-64.1	-41.3	-179.4	-148.2	-67.1	0	0	0	110.4	I71 L72 D73 V78 L79 L146 P169	I71-F75 WeakPolarHBondContact O-CB 3.2Å; I71-F75 PolarHBondContact O-N 2.74Å; L72-F75 PolarHBondContact O-N 3.21Å; D73-F75 VanDerWaalsContact C-N 3.34Å; D73-F75 PolarHBondContact O-N 3.04Å; F75-V78 PolarHBondContact O-N 2.78Å; F75-L79 HydrophobicContact CD1-CD1 3.69Å; F75-L79 HydrophobicContact CD1-CG 3.8Å; F75-L79 HydrophobicContact CE1-CD1 3.86Å; F75-L79 HydrophobicContact CE1-CD2 4.07Å; F75-L79 HydrophobicContact CE1-CG 3.81Å; F75-L79 WeakPolarHBondContact O-CB 3.43Å; F75-L79 VanDerWaalsContact O-CG 3.31Å; F75-L79 WeakPolarHBondContact O-CG 3.35Å; F75-L79 PolarHBondContact O-N 3.07Å; F75-L146 HydrophobicContact CD2-CD2 4.01Å; F75-P169 HydrophobicContact CD1-CG 4.4Å; F75-P169 VanDerWaalsContact CE1-CD 3.44Å; F75-P169 HydrophobicContact CE1-CG 3.54Å; F75-P169 HydrophobicContact CE2-CG 3.71Å; F75-P169 HydrophobicContact CZ-CG 3.15Å
76	M	60.3	Low	53.9	Low	42 Å²	42	71.6 Å²	71.6	21%	0.207	38%	0.382	C	S	.	.	H	α-helix	trans	-68.1	-35.6	176.5	-63.8	-72.7	-80	0	0	112.1	L72 D73 K74 S80 C92	L72-M76 WeakPolarHBondContact O-CG 3.45Å; L72-M76 PolarHBondContact O-N 2.77Å; D73-M76 CarbonylContact O-C 3.56Å; D73-M76 PolarHBondContact O-N 3.29Å; K74-M76 VanDerWaalsContact C-N 3.3Å; K74-M76 PolarHBondContact O-N 2.81Å; M76-S80 VanDerWaalsContact O-CB 3.25Å; M76-S80 WeakPolarHBondContact O-CB 3.48Å; M76-S80 PolarHBondContact O-N 2.91Å; M76-S80 PolarHBondContact O-OG 2.79Å; M76-C92 HydrophobicContact CE-CB 3.58Å; M76-C92 VanDerWaalsContact CE-SG 3.59Å
77	D	63.4	Low	55.3	Low	110 Å²	110	68.8 Å²	68.8	59%	0.588	36%	0.364	S	S	*	.	H	α-helix	trans	-65.2	-47	173	-76.3	-25.4	0	0	0	111.7	D73 K74 L79 S80 N81	D73-D77 PolarHBondContact O-N 2.88Å; K74-D77 PolarHBondContact O-N 3.08Å; D77-L79 PolarHBondContact O-N 2.86Å; D77-S80 WeakPolarHBondContact O-CB 3.39Å; D77-S80 PolarHBondContact O-N 3.3Å; D77-S80 VanDerWaalsContact O-N 3.1Å; D77-N81 PolarHBondContact O-N 2.87Å
78	V	62.7	Low	56.2	Low	24 Å²	24	64.6 Å²	64.6	15%	0.145	34%	0.342	C	S	.	.	H	α-helix	trans	-62.3	-42.3	177	169.1	0	0	0	0	111.5	K74 F75 S80 P82 L85 L146	K74-V78 WeakPolarHBondContact O-CG2 3.42Å; K74-V78 PolarHBondContact O-N 2.77Å; F75-V78 PolarHBondContact O-N 2.78Å; V78-S80 VanDerWaalsContact C-N 3.28Å; V78-S80 PolarHBondContact O-N 2.84Å; V78-P82 WeakPolarHBondContact O-CD 3.47Å; V78-L85 HydrophobicContact CG1-CD1 3.88Å; V78-L146 HydrophobicContact CG2-CD1 3.84Å
79	L	59.8	Low	57.2	Low	4 Å²	4	66.6 Å²	66.6	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-66.4	-28.2	173.9	-73.6	-179.2	0	0	0	113.3	F75 D77 F87 C90	F75-L79 HydrophobicContact CD1-CD1 3.69Å; F75-L79 HydrophobicContact CD1-CG 3.8Å; F75-L79 HydrophobicContact CE1-CD1 3.86Å; F75-L79 HydrophobicContact CE1-CD2 4.07Å; F75-L79 HydrophobicContact CE1-CG 3.81Å; F75-L79 WeakPolarHBondContact O-CB 3.43Å; F75-L79 VanDerWaalsContact O-CG 3.31Å; F75-L79 WeakPolarHBondContact O-CG 3.35Å; F75-L79 PolarHBondContact O-N 3.07Å; D77-L79 PolarHBondContact O-N 2.86Å; L79-F87 HydrophobicContact CD2-CD1 3.99Å; L79-F87 HydrophobicContact CD2-CE1 4.42Å; L79-C90 HydrophobicContact CB-CB 4.22Å; L79-C90 PolarHBondContact O-N 3.15Å
80	S	56.6	Low	58	Low	57 Å²	57	59.8 Å²	59.8	40%	0.399	31%	0.313	S	S	.	.	H	α-helix	trans	-80.9	-35.2	179.1	-63.5	0	0	0	0	112.7	M76 D77 V78 K89	M76-S80 VanDerWaalsContact O-CB 3.25Å; M76-S80 WeakPolarHBondContact O-CB 3.48Å; M76-S80 PolarHBondContact O-N 2.91Å; M76-S80 PolarHBondContact O-OG 2.79Å; D77-S80 WeakPolarHBondContact O-CB 3.39Å; D77-S80 PolarHBondContact O-N 3.3Å; D77-S80 VanDerWaalsContact O-N 3.1Å; V78-S80 VanDerWaalsContact C-N 3.28Å; V78-S80 PolarHBondContact O-N 2.84Å; S80-K89 WeakPolarHBondContact O-CE 3.31Å; S80-K89 PolarHBondContact O-NZ 2.77Å
81	N	58.2	Low	58.6	Low	102 Å²	102	63.1 Å²	63.1	55%	0.545	33%	0.327	S	S	.	.			trans	-141.4	65.1	-172.3	-157.7	32.8	0	0	0	114	D77 Q83	D77-N81 PolarHBondContact O-N 2.87Å; N81-Q83 PolarHBondContact O-N 3.38Å
82	P	57.2	Low	59	Low	34 Å²	34	63 Å²	63	22%	0.221	33%	0.329	C	S	.	.			trans	-72.3	93.7	178.5	30.2	-34.9	0	0	0	111.1	V78 F87 K89	V78-P82 WeakPolarHBondContact O-CD 3.47Å; P82-F87 HydrophobicContact CB-CB 4.02Å; P82-K89 HydrophobicContact CG-CB 4.2Å
83	Q	51.3	Low	59.3	Low	149 Å²	149	62.1 Å²	62.1	70%	0.696	33%	0.327	S	S	*	.	S	Bend	trans	-104.3	135.1	161.8	-66.6	-170.1	-13.6	0	0	108.6	N81 L85	N81-Q83 PolarHBondContact O-N 3.38Å; Q83-L85 PolarHBondContact O-N 2.79Å
84	N	53.1	Low	59.2	Low	168 Å²	168	65.3 Å²	65.3	90%	0.898	34%	0.335	S	S	*	.	S	Bend	trans	61.4	13	-175.7	-55.5	-12.8	0	0	0	116.6
85	L	56.7	Low	58.7	Low	28 Å²	28	65.5 Å²	65.5	15%	0.147	34%	0.341	C	S	.	.	S	Bend	trans	-125.6	135.9	174.2	-71.2	168.4	0	0	0	110.9	V78 Q83 F87 Q140 I144	V78-L85 HydrophobicContact CG1-CD1 3.88Å; Q83-L85 PolarHBondContact O-N 2.79Å; L85-F87 HydrophobicContact CB-CD2 4.49Å; L85-F87 PolarHBondContact O-N 2.89Å; L85-Q140 HydrophobicContact CD2-CB 3.69Å; L85-I144 HydrophobicContact CD1-CD1 3.84Å; L85-I144 HydrophobicContact CD2-CD1 4.13Å; L85-I144 HydrophobicContact CG-CD1 4.43Å
86	N	64.7	Low	58.1	Low	66 Å²	66	71.9 Å²	71.9	35%	0.353	37%	0.371	S	S	.	.			trans	-77	59.9	179.5	-78.4	22.8	0	0	0	112.3	I164 F165 L166	N86-I164 WeakPolarHBondContact CB-O 3.35Å; N86-I164 PolarHBondContact ND2-O 3.21Å; N86-F165 WeakPolarHBondContact O-CA 3.04Å; N86-L166 PolarHBondContact O-N 2.79Å
87	F	64.4	Low	57.8	Low	12 Å²	12	74 Å²	74	5%	0.053	38%	0.383	C	S	.	.	B	Isolated β-bridge	trans	-113.6	143.5	-176.5	-102.5	-95.2	0	0	0	113.6	L79 P82 L85 K89 L141 H148 L166	L79-F87 HydrophobicContact CD2-CD1 3.99Å; L79-F87 HydrophobicContact CD2-CE1 4.42Å; P82-F87 HydrophobicContact CB-CB 4.02Å; L85-F87 HydrophobicContact CB-CD2 4.49Å; L85-F87 PolarHBondContact O-N 2.89Å; F87-K89 PolarHBondContact O-N 2.82Å; F87-L141 HydrophobicContact CD2-CD2 4.34Å; F87-L141 HydrophobicContact CE2-CD1 3.66Å; F87-L141 HydrophobicContact CE2-CD2 3.54Å; F87-L141 HydrophobicContact CE2-CG 3.76Å; F87-L141 HydrophobicContact CZ-CD1 3.71Å; F87-L141 HydrophobicContact CZ-CD2 3.94Å; F87-L141 HydrophobicContact CZ-CG 4.24Å; F87-H148 AromaticContact CZ-CD2 3.93Å; F87-L166 HydrophobicContact CD1-CB 4.43Å; F87-L166 HydrophobicContact CD2-CB 4.21Å; F87-L166 HydrophobicContact CE1-CB 4.04Å; F87-L166 HydrophobicContact CE2-CB 3.77Å; F87-L166 HydrophobicContact CE2-CD1 3.67Å; F87-L166 HydrophobicContact CE2-CG 4.31Å; F87-L166 HydrophobicContact CZ-CB 3.68Å; F87-L166 HydrophobicContact CZ-CD1 3.99Å; F87-L166 HydrophobicContact CZ-CG 4.49Å
88	V	63.7	Low	57.3	Low	4 Å²	4	72.2 Å²	72.2	2%	0.024	37%	0.371	C	S	.	.			trans	-76.7	118.9	171.5	-177.5	0	0	0	0	109.7	C90 Y103 D104 F157 F165 L166	V88-C90 PolarHBondContact O-SG 2.76Å; V88-Y103 HydrophobicContact CG1-CD2 4.02Å; V88-D104 VanDerWaalsContact CG1-O 3.28Å; V88-D104 WeakPolarHBondContact CG1-O 3.2Å; V88-F157 HydrophobicContact CG2-CD2 3.82Å; V88-F157 HydrophobicContact CG2-CE2 4.19Å; V88-F165 HydrophobicContact CG2-CB 3.97Å; V88-L166 WeakPolarHBondContact CG2-O 3.28Å; V88-L166 PolarHBondContact N-O 2.82Å
89	K	62.8	Low	57.1	Low	111 Å²	111	72 Å²	72	48%	0.483	37%	0.369	S	S	.	.			trans	-64.2	132.3	179.6	-176.3	167.5	175.8	129.3	0	111.7	S80 P82 F87	S80-K89 WeakPolarHBondContact O-CE 3.31Å; S80-K89 PolarHBondContact O-NZ 2.77Å; P82-K89 HydrophobicContact CG-CB 4.2Å; F87-K89 PolarHBondContact O-N 2.82Å
90	C	58.9	Low	57.2	Low	1 Å²	1	73.8 Å²	73.8	1%	0.007	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	142.6	-174.3	-60.5	0	0	0	0	112.1	L79 V88 Y103	L79-C90 HydrophobicContact CB-CB 4.22Å; L79-C90 PolarHBondContact O-N 3.15Å; V88-C90 PolarHBondContact O-SG 2.76Å; C90-Y103 VanDerWaalsContact SG-CB 3.54Å
91	N	60.5	Low	57.6	Low	101 Å²	101	71.2 Å²	71.2	54%	0.54	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	128.2	170.2	-73.2	-9	0	0	0	109.6	D102	N91-D102 PolarHBondContact N-O 3.04Å; N91-D102 PolarHBondContact O-N 2.98Å
92	C	58.5	Low	58	Low	39 Å²	39	68.3 Å²	68.3	26%	0.264	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	139.3	-175.1	-56.8	0	0	0	0	112.3	M76 L99 M101	M76-C92 HydrophobicContact CE-CB 3.58Å; M76-C92 VanDerWaalsContact CE-SG 3.59Å; C92-L99 HydrophobicContact CB-CD1 4.41Å; C92-M101 HydrophobicContact CB-CG 4.46Å
93	T	55.8	Low	58.6	Low	64 Å²	64	67.2 Å²	67.2	39%	0.393	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	152.6	-178.7	55.2	0	0	0	0	110.8	L99 M100	T93-L99 WeakPolarHBondContact O-CD1 3.17Å; T93-M100 PolarHBondContact N-O 2.94Å; T93-M100 PolarHBondContact O-N 3.38Å; T93-M100 VanDerWaalsContact O-O 3.12Å; T93-M100 PolarHBondContact OG1-O 3.09Å
94	Y	52.9	Low	59.2	Low	136 Å²	136	64 Å²	64	53%	0.533	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	133.6	-174.5	-61	-101.5	0	0	0	109.8	E98 L99	Y94-E98 WeakPolarHBondContact CA-O 3.49Å; Y94-L99 HydrophobicContact CD1-CB 4.18Å; Y94-L99 HydrophobicContact CD1-CD1 3.92Å; Y94-L99 HydrophobicContact CD1-CG 4.47Å; Y94-L99 HydrophobicContact CD2-CD1 4.38Å; Y94-L99 HydrophobicContact CE1-CB 4.24Å; Y94-L99 HydrophobicContact CE1-CD1 3.65Å; Y94-L99 HydrophobicContact CE1-CD2 3.96Å; Y94-L99 HydrophobicContact CE1-CG 4.15Å; Y94-L99 HydrophobicContact CE2-CD1 4.11Å; Y94-L99 HydrophobicContact CG-CD1 4.28Å
95	D	49.8	Very low	59.6	Low	99 Å²	99	57.2 Å²	57.2	53%	0.529	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	135.9	169	-164.7	4.6	0	0	0	112.4	N97 E98	D95-N97 VanDerWaalsContact C-N 3.27Å; D95-N97 PolarHBondContact O-N 3.04Å; D95-E98 PolarHBondContact N-O 2.86Å; D95-E98 PolarHBondContact O-N 3.19Å
96	Q	48.2	Very low	59.9	Low	159 Å²	159	59.3 Å²	59.3	74%	0.743	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.8	-42.5	174.5	-82.6	163.4	78.2	0	0	121.8
97	N	54	Low	60.3	Low	87 Å²	87	58 Å²	58	47%	0.465	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.7	16	165.3	-90.9	-38.8	0	0	0	111.9	F9 D95	F9-N97 PolarHBondContact N-O 3.02Å; D95-N97 VanDerWaalsContact C-N 3.27Å; D95-N97 PolarHBondContact O-N 3.04Å
98	E	52.9	Low	60.9	Low	71 Å²	71	60.9 Å²	60.9	33%	0.332	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	134	-168.2	-53	-170.1	-168.6	0	0	111.7	V6 W7 K8 Y94 D95	V6-E98 HydrophobicContact CG1-CB 4.12Å; V6-E98 WeakPolarHBondContact CG1-OE2 3.45Å; W7-E98 VanDerWaalsContact O-CA 3.22Å; W7-E98 WeakPolarHBondContact O-CA 3.35Å; K8-E98 WeakPolarHBondContact CE-OE1 3.48Å; K8-E98 HydrophobicContact CG-CG 3.9Å; K8-E98 IonicContact NZ-OE1 3.48Å; K8-E98 PolarHBondContact NZ-OE1 2.93Å; Y94-E98 WeakPolarHBondContact CA-O 3.49Å; D95-E98 PolarHBondContact N-O 2.86Å; D95-E98 PolarHBondContact O-N 3.19Å
99	L	58.8	Low	61.8	Low	20 Å²	20	60.7 Å²	60.7	11%	0.105	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	119.2	167.2	167.4	51	0	0	0	108.5	V6 W7 C92 T93 Y94 M101	V6-L99 WeakPolarHBondContact CA-O 3.43Å; W7-L99 HydrophobicContact CE3-CB 4.34Å; W7-L99 HydrophobicContact CE3-CD2 3.72Å; W7-L99 HydrophobicContact CE3-CG 3.83Å; W7-L99 HydrophobicContact CZ3-CD2 3.9Å; W7-L99 HydrophobicContact CZ3-CG 4.26Å; W7-L99 PolarHBondContact N-O 2.99Å; W7-L99 PolarHBondContact O-N 2.87Å; W7-L99 VanDerWaalsContact O-N 3.09Å; C92-L99 HydrophobicContact CB-CD1 4.41Å; T93-L99 WeakPolarHBondContact O-CD1 3.17Å; Y94-L99 HydrophobicContact CD1-CB 4.18Å; Y94-L99 HydrophobicContact CD1-CD1 3.92Å; Y94-L99 HydrophobicContact CD1-CG 4.47Å; Y94-L99 HydrophobicContact CD2-CD1 4.38Å; Y94-L99 HydrophobicContact CE1-CB 4.24Å; Y94-L99 HydrophobicContact CE1-CD1 3.65Å; Y94-L99 HydrophobicContact CE1-CD2 3.96Å; Y94-L99 HydrophobicContact CE1-CG 4.15Å; Y94-L99 HydrophobicContact CE2-CD1 4.11Å; Y94-L99 HydrophobicContact CG-CD1 4.28Å; L99-M101 HydrophobicContact CD1-CG 4.43Å
100	M	62	Low	62.7	Low	41 Å²	41	55.5 Å²	55.5	20%	0.202	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	129.2	178.3	-59.4	-160.7	-68.4	0	0	111.6	R5 V6 T93	R5-M100 VanDerWaalsContact O-CA 3.31Å; R5-M100 WeakPolarHBondContact O-CA 3.19Å; V6-M100 HydrophobicContact CB-CG 4.4Å; V6-M100 HydrophobicContact CG1-CG 4.05Å; V6-M100 HydrophobicContact CG2-CG 3.87Å; V6-M100 HydrophobicContact CG2-SD 4.06Å; T93-M100 PolarHBondContact N-O 2.94Å; T93-M100 PolarHBondContact O-N 3.38Å; T93-M100 VanDerWaalsContact O-O 3.12Å; T93-M100 PolarHBondContact OG1-O 3.09Å
101	M	65.1	Low	63.9	Low	4 Å²	4	57 Å²	57	2%	0.02	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.1	175	-57.5	-167.3	-58.1	0	0	110.8	R4 R5 W7 C92 L99 P168	R4-M101 CarbonylContact C-O 3.59Å; R4-M101 VanDerWaalsContact CA-O 3.29Å; R4-M101 WeakPolarHBondContact CA-O 3.07Å; R5-M101 PolarHBondContact N-O 2.79Å; R5-M101 PolarHBondContact O-N 3.06Å; W7-M101 HydrophobicContact CE3-CE 4.49Å; W7-M101 HydrophobicContact CH2-CE 3.24Å; W7-M101 HydrophobicContact CH2-SD 3.97Å; W7-M101 HydrophobicContact CZ2-CE 3.99Å; W7-M101 HydrophobicContact CZ3-CE 3.54Å; W7-M101 HydrophobicContact CZ3-CG 4.36Å; W7-M101 HydrophobicContact CZ3-SD 3.75Å; C92-M101 HydrophobicContact CB-CG 4.46Å; L99-M101 HydrophobicContact CD1-CG 4.43Å; M101-P168 HydrophobicContact CE-CB 3.94Å; M101-P168 HydrophobicContact CE-CG 4.29Å
102	D	66.5	Low	64.8	Low	40 Å²	40	54.6 Å²	54.6	21%	0.214	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	128.3	175.5	-78.2	-18.6	0	0	0	110.4	R4 N91	R4-D102 VanDerWaalsContact CB-OD1 3.27Å; R4-D102 WeakPolarHBondContact CB-OD1 3.26Å; R4-D102 VanDerWaalsContact CG-OD1 3.32Å; R4-D102 WeakPolarHBondContact CG-OD1 3.37Å; R4-D102 IonicContact CZ-OD1 3.6Å; R4-D102 IonicContact CZ-OD2 2.83Å; R4-D102 IonicContact NE-OD1 3.62Å; R4-D102 PolarHBondContact NE-OD1 3.31Å; R4-D102 IonicContact NE-OD2 3.34Å; R4-D102 IonicContact NH2-OD1 2.71Å; R4-D102 PolarHBondContact NH2-OD1 3.43Å; R4-D102 IonicContact NH2-OD2 2.74Å; R4-D102 PolarHBondContact NH2-OD2 2.89Å; N91-D102 PolarHBondContact N-O 3.04Å; N91-D102 PolarHBondContact O-N 2.98Å
103	Y	69.2	Low	65.9	Low	11 Å²	11	53.5 Å²	53.5	4%	0.043	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144.5	179.6	60.3	-87.9	0	0	0	113.3	K2 K3 V88 C90 V105 F157 P168	K2-Y103 WeakPolarHBondContact CA-O 3.39Å; K3-Y103 HydrophobicContact CB-CD2 4.4Å; K3-Y103 HydrophobicContact CB-CE1 3.97Å; K3-Y103 HydrophobicContact CB-CE2 3.77Å; K3-Y103 HydrophobicContact CD-CE2 4.29Å; K3-Y103 PolarHBondContact N-O 3.13Å; K3-Y103 WeakPolarHBondContact O-CD1 3.26Å; K3-Y103 PolarHBondContact O-N 3.16Å; V88-Y103 HydrophobicContact CG1-CD2 4.02Å; C90-Y103 VanDerWaalsContact SG-CB 3.54Å; Y103-V105 HydrophobicContact CD2-CG2 4.05Å; Y103-V105 HydrophobicContact CE2-CG2 3.81Å; Y103-F157 HydrophobicContact CE2-CZ 4.31Å; Y103-P168 HydrophobicContact CD1-CG 4.3Å; Y103-P168 HydrophobicContact CE1-CG 4.05Å
104	D	64.6	Low	67	Low	82 Å²	82	51.7 Å²	51.7	44%	0.439	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	102.4	179.9	-85.5	-57.3	0	0	0	110.3	K2 V88 V106	K2-D104 WeakPolarHBondContact CE-OD1 3.35Å; K2-D104 WeakPolarHBondContact CE-OD2 3.46Å; K2-D104 WeakPolarHBondContact CG-OD1 3.32Å; K2-D104 IonicContact NZ-OD2 3.39Å; K2-D104 PolarHBondContact NZ-OD2 2.97Å; V88-D104 VanDerWaalsContact CG1-O 3.28Å; V88-D104 WeakPolarHBondContact CG1-O 3.2Å; D104-V106 PolarHBondContact O-N 3.38Å; D104-V106 VanDerWaalsContact O-N 3.16Å
105	V	60.9	Low	68.3	Low	25 Å²	25	49.6 Å²	49.6	15%	0.152	26%	0.264	C	S	.	.			trans	-63.4	114.9	176.9	178.3	0	0	0	0	110.3	M1 K3 Y103 F157	M1-V105 PolarHBondContact N-O 2.9Å; M1-V105 WeakPolarHBondContact O-CB 3.38Å; M1-V105 WeakPolarHBondContact O-CG2 3.24Å; M1-V105 PolarHBondContact O-N 2.92Å; K3-V105 HydrophobicContact CB-CG2 4.36Å; K3-V105 HydrophobicContact CD-CG2 4Å; K3-V105 HydrophobicContact CG-CG2 3.99Å; Y103-V105 HydrophobicContact CD2-CG2 4.05Å; Y103-V105 HydrophobicContact CE2-CG2 3.81Å; V105-F157 HydrophobicContact CG1-CD1 3.54Å; V105-F157 HydrophobicContact CG1-CE1 3.64Å; V105-F157 HydrophobicContact CG1-CG 4.17Å; V105-F157 HydrophobicContact CG1-CZ 4.34Å; V105-F157 HydrophobicContact CG2-CE1 4.19Å; V105-F157 HydrophobicContact CG2-CZ 4.24Å
106	V	64.4	Low	69.6	Low	73 Å²	73	52.2 Å²	52.2	44%	0.442	27%	0.268	S	S	.	.			trans	-94.5	122.6	170.2	179.1	0	0	0	0	108.3	D104 F157 F165	D104-V106 PolarHBondContact O-N 3.38Å; D104-V106 VanDerWaalsContact O-N 3.16Å; V106-F157 VanDerWaalsContact O-CB 3.25Å; V106-F157 WeakPolarHBondContact O-CB 3.41Å; V106-F165 HydrophobicContact CG1-CD2 4.29Å; V106-F165 HydrophobicContact CG1-CE2 4.13Å; V106-F165 HydrophobicContact CG1-CZ 4.5Å
107	G	71.8	Confident	71.1	Confident	38 Å²	38	47.2 Å²	47.2	39%	0.392	25%	0.251	S	S	.	.	S	Bend	trans	81.7	-161.1	-177.2	0	0	0	0	0	114.6	V158	G107-V158 CarbonylContact C-O 3.36Å; G107-V158 WeakPolarHBondContact CA-O 3.33Å
108	V	78.1	Confident	72.1	Confident	72 Å²	72	45.8 Å²	45.8	44%	0.436	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	144.4	-178.2	-178.5	0	0	0	0	108.9	D112 V113 F157 V158	V108-D112 HydrophobicContact CG1-CB 3.59Å; V108-V113 HydrophobicContact CB-CG2 4.27Å; V108-V113 HydrophobicContact CG1-CG2 3.95Å; V108-F157 CarbonylContact O-C 3.6Å; V108-F157 WeakPolarHBondContact O-CA 3.45Å; V108-V158 PolarHBondContact N-O 3.35Å; V108-V158 PolarHBondContact O-N 3.37Å
109	S	81.8	Confident	73	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.007	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	150.9	179.4	78	0	0	0	0	111.8	Y111 D112 V113 I156	S109-Y111 PolarHBondContact O-N 3Å; S109-D112 PolarHBondContact O-N 2.84Å; S109-D112 VanDerWaalsContact O-N 3.1Å; S109-D112 WeakPolarHBondContact OG-CB 3.3Å; S109-D112 PolarHBondContact OG-N 3.2Å; S109-D112 PolarHBondContact OG-OD2 2.78Å; S109-V113 WeakPolarHBondContact O-CG2 3.18Å; S109-V113 PolarHBondContact O-N 3.12Å; S109-I156 WeakPolarHBondContact CA-O 3.22Å
110	L	82.6	Confident	73.7	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-32.9	175.1	-79.1	176.8	0	0	0	112.2	V113 I114 L153 I156 V158 L650 L654	L110-V113 PolarHBondContact O-N 2.88Å; L110-I114 WeakPolarHBondContact O-CG1 3.31Å; L110-I114 PolarHBondContact O-N 2.85Å; L110-L153 HydrophobicContact CB-CD2 4.04Å; L110-L153 PolarHBondContact N-O 2.84Å; L110-I156 HydrophobicContact CD1-CB 3.98Å; L110-I156 HydrophobicContact CD1-CD1 4.34Å; L110-I156 HydrophobicContact CD1-CG2 3.74Å; L110-I156 HydrophobicContact CG-CB 4.43Å; L110-I156 HydrophobicContact CG-CG2 4.29Å; L110-I156 PolarHBondContact N-O 3.41Å; L110-V158 HydrophobicContact CD2-CG2 3.59Å; L110-V158 HydrophobicContact CG-CG2 3.93Å; L110-L650 HydrophobicContact CD1-CD1 4.4Å; L110-L654 HydrophobicContact CD1-CD1 4.45Å; L110-L654 HydrophobicContact CD1-CD2 4.31Å; L110-L654 HydrophobicContact CD2-CD2 4.14Å
111	Y	82.8	Confident	74.3	Confident	34 Å²	34	48.3 Å²	48.3	13%	0.133	26%	0.263	C	S	.	.	H	α-helix	trans	-59.1	-49.5	171.3	178.1	-90.7	0	0	0	111.9	S109 V113 I114 K115 L153 D154 V663	S109-Y111 PolarHBondContact O-N 3Å; Y111-V113 VanDerWaalsContact C-N 3.33Å; Y111-V113 PolarHBondContact O-N 3.07Å; Y111-I114 PolarHBondContact O-N 2.76Å; Y111-K115 HydrophobicContact CD1-CD 4.28Å; Y111-K115 HydrophobicContact CE1-CD 3.51Å; Y111-K115 WeakPolarHBondContact O-CB 3.22Å; Y111-K115 PolarHBondContact O-N 2.7Å; Y111-K115 PolarHBondContact OH-NZ 3.28Å; Y111-L153 PolarHBondContact N-O 2.81Å; Y111-D154 VanDerWaalsContact CB-OD1 3.3Å; Y111-D154 WeakPolarHBondContact CB-OD1 3.46Å; Y111-V663 HydrophobicContact CE2-CG2 4.44Å
112	D	80.7	Confident	74.7	Confident	50 Å²	50	54.8 Å²	54.8	27%	0.267	29%	0.293	S	S	.	.	H	α-helix	trans	-66.1	-35	178.2	-65.3	-52.9	0	0	0	111.8	V108 S109 K115 Y116	V108-D112 HydrophobicContact CG1-CB 3.59Å; S109-D112 PolarHBondContact O-N 2.84Å; S109-D112 VanDerWaalsContact O-N 3.1Å; S109-D112 WeakPolarHBondContact OG-CB 3.3Å; S109-D112 PolarHBondContact OG-N 3.2Å; S109-D112 PolarHBondContact OG-OD2 2.78Å; D112-K115 PolarHBondContact O-N 3.03Å; D112-Y116 HydrophobicContact CB-CD2 4.06Å; D112-Y116 HydrophobicContact CB-CE2 4.33Å; D112-Y116 WeakPolarHBondContact O-CB 3.48Å; D112-Y116 WeakPolarHBondContact O-CD2 3.31Å; D112-Y116 PolarHBondContact O-N 2.88Å; D112-Y116 WeakPolarHBondContact OD1-CE2 3.49Å
113	V	81.2	Confident	75	Confident	16 Å²	16	57 Å²	57	10%	0.097	31%	0.305	C	S	.	.	H	α-helix	trans	-63.8	-47.9	174.3	173	0	0	0	0	111.1	V108 S109 L110 Y111 K115 S117 L121	V108-V113 HydrophobicContact CB-CG2 4.27Å; V108-V113 HydrophobicContact CG1-CG2 3.95Å; S109-V113 WeakPolarHBondContact O-CG2 3.18Å; S109-V113 PolarHBondContact O-N 3.12Å; L110-V113 PolarHBondContact O-N 2.88Å; Y111-V113 VanDerWaalsContact C-N 3.33Å; Y111-V113 PolarHBondContact O-N 3.07Å; V113-K115 VanDerWaalsContact C-N 3.35Å; V113-K115 PolarHBondContact O-N 3.06Å; V113-S117 CarbonylContact O-C 3.56Å; V113-S117 VanDerWaalsContact O-CA 3.23Å; V113-S117 WeakPolarHBondContact O-CA 3.34Å; V113-S117 PolarHBondContact O-N 2.88Å; V113-L121 HydrophobicContact CG1-CD1 4.11Å; V113-L121 HydrophobicContact CG1-CG 4.15Å
114	I	79.8	Confident	75.1	Confident	25 Å²	25	61.8 Å²	61.8	13%	0.128	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-43	176.7	-70.3	166.7	0	0	0	110.7	L110 Y111 P118 L121 L153 L654 F657	L110-I114 WeakPolarHBondContact O-CG1 3.31Å; L110-I114 PolarHBondContact O-N 2.85Å; Y111-I114 PolarHBondContact O-N 2.76Å; I114-P118 WeakPolarHBondContact O-CD 3.3Å; I114-L121 HydrophobicContact CG1-CD1 3.74Å; I114-L153 HydrophobicContact CD1-CD1 4Å; I114-L153 HydrophobicContact CD1-CD2 3.89Å; I114-L654 HydrophobicContact CD1-CD2 4.36Å; I114-F657 HydrophobicContact CD1-CB 4.3Å; I114-F657 HydrophobicContact CG1-CB 4.16Å; I114-F657 HydrophobicContact CG2-CB 4.09Å
115	K	78.7	Confident	75.2	Confident	92 Å²	92	62.5 Å²	62.5	40%	0.4	33%	0.332	S	S	.	.	H	α-helix	trans	-74.7	-35.9	-173.4	-171.7	171.5	-174	170.9	0	114.6	Y111 D112 V113	Y111-K115 HydrophobicContact CD1-CD 4.28Å; Y111-K115 HydrophobicContact CE1-CD 3.51Å; Y111-K115 WeakPolarHBondContact O-CB 3.22Å; Y111-K115 PolarHBondContact O-N 2.7Å; Y111-K115 PolarHBondContact OH-NZ 3.28Å; D112-K115 PolarHBondContact O-N 3.03Å; V113-K115 VanDerWaalsContact C-N 3.35Å; V113-K115 PolarHBondContact O-N 3.06Å
116	Y	78.7	Confident	75.8	Confident	154 Å²	154	62.5 Å²	62.5	60%	0.604	33%	0.331	S	S	*	.	H	α-helix	trans	-120.5	-11.1	-173.6	-53.4	-66.9	0	0	0	114.4	D112	D112-Y116 HydrophobicContact CB-CD2 4.06Å; D112-Y116 HydrophobicContact CB-CE2 4.33Å; D112-Y116 WeakPolarHBondContact O-CB 3.48Å; D112-Y116 WeakPolarHBondContact O-CD2 3.31Å; D112-Y116 PolarHBondContact O-N 2.88Å; D112-Y116 WeakPolarHBondContact OD1-CE2 3.49Å
117	S	77.8	Confident	76.6	Confident	55 Å²	55	59.3 Å²	59.3	39%	0.385	31%	0.312	S	S	.	.			trans	-146.7	44.7	-177.4	-67.3	0	0	0	0	114.4	V113 G119 R120	V113-S117 CarbonylContact O-C 3.56Å; V113-S117 VanDerWaalsContact O-CA 3.23Å; V113-S117 WeakPolarHBondContact O-CA 3.34Å; V113-S117 PolarHBondContact O-N 2.88Å; S117-G119 PolarHBondContact O-N 3.41Å; S117-R120 PolarHBondContact O-N 2.9Å
118	P	75	Confident	76.7	Confident	56 Å²	56	58 Å²	58	36%	0.364	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-56.8	-26.8	-174.3	21.7	-32.9	0	0	0	113.7	I114 R120 L121 F657	I114-P118 WeakPolarHBondContact O-CD 3.3Å; P118-R120 PolarHBondContact O-N 2.88Å; P118-R120 VanDerWaalsContact O-N 3.08Å; P118-L121 PolarHBondContact O-N 2.67Å; P118-F657 HydrophobicContact CB-CD2 3.91Å; P118-F657 HydrophobicContact CB-CE2 3.66Å; P118-F657 VanDerWaalsContact O-CE2 3.25Å; P118-F657 WeakPolarHBondContact O-CE2 3.45Å
119	G	73.5	Confident	76.6	Confident	45 Å²	45	58 Å²	58	46%	0.464	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-54.1	-26.6	174.9	0	0	0	0	0	114.9	S117 L121 Q122	S117-G119 PolarHBondContact O-N 3.41Å; G119-L121 VanDerWaalsContact C-N 3.25Å; G119-L121 PolarHBondContact O-N 3.27Å; G119-Q122 PolarHBondContact O-N 3.08Å
120	R	73.5	Confident	76.5	Confident	138 Å²	138	58.1 Å²	58.1	52%	0.521	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-70.2	-16.6	177.2	-74.9	-173.4	170.5	-175	-3.8	114.2	S117 P118	S117-R120 PolarHBondContact O-N 2.9Å; P118-R120 PolarHBondContact O-N 2.88Å; P118-R120 VanDerWaalsContact O-N 3.08Å
121	L	73.2	Confident	76.4	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.016	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-103.5	0.8	-179.6	-63.9	174.9	0	0	0	113.5	V113 I114 P118 G119 N123 L130 L654 F657	V113-L121 HydrophobicContact CG1-CD1 4.11Å; V113-L121 HydrophobicContact CG1-CG 4.15Å; I114-L121 HydrophobicContact CG1-CD1 3.74Å; P118-L121 PolarHBondContact O-N 2.67Å; G119-L121 VanDerWaalsContact C-N 3.25Å; G119-L121 PolarHBondContact O-N 3.27Å; L121-N123 VanDerWaalsContact C-N 3.31Å; L121-N123 PolarHBondContact O-N 3.03Å; L121-L130 HydrophobicContact CD2-CD1 3.67Å; L121-L654 HydrophobicContact CD1-CD2 4.02Å; L121-F657 HydrophobicContact CB-CD2 4.49Å; L121-F657 HydrophobicContact CB-CE1 4.05Å; L121-F657 HydrophobicContact CB-CE2 3.97Å; L121-F657 HydrophobicContact CB-CZ 3.7Å
122	Q	73.4	Confident	76.1	Confident	140 Å²	140	58.4 Å²	58.4	65%	0.654	29%	0.293	S	S	*	.			trans	-66.7	-30.1	179.4	-70.9	-178.9	-13.9	0	0	113.4	G119 H124 F657	G119-Q122 PolarHBondContact O-N 3.08Å; Q122-H124 PolarHBondContact O-N 3.05Å; Q122-H124 PolarHBondContact O-ND1 3.26Å; Q122-H124 VanDerWaalsContact O-ND1 3.11Å; Q122-F657 HydrophobicContact CG-CZ 4.47Å
123	N	74.5	Confident	76	Confident	86 Å²	86	57.1 Å²	57.1	46%	0.46	29%	0.285	S	S	.	.	S	Bend	trans	-75.6	112.7	174.6	-175.7	-0.1	0	0	0	109.7	L121 N125 T126 L127	L121-N123 VanDerWaalsContact C-N 3.31Å; L121-N123 PolarHBondContact O-N 3.03Å; N123-N125 PolarHBondContact O-N 3.1Å; N123-N125 PolarHBondContact OD1-N 2.76Å; N123-T126 PolarHBondContact ND2-OG1 2.92Å; N123-T126 WeakPolarHBondContact O-CB 3.16Å; N123-T126 PolarHBondContact O-N 2.93Å; N123-L127 PolarHBondContact O-N 3.43Å
124	H	69.5	Low	75.9	Confident	112 Å²	112	56.4 Å²	56.4	52%	0.519	28%	0.281	S	S	.	.	H	α-helix	trans	-60.2	-33.9	-176.8	-65.3	31.8	0	0	0	111.5	Q122 T126 L127 L128	Q122-H124 PolarHBondContact O-N 3.05Å; Q122-H124 PolarHBondContact O-ND1 3.26Å; Q122-H124 VanDerWaalsContact O-ND1 3.11Å; H124-T126 VanDerWaalsContact C-N 3.26Å; H124-T126 PolarHBondContact O-N 3.11Å; H124-L127 PolarHBondContact O-N 3.44Å; H124-L128 WeakPolarHBondContact O-CB 3.48Å; H124-L128 WeakPolarHBondContact O-CD1 3.36Å; H124-L128 WeakPolarHBondContact O-CG 3.5Å; H124-L128 PolarHBondContact O-N 3.36Å
125	N	67.6	Low	75.9	Confident	97 Å²	97	55.3 Å²	55.3	52%	0.519	28%	0.275	S	S	.	.	H	α-helix	trans	-63	-32.5	175.6	-63.6	-1.1	0	0	0	112.3	N123 F129	N123-N125 PolarHBondContact O-N 3.1Å; N123-N125 PolarHBondContact OD1-N 2.76Å; N125-F129 WeakPolarHBondContact O-CB 3.39Å; N125-F129 PolarHBondContact O-N 2.89Å
126	T	74.3	Confident	75.8	Confident	24 Å²	24	54.9 Å²	54.9	15%	0.147	27%	0.274	C	S	.	.	H	α-helix	trans	-75.2	-41.4	177.6	-56.1	0	0	0	0	111.3	N123 H124 F129 L130 F162	N123-T126 PolarHBondContact ND2-OG1 2.92Å; N123-T126 WeakPolarHBondContact O-CB 3.16Å; N123-T126 PolarHBondContact O-N 2.93Å; H124-T126 VanDerWaalsContact C-N 3.26Å; H124-T126 PolarHBondContact O-N 3.11Å; T126-F129 PolarHBondContact O-N 3.03Å; T126-L130 HydrophobicContact CG2-CD1 4.43Å; T126-L130 VanDerWaalsContact O-CG 3.32Å; T126-L130 WeakPolarHBondContact O-CG 3.29Å; T126-L130 PolarHBondContact O-N 3.42Å; T126-L130 VanDerWaalsContact O-N 3.07Å; T126-F162 HydrophobicContact CG2-CD1 3.58Å; T126-F162 HydrophobicContact CG2-CE1 3.46Å; T126-F162 VanDerWaalsContact CG2-CE1 3.46Å; T126-F162 HydrophobicContact CG2-CE2 4.45Å; T126-F162 HydrophobicContact CG2-CG 4.14Å; T126-F162 HydrophobicContact CG2-CZ 3.93Å
127	L	79.3	Confident	75.7	Confident	6 Å²	6	48 Å²	48	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-57.7	-52.4	171.5	178.7	163.5	0	0	0	110.7	N123 H124 F129 L130 T131 L654 P689 L692	N123-L127 PolarHBondContact O-N 3.43Å; H124-L127 PolarHBondContact O-N 3.44Å; L127-F129 VanDerWaalsContact C-N 3.31Å; L127-F129 PolarHBondContact O-N 3.44Å; L127-L130 WeakPolarHBondContact O-CB 3.33Å; L127-L130 PolarHBondContact O-N 3.46Å; L127-T131 HydrophobicContact CD2-CG2 4.3Å; L127-T131 PolarHBondContact O-N 3.47Å; L127-T131 PolarHBondContact O-OG1 3.39Å; L127-L654 HydrophobicContact CD1-CB 4.42Å; L127-L654 WeakPolarHBondContact CD1-O 3.5Å; L127-L654 HydrophobicContact CG-CB 4.3Å; L127-P689 HydrophobicContact CD2-CG 4.34Å; L127-L692 HydrophobicContact CD2-CD1 4.22Å
128	L	74.2	Confident	75.8	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.052	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-38.6	-178.7	-70.4	167	0	0	0	112.1	H124 T131 F132 P689 L692 F730	H124-L128 WeakPolarHBondContact O-CB 3.48Å; H124-L128 WeakPolarHBondContact O-CD1 3.36Å; H124-L128 WeakPolarHBondContact O-CG 3.5Å; H124-L128 PolarHBondContact O-N 3.36Å; L128-T131 WeakPolarHBondContact CA-OG1 3.49Å; L128-T131 PolarHBondContact O-N 3.02Å; L128-T131 PolarHBondContact O-OG1 3.05Å; L128-F132 WeakPolarHBondContact O-CB 3.43Å; L128-F132 PolarHBondContact O-N 3.18Å; L128-P689 HydrophobicContact CD2-CB 4.17Å; L128-P689 HydrophobicContact CD2-CG 4.32Å; L128-L692 HydrophobicContact CD2-CD1 3.68Å; L128-L692 HydrophobicContact CD2-CD2 3.7Å; L128-L692 HydrophobicContact CD2-CG 3.75Å; L128-F730 VanDerWaalsContact C-CZ 3.45Å; L128-F730 HydrophobicContact CB-CE1 4.05Å; L128-F730 HydrophobicContact CB-CE2 3.68Å; L128-F730 HydrophobicContact CB-CZ 3.39Å
129	F	76.3	Confident	76	Confident	73 Å²	73	42.8 Å²	42.8	32%	0.32	21%	0.214	S	C	.	.	H	α-helix	trans	-67.6	-36.9	177.2	179.3	-116.6	0	0	0	112.6	N125 T126 L127 Q133 F162	N125-F129 WeakPolarHBondContact O-CB 3.39Å; N125-F129 PolarHBondContact O-N 2.89Å; T126-F129 PolarHBondContact O-N 3.03Å; L127-F129 VanDerWaalsContact C-N 3.31Å; L127-F129 PolarHBondContact O-N 3.44Å; F129-Q133 VanDerWaalsContact CZ-NE2 3.26Å; F129-Q133 PolarHBondContact O-N 3.11Å; F129-F162 HydrophobicContact CD1-CB 4.29Å; F129-F162 HydrophobicContact CE1-CB 4.23Å
130	L	80.6	Confident	75.9	Confident	3 Å²	3	44 Å²	44	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-67	-45.1	172.6	-71.4	169.2	0	0	0	111.1	L121 T126 L127 F132 Q133 A134 V158 F162 I164	L121-L130 HydrophobicContact CD2-CD1 3.67Å; T126-L130 HydrophobicContact CG2-CD1 4.43Å; T126-L130 VanDerWaalsContact O-CG 3.32Å; T126-L130 WeakPolarHBondContact O-CG 3.29Å; T126-L130 PolarHBondContact O-N 3.42Å; T126-L130 VanDerWaalsContact O-N 3.07Å; L127-L130 WeakPolarHBondContact O-CB 3.33Å; L127-L130 PolarHBondContact O-N 3.46Å; L130-F132 VanDerWaalsContact C-N 3.35Å; L130-F132 PolarHBondContact O-N 3.39Å; L130-Q133 PolarHBondContact O-N 3.41Å; L130-A134 PolarHBondContact O-N 2.83Å; L130-V158 HydrophobicContact CD2-CG1 3.81Å; L130-V158 HydrophobicContact CD2-CG2 4.13Å; L130-F162 HydrophobicContact CD1-CD1 4.38Å; L130-F162 HydrophobicContact CD2-CB 4.17Å; L130-F162 HydrophobicContact CD2-CD1 4.49Å; L130-I164 HydrophobicContact CB-CD1 4.03Å; L130-I164 HydrophobicContact CD2-CD1 3.81Å; L130-I164 HydrophobicContact CD2-CG1 3.69Å; L130-I164 WeakPolarHBondContact O-CD1 3.47Å
131	T	79.3	Confident	76	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.012	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-42.5	177.1	48.1	0	0	0	0	111.8	L127 L128 Q133 A134 I135 I651 L654	L127-T131 HydrophobicContact CD2-CG2 4.3Å; L127-T131 PolarHBondContact O-N 3.47Å; L127-T131 PolarHBondContact O-OG1 3.39Å; L128-T131 WeakPolarHBondContact CA-OG1 3.49Å; L128-T131 PolarHBondContact O-N 3.02Å; L128-T131 PolarHBondContact O-OG1 3.05Å; T131-Q133 PolarHBondContact O-N 2.89Å; T131-A134 PolarHBondContact O-N 3.31Å; T131-I135 WeakPolarHBondContact O-CD1 3.41Å; T131-I135 WeakPolarHBondContact O-CG1 3.33Å; T131-I135 PolarHBondContact O-N 3.43Å; T131-I651 HydrophobicContact CG2-CG1 3.79Å; T131-L654 HydrophobicContact CG2-CD1 3.85Å
132	F	76.6	Confident	76.2	Confident	40 Å²	40	38.6 Å²	38.6	18%	0.175	19%	0.189	C	C	.	.	H	α-helix	trans	-56.5	-47.6	175.4	178.6	-95.3	0	0	0	112.8	L128 L130 A134 I135 H136 L724 F730 F735	L128-F132 WeakPolarHBondContact O-CB 3.43Å; L128-F132 PolarHBondContact O-N 3.18Å; L130-F132 VanDerWaalsContact C-N 3.35Å; L130-F132 PolarHBondContact O-N 3.39Å; F132-A134 PolarHBondContact O-N 3.31Å; F132-I135 PolarHBondContact O-N 3.34Å; F132-H136 WeakPolarHBondContact O-CB 3.45Å; F132-H136 PolarHBondContact O-N 3.04Å; F132-L724 HydrophobicContact CD2-CD1 3.75Å; F132-L724 HydrophobicContact CE2-CD1 3.82Å; F132-F730 HydrophobicContact CB-CE2 4.44Å; F132-F735 AromaticContact CE2-CD2 3.67Å; F132-F735 HydrophobicContact CE2-CD2 3.67Å; F132-F735 AromaticContact CE2-CE2 3.8Å; F132-F735 HydrophobicContact CE2-CE2 3.8Å; F132-F735 AromaticContact CZ-CD2 3.82Å; F132-F735 HydrophobicContact CZ-CD2 3.82Å; F132-F735 AromaticContact CZ-CE2 3.88Å; F132-F735 HydrophobicContact CZ-CE2 3.88Å
133	Q	78.4	Confident	76	Confident	23 Å²	23	37.3 Å²	37.3	11%	0.107	18%	0.181	C	C	.	.	H	α-helix	trans	-64.8	-39	177.5	-77.8	-175.4	58.5	0	0	113.2	F129 L130 T131 I135 H136 A137 F162 N163 I164	F129-Q133 VanDerWaalsContact CZ-NE2 3.26Å; F129-Q133 PolarHBondContact O-N 3.11Å; L130-Q133 PolarHBondContact O-N 3.41Å; T131-Q133 PolarHBondContact O-N 2.89Å; Q133-I135 VanDerWaalsContact C-N 3.35Å; Q133-H136 PolarHBondContact O-N 2.91Å; Q133-A137 WeakPolarHBondContact O-CB 3.17Å; Q133-A137 PolarHBondContact O-N 3.16Å; Q133-F162 PolarHBondContact NE2-O 2.88Å; Q133-N163 VanDerWaalsContact OE1-CA 3.31Å; Q133-I164 HydrophobicContact CB-CB 4.21Å; Q133-I164 HydrophobicContact CB-CD1 4.07Å; Q133-I164 HydrophobicContact CB-CG1 4.16Å
134	A	80.2	Confident	75.7	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-63.6	-41.6	179.1	0	0	0	0	0	111.6	L130 T131 F132 I138 M151 I164 L647 L650	L130-A134 PolarHBondContact O-N 2.83Å; T131-A134 PolarHBondContact O-N 3.31Å; F132-A134 PolarHBondContact O-N 3.31Å; A134-I138 PolarHBondContact O-N 3.29Å; A134-M151 HydrophobicContact CB-CE 4.02Å; A134-I164 HydrophobicContact CB-CD1 3.98Å; A134-L647 HydrophobicContact CB-CD2 4.38Å; A134-L650 HydrophobicContact CB-CD2 4.19Å
135	I	79.2	Confident	75.5	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-64.9	-53.6	175	-58	151.8	0	0	0	109.5	T131 F132 Q133 A137 I138 T139 L647 V720 F723 L724 I727	T131-I135 WeakPolarHBondContact O-CD1 3.41Å; T131-I135 WeakPolarHBondContact O-CG1 3.33Å; T131-I135 PolarHBondContact O-N 3.43Å; F132-I135 PolarHBondContact O-N 3.34Å; Q133-I135 VanDerWaalsContact C-N 3.35Å; I135-A137 VanDerWaalsContact C-N 3.28Å; I135-A137 PolarHBondContact O-N 2.93Å; I135-I138 CarbonylContact O-C 3.47Å; I135-I138 WeakPolarHBondContact O-CA 3.17Å; I135-I138 PolarHBondContact O-N 3.47Å; I135-T139 PolarHBondContact O-N 3.36Å; I135-T139 PolarHBondContact O-OG1 3.38Å; I135-L647 HydrophobicContact CG1-CD1 4.39Å; I135-L647 HydrophobicContact CG1-CD2 3.93Å; I135-V720 HydrophobicContact CG2-CG1 3.72Å; I135-F723 HydrophobicContact CD1-CE1 4.46Å; I135-F723 HydrophobicContact CG1-CD1 4.36Å; I135-F723 HydrophobicContact CG1-CE1 4.31Å; I135-F723 HydrophobicContact CG2-CD1 4.45Å; I135-L724 HydrophobicContact CB-CD1 4.01Å; I135-L724 HydrophobicContact CD1-CD1 4.22Å; I135-L724 HydrophobicContact CG2-CB 3.83Å; I135-L724 HydrophobicContact CG2-CD1 3.69Å; I135-L724 HydrophobicContact CG2-CG 4.31Å; I135-I727 HydrophobicContact CD1-CB 4.35Å; I135-I727 HydrophobicContact CD1-CD1 3.4Å; I135-I727 HydrophobicContact CD1-CG1 4.4Å; I135-I727 HydrophobicContact CD1-CG2 3.92Å; I135-I727 HydrophobicContact CG1-CD1 4.44Å
136	H	77.4	Confident	75.6	Confident	83 Å²	83	31 Å²	31	38%	0.384	15%	0.15	S	C	.	.	H	α-helix	trans	-56.2	-39.9	-179.3	179	-103.6	0	0	0	112.7	F132 Q133 I138 T139 Q140	F132-H136 WeakPolarHBondContact O-CB 3.45Å; F132-H136 PolarHBondContact O-N 3.04Å; Q133-H136 PolarHBondContact O-N 2.91Å; H136-I138 VanDerWaalsContact C-N 3.32Å; H136-I138 PolarHBondContact O-N 3.07Å; H136-T139 WeakPolarHBondContact O-CB 3.47Å; H136-T139 PolarHBondContact O-N 2.89Å; H136-Q140 PolarHBondContact NE2-NE2 2.83Å; H136-Q140 WeakPolarHBondContact O-CG 3.4Å; H136-Q140 PolarHBondContact O-N 3.4Å
137	A	76.6	Confident	75.4	Confident	9 Å²	9	30.4 Å²	30.4	7%	0.074	15%	0.147	C	C	.	.	H	α-helix	trans	-62.3	-36.7	176.1	0	0	0	0	0	112.7	Q133 I135 L141 L166	Q133-A137 WeakPolarHBondContact O-CB 3.17Å; Q133-A137 PolarHBondContact O-N 3.16Å; I135-A137 VanDerWaalsContact C-N 3.28Å; I135-A137 PolarHBondContact O-N 2.93Å; A137-L141 PolarHBondContact O-N 3.45Å; A137-L166 HydrophobicContact CB-CD1 3.8Å; A137-L166 HydrophobicContact CB-CG 4.33Å
138	I	79.5	Confident	75.2	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-75.7	-36.2	172.4	-68.5	-161.8	0	0	0	111.7	A134 I135 H136 Q140 L141 H142 M151 L166 D643 L647 V720	A134-I138 PolarHBondContact O-N 3.29Å; I135-I138 CarbonylContact O-C 3.47Å; I135-I138 WeakPolarHBondContact O-CA 3.17Å; I135-I138 PolarHBondContact O-N 3.47Å; H136-I138 VanDerWaalsContact C-N 3.32Å; H136-I138 PolarHBondContact O-N 3.07Å; I138-Q140 PolarHBondContact O-N 2.77Å; I138-L141 HydrophobicContact CG1-CD1 4.48Å; I138-L141 WeakPolarHBondContact O-CB 3.29Å; I138-L141 PolarHBondContact O-N 3.03Å; I138-H142 VanDerWaalsContact CG2-CD2 3.49Å; I138-H142 WeakPolarHBondContact CG2-CD2 3.32Å; I138-H142 WeakPolarHBondContact CG2-NE2 3.47Å; I138-H142 PolarHBondContact O-CD2 3.44Å; I138-H142 PolarHBondContact O-N 3.31Å; I138-M151 HydrophobicContact CD1-CE 3.43Å; I138-M151 VanDerWaalsContact CD1-CE 3.43Å; I138-M151 HydrophobicContact CD1-CG 3.88Å; I138-M151 HydrophobicContact CD1-SD 3.47Å; I138-M151 WeakPolarHBondContact CD1-SD 3.41Å; I138-M151 HydrophobicContact CG1-CE 3.85Å; I138-L166 HydrophobicContact CG1-CD1 4.16Å; I138-D643 HydrophobicContact CD1-CB 4.17Å; I138-D643 HydrophobicContact CG2-CB 4.23Å; I138-L647 HydrophobicContact CD1-CD1 4.37Å; I138-L647 HydrophobicContact CD1-CG 4.34Å; I138-V720 HydrophobicContact CB-CG1 4.34Å; I138-V720 HydrophobicContact CG2-CB 4.47Å; I138-V720 HydrophobicContact CG2-CG1 4.04Å; I138-V720 HydrophobicContact CG2-CG2 3.91Å
139	T	78.1	Confident	75	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.018	15%	0.147	C	C	.	.	H	α-helix	trans	-54.2	-41.5	173.2	-44.9	0	0	0	0	111.3	I135 H136 K143 D721	I135-T139 PolarHBondContact O-N 3.36Å; I135-T139 PolarHBondContact O-OG1 3.38Å; H136-T139 WeakPolarHBondContact O-CB 3.47Å; H136-T139 PolarHBondContact O-N 2.89Å; T139-K143 HydrophobicContact CG2-CD 4.13Å; T139-K143 VanDerWaalsContact CG2-NZ 3.29Å; T139-K143 WeakPolarHBondContact O-CB 3.43Å; T139-K143 WeakPolarHBondContact O-CD 3.32Å; T139-K143 VanDerWaalsContact O-CG 3.27Å; T139-K143 WeakPolarHBondContact O-CG 3.37Å; T139-K143 PolarHBondContact O-N 3.4Å; T139-D721 VanDerWaalsContact CG2-OD1 3.26Å; T139-D721 WeakPolarHBondContact CG2-OD1 3.44Å
140	Q	73.3	Confident	74.6	Confident	70 Å²	70	27 Å²	27	33%	0.327	14%	0.135	S	C	.	.	H	α-helix	trans	-71.2	-30.7	177.3	-60.7	-63.7	-11.7	0	0	113.3	L85 H136 I138 I144	L85-Q140 HydrophobicContact CD2-CB 3.69Å; H136-Q140 PolarHBondContact NE2-NE2 2.83Å; H136-Q140 WeakPolarHBondContact O-CG 3.4Å; H136-Q140 PolarHBondContact O-N 3.4Å; I138-Q140 PolarHBondContact O-N 2.77Å; Q140-I144 WeakPolarHBondContact O-CD1 3.46Å; Q140-I144 WeakPolarHBondContact O-CG1 3.01Å
141	L	73.8	Confident	74.5	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-68.1	-46.9	171.1	-78.4	179	0	0	0	112.4	F87 A137 I138 K143 I144 N145 L146 H148 L166	F87-L141 HydrophobicContact CD2-CD2 4.34Å; F87-L141 HydrophobicContact CE2-CD1 3.66Å; F87-L141 HydrophobicContact CE2-CD2 3.54Å; F87-L141 HydrophobicContact CE2-CG 3.76Å; F87-L141 HydrophobicContact CZ-CD1 3.71Å; F87-L141 HydrophobicContact CZ-CD2 3.94Å; F87-L141 HydrophobicContact CZ-CG 4.24Å; A137-L141 PolarHBondContact O-N 3.45Å; I138-L141 HydrophobicContact CG1-CD1 4.48Å; I138-L141 WeakPolarHBondContact O-CB 3.29Å; I138-L141 PolarHBondContact O-N 3.03Å; L141-K143 VanDerWaalsContact C-N 3.27Å; L141-K143 PolarHBondContact O-N 2.65Å; L141-I144 PolarHBondContact O-N 3.24Å; L141-N145 PolarHBondContact O-N 2.82Å; L141-L146 WeakPolarHBondContact CB-O 3.37Å; L141-L146 HydrophobicContact CD2-CB 4.5Å; L141-L146 PolarHBondContact O-N 2.91Å; L141-L146 VanDerWaalsContact O-N 3.14Å; L141-H148 HydrophobicContact CD1-CB 4Å; L141-L166 HydrophobicContact CD1-CD1 4.25Å
142	H	77.6	Confident	74.4	Confident	28 Å²	28	27.5 Å²	27.5	13%	0.13	14%	0.138	C	C	.	.	H	α-helix	trans	-64	-36.3	-178.6	-73.3	-155.8	0	0	0	110.2	I138 I144 N145 F640 D643 V720	I138-H142 VanDerWaalsContact CG2-CD2 3.49Å; I138-H142 WeakPolarHBondContact CG2-CD2 3.32Å; I138-H142 WeakPolarHBondContact CG2-NE2 3.47Å; I138-H142 PolarHBondContact O-CD2 3.44Å; I138-H142 PolarHBondContact O-N 3.31Å; H142-I144 PolarHBondContact O-N 3.29Å; H142-I144 VanDerWaalsContact O-N 3.15Å; H142-N145 WeakPolarHBondContact O-CA 3.39Å; H142-N145 PolarHBondContact O-N 3.16Å; H142-N145 PolarHBondContact O-OD1 3.48Å; H142-F640 HydrophobicContact CB-CD1 4.49Å; H142-F640 AromaticContact CD2-CD1 3.54Å; H142-F640 AromaticContact CD2-CE1 3.9Å; H142-F640 AromaticContact CE1-CD1 3.64Å; H142-F640 AromaticContact CG-CD1 3.73Å; H142-F640 AromaticContact ND1-CD1 3.8Å; H142-F640 AromaticContact NE2-CD1 3.49Å; H142-F640 WeakPolarHBondContact NE2-CD1 3.44Å; H142-D643 IonicContact CD2-OD2 2.61Å; H142-D643 IonicContact CE1-OD2 2.82Å; H142-D643 IonicContact NE2-OD2 2.71Å; H142-D643 PolarHBondContact NE2-OD2 2.84Å; H142-V720 WeakPolarHBondContact CE1-CG2 3.46Å; H142-V720 VanDerWaalsContact ND1-CG2 3.3Å; H142-V720 WeakPolarHBondContact ND1-CG2 3.27Å
143	K	68.9	Low	74.5	Confident	113 Å²	113	26 Å²	26	49%	0.491	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-8.9	171.1	-75.1	169.2	-177.3	168.2	0	115.5	T139 L141 D721	T139-K143 HydrophobicContact CG2-CD 4.13Å; T139-K143 VanDerWaalsContact CG2-NZ 3.29Å; T139-K143 WeakPolarHBondContact O-CB 3.43Å; T139-K143 WeakPolarHBondContact O-CD 3.32Å; T139-K143 VanDerWaalsContact O-CG 3.27Å; T139-K143 WeakPolarHBondContact O-CG 3.37Å; T139-K143 PolarHBondContact O-N 3.4Å; L141-K143 VanDerWaalsContact C-N 3.27Å; L141-K143 PolarHBondContact O-N 2.65Å; K143-D721 VanDerWaalsContact CE-OD1 3.31Å; K143-D721 WeakPolarHBondContact CE-OD1 3.48Å; K143-D721 WeakPolarHBondContact CE-OD2 3.44Å; K143-D721 IonicContact NZ-OD1 3.99Å; K143-D721 PolarHBondContact NZ-OD1 3.48Å; K143-D721 IonicContact NZ-OD2 2.74Å
144	I	69.7	Low	74.6	Confident	62 Å²	62	27.5 Å²	27.5	32%	0.318	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	0.8	174	-60.7	167.4	0	0	0	111	K74 L85 Q140 L141 H142 L146	K74-I144 PolarHBondContact NZ-O 2.97Å; K74-I144 VanDerWaalsContact NZ-O 3.16Å; L85-I144 HydrophobicContact CD1-CD1 3.84Å; L85-I144 HydrophobicContact CD2-CD1 4.13Å; L85-I144 HydrophobicContact CG-CD1 4.43Å; Q140-I144 WeakPolarHBondContact O-CD1 3.46Å; Q140-I144 WeakPolarHBondContact O-CG1 3.01Å; L141-I144 PolarHBondContact O-N 3.24Å; H142-I144 PolarHBondContact O-N 3.29Å; H142-I144 VanDerWaalsContact O-N 3.15Å; I144-L146 HydrophobicContact CG2-CD1 3.82Å; I144-L146 HydrophobicContact CG2-CG 4.26Å
145	N	65	Low	74.6	Confident	98 Å²	98	27.5 Å²	27.5	52%	0.524	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	50	-172.2	-58.6	22.6	0	0	0	112.4	L141 H142 F640	L141-N145 PolarHBondContact O-N 2.82Å; H142-N145 WeakPolarHBondContact O-CA 3.39Å; H142-N145 PolarHBondContact O-N 3.16Å; H142-N145 PolarHBondContact O-OD1 3.48Å; N145-F640 HydrophobicContact CB-CZ 4.36Å
146	L	68.5	Low	74.8	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.14	C	C	.	.			trans	-126	108.9	175.3	-69.7	171	0	0	0	110.8	I71 K74 F75 V78 L141 I144	I71-L146 HydrophobicContact CG2-CD2 4.17Å; K74-L146 HydrophobicContact CB-CD2 4.16Å; K74-L146 HydrophobicContact CD-CD2 4.49Å; F75-L146 HydrophobicContact CD2-CD2 4.01Å; V78-L146 HydrophobicContact CG2-CD1 3.84Å; L141-L146 WeakPolarHBondContact CB-O 3.37Å; L141-L146 HydrophobicContact CD2-CB 4.5Å; L141-L146 PolarHBondContact O-N 2.91Å; L141-L146 VanDerWaalsContact O-N 3.14Å; I144-L146 HydrophobicContact CG2-CD1 3.82Å; I144-L146 HydrophobicContact CG2-CG 4.26Å
147	P	70.5	Confident	75.1	Confident	12 Å²	12	23.5 Å²	23.5	8%	0.078	12%	0.121	C	C	.	.			trans	-76.4	148.9	174.1	31.2	-34.5	0	0	0	110.8	F636 L639 F640	P147-F636 HydrophobicContact CG-CD1 3.84Å; P147-F636 HydrophobicContact CG-CE1 4.16Å; P147-L639 HydrophobicContact CB-CB 3.65Å; P147-L639 HydrophobicContact CG-CB 3.66Å; P147-L639 HydrophobicContact CG-CD1 3.96Å; P147-L639 HydrophobicContact CG-CG 4.48Å; P147-F640 HydrophobicContact CB-CD1 3.69Å; P147-F640 HydrophobicContact CB-CE1 3.78Å; P147-F640 HydrophobicContact CB-CG 4.45Å; P147-F640 HydrophobicContact CG-CE1 4.23Å; P147-F640 VanDerWaalsContact N-CE1 3.34Å
148	H	76.5	Confident	75.4	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.122	C	C	.	.			trans	-89.2	-40.1	177.4	-175	-113.4	0	0	0	112.3	F87 L141 G150 M151 G167 P169 D643	F87-H148 AromaticContact CZ-CD2 3.93Å; L141-H148 HydrophobicContact CD1-CB 4Å; H148-G150 PolarHBondContact O-N 2.67Å; H148-G150 VanDerWaalsContact O-N 3.07Å; H148-M151 PolarHBondContact ND1-N 2.73Å; H148-G167 PolarHBondContact NE2-O 2.87Å; H148-P169 WeakPolarHBondContact O-CA 3.32Å; H148-P169 WeakPolarHBondContact O-CB 3.48Å; H148-D643 WeakPolarHBondContact CB-OD1 3.35Å; H148-D643 PolarHBondContact N-OD2 3.15Å
149	S	69.1	Low	75.4	Confident	13 Å²	13	25.6 Å²	25.6	9%	0.091	13%	0.132	C	C	.	.			trans	35.9	52	-179.8	-43.6	0	0	0	0	112.4	K170 A171 L639 D643	S149-K170 PolarHBondContact O-N 2.96Å; S149-A171 PolarHBondContact O-N 3.48Å; S149-L639 PolarHBondContact OG-O 3.44Å; S149-D643 WeakPolarHBondContact CA-OD1 3.38Å; S149-D643 PolarHBondContact N-OD1 3.31Å
150	G	67.3	Low	75.2	Confident	6 Å²	6	34 Å²	34	6%	0.062	17%	0.171	C	C	.	.			trans	-170.2	15.9	-169.7	0	0	0	0	0	115.6	H148 T152 N155	H148-G150 PolarHBondContact O-N 2.67Å; H148-G150 VanDerWaalsContact O-N 3.07Å; G150-T152 PolarHBondContact O-N 2.9Å; G150-N155 PolarHBondContact O-ND2 2.74Å
151	M	78.6	Confident	75.1	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	19%	0.19	C	C	.	.			trans	-72.4	107	178.8	-104.6	-157.8	166.5	0	0	111.5	A134 I138 H148 I156 L166 L647 R673	A134-M151 HydrophobicContact CB-CE 4.02Å; I138-M151 HydrophobicContact CD1-CE 3.43Å; I138-M151 VanDerWaalsContact CD1-CE 3.43Å; I138-M151 HydrophobicContact CD1-CG 3.88Å; I138-M151 HydrophobicContact CD1-SD 3.47Å; I138-M151 WeakPolarHBondContact CD1-SD 3.41Å; I138-M151 HydrophobicContact CG1-CE 3.85Å; H148-M151 PolarHBondContact ND1-N 2.73Å; M151-I156 HydrophobicContact CE-CD1 3.84Å; M151-I156 HydrophobicContact CG-CD1 4.13Å; M151-I156 HydrophobicContact SD-CD1 4.2Å; M151-L166 HydrophobicContact CE-CD2 3.82Å; M151-L647 HydrophobicContact CE-CD2 3.73Å; M151-L647 HydrophobicContact CE-CG 4.49Å; M151-L647 HydrophobicContact SD-CD2 3.57Å; M151-L647 VanDerWaalsContact SD-CD2 3.57Å; M151-L647 HydrophobicContact SD-CG 3.82Å; M151-R673 PolarHBondContact O-NH1 3.05Å
152	T	77.7	Confident	74.9	Confident	14 Å²	14	41.7 Å²	41.7	9%	0.086	20%	0.203	C	C	.	.			trans	-139.7	160.6	168.2	50.6	0	0	0	0	109.6	G150 D154 N155 K170	G150-T152 PolarHBondContact O-N 2.9Å; T152-D154 PolarHBondContact O-N 3.31Å; T152-N155 WeakPolarHBondContact O-CA 3.47Å; T152-N155 WeakPolarHBondContact O-CB 3.47Å; T152-N155 PolarHBondContact O-N 2.96Å; T152-K170 WeakPolarHBondContact OG1-CE 3.5Å; T152-K170 PolarHBondContact OG1-NZ 3.08Å
153	L	79.6	Confident	74.9	Confident	7 Å²	7	43.1 Å²	43.1	4%	0.037	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-53.1	-29.6	-176.9	-62.8	169.5	0	0	0	114.4	L110 Y111 I114 N155 L650 E653	L110-L153 HydrophobicContact CB-CD2 4.04Å; L110-L153 PolarHBondContact N-O 2.84Å; Y111-L153 PolarHBondContact N-O 2.81Å; I114-L153 HydrophobicContact CD1-CD1 4Å; I114-L153 HydrophobicContact CD1-CD2 3.89Å; L153-N155 VanDerWaalsContact C-N 3.32Å; L153-N155 PolarHBondContact O-N 3.4Å; L153-L650 HydrophobicContact CD2-CD1 3.71Å; L153-E653 HydrophobicContact CD1-CB 4.35Å; L153-E653 HydrophobicContact CD1-CG 4.46Å; L153-E653 HydrophobicContact CD2-CB 4.37Å
154	D	79.1	Confident	75.3	Confident	56 Å²	56	37.9 Å²	37.9	30%	0.299	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-71.3	-18	174.4	-99.8	55.6	0	0	0	115.4	Y111 T152 N666	Y111-D154 VanDerWaalsContact CB-OD1 3.3Å; Y111-D154 WeakPolarHBondContact CB-OD1 3.46Å; T152-D154 PolarHBondContact O-N 3.31Å; D154-N666 PolarHBondContact OD1-ND2 3.01Å
155	N	80.5	Confident	75.8	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-113.9	8.4	-165.9	-150.2	33.6	0	0	0	113.1	R5 G150 T152 L153 G167 P168	R5-N155 PolarHBondContact NH2-OD1 3.48Å; G150-N155 PolarHBondContact O-ND2 2.74Å; T152-N155 WeakPolarHBondContact O-CA 3.47Å; T152-N155 WeakPolarHBondContact O-CB 3.47Å; T152-N155 PolarHBondContact O-N 2.96Å; L153-N155 VanDerWaalsContact C-N 3.32Å; L153-N155 PolarHBondContact O-N 3.4Å; N155-G167 PolarHBondContact O-N 3.47Å; N155-P168 PolarHBondContact ND2-O 2.87Å; N155-P168 PolarHBondContact OD1-O 3.35Å
156	I	83.1	Confident	76.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	127.2	176.9	-54	177.3	0	0	0	107.2	S109 L110 M151 I164 L166 L650	S109-I156 WeakPolarHBondContact CA-O 3.22Å; L110-I156 HydrophobicContact CD1-CB 3.98Å; L110-I156 HydrophobicContact CD1-CD1 4.34Å; L110-I156 HydrophobicContact CD1-CG2 3.74Å; L110-I156 HydrophobicContact CG-CB 4.43Å; L110-I156 HydrophobicContact CG-CG2 4.29Å; L110-I156 PolarHBondContact N-O 3.41Å; M151-I156 HydrophobicContact CE-CD1 3.84Å; M151-I156 HydrophobicContact CG-CD1 4.13Å; M151-I156 HydrophobicContact SD-CD1 4.2Å; I156-I164 HydrophobicContact CG2-CD1 4.49Å; I156-I164 HydrophobicContact CG2-CG2 3.59Å; I156-L166 HydrophobicContact CG1-CD2 4.08Å; I156-L650 HydrophobicContact CD1-CD1 3.69Å; I156-L650 HydrophobicContact CD1-CD2 3.63Å; I156-L650 HydrophobicContact CD1-CG 4.33Å
157	F	83.9	Confident	76.8	Confident	1 Å²	1	32.5 Å²	32.5	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	148.1	-176.2	-50.9	-79.7	0	0	0	111.4	V88 Y103 V105 V106 V108 I164 F165	V88-F157 HydrophobicContact CG2-CD2 3.82Å; V88-F157 HydrophobicContact CG2-CE2 4.19Å; Y103-F157 HydrophobicContact CE2-CZ 4.31Å; V105-F157 HydrophobicContact CG1-CD1 3.54Å; V105-F157 HydrophobicContact CG1-CE1 3.64Å; V105-F157 HydrophobicContact CG1-CG 4.17Å; V105-F157 HydrophobicContact CG1-CZ 4.34Å; V105-F157 HydrophobicContact CG2-CE1 4.19Å; V105-F157 HydrophobicContact CG2-CZ 4.24Å; V106-F157 VanDerWaalsContact O-CB 3.25Å; V106-F157 WeakPolarHBondContact O-CB 3.41Å; V108-F157 CarbonylContact O-C 3.6Å; V108-F157 WeakPolarHBondContact O-CA 3.45Å; F157-I164 CarbonylContact O-C 3.56Å; F157-I164 WeakPolarHBondContact O-CA 3.42Å; F157-F165 PolarHBondContact N-O 2.86Å; F157-F165 PolarHBondContact O-N 2.82Å
158	V	83.2	Confident	76.7	Confident	13 Å²	13	31.9 Å²	31.9	8%	0.079	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	132.3	-176	-171.2	0	0	0	0	110.3	G107 V108 L110 L130 F162 N163 I164	G107-V158 CarbonylContact C-O 3.36Å; G107-V158 WeakPolarHBondContact CA-O 3.33Å; V108-V158 PolarHBondContact N-O 3.35Å; V108-V158 PolarHBondContact O-N 3.37Å; L110-V158 HydrophobicContact CD2-CG2 3.59Å; L110-V158 HydrophobicContact CG-CG2 3.93Å; L130-V158 HydrophobicContact CD2-CG1 3.81Å; L130-V158 HydrophobicContact CD2-CG2 4.13Å; V158-F162 HydrophobicContact CG1-CB 4.45Å; V158-F162 HydrophobicContact CG1-CD1 4.3Å; V158-N163 WeakPolarHBondContact CA-O 3.22Å; V158-I164 HydrophobicContact CG2-CG1 4.41Å
159	D	80.3	Confident	76.2	Confident	39 Å²	39	32.4 Å²	32.4	21%	0.209	16%	0.158	C	C	.	.			trans	-87.1	-178.8	176	82.9	-2.7	0	0	0	113.7	K161 F162 N163 F165	D159-K161 PolarHBondContact O-N 2.85Å; D159-K161 VanDerWaalsContact OD1-CA 3.31Å; D159-K161 WeakPolarHBondContact OD1-CA 3.22Å; D159-K161 WeakPolarHBondContact OD1-CB 3.46Å; D159-K161 PolarHBondContact OD1-N 2.92Å; D159-F162 PolarHBondContact O-N 2.98Å; D159-F162 PolarHBondContact OD1-N 2.86Å; D159-N163 PolarHBondContact N-O 3.37Å; D159-N163 VanDerWaalsContact N-O 3.07Å; D159-N163 PolarHBondContact OD1-N 2.9Å; D159-N163 PolarHBondContact OD1-ND2 3.25Å; D159-N163 PolarHBondContact OD2-ND2 3.2Å; D159-F165 HydrophobicContact CB-CE2 4.2Å
160	E	72.1	Confident	75.8	Confident	181 Å²	181	35 Å²	35	85%	0.846	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-11.7	179.9	-59.6	-169.1	143.6	0	0	114.4
161	K	72	Confident	75.1	Confident	167 Å²	167	36.2 Å²	36.2	73%	0.726	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.9	7	177.2	-63.1	178.7	179.9	178.9	0	112.4	D159 N163	D159-K161 PolarHBondContact O-N 2.85Å; D159-K161 VanDerWaalsContact OD1-CA 3.31Å; D159-K161 WeakPolarHBondContact OD1-CA 3.22Å; D159-K161 WeakPolarHBondContact OD1-CB 3.46Å; D159-K161 PolarHBondContact OD1-N 2.92Å; K161-N163 VanDerWaalsContact C-N 3.31Å
162	F	70.8	Confident	73.8	Confident	64 Å²	64	38.9 Å²	38.9	28%	0.281	19%	0.191	S	C	.	.			trans	64	26.6	-172.8	-56.3	-88.1	0	0	0	114.7	T126 F129 L130 Q133 V158 D159	T126-F162 HydrophobicContact CG2-CD1 3.58Å; T126-F162 HydrophobicContact CG2-CE1 3.46Å; T126-F162 VanDerWaalsContact CG2-CE1 3.46Å; T126-F162 HydrophobicContact CG2-CE2 4.45Å; T126-F162 HydrophobicContact CG2-CG 4.14Å; T126-F162 HydrophobicContact CG2-CZ 3.93Å; F129-F162 HydrophobicContact CD1-CB 4.29Å; F129-F162 HydrophobicContact CE1-CB 4.23Å; L130-F162 HydrophobicContact CD1-CD1 4.38Å; L130-F162 HydrophobicContact CD2-CB 4.17Å; L130-F162 HydrophobicContact CD2-CD1 4.49Å; Q133-F162 PolarHBondContact NE2-O 2.88Å; V158-F162 HydrophobicContact CG1-CB 4.45Å; V158-F162 HydrophobicContact CG1-CD1 4.3Å; D159-F162 PolarHBondContact O-N 2.98Å; D159-F162 PolarHBondContact OD1-N 2.86Å
163	N	75.7	Confident	72.3	Confident	58 Å²	58	41.1 Å²	41.1	31%	0.31	20%	0.202	S	C	.	.			trans	-76.9	137.6	167.3	-56.1	-59.6	0	0	0	110.4	Q133 V158 D159 K161 F165	Q133-N163 VanDerWaalsContact OE1-CA 3.31Å; V158-N163 WeakPolarHBondContact CA-O 3.22Å; D159-N163 PolarHBondContact N-O 3.37Å; D159-N163 VanDerWaalsContact N-O 3.07Å; D159-N163 PolarHBondContact OD1-N 2.9Å; D159-N163 PolarHBondContact OD1-ND2 3.25Å; D159-N163 PolarHBondContact OD2-ND2 3.2Å; K161-N163 VanDerWaalsContact C-N 3.31Å; N163-F165 HydrophobicContact CB-CE2 4.09Å; N163-F165 HydrophobicContact CB-CZ 4.45Å
164	I	78.4	Confident	70.6	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	140	178.4	-67.8	-169.6	0	0	0	112.2	N86 L130 Q133 A134 I156 F157 V158	N86-I164 WeakPolarHBondContact CB-O 3.35Å; N86-I164 PolarHBondContact ND2-O 3.21Å; L130-I164 HydrophobicContact CB-CD1 4.03Å; L130-I164 HydrophobicContact CD2-CD1 3.81Å; L130-I164 HydrophobicContact CD2-CG1 3.69Å; L130-I164 WeakPolarHBondContact O-CD1 3.47Å; Q133-I164 HydrophobicContact CB-CB 4.21Å; Q133-I164 HydrophobicContact CB-CD1 4.07Å; Q133-I164 HydrophobicContact CB-CG1 4.16Å; A134-I164 HydrophobicContact CB-CD1 3.98Å; I156-I164 HydrophobicContact CG2-CD1 4.49Å; I156-I164 HydrophobicContact CG2-CG2 3.59Å; F157-I164 CarbonylContact O-C 3.56Å; F157-I164 WeakPolarHBondContact O-CA 3.42Å; V158-I164 HydrophobicContact CG2-CG1 4.41Å
165	F	80.7	Confident	68.8	Low	48 Å²	48	49 Å²	49	21%	0.211	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134	169.8	-59	-89.1	0	0	0	111.4	N86 V88 V106 F157 D159 N163	N86-F165 WeakPolarHBondContact O-CA 3.04Å; V88-F165 HydrophobicContact CG2-CB 3.97Å; V106-F165 HydrophobicContact CG1-CD2 4.29Å; V106-F165 HydrophobicContact CG1-CE2 4.13Å; V106-F165 HydrophobicContact CG1-CZ 4.5Å; F157-F165 PolarHBondContact N-O 2.86Å; F157-F165 PolarHBondContact O-N 2.82Å; D159-F165 HydrophobicContact CB-CE2 4.2Å; N163-F165 HydrophobicContact CB-CE2 4.09Å; N163-F165 HydrophobicContact CB-CZ 4.45Å
166	L	78.8	Confident	66.9	Low	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	137	179.6	-64.9	176.4	0	0	0	112.2	N86 F87 V88 A137 I138 L141 M151 I156	N86-L166 PolarHBondContact O-N 2.79Å; F87-L166 HydrophobicContact CD1-CB 4.43Å; F87-L166 HydrophobicContact CD2-CB 4.21Å; F87-L166 HydrophobicContact CE1-CB 4.04Å; F87-L166 HydrophobicContact CE2-CB 3.77Å; F87-L166 HydrophobicContact CE2-CD1 3.67Å; F87-L166 HydrophobicContact CE2-CG 4.31Å; F87-L166 HydrophobicContact CZ-CB 3.68Å; F87-L166 HydrophobicContact CZ-CD1 3.99Å; F87-L166 HydrophobicContact CZ-CG 4.49Å; V88-L166 WeakPolarHBondContact CG2-O 3.28Å; V88-L166 PolarHBondContact N-O 2.82Å; A137-L166 HydrophobicContact CB-CD1 3.8Å; A137-L166 HydrophobicContact CB-CG 4.33Å; I138-L166 HydrophobicContact CG1-CD1 4.16Å; L141-L166 HydrophobicContact CD1-CD1 4.25Å; M151-L166 HydrophobicContact CE-CD2 3.82Å; I156-L166 HydrophobicContact CG1-CD2 4.08Å
167	G	74	Confident	64.8	Low	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.285	C	S	.	.			trans	-86.6	-179.7	171.9	0	0	0	0	0	113.8	H148 N155	H148-G167 PolarHBondContact NE2-O 2.87Å; N155-G167 PolarHBondContact O-N 3.47Å
168	P	68.7	Low	62.6	Low	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.306	C	S	.	.			trans	-72.5	151.2	-176.9	26.2	-31.9	0	0	0	113.9	R5 M101 Y103 N155	R5-P168 PolarHBondContact NH1-O 3.31Å; M101-P168 HydrophobicContact CE-CB 3.94Å; M101-P168 HydrophobicContact CE-CG 4.29Å; Y103-P168 HydrophobicContact CD1-CG 4.3Å; Y103-P168 HydrophobicContact CE1-CG 4.05Å; N155-P168 PolarHBondContact ND2-O 2.87Å; N155-P168 PolarHBondContact OD1-O 3.35Å
169	P	66.1	Low	60.2	Low	11 Å²	11	66.8 Å²	66.8	7%	0.071	34%	0.335	C	S	.	.			trans	-50.6	165.1	-179.8	-34.6	38.6	0	0	0	118.1	R5 F75 H148 A171	R5-P169 PolarHBondContact NH1-O 2.86Å; F75-P169 HydrophobicContact CD1-CG 4.4Å; F75-P169 VanDerWaalsContact CE1-CD 3.44Å; F75-P169 HydrophobicContact CE1-CG 3.54Å; F75-P169 HydrophobicContact CE2-CG 3.71Å; F75-P169 HydrophobicContact CZ-CG 3.15Å; H148-P169 WeakPolarHBondContact O-CA 3.32Å; H148-P169 WeakPolarHBondContact O-CB 3.48Å; P169-A171 HydrophobicContact CB-CB 4.41Å
170	K	62	Low	58.1	Low	67 Å²	67	69.2 Å²	69.2	29%	0.291	35%	0.351	S	S	.	.	S	Bend	trans	-106.7	-8.2	161.1	-64.3	-171.5	-176.7	-178.9	0	113.6	S149 T152 I172 D173	S149-K170 PolarHBondContact O-N 2.96Å; T152-K170 WeakPolarHBondContact OG1-CE 3.5Å; T152-K170 PolarHBondContact OG1-NZ 3.08Å; K170-I172 PolarHBondContact O-N 2.81Å; K170-D173 WeakPolarHBondContact O-CB 3.17Å; K170-D173 PolarHBondContact O-N 3.09Å
171	A	51.1	Low	56	Low	32 Å²	32	66.8 Å²	66.8	26%	0.264	34%	0.344	S	S	.	.	H	α-helix	trans	-47.2	-37.1	-175.8	0	0	0	0	0	115.2	S149 P169 D173 F174	S149-A171 PolarHBondContact O-N 3.48Å; P169-A171 HydrophobicContact CB-CB 4.41Å; A171-D173 PolarHBondContact O-N 3.28Å; A171-F174 WeakPolarHBondContact O-CB 3.48Å; A171-F174 PolarHBondContact O-N 3.04Å
172	I	51.9	Low	54	Low	57 Å²	57	64.1 Å²	64.1	29%	0.292	33%	0.334	S	S	.	.	H	α-helix	trans	-67.2	-25	-178.5	-70.3	161.1	0	0	0	112.2	W7 K170 F174	W7-I172 HydrophobicContact CD2-CG2 3.81Å; W7-I172 HydrophobicContact CE3-CG2 4.14Å; W7-I172 HydrophobicContact CG-CG2 4.24Å; W7-I172 HydrophobicContact CH2-CB 4.16Å; W7-I172 HydrophobicContact CH2-CD1 3.36Å; W7-I172 HydrophobicContact CH2-CG1 4.34Å; W7-I172 HydrophobicContact CH2-CG2 4.23Å; W7-I172 HydrophobicContact CZ2-CB 3.82Å; W7-I172 HydrophobicContact CZ2-CD1 3.94Å; W7-I172 HydrophobicContact CZ2-CG1 4.47Å; W7-I172 HydrophobicContact CZ2-CG2 3.92Å; W7-I172 HydrophobicContact CZ3-CD1 3.74Å; W7-I172 HydrophobicContact CZ3-CG2 4.34Å; K170-I172 PolarHBondContact O-N 2.81Å; I172-F174 VanDerWaalsContact C-N 3.32Å
173	D	46.7	Very low	52.2	Low	60 Å²	60	68.1 Å²	68.1	32%	0.321	36%	0.358	S	S	.	.	H	α-helix	trans	-79.2	-14	174	-52.9	-43.2	0	0	0	112.5	W7 K170 A171 S176 N177	W7-D173 PolarHBondContact NE1-OD1 2.86Å; K170-D173 WeakPolarHBondContact O-CB 3.17Å; K170-D173 PolarHBondContact O-N 3.09Å; A171-D173 PolarHBondContact O-N 3.28Å; D173-S176 PolarHBondContact O-OG 3.08Å; D173-N177 PolarHBondContact O-ND2 2.7Å
174	F	42.9	Very low	50	Low	129 Å²	129	74.2 Å²	74.2	57%	0.566	38%	0.381	S	S	*	.	H	α-helix	trans	-82.8	-42.8	178.6	-155.1	-89.8	0	0	0	111.3	A171 I172 S176 N177 I178	A171-F174 WeakPolarHBondContact O-CB 3.48Å; A171-F174 PolarHBondContact O-N 3.04Å; I172-F174 VanDerWaalsContact C-N 3.32Å; F174-S176 PolarHBondContact O-N 3.15Å; F174-N177 PolarHBondContact O-N 2.79Å; F174-I178 HydrophobicContact CD1-CD1 3.96Å; F174-I178 HydrophobicContact CD1-CG1 4.2Å; F174-I178 HydrophobicContact CE1-CD1 4.11Å; F174-I178 HydrophobicContact CE1-CG1 4.24Å; F174-I178 PolarHBondContact O-N 3.36Å
175	L	42.1	Very low	47.6	Very low	101 Å²	101	83.2 Å²	83.2	53%	0.529	42%	0.423	S	S	.	.	H	α-helix	trans	-62.5	-26.7	177.9	-70.4	171	0	0	0	113.4	W43	W43-L175 HydrophobicContact CZ2-CD1 4.04Å
176	S	39.8	Very low	45.1	Very low	69 Å²	69	89.3 Å²	89.3	48%	0.483	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-23.7	172.2	47.3	0	0	0	0	114.1	D173 F174	D173-S176 PolarHBondContact O-OG 3.08Å; F174-S176 PolarHBondContact O-N 3.15Å
177	N	39.3	Very low	42.8	Very low	93 Å²	93	96.4 Å²	96.4	50%	0.497	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-21.1	-177.6	-76.5	-48.9	0	0	0	113.4	D173 F174 M179 T180	D173-N177 PolarHBondContact O-ND2 2.7Å; F174-N177 PolarHBondContact O-N 2.79Å; N177-M179 PolarHBondContact O-N 3.34Å; N177-T180 PolarHBondContact O-N 3.44Å; N177-T180 PolarHBondContact O-OG1 2.86Å
178	I	37.8	Very low	40.5	Very low	85 Å²	85	101.3 Å²	101.3	44%	0.436	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-60.2	-29.6	175.6	-70.7	173	0	0	0	111.5	F174 T180	F174-I178 HydrophobicContact CD1-CD1 3.96Å; F174-I178 HydrophobicContact CD1-CG1 4.2Å; F174-I178 HydrophobicContact CE1-CD1 4.11Å; F174-I178 HydrophobicContact CE1-CG1 4.24Å; F174-I178 PolarHBondContact O-N 3.36Å; I178-T180 PolarHBondContact O-N 3.26Å
179	M	32.8	Very low	38.6	Very low	140 Å²	140	103.5 Å²	103.5	69%	0.69	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-63.3	0.7	176.6	-64.7	-168	72.6	0	0	115.7	N177	N177-M179 PolarHBondContact O-N 3.34Å
180	T	35.7	Very low	36.9	Very low	90 Å²	90	106.9 Å²	106.9	55%	0.552	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-123	-10.7	-174.3	66.1	0	0	0	0	116.2	N177 I178	N177-T180 PolarHBondContact O-N 3.44Å; N177-T180 PolarHBondContact O-OG1 2.86Å; I178-T180 PolarHBondContact O-N 3.26Å
181	N	29.6	Very low	35.4	Very low	129 Å²	129	112 Å²	112	69%	0.69	58%	0.579	S	S	*	*			trans	-119.7	8.3	-162.2	-78.1	-21.2	0	0	0	116.8	L183	N181-L183 PolarHBondContact O-N 2.87Å
182	E	29.6	Very low	34.7	Very low	112 Å²	112	115.7 Å²	115.7	52%	0.523	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.6	43.6	-177.4	-83.3	177.9	-178.3	0	0	115.6	H50 I53	H50-E182 IonicContact CE1-OE1 3.33Å; H50-E182 IonicContact ND1-OE1 3.14Å; H50-E182 PolarHBondContact ND1-OE1 2.83Å; I53-E182 WeakPolarHBondContact CD1-OE1 3.35Å
183	L	33.2	Very low	34	Very low	148 Å²	148	117.4 Å²	117.4	78%	0.775	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	-11.2	-166.1	-76.5	174.5	0	0	0	119.1	N181	N181-L183 PolarHBondContact O-N 2.87Å
184	K	28.1	Very low	33.4	Very low	186 Å²	186	121.5 Å²	121.5	81%	0.809	62%	0.624	S	S	*	*			trans	-152	91.4	-172.5	-63.6	-169.6	179.5	-175.5	0	118.1
185	E	28.3	Very low	33.2	Very low	191 Å²	191	119.6 Å²	119.6	89%	0.893	63%	0.632	S	S	*	*				61.2	159.3	125.6	-63.9	167.1	152.8	0	0	123.4
186	E	28.9	Very low	33	Very low	176 Å²	176	121.6 Å²	121.6	82%	0.822	64%	0.64	S	S	*	*			trans	-127.8	-162.1	-165.6	-62	166.2	139.5	0	0	111.8
187	E	29.5	Very low	33.1	Very low	149 Å²	149	121 Å²	121	70%	0.696	64%	0.635	S	S	*	*			trans	95.5	136.6	-169.9	-65.5	-168.8	-92.3	0	0	114.8	E710	E187-E710 WeakPolarHBondContact CA-OE1 3.4Å; E187-E710 PolarHBondContact N-OE1 2.96Å; E187-E710 VanDerWaalsContact N-OE1 3.12Å
188	N	27.4	Very low	33.6	Very low	102 Å²	102	120.5 Å²	120.5	55%	0.545	63%	0.632	S	S	.	*			cis	-166.1	124.2	-3.2	-94.3	-35.9	0	0	0	112.6	G709 E710	N188-G709 PolarHBondContact N-O 2.61Å; N188-E710 VanDerWaalsContact C-OE2 3.24Å; N188-E710 WeakPolarHBondContact CA-OE1 3.39Å; N188-E710 WeakPolarHBondContact CA-OE2 3.35Å; N188-E710 VanDerWaalsContact N-CD 3.3Å; N188-E710 PolarHBondContact N-OE1 2.97Å
189	T	28.6	Very low	34.7	Very low	47 Å²	47	118.5 Å²	118.5	29%	0.288	63%	0.626	S	S	.	*			trans	-155.8	142.8	161.7	58.3	0	0	0	0	116.3	E710 Q711	T189-E710 HydrophobicContact CG2-CB 4.05Å; T189-E710 PolarHBondContact N-OE2 2.76Å; T189-E710 WeakPolarHBondContact OG1-CB 3.4Å; T189-Q711 HydrophobicContact CG2-CB 4.26Å; T189-Q711 WeakPolarHBondContact OG1-CG 3.48Å; T189-Q711 PolarHBondContact OG1-N 3.47Å
190	A	29.5	Very low	36.2	Very low	82 Å²	82	114.2 Å²	114.2	68%	0.678	61%	0.61	S	S	*	*			trans	-153	131	166	0	0	0	0	0	112
191	E	30.2	Very low	38.2	Very low	173 Å²	173	114 Å²	114	81%	0.808	60%	0.601	S	S	*	*			trans	-167	8.3	170.4	-131.2	170.2	-157.5	0	0	116.1
192	I	37.9	Very low	40.7	Very low	111 Å²	111	108.8 Å²	108.8	57%	0.569	57%	0.573	S	S	*	*			trans	-88.3	-7.8	-172.3	-71.5	173.5	0	0	0	112.8	I194	I192-I194 PolarHBondContact O-N 2.7Å
193	D	35.5	Very low	43.2	Very low	93 Å²	93	104.1 Å²	104.1	50%	0.497	55%	0.553	S	S	.	*			trans	-67.2	-35.2	-148.9	-63.8	-88.4	0	0	0	118	A195 M196 C197	D193-A195 PolarHBondContact O-N 3.05Å; D193-M196 CarbonylContact O-C 3.58Å; D193-M196 WeakPolarHBondContact O-CA 3.4Å; D193-M196 PolarHBondContact O-N 2.83Å; D193-C197 HydrophobicContact CB-CB 4.45Å; D193-C197 VanDerWaalsContact O-CB 3.3Å; D193-C197 WeakPolarHBondContact O-CB 3.39Å; D193-C197 PolarHBondContact O-N 3.12Å
194	I	35.5	Very low	45.5	Very low	146 Å²	146	100.8 Å²	100.8	75%	0.749	54%	0.539	S	S	*	.	H	α-helix	trans	-56	-40.3	-150	-60.2	177.7	0	0	0	115.2	I192 C197	I192-I194 PolarHBondContact O-N 2.7Å; I194-C197 WeakPolarHBondContact O-CB 3.35Å
195	A	37.3	Very low	48.4	Very low	89 Å²	89	93.8 Å²	93.8	74%	0.736	51%	0.51	S	S	*	.	H	α-helix	trans	-74.6	-38.1	177.6	0	0	0	0	0	112.8	D193 C197 N198	D193-A195 PolarHBondContact O-N 3.05Å; A195-C197 VanDerWaalsContact C-N 3.29Å; A195-N198 PolarHBondContact O-N 3.03Å
196	M	38.2	Very low	51.2	Low	142 Å²	142	84.7 Å²	84.7	70%	0.7	47%	0.467	S	S	*	.	H	α-helix	trans	-74.5	-23.3	177	-147	158.4	177.6	0	0	111.7	D193 S199 S200	D193-M196 CarbonylContact O-C 3.58Å; D193-M196 WeakPolarHBondContact O-CA 3.4Å; D193-M196 PolarHBondContact O-N 2.83Å; M196-S199 PolarHBondContact O-OG 2.91Å; M196-S200 WeakPolarHBondContact O-CB 3.36Å; M196-S200 PolarHBondContact O-N 3.2Å; M196-S200 PolarHBondContact O-OG 2.8Å
197	C	41.6	Very low	53.8	Low	56 Å²	56	77.4 Å²	77.4	38%	0.378	44%	0.435	S	S	.	.	H	α-helix	trans	-66	-38.1	173.6	-169.3	0	0	0	0	111.1	D193 I194 A195 S200 K201	D193-C197 HydrophobicContact CB-CB 4.45Å; D193-C197 VanDerWaalsContact O-CB 3.3Å; D193-C197 WeakPolarHBondContact O-CB 3.39Å; D193-C197 PolarHBondContact O-N 3.12Å; I194-C197 WeakPolarHBondContact O-CB 3.35Å; A195-C197 VanDerWaalsContact C-N 3.29Å; C197-S200 WeakPolarHBondContact CA-OG 3.35Å; C197-S200 PolarHBondContact O-OG 3.38Å; C197-S200 VanDerWaalsContact O-OG 3.12Å; C197-K201 WeakPolarHBondContact O-CA 3.22Å; C197-K201 WeakPolarHBondContact O-CB 3.37Å; C197-K201 PolarHBondContact O-N 3.47Å
198	N	51.3	Low	56.6	Low	83 Å²	83	72.4 Å²	72.4	44%	0.444	41%	0.412	S	S	.	.	H	α-helix	trans	-69.2	-39.2	-178	-81.5	-16.3	0	0	0	113.6	A195 L202	A195-N198 PolarHBondContact O-N 3.03Å; N198-L202 VanDerWaalsContact O-CB 3.31Å; N198-L202 WeakPolarHBondContact O-CB 3.21Å; N198-L202 PolarHBondContact O-N 3.13Å
199	S	60.2	Low	59.6	Low	43 Å²	43	67.5 Å²	67.5	30%	0.301	39%	0.386	S	S	.	.	H	α-helix	trans	-72.6	-39.6	176.4	55.2	0	0	0	0	112.5	M196 L202 S203	M196-S199 PolarHBondContact O-OG 2.91Å; S199-L202 PolarHBondContact O-N 2.83Å; S199-S203 PolarHBondContact O-N 3.09Å
200	S	64.4	Low	62.4	Low	50 Å²	50	65.6 Å²	65.6	35%	0.35	37%	0.374	S	S	.	.	H	α-helix	trans	-69.9	-36.8	174.2	55.9	0	0	0	0	112.8	M196 C197 S203 T204	M196-S200 WeakPolarHBondContact O-CB 3.36Å; M196-S200 PolarHBondContact O-N 3.2Å; M196-S200 PolarHBondContact O-OG 2.8Å; C197-S200 WeakPolarHBondContact CA-OG 3.35Å; C197-S200 PolarHBondContact O-OG 3.38Å; C197-S200 VanDerWaalsContact O-OG 3.12Å; S200-S203 PolarHBondContact O-N 3.11Å; S200-T204 VanDerWaalsContact O-CB 3.24Å; S200-T204 WeakPolarHBondContact O-CB 3.48Å; S200-T204 PolarHBondContact O-N 2.82Å; S200-T204 PolarHBondContact O-OG1 2.76Å
201	K	77.4	Confident	64.9	Low	85 Å²	85	63.3 Å²	63.3	37%	0.37	35%	0.351	S	S	.	.	H	α-helix	trans	-64.2	-44.5	171.5	-177	-176.2	177.5	-164.7	0	110.7	C197 T204 M205 F222	C197-K201 WeakPolarHBondContact O-CA 3.22Å; C197-K201 WeakPolarHBondContact O-CB 3.37Å; C197-K201 PolarHBondContact O-N 3.47Å; K201-T204 PolarHBondContact O-N 3.21Å; K201-M205 WeakPolarHBondContact O-CB 3.21Å; K201-M205 PolarHBondContact O-N 3.08Å; K201-F222 HydrophobicContact CD-CE2 3.88Å; K201-F222 HydrophobicContact CG-CE2 3.89Å; K201-F222 HydrophobicContact CG-CZ 4.12Å
202	L	82.9	Confident	67.4	Low	21 Å²	21	58 Å²	58	11%	0.11	33%	0.326	C	S	.	.	H	α-helix	trans	-58.4	-52.3	173	173.3	58.5	0	0	0	111.3	N198 S199 T204 M205 T206 F222 L226 F498 T613	N198-L202 VanDerWaalsContact O-CB 3.31Å; N198-L202 WeakPolarHBondContact O-CB 3.21Å; N198-L202 PolarHBondContact O-N 3.13Å; S199-L202 PolarHBondContact O-N 2.83Å; L202-T204 PolarHBondContact O-N 3.29Å; L202-M205 PolarHBondContact O-N 2.94Å; L202-T206 WeakPolarHBondContact O-CB 3.32Å; L202-T206 PolarHBondContact O-N 3.42Å; L202-T206 PolarHBondContact O-OG1 3.24Å; L202-F222 HydrophobicContact CB-CE1 4.42Å; L202-F222 HydrophobicContact CB-CZ 4.22Å; L202-F222 HydrophobicContact CD1-CE1 3.87Å; L202-F222 HydrophobicContact CD1-CZ 4.46Å; L202-L226 HydrophobicContact CD1-CD1 3.98Å; L202-F498 HydrophobicContact CD1-CE1 4.05Å; L202-F498 HydrophobicContact CD1-CZ 4.13Å; L202-F498 HydrophobicContact CD2-CE1 4.07Å; L202-T613 HydrophobicContact CB-CG2 4.33Å; L202-T613 HydrophobicContact CD2-CG2 3.88Å; L202-T613 HydrophobicContact CG-CG2 3.79Å
203	S	81.5	Confident	69.5	Low	13 Å²	13	58.2 Å²	58.2	9%	0.091	32%	0.323	C	S	.	.	H	α-helix	trans	-56	-48.3	177.6	-179.6	0	0	0	0	112.8	S199 S200 T207	S199-S203 PolarHBondContact O-N 3.09Å; S200-S203 PolarHBondContact O-N 3.11Å; S203-T207 VanDerWaalsContact O-CB 3.25Å; S203-T207 WeakPolarHBondContact O-CB 3.41Å; S203-T207 PolarHBondContact O-N 2.84Å; S203-T207 PolarHBondContact O-OG1 2.87Å
204	T	82.3	Confident	72	Confident	79 Å²	79	54.9 Å²	54.9	49%	0.485	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-45.8	177.8	-59.8	0	0	0	0	111.7	S200 K201 L202 N208	S200-T204 VanDerWaalsContact O-CB 3.24Å; S200-T204 WeakPolarHBondContact O-CB 3.48Å; S200-T204 PolarHBondContact O-N 2.82Å; S200-T204 PolarHBondContact O-OG1 2.76Å; K201-T204 PolarHBondContact O-N 3.21Å; L202-T204 PolarHBondContact O-N 3.29Å; T204-N208 WeakPolarHBondContact CG2-ND2 3.42Å; T204-N208 VanDerWaalsContact O-CB 3.23Å; T204-N208 WeakPolarHBondContact O-CB 3.38Å; T204-N208 PolarHBondContact O-N 2.97Å; T204-N208 PolarHBondContact O-ND2 3.45Å; T204-N208 VanDerWaalsContact O-ND2 3.15Å
205	M	87.3	Confident	74.7	Confident	39 Å²	39	50.3 Å²	50.3	19%	0.192	28%	0.284	C	S	.	.	H	α-helix	trans	-71.3	-41.4	-175.5	-166.2	60.6	169.2	0	0	111.5	K201 L202 W209 V214 D218 Y219 F222	K201-M205 WeakPolarHBondContact O-CB 3.21Å; K201-M205 PolarHBondContact O-N 3.08Å; L202-M205 PolarHBondContact O-N 2.94Å; M205-W209 WeakPolarHBondContact O-CB 3.38Å; M205-W209 PolarHBondContact O-N 3.17Å; M205-V214 HydrophobicContact CE-CG1 3.62Å; M205-V214 HydrophobicContact CE-CG2 4.33Å; M205-V214 HydrophobicContact SD-CB 4.39Å; M205-V214 HydrophobicContact SD-CG1 3.88Å; M205-V214 HydrophobicContact SD-CG2 3.72Å; M205-D218 HydrophobicContact CE-CB 4.34Å; M205-Y219 HydrophobicContact CG-CD2 3.96Å; M205-Y219 HydrophobicContact CG-CE2 4.27Å; M205-F222 HydrophobicContact CB-CD1 3.96Å; M205-F222 HydrophobicContact CB-CE1 3.7Å; M205-F222 HydrophobicContact CB-CZ 4.16Å; M205-F222 HydrophobicContact CE-CB 3.92Å; M205-F222 HydrophobicContact CE-CG 4.33Å; M205-F222 HydrophobicContact CG-CB 4.3Å; M205-F222 HydrophobicContact CG-CD1 3.41Å; M205-F222 VanDerWaalsContact CG-CD1 3.41Å; M205-F222 HydrophobicContact CG-CD2 4.44Å; M205-F222 HydrophobicContact CG-CE1 3.71Å; M205-F222 HydrophobicContact CG-CG 3.8Å; M205-F222 HydrophobicContact CG-CZ 4.35Å
206	T	87.7	Confident	77.3	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-47.8	172.8	-55.1	0	0	0	0	111.6	L202 N208 W209 V210 Y219 P503 L605 F608	L202-T206 WeakPolarHBondContact O-CB 3.32Å; L202-T206 PolarHBondContact O-N 3.42Å; L202-T206 PolarHBondContact O-OG1 3.24Å; T206-N208 PolarHBondContact O-N 2.99Å; T206-W209 PolarHBondContact O-N 3.36Å; T206-V210 WeakPolarHBondContact O-CG2 3.13Å; T206-V210 PolarHBondContact O-N 3.16Å; T206-Y219 PolarHBondContact OG1-OH 3.24Å; T206-P503 HydrophobicContact CG2-CG 3.87Å; T206-L605 HydrophobicContact CG2-CD1 4.38Å; T206-F608 HydrophobicContact CG2-CD1 4.28Å; T206-F608 HydrophobicContact CG2-CE1 3.9Å
207	T	84.3	Confident	80.1	Confident	23 Å²	23	41 Å²	41	14%	0.141	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-45.3	178.8	-58.7	0	0	0	0	110.9	S203 W209 V210 L211	S203-T207 VanDerWaalsContact O-CB 3.25Å; S203-T207 WeakPolarHBondContact O-CB 3.41Å; S203-T207 PolarHBondContact O-N 2.84Å; S203-T207 PolarHBondContact O-OG1 2.87Å; T207-W209 PolarHBondContact O-N 2.97Å; T207-V210 PolarHBondContact O-N 3.07Å; T207-L211 HydrophobicContact CG2-CD1 3.9Å; T207-L211 WeakPolarHBondContact O-CB 3.27Å; T207-L211 VanDerWaalsContact O-CG 3.28Å; T207-L211 WeakPolarHBondContact O-CG 3.26Å; T207-L211 PolarHBondContact O-N 2.88Å
208	N	87.8	Confident	82.5	Confident	43 Å²	43	42.2 Å²	42.2	23%	0.23	23%	0.225	C	C	.	.	H	α-helix	trans	-63.9	-38	176	-77.4	-30	0	0	0	112.8	T204 T206 L211 H212 K213 V214	T204-N208 WeakPolarHBondContact CG2-ND2 3.42Å; T204-N208 VanDerWaalsContact O-CB 3.23Å; T204-N208 WeakPolarHBondContact O-CB 3.38Å; T204-N208 PolarHBondContact O-N 2.97Å; T204-N208 PolarHBondContact O-ND2 3.45Å; T204-N208 VanDerWaalsContact O-ND2 3.15Å; T206-N208 PolarHBondContact O-N 2.99Å; N208-L211 CarbonylContact O-C 3.48Å; N208-L211 PolarHBondContact O-N 2.86Å; N208-H212 PolarHBondContact O-N 3.01Å; N208-K213 HydrophobicContact CB-CB 3.84Å; N208-K213 WeakPolarHBondContact O-CA 3.38Å; N208-K213 PolarHBondContact O-N 3.45Å; N208-K213 VanDerWaalsContact OD1-CD 3.3Å; N208-K213 WeakPolarHBondContact OD1-CD 3.32Å; N208-V214 HydrophobicContact CB-CB 4.19Å; N208-V214 HydrophobicContact CB-CG2 3.67Å; N208-V214 PolarHBondContact O-N 3.17Å
209	W	91	Very high	84.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.8	-47.7	176.2	173.4	74.3	0	0	0	112	M205 T206 T207 L211 H212 V214 N216 Y219 L455 H456 I459 H502 P503 R505	M205-W209 WeakPolarHBondContact O-CB 3.38Å; M205-W209 PolarHBondContact O-N 3.17Å; T206-W209 PolarHBondContact O-N 3.36Å; T207-W209 PolarHBondContact O-N 2.97Å; W209-L211 VanDerWaalsContact C-N 3.25Å; W209-L211 PolarHBondContact O-N 3.43Å; W209-H212 PolarHBondContact O-N 2.88Å; W209-H212 VanDerWaalsContact O-N 3.12Å; W209-V214 HydrophobicContact CB-CB 4.37Å; W209-V214 HydrophobicContact CB-CG1 4.33Å; W209-N216 PolarHBondContact NE1-OD1 2.98Å; W209-Y219 HydrophobicContact CB-CD1 4.15Å; W209-Y219 HydrophobicContact CB-CD2 3.57Å; W209-Y219 HydrophobicContact CB-CE2 4.08Å; W209-Y219 HydrophobicContact CB-CG 3.65Å; W209-Y219 AromaticContact CD1-CD1 3.73Å; W209-Y219 AromaticContact CD1-CG 3.53Å; W209-Y219 AromaticContact CD2-CD1 3.46Å; W209-Y219 HydrophobicContact CD2-CD1 3.46Å; W209-Y219 VanDerWaalsContact CD2-CD1 3.46Å; W209-Y219 HydrophobicContact CD2-CD2 4.49Å; W209-Y219 AromaticContact CD2-CE1 3.73Å; W209-Y219 HydrophobicContact CD2-CE1 3.73Å; W209-Y219 AromaticContact CD2-CG 3.89Å; W209-Y219 HydrophobicContact CD2-CG 3.89Å; W209-Y219 AromaticContact CE2-CD1 3.66Å; W209-Y219 HydrophobicContact CE3-CD1 4.03Å; W209-Y219 AromaticContact CE3-CE1 3.8Å; W209-Y219 HydrophobicContact CE3-CE1 3.8Å; W209-Y219 AromaticContact CG-CD1 3.51Å; W209-Y219 HydrophobicContact CG-CD1 3.51Å; W209-Y219 AromaticContact CG-CD2 3.85Å; W209-Y219 HydrophobicContact CG-CD2 3.85Å; W209-Y219 HydrophobicContact CG-CE1 4.09Å; W209-Y219 HydrophobicContact CG-CE2 4.43Å; W209-Y219 AromaticContact CG-CG 3.38Å; W209-Y219 HydrophobicContact CG-CG 3.38Å; W209-Y219 HydrophobicContact CZ2-CD1 4.37Å; W209-Y219 HydrophobicContact CZ3-CE1 4.33Å; W209-Y219 AromaticContact NE1-CD1 3.79Å; W209-L455 HydrophobicContact CZ2-CB 4.39Å; W209-L455 HydrophobicContact CZ2-CD2 4.11Å; W209-L455 HydrophobicContact CZ2-CG 4.36Å; W209-H456 HydrophobicContact CH2-CB 4.35Å; W209-I459 HydrophobicContact CH2-CD1 4.25Å; W209-I459 HydrophobicContact CZ2-CD1 4.34Å; W209-H502 AromaticContact CE3-CE1 3.82Å; W209-H502 AromaticContact CZ3-CE1 3.35Å; W209-H502 WeakPolarHBondContact CZ3-CE1 3.12Å; W209-H502 AromaticContact CZ3-ND1 3.7Å; W209-P503 WeakPolarHBondContact CZ3-O 3.4Å; W209-R505 HydrophobicContact CD2-CB 4.48Å; W209-R505 HydrophobicContact CE3-CB 4.45Å; W209-R505 HydrophobicContact CH2-CB 3.77Å; W209-R505 HydrophobicContact CZ2-CB 3.79Å; W209-R505 HydrophobicContact CZ2-CG 4.45Å; W209-R505 HydrophobicContact CZ3-CB 4.09Å; W209-R505 WeakPolarHBondContact O-CG 3.47Å; W209-R505 PolarHBondContact O-NE 3.13Å
210	V	86.9	Confident	86.3	Confident	6 Å²	6	36.2 Å²	36.2	4%	0.036	19%	0.19	C	C	.	.	H	α-helix	trans	-59.2	-36.7	176.7	171.8	0	0	0	0	111.9	T206 T207 P503 I506 L605	T206-V210 WeakPolarHBondContact O-CG2 3.13Å; T206-V210 PolarHBondContact O-N 3.16Å; T207-V210 PolarHBondContact O-N 3.07Å; V210-P503 HydrophobicContact CG2-CB 4.13Å; V210-P503 HydrophobicContact CG2-CG 4.13Å; V210-I506 HydrophobicContact CG1-CD1 4.13Å; V210-I506 HydrophobicContact CG1-CG1 3.94Å; V210-I506 PolarHBondContact O-N 3.2Å; V210-L605 HydrophobicContact CG1-CD2 4.36Å; V210-L605 HydrophobicContact CG2-CD1 4.25Å
211	L	82.6	Confident	87.7	Confident	35 Å²	35	35.7 Å²	35.7	18%	0.183	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	10.7	178.4	-64.6	176.4	0	0	0	114.9	T207 N208 W209 K213 I506	T207-L211 HydrophobicContact CG2-CD1 3.9Å; T207-L211 WeakPolarHBondContact O-CB 3.27Å; T207-L211 VanDerWaalsContact O-CG 3.28Å; T207-L211 WeakPolarHBondContact O-CG 3.26Å; T207-L211 PolarHBondContact O-N 2.88Å; N208-L211 CarbonylContact O-C 3.48Å; N208-L211 PolarHBondContact O-N 2.86Å; W209-L211 VanDerWaalsContact C-N 3.25Å; W209-L211 PolarHBondContact O-N 3.43Å; L211-K213 PolarHBondContact O-N 2.69Å; L211-K213 VanDerWaalsContact O-N 3.13Å; L211-I506 HydrophobicContact CD2-CD1 4.3Å
212	H	82.7	Confident	88.4	Confident	61 Å²	61	32 Å²	32	28%	0.282	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	12	-175.7	-76.5	-105.9	0	0	0	116.2	N208 W209 V214 I506	N208-H212 PolarHBondContact O-N 3.01Å; W209-H212 PolarHBondContact O-N 2.88Å; W209-H212 VanDerWaalsContact O-N 3.12Å; H212-V214 VanDerWaalsContact C-N 3.26Å; H212-V214 PolarHBondContact O-N 3.01Å; H212-I506 PolarHBondContact CD2-O 3.43Å; H212-I506 PolarHBondContact NE2-O 3.12Å
213	K	80.7	Confident	88.9	Confident	115 Å²	115	31 Å²	31	50%	0.5	16%	0.161	S	C	.	.	S	Bend	trans	-72.5	-18.8	171.5	-67.5	-176.1	172.8	-172	0	112.5	N208 L211 D521	N208-K213 HydrophobicContact CB-CB 3.84Å; N208-K213 WeakPolarHBondContact O-CA 3.38Å; N208-K213 PolarHBondContact O-N 3.45Å; N208-K213 VanDerWaalsContact OD1-CD 3.3Å; N208-K213 WeakPolarHBondContact OD1-CD 3.32Å; L211-K213 PolarHBondContact O-N 2.69Å; L211-K213 VanDerWaalsContact O-N 3.13Å; K213-D521 IonicContact NZ-OD1 2.8Å
214	V	87.9	Confident	89.3	Confident	24 Å²	24	30.4 Å²	30.4	15%	0.145	16%	0.157	C	C	.	.	S	Bend	trans	-128.1	144.6	177.4	161.9	0	0	0	0	109.9	M205 N208 W209 H212 D218 R505	M205-V214 HydrophobicContact CE-CG1 3.62Å; M205-V214 HydrophobicContact CE-CG2 4.33Å; M205-V214 HydrophobicContact SD-CB 4.39Å; M205-V214 HydrophobicContact SD-CG1 3.88Å; M205-V214 HydrophobicContact SD-CG2 3.72Å; N208-V214 HydrophobicContact CB-CB 4.19Å; N208-V214 HydrophobicContact CB-CG2 3.67Å; N208-V214 PolarHBondContact O-N 3.17Å; W209-V214 HydrophobicContact CB-CB 4.37Å; W209-V214 HydrophobicContact CB-CG1 4.33Å; H212-V214 VanDerWaalsContact C-N 3.26Å; H212-V214 PolarHBondContact O-N 3.01Å; V214-D218 HydrophobicContact CG1-CB 4.18Å; V214-R505 PolarHBondContact O-NH2 2.78Å
215	T	91.9	Very high	89.6	Confident	49 Å²	49	31.8 Å²	31.8	30%	0.301	16%	0.158	S	C	.	.			trans	-74.9	160.3	-179.4	77.2	0	0	0	0	112.3	Y217 D218 Y219 E447	T215-Y217 VanDerWaalsContact C-N 3.32Å; T215-Y217 PolarHBondContact OG1-N 3.46Å; T215-D218 WeakPolarHBondContact CB-OD2 3.01Å; T215-D218 WeakPolarHBondContact CG2-OD2 3.23Å; T215-D218 WeakPolarHBondContact OG1-CB 3.1Å; T215-D218 PolarHBondContact OG1-N 3.08Å; T215-D218 PolarHBondContact OG1-OD2 2.52Å; T215-Y219 WeakPolarHBondContact O-CB 3.4Å; T215-Y219 PolarHBondContact O-N 3.37Å; T215-Y219 VanDerWaalsContact O-N 3.11Å; T215-E447 WeakPolarHBondContact CB-OE1 3.3Å
216	N	93.7	Very high	89.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-40.8	171	-68	-23.4	0	0	0	111	W209 L220 L446 E447 S452 L455 R505	W209-N216 PolarHBondContact NE1-OD1 2.98Å; N216-L220 WeakPolarHBondContact O-CB 3.49Å; N216-L220 VanDerWaalsContact O-CG 3.26Å; N216-L220 WeakPolarHBondContact O-CG 3.43Å; N216-L220 PolarHBondContact O-N 2.92Å; N216-L446 HydrophobicContact CB-CD1 4.12Å; N216-L446 HydrophobicContact CB-CG 4.07Å; N216-L446 PolarHBondContact ND2-O 3.17Å; N216-E447 WeakPolarHBondContact CA-OE1 3.37Å; N216-E447 VanDerWaalsContact CB-OE1 3.28Å; N216-E447 WeakPolarHBondContact CB-OE1 3.34Å; N216-E447 VanDerWaalsContact N-CD 3.25Å; N216-E447 PolarHBondContact N-OE1 2.78Å; N216-E447 PolarHBondContact N-OE2 2.97Å; N216-S452 PolarHBondContact ND2-OG 2.83Å; N216-L455 HydrophobicContact CB-CD2 3.7Å; N216-R505 PolarHBondContact ND2-NH1 3.5Å; N216-R505 WeakPolarHBondContact OD1-CD 3.31Å; N216-R505 VanDerWaalsContact OD1-CZ 3.27Å; N216-R505 PolarHBondContact OD1-NE 2.93Å; N216-R505 PolarHBondContact OD1-NH1 2.83Å
217	Y	95.1	Very high	89.4	Confident	37 Å²	37	32.8 Å²	32.8	15%	0.145	16%	0.164	C	C	.	.	H	α-helix	trans	-59.4	-51.7	176.9	-179	-91.1	0	0	0	112.5	T215 Y219 L220 M221 L240 P407 F410 T411 L446 E447	T215-Y217 VanDerWaalsContact C-N 3.32Å; T215-Y217 PolarHBondContact OG1-N 3.46Å; Y217-Y219 VanDerWaalsContact C-N 3.32Å; Y217-Y219 PolarHBondContact O-N 3.09Å; Y217-L220 PolarHBondContact O-N 2.76Å; Y217-M221 HydrophobicContact CD1-CG 4.16Å; Y217-M221 HydrophobicContact CE1-CG 3.56Å; Y217-M221 HydrophobicContact CE2-CG 4.19Å; Y217-M221 HydrophobicContact CE2-SD 4.49Å; Y217-M221 WeakPolarHBondContact O-CG 3.44Å; Y217-M221 PolarHBondContact O-N 2.81Å; Y217-L240 HydrophobicContact CD2-CD2 3.67Å; Y217-L240 HydrophobicContact CE2-CD2 4Å; Y217-P407 HydrophobicContact CE2-CB 4.15Å; Y217-F410 HydrophobicContact CD2-CB 3.98Å; Y217-F410 HydrophobicContact CD2-CG 4.45Å; Y217-F410 HydrophobicContact CE2-CB 3.89Å; Y217-T411 HydrophobicContact CE1-CG2 3.99Å; Y217-T411 HydrophobicContact CE2-CG2 3.8Å; Y217-T411 VanDerWaalsContact CZ-CG2 3.44Å; Y217-T411 WeakPolarHBondContact OH-CG2 3.32Å; Y217-L446 HydrophobicContact CD2-CD2 4.26Å; Y217-E447 PolarHBondContact N-OE1 3.06Å
218	D	93.8	Very high	89.3	Confident	80 Å²	80	33.3 Å²	33.3	43%	0.428	17%	0.174	S	C	.	.	H	α-helix	trans	-66	-37.2	-176.8	-58	-45.8	0	0	0	111.5	M205 V214 T215 M221 F222	M205-D218 HydrophobicContact CE-CB 4.34Å; V214-D218 HydrophobicContact CG1-CB 4.18Å; T215-D218 WeakPolarHBondContact CB-OD2 3.01Å; T215-D218 WeakPolarHBondContact CG2-OD2 3.23Å; T215-D218 WeakPolarHBondContact OG1-CB 3.1Å; T215-D218 PolarHBondContact OG1-N 3.08Å; T215-D218 PolarHBondContact OG1-OD2 2.52Å; D218-M221 PolarHBondContact O-N 2.7Å; D218-F222 WeakPolarHBondContact O-CB 3.5Å; D218-F222 PolarHBondContact O-N 3.15Å
219	Y	94.8	Very high	89.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65.8	-45.4	175.5	-170.6	-114.5	0	0	0	112.2	M205 T206 W209 T215 Y217 M221 F222 L223 I459 H502	M205-Y219 HydrophobicContact CG-CD2 3.96Å; M205-Y219 HydrophobicContact CG-CE2 4.27Å; T206-Y219 PolarHBondContact OG1-OH 3.24Å; W209-Y219 HydrophobicContact CB-CD1 4.15Å; W209-Y219 HydrophobicContact CB-CD2 3.57Å; W209-Y219 HydrophobicContact CB-CE2 4.08Å; W209-Y219 HydrophobicContact CB-CG 3.65Å; W209-Y219 AromaticContact CD1-CD1 3.73Å; W209-Y219 AromaticContact CD1-CG 3.53Å; W209-Y219 AromaticContact CD2-CD1 3.46Å; W209-Y219 HydrophobicContact CD2-CD1 3.46Å; W209-Y219 VanDerWaalsContact CD2-CD1 3.46Å; W209-Y219 HydrophobicContact CD2-CD2 4.49Å; W209-Y219 AromaticContact CD2-CE1 3.73Å; W209-Y219 HydrophobicContact CD2-CE1 3.73Å; W209-Y219 AromaticContact CD2-CG 3.89Å; W209-Y219 HydrophobicContact CD2-CG 3.89Å; W209-Y219 AromaticContact CE2-CD1 3.66Å; W209-Y219 HydrophobicContact CE3-CD1 4.03Å; W209-Y219 AromaticContact CE3-CE1 3.8Å; W209-Y219 HydrophobicContact CE3-CE1 3.8Å; W209-Y219 AromaticContact CG-CD1 3.51Å; W209-Y219 HydrophobicContact CG-CD1 3.51Å; W209-Y219 AromaticContact CG-CD2 3.85Å; W209-Y219 HydrophobicContact CG-CD2 3.85Å; W209-Y219 HydrophobicContact CG-CE1 4.09Å; W209-Y219 HydrophobicContact CG-CE2 4.43Å; W209-Y219 AromaticContact CG-CG 3.38Å; W209-Y219 HydrophobicContact CG-CG 3.38Å; W209-Y219 HydrophobicContact CZ2-CD1 4.37Å; W209-Y219 HydrophobicContact CZ3-CE1 4.33Å; W209-Y219 AromaticContact NE1-CD1 3.79Å; T215-Y219 WeakPolarHBondContact O-CB 3.4Å; T215-Y219 PolarHBondContact O-N 3.37Å; T215-Y219 VanDerWaalsContact O-N 3.11Å; Y217-Y219 VanDerWaalsContact C-N 3.32Å; Y217-Y219 PolarHBondContact O-N 3.09Å; Y219-M221 VanDerWaalsContact C-N 3.33Å; Y219-M221 PolarHBondContact O-N 3.18Å; Y219-F222 HydrophobicContact CE2-CD1 4.39Å; Y219-F222 PolarHBondContact O-N 3.03Å; Y219-L223 HydrophobicContact CD1-CD1 4.15Å; Y219-L223 HydrophobicContact CD1-CG 4.41Å; Y219-L223 HydrophobicContact CE1-CD1 3.63Å; Y219-L223 HydrophobicContact CE1-CD2 4.45Å; Y219-L223 HydrophobicContact CE1-CG 4.06Å; Y219-L223 HydrophobicContact CE2-CD2 4.41Å; Y219-L223 WeakPolarHBondContact O-CG 3.43Å; Y219-L223 PolarHBondContact O-N 2.89Å; Y219-I459 HydrophobicContact CD1-CD1 4.24Å; Y219-I459 HydrophobicContact CE1-CD1 3.94Å; Y219-H502 AromaticContact CE1-CE1 3.62Å; Y219-H502 AromaticContact CE1-NE2 3.53Å; Y219-H502 AromaticContact CZ-CE1 3.9Å; Y219-H502 AromaticContact CZ-NE2 3.57Å; Y219-H502 PolarHBondContact OH-CE1 3.31Å; Y219-H502 PolarHBondContact OH-NE2 3.33Å
220	L	94.9	Very high	89.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.9	-36.1	176.1	-69.6	-176	0	0	0	112.2	N216 Y217 L223 N224 L240 P241 L446 L455 W458 I459	N216-L220 WeakPolarHBondContact O-CB 3.49Å; N216-L220 VanDerWaalsContact O-CG 3.26Å; N216-L220 WeakPolarHBondContact O-CG 3.43Å; N216-L220 PolarHBondContact O-N 2.92Å; Y217-L220 PolarHBondContact O-N 2.76Å; L220-L223 PolarHBondContact O-N 2.92Å; L220-N224 PolarHBondContact O-N 2.95Å; L220-N224 PolarHBondContact O-ND2 2.91Å; L220-L240 HydrophobicContact CB-CD2 4.43Å; L220-L240 HydrophobicContact CB-CG 4.26Å; L220-L240 HydrophobicContact CD1-CD2 4.04Å; L220-L240 HydrophobicContact CD1-CG 3.98Å; L220-P241 VanDerWaalsContact CD1-CD 3.48Å; L220-P241 HydrophobicContact CD1-CG 4.21Å; L220-L446 HydrophobicContact CD1-CD1 4.32Å; L220-L455 HydrophobicContact CD1-CD1 4.22Å; L220-L455 HydrophobicContact CD1-CD2 4.24Å; L220-L455 HydrophobicContact CD2-CD2 4.49Å; L220-L455 HydrophobicContact CG-CD2 4.38Å; L220-W458 HydrophobicContact CD1-CZ3 4.24Å; L220-W458 HydrophobicContact CD2-CE3 4.27Å; L220-W458 HydrophobicContact CD2-CZ3 3.83Å; L220-I459 HydrophobicContact CD2-CD1 4.05Å; L220-I459 HydrophobicContact CD2-CG1 3.93Å
221	M	94.2	Very high	89.2	Confident	39 Å²	39	40 Å²	40	19%	0.192	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-41.2	173.8	-76.1	-52.5	-49.5	0	0	112.1	Y217 D218 Y219 N224 E225 K231 A238 L240 P407	Y217-M221 HydrophobicContact CD1-CG 4.16Å; Y217-M221 HydrophobicContact CE1-CG 3.56Å; Y217-M221 HydrophobicContact CE2-CG 4.19Å; Y217-M221 HydrophobicContact CE2-SD 4.49Å; Y217-M221 WeakPolarHBondContact O-CG 3.44Å; Y217-M221 PolarHBondContact O-N 2.81Å; D218-M221 PolarHBondContact O-N 2.7Å; Y219-M221 VanDerWaalsContact C-N 3.33Å; Y219-M221 PolarHBondContact O-N 3.18Å; M221-N224 PolarHBondContact O-N 2.97Å; M221-E225 PolarHBondContact O-N 2.78Å; M221-K231 HydrophobicContact CE-CB 4.05Å; M221-A238 HydrophobicContact CE-CB 4.06Å; M221-A238 HydrophobicContact SD-CB 4.35Å; M221-L240 HydrophobicContact SD-CD1 4.13Å; M221-P407 HydrophobicContact CE-CG 4.41Å; M221-P407 HydrophobicContact SD-CB 3.77Å; M221-P407 HydrophobicContact SD-CG 3.65Å
222	F	93.1	Very high	89.3	Confident	9 Å²	9	40.4 Å²	40.4	4%	0.039	22%	0.215	C	C	.	.	H	α-helix	trans	-63.4	-40.1	173.9	170.8	-107.6	0	0	0	112.9	K201 L202 M205 D218 Y219 N224 E225 L226	K201-F222 HydrophobicContact CD-CE2 3.88Å; K201-F222 HydrophobicContact CG-CE2 3.89Å; K201-F222 HydrophobicContact CG-CZ 4.12Å; L202-F222 HydrophobicContact CB-CE1 4.42Å; L202-F222 HydrophobicContact CB-CZ 4.22Å; L202-F222 HydrophobicContact CD1-CE1 3.87Å; L202-F222 HydrophobicContact CD1-CZ 4.46Å; M205-F222 HydrophobicContact CB-CD1 3.96Å; M205-F222 HydrophobicContact CB-CE1 3.7Å; M205-F222 HydrophobicContact CB-CZ 4.16Å; M205-F222 HydrophobicContact CE-CB 3.92Å; M205-F222 HydrophobicContact CE-CG 4.33Å; M205-F222 HydrophobicContact CG-CB 4.3Å; M205-F222 HydrophobicContact CG-CD1 3.41Å; M205-F222 VanDerWaalsContact CG-CD1 3.41Å; M205-F222 HydrophobicContact CG-CD2 4.44Å; M205-F222 HydrophobicContact CG-CE1 3.71Å; M205-F222 HydrophobicContact CG-CG 3.8Å; M205-F222 HydrophobicContact CG-CZ 4.35Å; D218-F222 WeakPolarHBondContact O-CB 3.5Å; D218-F222 PolarHBondContact O-N 3.15Å; Y219-F222 HydrophobicContact CE2-CD1 4.39Å; Y219-F222 PolarHBondContact O-N 3.03Å; F222-N224 VanDerWaalsContact C-N 3.35Å; F222-E225 PolarHBondContact O-N 3.05Å; F222-L226 HydrophobicContact CD1-CD1 4.26Å; F222-L226 HydrophobicContact CD2-CG 4.5Å; F222-L226 HydrophobicContact CE1-CD1 3.6Å; F222-L226 HydrophobicContact CE1-CG 4.36Å; F222-L226 HydrophobicContact CE2-CD1 4.11Å; F222-L226 HydrophobicContact CE2-CD2 4.28Å; F222-L226 HydrophobicContact CE2-CG 4.06Å; F222-L226 HydrophobicContact CZ-CD1 3.53Å; F222-L226 HydrophobicContact CZ-CD2 4.33Å; F222-L226 HydrophobicContact CZ-CG 4Å; F222-L226 WeakPolarHBondContact O-CG 3.48Å; F222-L226 PolarHBondContact O-N 2.81Å
223	L	91.8	Very high	89.5	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.6	-35.1	174.1	-66.9	-170.1	0	0	0	112.8	Y219 L220 A227 I459 F463 L497 F498	Y219-L223 HydrophobicContact CD1-CD1 4.15Å; Y219-L223 HydrophobicContact CD1-CG 4.41Å; Y219-L223 HydrophobicContact CE1-CD1 3.63Å; Y219-L223 HydrophobicContact CE1-CD2 4.45Å; Y219-L223 HydrophobicContact CE1-CG 4.06Å; Y219-L223 HydrophobicContact CE2-CD2 4.41Å; Y219-L223 WeakPolarHBondContact O-CG 3.43Å; Y219-L223 PolarHBondContact O-N 2.89Å; L220-L223 PolarHBondContact O-N 2.92Å; L223-A227 WeakPolarHBondContact O-CB 3.29Å; L223-A227 PolarHBondContact O-N 3.26Å; L223-A227 VanDerWaalsContact O-N 3.11Å; L223-I459 HydrophobicContact CD1-CD1 4.03Å; L223-I459 HydrophobicContact CD1-CG1 4.18Å; L223-I459 HydrophobicContact CD1-CG2 3.67Å; L223-F463 HydrophobicContact CB-CD1 4.43Å; L223-F463 HydrophobicContact CB-CE1 4.42Å; L223-L497 HydrophobicContact CD2-CD1 4.4Å; L223-L497 WeakPolarHBondContact O-CD1 3.27Å; L223-F498 HydrophobicContact CD1-CE2 4.24Å; L223-F498 HydrophobicContact CD2-CE2 3.99Å; L223-F498 HydrophobicContact CD2-CZ 3.63Å
224	N	90.9	Very high	89.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.6	-47.1	171.7	-81.5	-79.2	0	0	0	111.2	L220 M221 F222 L226 A227 G228 R229 A238 I239	L220-N224 PolarHBondContact O-N 2.95Å; L220-N224 PolarHBondContact O-ND2 2.91Å; M221-N224 PolarHBondContact O-N 2.97Å; F222-N224 VanDerWaalsContact C-N 3.35Å; N224-L226 VanDerWaalsContact C-N 3.33Å; N224-L226 PolarHBondContact O-N 3.46Å; N224-A227 CarbonylContact O-C 3.53Å; N224-A227 WeakPolarHBondContact O-CA 3.3Å; N224-A227 PolarHBondContact O-N 2.73Å; N224-G228 PolarHBondContact O-N 3.09Å; N224-R229 CarbonylContact C-O 3.55Å; N224-R229 HydrophobicContact CB-CB 3.95Å; N224-R229 WeakPolarHBondContact O-CA 3.22Å; N224-R229 WeakPolarHBondContact O-CB 3.47Å; N224-R229 PolarHBondContact O-N 2.85Å; N224-R229 VanDerWaalsContact O-O 3.12Å; N224-R229 VanDerWaalsContact OD1-CD 3.26Å; N224-R229 WeakPolarHBondContact OD1-CD 3.22Å; N224-A238 HydrophobicContact CB-CB 3.82Å; N224-A238 VanDerWaalsContact OD1-CA 3.29Å; N224-A238 WeakPolarHBondContact OD1-CA 3.39Å; N224-I239 PolarHBondContact ND2-O 3.48Å; N224-I239 PolarHBondContact OD1-N 3.05Å
225	E	88.4	Confident	89.1	Confident	107 Å²	107	38 Å²	38	50%	0.5	22%	0.216	S	C	.	.	H	α-helix	trans	-55.5	-45.8	176.8	-170.8	-172.4	174.5	0	0	111.5	M221 F222 A227 G228 R229	M221-E225 PolarHBondContact O-N 2.78Å; F222-E225 PolarHBondContact O-N 3.05Å; E225-A227 VanDerWaalsContact C-N 3.32Å; E225-A227 PolarHBondContact O-N 2.89Å; E225-G228 PolarHBondContact O-N 2.78Å; E225-R229 PolarHBondContact N-O 2.88Å
226	L	86.1	Confident	88.7	Confident	56 Å²	56	37 Å²	37	29%	0.293	21%	0.208	S	C	.	.	H	α-helix	trans	-63.5	-32.5	174.8	-72.8	-178.1	0	0	0	113.7	L202 F222 N224 G228 L497	L202-L226 HydrophobicContact CD1-CD1 3.98Å; F222-L226 HydrophobicContact CD1-CD1 4.26Å; F222-L226 HydrophobicContact CD2-CG 4.5Å; F222-L226 HydrophobicContact CE1-CD1 3.6Å; F222-L226 HydrophobicContact CE1-CG 4.36Å; F222-L226 HydrophobicContact CE2-CD1 4.11Å; F222-L226 HydrophobicContact CE2-CD2 4.28Å; F222-L226 HydrophobicContact CE2-CG 4.06Å; F222-L226 HydrophobicContact CZ-CD1 3.53Å; F222-L226 HydrophobicContact CZ-CD2 4.33Å; F222-L226 HydrophobicContact CZ-CG 4Å; F222-L226 WeakPolarHBondContact O-CG 3.48Å; F222-L226 PolarHBondContact O-N 2.81Å; N224-L226 VanDerWaalsContact C-N 3.33Å; N224-L226 PolarHBondContact O-N 3.46Å; L226-G228 PolarHBondContact O-N 2.69Å; L226-L497 HydrophobicContact CB-CD1 3.91Å; L226-L497 HydrophobicContact CB-CD2 4.25Å
227	A	83.7	Confident	88.4	Confident	4 Å²	4	37.3 Å²	37.3	3%	0.033	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	7.7	174.2	0	0	0	0	0	113.6	L223 N224 E225 R229 F463 V495 L497	L223-A227 WeakPolarHBondContact O-CB 3.29Å; L223-A227 PolarHBondContact O-N 3.26Å; L223-A227 VanDerWaalsContact O-N 3.11Å; N224-A227 CarbonylContact O-C 3.53Å; N224-A227 WeakPolarHBondContact O-CA 3.3Å; N224-A227 PolarHBondContact O-N 2.73Å; E225-A227 VanDerWaalsContact C-N 3.32Å; E225-A227 PolarHBondContact O-N 2.89Å; A227-R229 HydrophobicContact CB-CG 4.44Å; A227-R229 PolarHBondContact O-N 3.43Å; A227-F463 HydrophobicContact CB-CD1 3.93Å; A227-F463 HydrophobicContact CB-CE1 3.85Å; A227-V495 HydrophobicContact CB-CB 4.34Å; A227-L497 HydrophobicContact CB-CD1 4.26Å; A227-L497 HydrophobicContact CB-CD2 4.38Å; A227-L497 HydrophobicContact CB-CG 4.42Å
228	G	82.5	Confident	88.2	Confident	34 Å²	34	35.6 Å²	35.6	35%	0.351	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	7	-176.1	0	0	0	0	0	114.5	N224 E225 L226 H230	N224-G228 PolarHBondContact O-N 3.09Å; E225-G228 PolarHBondContact O-N 2.78Å; L226-G228 PolarHBondContact O-N 2.69Å; G228-H230 PolarHBondContact O-CE1 3.27Å; G228-H230 VanDerWaalsContact O-CE1 3.29Å; G228-H230 PolarHBondContact O-ND1 2.88Å
229	R	87.9	Confident	88.1	Confident	8 Å²	8	31.8 Å²	31.8	3%	0.03	18%	0.183	C	C	.	.			trans	-88.7	134.2	179.7	-63.9	-180	176.4	138.5	3	111.4	N224 E225 A227 N236 N462 G493	N224-R229 CarbonylContact C-O 3.55Å; N224-R229 HydrophobicContact CB-CB 3.95Å; N224-R229 WeakPolarHBondContact O-CA 3.22Å; N224-R229 WeakPolarHBondContact O-CB 3.47Å; N224-R229 PolarHBondContact O-N 2.85Å; N224-R229 VanDerWaalsContact O-O 3.12Å; N224-R229 VanDerWaalsContact OD1-CD 3.26Å; N224-R229 WeakPolarHBondContact OD1-CD 3.22Å; E225-R229 PolarHBondContact N-O 2.88Å; A227-R229 HydrophobicContact CB-CG 4.44Å; A227-R229 PolarHBondContact O-N 3.43Å; R229-N236 CarbonylContact C-O 3.49Å; R229-N236 WeakPolarHBondContact CA-O 3.21Å; R229-N462 PolarHBondContact NH1-O 2.93Å; R229-G493 PolarHBondContact NE-O 3.05Å; R229-G493 PolarHBondContact NH2-O 3.33Å
230	H	87.1	Confident	88	Confident	98 Å²	98	31.8 Å²	31.8	45%	0.454	18%	0.183	S	C	.	.	B	Isolated β-bridge	trans	-125.7	146.4	-173	-65.1	83.1	0	0	0	111.5	G228 G232 D233 N236 A238	G228-H230 PolarHBondContact O-CE1 3.27Å; G228-H230 VanDerWaalsContact O-CE1 3.29Å; G228-H230 PolarHBondContact O-ND1 2.88Å; H230-G232 PolarHBondContact O-N 3.39Å; H230-D233 HydrophobicContact CB-CB 4.29Å; H230-N236 PolarHBondContact N-O 3.07Å; H230-A238 PolarHBondContact O-N 3.25Å
231	K	89.5	Confident	88	Confident	85 Å²	85	31.8 Å²	31.8	37%	0.37	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	129.6	169.9	-176.1	-173.9	176.2	-172.5	0	109	M221 P407 E408 T411	M221-K231 HydrophobicContact CE-CB 4.05Å; K231-P407 HydrophobicContact CB-CG 4.24Å; K231-P407 HydrophobicContact CD-CB 4.02Å; K231-P407 HydrophobicContact CG-CB 4.06Å; K231-P407 HydrophobicContact CG-CG 4.11Å; K231-E408 VanDerWaalsContact CE-OE1 3.22Å; K231-E408 WeakPolarHBondContact CE-OE1 3.17Å; K231-E408 WeakPolarHBondContact CG-OE1 3.45Å; K231-T411 PolarHBondContact NZ-OG1 2.93Å
232	G	85.2	Confident	87.9	Confident	43 Å²	43	29.9 Å²	29.9	44%	0.443	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	-5.2	177.7	0	0	0	0	0	116.5	H230 Y364 E408	H230-G232 PolarHBondContact O-N 3.39Å; G232-Y364 WeakPolarHBondContact CA-OH 3.23Å; G232-E408 PolarHBondContact N-OE1 2.98Å
233	D	85.2	Confident	87.9	Confident	53 Å²	53	29.6 Å²	29.6	28%	0.283	17%	0.173	S	C	.	.			trans	-93.3	117.7	172.5	-176.3	-15.3	0	0	0	109.7	H230 S235 N236 S237	H230-D233 HydrophobicContact CB-CB 4.29Å; D233-S235 VanDerWaalsContact C-N 3.33Å; D233-S235 PolarHBondContact O-N 3.11Å; D233-S235 WeakPolarHBondContact OD1-CA 3.33Å; D233-S235 WeakPolarHBondContact OD1-CB 3.44Å; D233-S235 PolarHBondContact OD1-N 2.76Å; D233-S235 PolarHBondContact OD1-OG 2.65Å; D233-S235 PolarHBondContact OD2-OG 2.99Å; D233-N236 CarbonylContact O-C 3.6Å; D233-N236 PolarHBondContact OD1-N 3.37Å; D233-S237 WeakPolarHBondContact O-CA 3.2Å; D233-S237 WeakPolarHBondContact O-CB 3.49Å; D233-S237 PolarHBondContact O-N 3.06Å
234	P	82.8	Confident	87.8	Confident	28 Å²	28	29.7 Å²	29.7	18%	0.182	17%	0.173	C	C	.	.	S	Bend	trans	-62.6	-37.3	176	-20.7	32.2	0	0	0	113.5	D361 Y364 Y365	P234-D361 VanDerWaalsContact CB-OD1 3.32Å; P234-D361 WeakPolarHBondContact CB-OD1 3.14Å; P234-Y364 HydrophobicContact CB-CD1 3.68Å; P234-Y364 HydrophobicContact CB-CE1 4.08Å; P234-Y364 HydrophobicContact CB-CG 4.32Å; P234-Y364 HydrophobicContact CG-CD1 3.89Å; P234-Y364 HydrophobicContact CG-CE1 3.77Å; P234-Y365 HydrophobicContact CB-CE2 3.97Å; P234-Y365 HydrophobicContact CG-CE1 4.15Å; P234-Y365 HydrophobicContact CG-CE2 4.37Å; P234-Y365 WeakPolarHBondContact CG-OH 3.04Å
235	S	78.3	Confident	87.6	Confident	69 Å²	69	31.5 Å²	31.5	48%	0.483	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-24.7	-172.9	70.4	0	0	0	0	113.5	D233	D233-S235 VanDerWaalsContact C-N 3.33Å; D233-S235 PolarHBondContact O-N 3.11Å; D233-S235 WeakPolarHBondContact OD1-CA 3.33Å; D233-S235 WeakPolarHBondContact OD1-CB 3.44Å; D233-S235 PolarHBondContact OD1-N 2.76Å; D233-S235 PolarHBondContact OD1-OG 2.65Å; D233-S235 PolarHBondContact OD2-OG 2.99Å
236	N	83.2	Confident	87.7	Confident	27 Å²	27	26.5 Å²	26.5	14%	0.144	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-137.9	48.1	179.4	-75.5	-78.7	0	0	0	110.2	R229 H230 D233 A238 R491 G493	R229-N236 CarbonylContact C-O 3.49Å; R229-N236 WeakPolarHBondContact CA-O 3.21Å; H230-N236 PolarHBondContact N-O 3.07Å; D233-N236 CarbonylContact O-C 3.6Å; D233-N236 PolarHBondContact OD1-N 3.37Å; N236-A238 PolarHBondContact O-N 2.92Å; N236-R491 PolarHBondContact ND2-O 3.11Å; N236-R491 PolarHBondContact OD1-O 2.65Å; N236-R491 VanDerWaalsContact OD1-O 3.08Å; N236-G493 WeakPolarHBondContact OD1-CA 3.24Å; N236-G493 PolarHBondContact OD1-N 3Å
237	S	87.3	Confident	87.6	Confident	7 Å²	7	28.9 Å²	28.9	5%	0.049	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-58.5	128.8	-177.2	-179.3	0	0	0	0	110.7	D233 Y364	D233-S237 WeakPolarHBondContact O-CA 3.2Å; D233-S237 WeakPolarHBondContact O-CB 3.49Å; D233-S237 PolarHBondContact O-N 3.06Å; S237-Y364 WeakPolarHBondContact OG-CD2 3.16Å
238	A	90.8	Very high	87.5	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.192	C	C	.	.			trans	-56.2	141.5	163	0	0	0	0	0	110.2	M221 N224 H230 N236 P407	M221-A238 HydrophobicContact CE-CB 4.06Å; M221-A238 HydrophobicContact SD-CB 4.35Å; N224-A238 HydrophobicContact CB-CB 3.82Å; N224-A238 VanDerWaalsContact OD1-CA 3.29Å; N224-A238 WeakPolarHBondContact OD1-CA 3.39Å; H230-A238 PolarHBondContact O-N 3.25Å; N236-A238 PolarHBondContact O-N 2.92Å; A238-P407 HydrophobicContact CB-CG 3.64Å; A238-P407 VanDerWaalsContact O-CD 3.25Å; A238-P407 WeakPolarHBondContact O-CD 3.34Å
239	I	91.7	Very high	87.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.192	C	C	.	.			trans	-122.6	143.2	-178.2	63.9	165.8	0	0	0	111.6	N224 I358 M359 C405 W458 N462 F463	N224-I239 PolarHBondContact ND2-O 3.48Å; N224-I239 PolarHBondContact OD1-N 3.05Å; I239-I358 HydrophobicContact CD1-CG2 3.88Å; I239-I358 HydrophobicContact CG2-CG2 4.45Å; I239-M359 HydrophobicContact CB-CE 4.46Å; I239-M359 HydrophobicContact CG2-CB 4.06Å; I239-M359 HydrophobicContact CG2-CE 3.67Å; I239-M359 HydrophobicContact CG2-CG 4.45Å; I239-C405 WeakPolarHBondContact CA-O 3.17Å; I239-W458 HydrophobicContact CD1-CH2 4.23Å; I239-W458 HydrophobicContact CD1-CZ2 4.2Å; I239-W458 HydrophobicContact CG1-CH2 4.07Å; I239-W458 HydrophobicContact CG1-CZ2 4.41Å; I239-N462 HydrophobicContact CD1-CB 4.08Å; I239-N462 WeakPolarHBondContact CD1-OD1 3.44Å; I239-F463 HydrophobicContact CG1-CZ 4.13Å
240	L	94.1	Very high	86.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-131.5	157.9	172.7	-82.9	90.2	0	0	0	109.6	Y217 L220 M221 C405 P407 F410 L446	Y217-L240 HydrophobicContact CD2-CD2 3.67Å; Y217-L240 HydrophobicContact CE2-CD2 4Å; L220-L240 HydrophobicContact CB-CD2 4.43Å; L220-L240 HydrophobicContact CB-CG 4.26Å; L220-L240 HydrophobicContact CD1-CD2 4.04Å; L220-L240 HydrophobicContact CD1-CG 3.98Å; M221-L240 HydrophobicContact SD-CD1 4.13Å; L240-C405 PolarHBondContact N-O 2.83Å; L240-C405 WeakPolarHBondContact O-CA 3.38Å; L240-C405 WeakPolarHBondContact O-CB 3.48Å; L240-C405 PolarHBondContact O-N 2.85Å; L240-P407 HydrophobicContact CD1-CB 3.82Å; L240-P407 HydrophobicContact CD1-CG 3.56Å; L240-F410 HydrophobicContact CB-CD2 4.38Å; L240-F410 HydrophobicContact CB-CE2 3.75Å; L240-F410 HydrophobicContact CB-CZ 4.48Å; L240-F410 HydrophobicContact CD2-CD2 3.88Å; L240-F410 HydrophobicContact CD2-CE2 3.87Å; L240-F410 HydrophobicContact CD2-CG 4.47Å; L240-F410 HydrophobicContact CD2-CZ 4.46Å; L240-F410 HydrophobicContact CG-CE2 4.4Å; L240-L446 HydrophobicContact CD2-CD2 3.92Å
241	P	93.9	Very high	85.5	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.217	C	C	.	.			trans	-69.2	139.6	176.9	28.2	-34.4	0	0	0	111.2	L220 I243 L256 L446 L455 W458	L220-P241 VanDerWaalsContact CD1-CD 3.48Å; L220-P241 HydrophobicContact CD1-CG 4.21Å; P241-I243 HydrophobicContact CB-CD1 4.2Å; P241-I243 HydrophobicContact CG-CD1 3.83Å; P241-L256 HydrophobicContact CB-CD2 4Å; P241-L446 HydrophobicContact CG-CD1 4.33Å; P241-L455 HydrophobicContact CG-CD1 3.78Å; P241-W458 HydrophobicContact CB-CD2 3.83Å; P241-W458 HydrophobicContact CB-CE3 4.4Å; P241-W458 HydrophobicContact CB-CG 4.03Å; P241-W458 HydrophobicContact CB-CZ2 4.26Å; P241-W458 HydrophobicContact CG-CD2 4.19Å; P241-W458 HydrophobicContact CG-CE3 4.26Å
242	W	92.8	Very high	85.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.237	C	C	.	.			trans	-65	131.9	156.2	-71	107.8	0	0	0	110.2	F246 R254 Y367 I394 Y398 D403 E404 C405 F409	W242-F246 AromaticContact CE3-CE2 3.75Å; W242-F246 HydrophobicContact CE3-CE2 3.75Å; W242-F246 HydrophobicContact CE3-CZ 4.07Å; W242-F246 AromaticContact CZ3-CE2 3.73Å; W242-F246 HydrophobicContact CZ3-CE2 3.73Å; W242-F246 HydrophobicContact CZ3-CZ 4.1Å; W242-R254 WeakPolarHBondContact O-CB 3.42Å; W242-R254 WeakPolarHBondContact O-CD 3.43Å; W242-R254 PolarHBondContact O-NE 2.68Å; W242-Y367 HydrophobicContact CZ2-CE1 4Å; W242-Y367 HydrophobicContact CZ2-CE2 4.47Å; W242-Y367 AromaticContact CZ2-CZ 3.81Å; W242-Y367 PolarHBondContact NE1-OH 2.81Å; W242-I394 HydrophobicContact CH2-CD1 3.96Å; W242-I394 HydrophobicContact CZ3-CD1 4.04Å; W242-Y398 HydrophobicContact CB-CD2 3.74Å; W242-Y398 HydrophobicContact CB-CE2 3.6Å; W242-Y398 AromaticContact CD2-CD2 3.75Å; W242-Y398 HydrophobicContact CD2-CD2 3.75Å; W242-Y398 HydrophobicContact CE3-CD2 4.03Å; W242-Y398 AromaticContact CG-CD2 3.63Å; W242-Y398 HydrophobicContact CG-CD2 3.63Å; W242-Y398 AromaticContact CG-CE2 3.96Å; W242-Y398 HydrophobicContact CG-CE2 3.96Å; W242-D403 PolarHBondContact NE1-O 3.38Å; W242-E404 PolarHBondContact N-OE2 2.83Å; W242-E404 PolarHBondContact NE1-O 3.42Å; W242-E404 VanDerWaalsContact NE1-O 3.13Å; W242-C405 HydrophobicContact CD2-CB 3.67Å; W242-C405 HydrophobicContact CE3-CB 4.06Å; W242-C405 HydrophobicContact CG-CB 3.93Å; W242-C405 HydrophobicContact CZ2-CB 4.3Å; W242-F409 AromaticContact CH2-CD2 3.81Å; W242-F409 HydrophobicContact CH2-CD2 3.81Å; W242-F409 AromaticContact CH2-CE2 3.85Å; W242-F409 HydrophobicContact CH2-CE2 3.85Å; W242-F409 HydrophobicContact CZ2-CD2 4.49Å; W242-F409 HydrophobicContact CZ2-CE2 4.37Å; W242-F409 HydrophobicContact CZ3-CD2 4.41Å
243	I	92.4	Very high	85.1	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.01	23%	0.232	C	C	.	.			trans	-96.3	-36.7	-172.6	-58.4	-55.9	0	0	0	113.9	P241 L253 R254 F410 L445 L446 V451	P241-I243 HydrophobicContact CB-CD1 4.2Å; P241-I243 HydrophobicContact CG-CD1 3.83Å; I243-L253 HydrophobicContact CG2-CD2 3.85Å; I243-L253 WeakPolarHBondContact O-CA 3.23Å; I243-R254 PolarHBondContact O-N 3.32Å; I243-F410 HydrophobicContact CG1-CE1 4.49Å; I243-F410 HydrophobicContact CG1-CZ 4.41Å; I243-L445 HydrophobicContact CG2-CB 3.73Å; I243-L446 HydrophobicContact CD1-CD1 3.93Å; I243-L446 HydrophobicContact CG1-CB 4.29Å; I243-L446 HydrophobicContact CG1-CD1 4.49Å; I243-V451 HydrophobicContact CD1-CG1 3.84Å; I243-V451 HydrophobicContact CD1-CG2 4.21Å; I243-V451 HydrophobicContact CG2-CG2 3.62Å
244	T	90.3	Very high	85.3	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.012	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-152.2	171.7	-177.6	-169.5	0	0	0	0	110.9	F246 Q252 L445	T244-F246 HydrophobicContact CG2-CD1 3.77Å; T244-F246 HydrophobicContact CG2-CE1 3.83Å; T244-F246 HydrophobicContact CG2-CG 4.33Å; T244-F246 HydrophobicContact CG2-CZ 4.44Å; T244-F246 WeakPolarHBondContact O-CD2 3.34Å; T244-F246 WeakPolarHBondContact O-CE2 3.3Å; T244-Q252 PolarHBondContact OG1-O 3.21Å; T244-L445 HydrophobicContact CG2-CD1 3.72Å
245	N	87.3	Confident	85.6	Confident	38 Å²	38	43.1 Å²	43.1	20%	0.203	23%	0.229	C	C	.	.			trans	-82.8	-14.2	-178.7	61.3	-34	0	0	0	115.1	D247 Y398	N245-D247 PolarHBondContact ND2-OD2 2.87Å; N245-D247 PolarHBondContact O-N 3.03Å; N245-Y398 HydrophobicContact CB-CD1 4.08Å; N245-Y398 HydrophobicContact CB-CE1 3.64Å
246	F	89	Confident	86.3	Confident	3 Å²	3	40.1 Å²	40.1	1%	0.013	21%	0.208	C	C	.	.	S	Bend	trans	61.6	16.7	-178.9	-43	-77.2	0	0	0	115.9	W242 T244 I394 A395 P429 W431 F438 Y441 H442	W242-F246 AromaticContact CE3-CE2 3.75Å; W242-F246 HydrophobicContact CE3-CE2 3.75Å; W242-F246 HydrophobicContact CE3-CZ 4.07Å; W242-F246 AromaticContact CZ3-CE2 3.73Å; W242-F246 HydrophobicContact CZ3-CE2 3.73Å; W242-F246 HydrophobicContact CZ3-CZ 4.1Å; T244-F246 HydrophobicContact CG2-CD1 3.77Å; T244-F246 HydrophobicContact CG2-CE1 3.83Å; T244-F246 HydrophobicContact CG2-CG 4.33Å; T244-F246 HydrophobicContact CG2-CZ 4.44Å; T244-F246 WeakPolarHBondContact O-CD2 3.34Å; T244-F246 WeakPolarHBondContact O-CE2 3.3Å; F246-I394 HydrophobicContact CB-CG2 4.46Å; F246-I394 HydrophobicContact CD2-CG1 4.26Å; F246-I394 HydrophobicContact CE2-CG1 4.19Å; F246-I394 HydrophobicContact CG-CG2 4.47Å; F246-A395 HydrophobicContact CB-CB 4.09Å; F246-P429 HydrophobicContact CB-CG 3.99Å; F246-W431 WeakPolarHBondContact O-CH2 3.44Å; F246-F438 AromaticContact CD1-CE2 3.71Å; F246-F438 HydrophobicContact CD1-CE2 3.71Å; F246-F438 HydrophobicContact CD1-CZ 4.1Å; F246-F438 AromaticContact CE1-CE2 3.68Å; F246-F438 HydrophobicContact CE1-CE2 3.68Å; F246-F438 AromaticContact CE1-CZ 3.61Å; F246-F438 HydrophobicContact CE1-CZ 3.61Å; F246-F438 HydrophobicContact CG-CE2 4.47Å; F246-F438 HydrophobicContact CZ-CE2 4.43Å; F246-F438 AromaticContact CZ-CZ 3.98Å; F246-F438 HydrophobicContact CZ-CZ 3.98Å; F246-Y441 HydrophobicContact CD1-CE1 4.39Å; F246-H442 AromaticContact CE1-CD2 3.78Å; F246-H442 AromaticContact CE1-NE2 3.99Å; F246-H442 AromaticContact CZ-CD2 3.87Å; F246-H442 AromaticContact CZ-CE1 3.92Å; F246-H442 AromaticContact CZ-NE2 3.56Å
247	D	84	Confident	86.6	Confident	106 Å²	106	41.9 Å²	41.9	57%	0.567	22%	0.219	S	C	*	.	S	Bend	trans	-81.3	-28.9	173.1	-64.4	-52.3	0	0	0	112.8	N245	N245-D247 PolarHBondContact ND2-OD2 2.87Å; N245-D247 PolarHBondContact O-N 3.03Å
248	T	82.4	Confident	86.8	Confident	72 Å²	72	43.8 Å²	43.8	44%	0.442	23%	0.227	S	C	.	.	S	Bend	trans	-138.8	153.9	175.3	63.9	0	0	0	0	111.5	F250 G251 W431	T248-F250 PolarHBondContact O-N 2.75Å; T248-G251 PolarHBondContact O-N 2.89Å; T248-G251 VanDerWaalsContact OG1-CA 3.3Å; T248-G251 WeakPolarHBondContact OG1-CA 3.38Å; T248-G251 PolarHBondContact OG1-N 2.93Å; T248-W431 VanDerWaalsContact C-CZ2 3.4Å; T248-W431 WeakPolarHBondContact O-CZ2 3.31Å
249	P	76.4	Confident	86.8	Confident	54 Å²	54	44.1 Å²	44.1	35%	0.351	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-20.5	-176	24.6	-34.4	0	0	0	113.9	W431 Y441	P249-W431 HydrophobicContact CB-CD2 3.77Å; P249-W431 HydrophobicContact CB-CE3 4.31Å; P249-W431 HydrophobicContact CB-CG 3.93Å; P249-W431 HydrophobicContact CB-CZ2 4.32Å; P249-W431 HydrophobicContact CG-CD2 4.31Å; P249-W431 HydrophobicContact CG-CE3 4.39Å; P249-Y441 PolarHBondContact O-OH 2.78Å
250	F	72.1	Confident	86.7	Confident	197 Å²	197	44.4 Å²	44.4	86%	0.864	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.6	46	171.1	-56	-77.2	0	0	0	109.6	T248	T248-F250 PolarHBondContact O-N 2.75Å
251	G	67.6	Low	86.4	Confident	13 Å²	13	46.3 Å²	46.3	13%	0.134	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-57.7	159.1	177.5	0	0	0	0	0	112.2	T248 L253	T248-G251 PolarHBondContact O-N 2.89Å; T248-G251 VanDerWaalsContact OG1-CA 3.3Å; T248-G251 WeakPolarHBondContact OG1-CA 3.38Å; T248-G251 PolarHBondContact OG1-N 2.93Å; G251-L253 PolarHBondContact O-N 2.91Å
252	Q	79.9	Confident	86.2	Confident	172 Å²	172	46.7 Å²	46.7	80%	0.804	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-60.7	131.9	174.9	-68	179.6	-5.1	0	0	108.7	T244	T244-Q252 PolarHBondContact OG1-O 3.21Å
253	L	85.7	Confident	86	Confident	64 Å²	64	50 Å²	50	34%	0.335	26%	0.257	S	S	.	.	B	Isolated β-bridge	trans	-66.4	141.6	170	-69.2	176.3	0	0	0	108.6	I243 G251 E450 V451	I243-L253 HydrophobicContact CG2-CD2 3.85Å; I243-L253 WeakPolarHBondContact O-CA 3.23Å; G251-L253 PolarHBondContact O-N 2.91Å; L253-E450 HydrophobicContact CD1-CB 3.58Å; L253-V451 HydrophobicContact CD1-CG2 4.42Å; L253-V451 HydrophobicContact CD2-CG2 4.02Å
254	R	89.1	Confident	85.8	Confident	16 Å²	16	52.3 Å²	52.3	6%	0.06	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-65.2	138.1	178	-165.8	177.6	71.9	88.2	-31.4	110	W242 I243 L256 K258 L263 E404	W242-R254 WeakPolarHBondContact O-CB 3.42Å; W242-R254 WeakPolarHBondContact O-CD 3.43Å; W242-R254 PolarHBondContact O-NE 2.68Å; I243-R254 PolarHBondContact O-N 3.32Å; R254-L256 PolarHBondContact O-N 3.27Å; R254-L256 VanDerWaalsContact O-N 3.15Å; R254-K258 PolarHBondContact NH1-O 3.29Å; R254-L263 HydrophobicContact CG-CD1 3.55Å; R254-E404 IonicContact CZ-OE1 2.67Å; R254-E404 IonicContact CZ-OE2 3.23Å; R254-E404 IonicContact NH2-OE1 2.74Å; R254-E404 PolarHBondContact NH2-OE1 3.17Å; R254-E404 IonicContact NH2-OE2 2.69Å; R254-E404 PolarHBondContact NH2-OE2 2.99Å
255	D	89.5	Confident	85.6	Confident	63 Å²	63	56 Å²	56	34%	0.337	29%	0.288	S	S	.	.			trans	-61.4	115.1	165.4	179.1	7.4	0	0	0	109.3	T257 K258 L263	D255-T257 VanDerWaalsContact CG-OG1 3.29Å; D255-T257 WeakPolarHBondContact OD1-CA 3.31Å; D255-T257 WeakPolarHBondContact OD1-CB 3.5Å; D255-T257 PolarHBondContact OD1-N 3.03Å; D255-T257 PolarHBondContact OD1-OG1 2.91Å; D255-T257 PolarHBondContact OD2-OG1 3.28Å; D255-K258 WeakPolarHBondContact OD2-CD 3.45Å; D255-L263 HydrophobicContact CB-CD2 4.42Å
256	L	93	Very high	85.6	Confident	7 Å²	7	55.6 Å²	55.6	4%	0.037	29%	0.293	C	S	.	.	S	Bend	trans	-90.9	-3.8	179.5	-63.1	-174.5	0	0	0	112.7	P241 R254 K258 V451 N454 L455 H457 W458	P241-L256 HydrophobicContact CB-CD2 4Å; R254-L256 PolarHBondContact O-N 3.27Å; R254-L256 VanDerWaalsContact O-N 3.15Å; L256-K258 PolarHBondContact O-N 3.2Å; L256-V451 HydrophobicContact CD1-CG1 4.22Å; L256-N454 HydrophobicContact CB-CB 4.31Å; L256-N454 HydrophobicContact CD1-CB 4.16Å; L256-L455 HydrophobicContact CD1-CB 4.5Å; L256-L455 HydrophobicContact CD1-CD1 4.44Å; L256-H457 CarbonylContact O-C 3.54Å; L256-W458 HydrophobicContact CB-CB 4.14Å; L256-W458 HydrophobicContact CD2-CB 4.38Å; L256-W458 PolarHBondContact O-N 3.42Å
257	T	90.5	Very high	85.5	Confident	63 Å²	63	59.5 Å²	59.5	39%	0.387	31%	0.311	S	S	.	.	S	Bend	trans	-79	-7.2	171.8	73.2	0	0	0	0	113.1	D255 H457	D255-T257 VanDerWaalsContact CG-OG1 3.29Å; D255-T257 WeakPolarHBondContact OD1-CA 3.31Å; D255-T257 WeakPolarHBondContact OD1-CB 3.5Å; D255-T257 PolarHBondContact OD1-N 3.03Å; D255-T257 PolarHBondContact OD1-OG1 2.91Å; D255-T257 PolarHBondContact OD2-OG1 3.28Å; T257-H457 HydrophobicContact CG2-CB 4.29Å
258	K	90.8	Very high	85.6	Confident	48 Å²	48	61 Å²	61	21%	0.209	32%	0.319	C	S	.	.	S	Bend	trans	-128.2	146.6	179.5	-64.8	-178.2	170.5	-147.4	0	110.4	R254 D255 L256 H262 L263 E267	R254-K258 PolarHBondContact NH1-O 3.29Å; D255-K258 WeakPolarHBondContact OD2-CD 3.45Å; L256-K258 PolarHBondContact O-N 3.2Å; K258-H262 HydrophobicContact CB-CB 4.34Å; K258-H262 WeakPolarHBondContact CD-NE2 3.08Å; K258-H262 WeakPolarHBondContact CE-NE2 3.17Å; K258-H262 PolarHBondContact NZ-NE2 3.21Å; K258-L263 HydrophobicContact CB-CD2 4.04Å; K258-L263 HydrophobicContact CB-CG 4.13Å; K258-L263 HydrophobicContact CD-CD2 3.93Å; K258-E267 IonicContact NZ-OE1 3.34Å; K258-E267 PolarHBondContact NZ-OE1 3.01Å
259	S	89.7	Confident	85.7	Confident	7 Å²	7	61.8 Å²	61.8	5%	0.049	32%	0.318	C	S	.	.			trans	-72	153.4	172.2	50.8	0	0	0	0	110.9	Y261 H262 L263 N477	S259-Y261 PolarHBondContact O-N 2.88Å; S259-Y261 VanDerWaalsContact O-N 3.17Å; S259-H262 WeakPolarHBondContact O-CB 3.4Å; S259-H262 PolarHBondContact O-N 3.07Å; S259-L263 PolarHBondContact O-N 3.2Å; S259-N477 VanDerWaalsContact CB-OD1 3.32Å; S259-N477 WeakPolarHBondContact CB-OD1 3.3Å; S259-N477 PolarHBondContact OG-OD1 2.69Å
260	K	90.1	Very high	86.2	Confident	5 Å²	5	59.2 Å²	59.2	2%	0.022	30%	0.301	C	S	.	.	H	α-helix	trans	-54.7	-35	178.6	177.7	60	176.1	160.7	0	112.7	L263 C264 Y398 T401 P402 D403 E404	K260-L263 PolarHBondContact O-N 2.96Å; K260-C264 VanDerWaalsContact CE-SG 3.51Å; K260-C264 PolarHBondContact NZ-SG 3.16Å; K260-C264 PolarHBondContact O-N 3.41Å; K260-C264 PolarHBondContact O-SG 3.28Å; K260-Y398 HydrophobicContact CD-CE2 4.05Å; K260-Y398 WeakPolarHBondContact CE-O 3.38Å; K260-Y398 PolarHBondContact NZ-O 3.37Å; K260-T401 WeakPolarHBondContact CE-O 3.4Å; K260-P402 CarbonylContact C-O 3.57Å; K260-P402 VanDerWaalsContact C-O 3.24Å; K260-P402 WeakPolarHBondContact CG-O 3.48Å; K260-D403 WeakPolarHBondContact CG-O 3.33Å; K260-E404 VanDerWaalsContact CB-CD 3.46Å; K260-E404 HydrophobicContact CB-CG 4.2Å; K260-E404 WeakPolarHBondContact CB-OE1 3.14Å; K260-E404 PolarHBondContact N-OE1 3.29Å
261	Y	88.6	Confident	86.9	Confident	40 Å²	40	53.1 Å²	53.1	16%	0.157	28%	0.278	C	S	.	.	H	α-helix	trans	-67.5	-40.9	177.8	-167.8	-75.2	0	0	0	112	S259 L263 C264 K265 L270 L355 P402	S259-Y261 PolarHBondContact O-N 2.88Å; S259-Y261 VanDerWaalsContact O-N 3.17Å; Y261-L263 VanDerWaalsContact C-N 3.33Å; Y261-L263 PolarHBondContact O-N 3.06Å; Y261-C264 PolarHBondContact O-N 3.36Å; Y261-K265 HydrophobicContact CD1-CB 4.34Å; Y261-K265 HydrophobicContact CD1-CG 3.67Å; Y261-K265 HydrophobicContact CE1-CB 4.19Å; Y261-K265 HydrophobicContact CE1-CG 3.39Å; Y261-K265 HydrophobicContact CE2-CG 4.42Å; Y261-K265 HydrophobicContact CG-CG 4.34Å; Y261-K265 PolarHBondContact O-N 3.35Å; Y261-L270 HydrophobicContact CD1-CD2 3.87Å; Y261-L270 HydrophobicContact CE1-CD2 3.74Å; Y261-L355 HydrophobicContact CD1-CD2 3.16Å; Y261-L355 HydrophobicContact CD2-CD2 4.44Å; Y261-L355 HydrophobicContact CE1-CD2 3.75Å; Y261-L355 HydrophobicContact CG-CD2 3.57Å; Y261-P402 WeakPolarHBondContact CA-O 3.36Å; Y261-P402 WeakPolarHBondContact CB-O 3.41Å; Y261-P402 HydrophobicContact CD2-CB 3.56Å; Y261-P402 HydrophobicContact CD2-CG 3.92Å; Y261-P402 HydrophobicContact CE2-CB 4.16Å; Y261-P402 HydrophobicContact CE2-CG 4.19Å; Y261-P402 HydrophobicContact CG-CB 4.09Å; Y261-P402 PolarHBondContact N-O 2.91Å
262	H	89.6	Confident	87.7	Confident	9 Å²	9	54.7 Å²	54.7	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-58.3	-45.6	173.4	-174.6	150.4	0	0	0	110.9	K258 S259 C264 G266 E267 L270 A475	K258-H262 HydrophobicContact CB-CB 4.34Å; K258-H262 WeakPolarHBondContact CD-NE2 3.08Å; K258-H262 WeakPolarHBondContact CE-NE2 3.17Å; K258-H262 PolarHBondContact NZ-NE2 3.21Å; S259-H262 WeakPolarHBondContact O-CB 3.4Å; S259-H262 PolarHBondContact O-N 3.07Å; H262-C264 VanDerWaalsContact C-N 3.34Å; H262-C264 PolarHBondContact O-N 3.36Å; H262-G266 WeakPolarHBondContact O-CA 3.32Å; H262-G266 PolarHBondContact O-N 3.37Å; H262-E267 VanDerWaalsContact NE2-CG 3.31Å; H262-E267 WeakPolarHBondContact NE2-CG 3.34Å; H262-E267 IonicContact NE2-OE1 2.69Å; H262-L270 HydrophobicContact CB-CD1 3.67Å; H262-A475 PolarHBondContact ND1-O 3.25Å
263	L	88.4	Confident	87.8	Confident	70 Å²	70	48.2 Å²	48.2	37%	0.366	26%	0.26	S	S	.	.	H	α-helix	trans	-65.2	-34.4	177.3	-63.1	174.3	0	0	0	113	R254 D255 K258 S259 K260 Y261	R254-L263 HydrophobicContact CG-CD1 3.55Å; D255-L263 HydrophobicContact CB-CD2 4.42Å; K258-L263 HydrophobicContact CB-CD2 4.04Å; K258-L263 HydrophobicContact CB-CG 4.13Å; K258-L263 HydrophobicContact CD-CD2 3.93Å; S259-L263 PolarHBondContact O-N 3.2Å; K260-L263 PolarHBondContact O-N 2.96Å; Y261-L263 VanDerWaalsContact C-N 3.33Å; Y261-L263 PolarHBondContact O-N 3.06Å
264	C	87.2	Confident	87.7	Confident	49 Å²	49	47.3 Å²	47.3	33%	0.331	25%	0.254	S	S	.	.	H	α-helix	trans	-88.2	-22.9	-176.5	-61.2	0	0	0	0	114.9	K260 Y261 H262 P402	K260-C264 VanDerWaalsContact CE-SG 3.51Å; K260-C264 PolarHBondContact NZ-SG 3.16Å; K260-C264 PolarHBondContact O-N 3.41Å; K260-C264 PolarHBondContact O-SG 3.28Å; Y261-C264 PolarHBondContact O-N 3.36Å; H262-C264 VanDerWaalsContact C-N 3.34Å; H262-C264 PolarHBondContact O-N 3.36Å; C264-P402 HydrophobicContact CB-CB 4.1Å
265	K	86.9	Confident	87.3	Confident	80 Å²	80	48.5 Å²	48.5	35%	0.348	27%	0.267	S	S	.	.	H	α-helix	trans	-101.5	-24.7	176.6	-59.6	-49	-173.9	-174.2	0	113.8	Y261 Q269	Y261-K265 HydrophobicContact CD1-CB 4.34Å; Y261-K265 HydrophobicContact CD1-CG 3.67Å; Y261-K265 HydrophobicContact CE1-CB 4.19Å; Y261-K265 HydrophobicContact CE1-CG 3.39Å; Y261-K265 HydrophobicContact CE2-CG 4.42Å; Y261-K265 HydrophobicContact CG-CG 4.34Å; Y261-K265 PolarHBondContact O-N 3.35Å; K265-Q269 HydrophobicContact CB-CB 4.29Å; K265-Q269 HydrophobicContact CB-CG 4.41Å; K265-Q269 WeakPolarHBondContact O-CB 3.46Å
266	G	87	Confident	86.2	Confident	29 Å²	29	48.7 Å²	48.7	30%	0.299	27%	0.271	S	S	.	.			trans	77.8	161.2	-177.4	0	0	0	0	0	113.8	H262 D268 Q269 L270	H262-G266 WeakPolarHBondContact O-CA 3.32Å; H262-G266 PolarHBondContact O-N 3.37Å; G266-D268 PolarHBondContact O-N 3.14Å; G266-Q269 PolarHBondContact O-N 3Å; G266-L270 PolarHBondContact O-N 2.71Å
267	E	86.6	Confident	84.6	Confident	85 Å²	85	49 Å²	49	40%	0.397	27%	0.273	S	S	.	.	H	α-helix	trans	-67.5	-33.4	-170.6	-73.2	-166.2	-143.9	0	0	114	K258 H262 L270 N271 K476	K258-E267 IonicContact NZ-OE1 3.34Å; K258-E267 PolarHBondContact NZ-OE1 3.01Å; H262-E267 VanDerWaalsContact NE2-CG 3.31Å; H262-E267 WeakPolarHBondContact NE2-CG 3.34Å; H262-E267 IonicContact NE2-OE1 2.69Å; E267-L270 PolarHBondContact O-N 3.42Å; E267-N271 VanDerWaalsContact O-CB 3.27Å; E267-N271 WeakPolarHBondContact O-CB 3.42Å; E267-N271 PolarHBondContact O-N 3.46Å; E267-N271 PolarHBondContact O-OD1 2.87Å; E267-K476 HydrophobicContact CB-CD 4.48Å; E267-K476 HydrophobicContact CG-CD 4.24Å; E267-K476 IonicContact OE2-NZ 3.17Å; E267-K476 PolarHBondContact OE2-NZ 3.31Å
268	D	85.8	Confident	82.8	Confident	137 Å²	137	50.8 Å²	50.8	73%	0.733	28%	0.28	S	S	*	.	H	α-helix	trans	-68.2	-38.9	179.3	-64.1	-43	0	0	0	112	G266 A272	G266-D268 PolarHBondContact O-N 3.14Å; D268-A272 WeakPolarHBondContact O-CB 3.49Å; D268-A272 PolarHBondContact O-N 3.22Å
269	Q	84.8	Confident	80.6	Confident	90 Å²	90	51.3 Å²	51.3	42%	0.421	29%	0.289	S	S	.	.	H	α-helix	trans	-70.4	-39.5	176	-175.1	169.3	11.6	0	0	111.4	K265 G266 A272 N273	K265-Q269 HydrophobicContact CB-CB 4.29Å; K265-Q269 HydrophobicContact CB-CG 4.41Å; K265-Q269 WeakPolarHBondContact O-CB 3.46Å; G266-Q269 PolarHBondContact O-N 3Å; Q269-A272 PolarHBondContact O-N 3.33Å; Q269-N273 VanDerWaalsContact O-CG 3.3Å; Q269-N273 PolarHBondContact O-N 2.66Å; Q269-N273 PolarHBondContact O-OD1 2.78Å
270	L	87.5	Confident	78.2	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-64.5	-45.5	175.3	-73.4	-166.2	0	0	0	112.2	Y261 H262 G266 E267 A272 N273 F274 H354 L355 K476	Y261-L270 HydrophobicContact CD1-CD2 3.87Å; Y261-L270 HydrophobicContact CE1-CD2 3.74Å; H262-L270 HydrophobicContact CB-CD1 3.67Å; G266-L270 PolarHBondContact O-N 2.71Å; E267-L270 PolarHBondContact O-N 3.42Å; L270-A272 VanDerWaalsContact C-N 3.27Å; L270-A272 PolarHBondContact O-N 3.1Å; L270-N273 PolarHBondContact O-N 2.85Å; L270-F274 PolarHBondContact O-N 3Å; L270-F274 VanDerWaalsContact O-N 3.13Å; L270-H354 HydrophobicContact CD2-CB 4.25Å; L270-H354 WeakPolarHBondContact CD2-O 3.2Å; L270-H354 PolarHBondContact O-CD2 3.24Å; L270-L355 HydrophobicContact CD2-CD2 4.09Å; L270-K476 HydrophobicContact CB-CB 4.34Å; L270-K476 HydrophobicContact CB-CD 4.48Å; L270-K476 HydrophobicContact CD1-CB 3.77Å; L270-K476 WeakPolarHBondContact CD1-O 3.42Å
271	N	87.6	Confident	75.7	Confident	69 Å²	69	63 Å²	63	37%	0.369	35%	0.346	S	S	.	.	H	α-helix	trans	-57.4	-42.1	171.6	-73.4	-5.7	0	0	0	110.7	E267 A275 K476	E267-N271 VanDerWaalsContact O-CB 3.27Å; E267-N271 WeakPolarHBondContact O-CB 3.42Å; E267-N271 PolarHBondContact O-N 3.46Å; E267-N271 PolarHBondContact O-OD1 2.87Å; N271-A275 WeakPolarHBondContact O-CB 3.46Å; N271-A275 PolarHBondContact O-N 2.86Å; N271-K476 PolarHBondContact ND2-NZ 3.39Å; N271-K476 WeakPolarHBondContact OD1-CD 3.21Å; N271-K476 WeakPolarHBondContact OD1-CE 3.32Å; N271-K476 PolarHBondContact OD1-NZ 2.96Å
272	A	82.4	Confident	73.1	Confident	45 Å²	45	65.2 Å²	65.2	37%	0.372	36%	0.364	S	S	.	.	H	α-helix	trans	-68.5	-36.3	179	0	0	0	0	0	113.3	D268 Q269 L270 T276	D268-A272 WeakPolarHBondContact O-CB 3.49Å; D268-A272 PolarHBondContact O-N 3.22Å; Q269-A272 PolarHBondContact O-N 3.33Å; L270-A272 VanDerWaalsContact C-N 3.27Å; L270-A272 PolarHBondContact O-N 3.1Å; A272-T276 VanDerWaalsContact O-CB 3.27Å; A272-T276 WeakPolarHBondContact O-CB 3.14Å; A272-T276 VanDerWaalsContact O-CG2 3.24Å; A272-T276 WeakPolarHBondContact O-CG2 3.42Å; A272-T276 PolarHBondContact O-N 3.37Å; A272-T276 PolarHBondContact O-OG1 2.86Å
273	N	82.3	Confident	70.2	Confident	37 Å²	37	71 Å²	71	20%	0.198	39%	0.394	C	S	.	.	H	α-helix	trans	-62.6	-50.6	173.9	-71.1	-3.2	0	0	0	110.8	Q269 L270 A275 T276 S277 H353 H354	Q269-N273 VanDerWaalsContact O-CG 3.3Å; Q269-N273 PolarHBondContact O-N 2.66Å; Q269-N273 PolarHBondContact O-OD1 2.78Å; L270-N273 PolarHBondContact O-N 2.85Å; N273-A275 VanDerWaalsContact C-N 3.34Å; N273-A275 PolarHBondContact O-N 3.21Å; N273-T276 PolarHBondContact O-N 2.59Å; N273-T276 PolarHBondContact O-OG1 3.29Å; N273-T276 VanDerWaalsContact O-OG1 3.13Å; N273-S277 PolarHBondContact O-N 3.24Å; N273-S277 PolarHBondContact O-OG 3.34Å; N273-H353 CarbonylContact C-O 3.52Å; N273-H354 PolarHBondContact ND2-O 3.21Å
274	F	85.1	Confident	67.5	Low	44 Å²	44	72.6 Å²	72.6	19%	0.193	41%	0.411	C	S	.	.	H	α-helix	trans	-67.2	-34.3	179.2	-168.2	-90.8	0	0	0	112.2	L270 S277 P352 H353 H354 V473 V478	L270-F274 PolarHBondContact O-N 3Å; L270-F274 VanDerWaalsContact O-N 3.13Å; F274-S277 PolarHBondContact O-OG 2.79Å; F274-P352 HydrophobicContact CD1-CB 4.35Å; F274-P352 VanDerWaalsContact CD2-C 3.47Å; F274-P352 HydrophobicContact CD2-CB 3.85Å; F274-P352 HydrophobicContact CE1-CB 4.17Å; F274-P352 HydrophobicContact CE2-CB 3.65Å; F274-P352 HydrophobicContact CE2-CG 4.21Å; F274-P352 VanDerWaalsContact CE2-O 3.24Å; F274-P352 WeakPolarHBondContact CE2-O 3.33Å; F274-P352 HydrophobicContact CG-CB 4.21Å; F274-P352 HydrophobicContact CZ-CB 3.82Å; F274-P352 HydrophobicContact CZ-CG 4.18Å; F274-H353 WeakPolarHBondContact CA-O 3.32Å; F274-H353 PolarHBondContact N-O 3.46Å; F274-H354 AromaticContact CD2-CE1 3.17Å; F274-H354 WeakPolarHBondContact CD2-CE1 3.32Å; F274-H354 AromaticContact CD2-ND1 3.47Å; F274-H354 WeakPolarHBondContact CD2-ND1 3.45Å; F274-H354 AromaticContact CD2-NE2 3.65Å; F274-H354 AromaticContact CE2-CE1 3.58Å; F274-H354 AromaticContact CE2-ND1 3.97Å; F274-H354 AromaticContact CG-CE1 3.61Å; F274-H354 AromaticContact CG-NE2 3.6Å; F274-V473 HydrophobicContact CE1-CG1 4.46Å; F274-V473 HydrophobicContact CE2-CG2 4.22Å; F274-V473 HydrophobicContact CZ-CG1 4.15Å; F274-V473 HydrophobicContact CZ-CG2 3.98Å; F274-V478 HydrophobicContact CE2-CG2 4.19Å
275	A	79.6	Confident	64.6	Low	42 Å²	42	75.8 Å²	75.8	35%	0.347	42%	0.419	S	S	.	.	H	α-helix	trans	-81.1	-25.9	177.1	0	0	0	0	0	113.6	N271 N273 L278 C279	N271-A275 WeakPolarHBondContact O-CB 3.46Å; N271-A275 PolarHBondContact O-N 2.86Å; N273-A275 VanDerWaalsContact C-N 3.34Å; N273-A275 PolarHBondContact O-N 3.21Å; A275-L278 WeakPolarHBondContact O-CB 3.36Å; A275-L278 PolarHBondContact O-N 3.37Å; A275-C279 WeakPolarHBondContact O-CB 3.22Å; A275-C279 PolarHBondContact O-N 2.99Å; A275-C279 PolarHBondContact O-SG 3.39Å
276	T	67.2	Low	61.7	Low	67 Å²	67	83.6 Å²	83.6	41%	0.411	45%	0.446	S	S	.	.	H	α-helix	trans	-77.8	-29.9	176.9	45.6	0	0	0	0	112.3	A272 N273 L278 C279 N280	A272-T276 VanDerWaalsContact O-CB 3.27Å; A272-T276 WeakPolarHBondContact O-CB 3.14Å; A272-T276 VanDerWaalsContact O-CG2 3.24Å; A272-T276 WeakPolarHBondContact O-CG2 3.42Å; A272-T276 PolarHBondContact O-N 3.37Å; A272-T276 PolarHBondContact O-OG1 2.86Å; N273-T276 PolarHBondContact O-N 2.59Å; N273-T276 PolarHBondContact O-OG1 3.29Å; N273-T276 VanDerWaalsContact O-OG1 3.13Å; T276-L278 VanDerWaalsContact C-N 3.33Å; T276-C279 PolarHBondContact O-N 3.45Å; T276-N280 VanDerWaalsContact O-CB 3.3Å; T276-N280 WeakPolarHBondContact O-CB 3.46Å; T276-N280 PolarHBondContact O-N 2.57Å; T276-N280 PolarHBondContact O-ND2 3.49Å
277	S	58.2	Low	58.9	Low	13 Å²	13	87.5 Å²	87.5	9%	0.091	47%	0.466	C	S	.	.	H	α-helix	trans	-61.1	-40.4	166.7	26.2	0	0	0	0	111.4	N273 F274 F350 P352	N273-S277 PolarHBondContact O-N 3.24Å; N273-S277 PolarHBondContact O-OG 3.34Å; F274-S277 PolarHBondContact O-OG 2.79Å; S277-F350 WeakPolarHBondContact CB-O 3.36Å; S277-P352 WeakPolarHBondContact OG-CA 3.46Å
278	L	53.8	Low	56.1	Low	101 Å²	101	87 Å²	87	53%	0.529	48%	0.483	S	S	.	.	H	α-helix	trans	-66.7	-49	167.1	-99.2	66.2	0	0	0	113.2	A275 T276 H281 P352	A275-L278 WeakPolarHBondContact O-CB 3.36Å; A275-L278 PolarHBondContact O-N 3.37Å; T276-L278 VanDerWaalsContact C-N 3.33Å; L278-H281 PolarHBondContact O-N 3Å; L278-P352 HydrophobicContact CD1-CB 3.55Å; L278-P352 HydrophobicContact CD1-CG 3.93Å
279	C	43.7	Very low	53.3	Low	58 Å²	58	91.5 Å²	91.5	39%	0.392	49%	0.49	S	S	.	.	H	α-helix	trans	-82.3	-16.3	-166.7	-81.1	0	0	0	0	114.7	A275 T276 H281 T282 I283	A275-C279 WeakPolarHBondContact O-CB 3.22Å; A275-C279 PolarHBondContact O-N 2.99Å; A275-C279 PolarHBondContact O-SG 3.39Å; T276-C279 PolarHBondContact O-N 3.45Å; C279-H281 PolarHBondContact O-N 2.86Å; C279-T282 WeakPolarHBondContact O-CA 3.47Å; C279-T282 PolarHBondContact O-N 3.38Å; C279-T282 PolarHBondContact O-OG1 2.82Å; C279-I283 PolarHBondContact O-N 3.38Å
280	N	38.8	Very low	50.7	Low	108 Å²	108	93.7 Å²	93.7	58%	0.578	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.6	172.4	-76.4	-21.2	0	0	0	112.1	T276 T282	T276-N280 VanDerWaalsContact O-CB 3.3Å; T276-N280 WeakPolarHBondContact O-CB 3.46Å; T276-N280 PolarHBondContact O-N 2.57Å; T276-N280 PolarHBondContact O-ND2 3.49Å; N280-T282 PolarHBondContact O-N 3.28Å
281	H	38.3	Very low	47.8	Very low	150 Å²	150	101.7 Å²	101.7	69%	0.694	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-2.4	166.6	-73.7	-86.6	0	0	0	114.5	L278 C279	L278-H281 PolarHBondContact O-N 3Å; C279-H281 PolarHBondContact O-N 2.86Å
282	T	33.8	Very low	44.9	Very low	87 Å²	87	101 Å²	101	53%	0.534	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.2	-9.7	179.8	70.1	0	0	0	0	114.8	C279 N280 S284 K285	C279-T282 WeakPolarHBondContact O-CA 3.47Å; C279-T282 PolarHBondContact O-N 3.38Å; C279-T282 PolarHBondContact O-OG1 2.82Å; N280-T282 PolarHBondContact O-N 3.28Å; T282-S284 PolarHBondContact O-N 2.94Å; T282-K285 PolarHBondContact O-N 3.11Å
283	I	29.8	Very low	42.2	Very low	131 Å²	131	104.8 Å²	104.8	67%	0.672	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	35.5	173.6	-50.5	176.6	0	0	0	111.7	C279	C279-I283 PolarHBondContact O-N 3.38Å
284	S	30.4	Very low	39.6	Very low	102 Å²	102	110.5 Å²	110.5	71%	0.713	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	2.7	161	-170.7	0	0	0	0	112.5	T282	T282-S284 PolarHBondContact O-N 2.94Å
285	K	27	Very low	36.8	Very low	116 Å²	116	113.5 Å²	113.5	50%	0.504	62%	0.623	S	S	.	*			trans	-131.6	92.4	172.8	-73.6	-170.1	170.3	175.5	0	112	T282 P287 E1066	T282-K285 PolarHBondContact O-N 3.11Å; K285-P287 WeakPolarHBondContact O-CD 3.19Å; K285-E1066 WeakPolarHBondContact CE-OE2 3.46Å; K285-E1066 IonicContact NZ-OE1 3.01Å; K285-E1066 PolarHBondContact NZ-OE1 3.05Å; K285-E1066 IonicContact NZ-OE2 3.57Å; K285-E1066 PolarHBondContact NZ-OE2 3.46Å
286	R	26	Very low	34.4	Very low	245 Å²	245	118.4 Å²	118.4	93%	0.925	65%	0.648	S	S	*	*			trans	-60.1	124.6	165.3	-83.2	-173.6	171.7	-170.8	-2.1	109.7	G288	R286-G288 PolarHBondContact O-N 2.8Å; R286-G288 VanDerWaalsContact O-N 3.16Å
287	P	28.1	Very low	32.4	Very low	111 Å²	111	123.6 Å²	123.6	72%	0.721	67%	0.668	S	S	*	*			trans	-73.4	103.7	164.4	29.9	-31	0	0	0	108.5	K285 W289	K285-P287 WeakPolarHBondContact O-CD 3.19Å; P287-W289 PolarHBondContact O-N 3.13Å; P287-W289 VanDerWaalsContact O-N 3.08Å
288	G	29	Very low	31.1	Very low	73 Å²	73	126.3 Å²	126.3	75%	0.753	70%	0.698	S	S	*	*			trans	-69.2	101.9	175.2	0	0	0	0	0	110.9	R286 T290	R286-G288 PolarHBondContact O-N 2.8Å; R286-G288 VanDerWaalsContact O-N 3.16Å; G288-T290 PolarHBondContact O-N 3.44Å
289	W	27.1	Very low	30	Very low	232 Å²	232	130 Å²	130	88%	0.879	71%	0.712	S	S	*	*			trans	-65.1	125.3	169.7	-75.7	24.9	0	0	0	110.2	P287	P287-W289 PolarHBondContact O-N 3.13Å; P287-W289 VanDerWaalsContact O-N 3.08Å
290	T	28.4	Very low	29.1	Very low	136 Å²	136	136.9 Å²	136.9	83%	0.834	73%	0.731	S	S	*	*			trans	-118.7	112.5	151.3	49.2	0	0	0	0	108.9	G288	G288-T290 PolarHBondContact O-N 3.44Å
291	L	27.6	Very low	28.6	Very low	168 Å²	168	138.7 Å²	138.7	88%	0.88	74%	0.741	S	S	*	*			trans	-57.4	135.4	170.5	-158.3	72.8	0	0	0	109.4
292	G	26.2	Very low	28	Very low	54 Å²	54	137.3 Å²	137.3	56%	0.557	74%	0.743	S	S	*	*			trans	-94.8	-132.5	-173.9	0	0	0	0	0	114.5
293	T	26.6	Very low	27.6	Very low	125 Å²	125	144.2 Å²	144.2	77%	0.767	76%	0.759	S	S	*	*			trans	75.3	146	-173.5	80	0	0	0	0	113.6
294	H	26.7	Very low	27.3	Very low	158 Å²	158	142.8 Å²	142.8	73%	0.731	76%	0.761	S	S	*	*			cis	-145.2	159.1	4.5	-91.7	-61.3	0	0	0	107.9
295	N	26.6	Very low	27.3	Very low	106 Å²	106	144.7 Å²	144.7	57%	0.567	76%	0.758	S	S	*	*			cis	-158.4	157	-6.2	-135.5	26.8	0	0	0	110.5	E297	N295-E297 WeakPolarHBondContact ND2-CG 3.41Å
296	V	30.1	Very low	27.4	Very low	145 Å²	145	148.6 Å²	148.6	88%	0.879	78%	0.778	S	S	*	*			trans	-133.3	137.1	139.9	178.6	0	0	0	0	106.5
297	E	24.8	Very low	27.5	Very low	176 Å²	176	144.2 Å²	144.2	82%	0.822	77%	0.768	S	S	*	*			trans	-89.4	145.3	-165	-63	173.3	127.3	0	0	113.1	N295	N295-E297 WeakPolarHBondContact ND2-CG 3.41Å
298	G	31.1	Very low	27.4	Very low	71 Å²	71	142.8 Å²	142.8	73%	0.732	75%	0.754	S	S	*	*			trans	-167.7	30.8	-170.4	0	0	0	0	0	118.2
299	H	30.4	Very low	27.5	Very low	178 Å²	178	149.5 Å²	149.5	82%	0.824	76%	0.763	S	S	*	*			trans	61.4	137.5	168.6	-75.7	-95.8	0	0	0	121.1
300	Y	24.4	Very low	27.5	Very low	203 Å²	203	147.3 Å²	147.3	80%	0.796	77%	0.765	S	S	*	*			trans	-21.2	159	154.9	-57.3	-95.4	0	0	0	118.3
301	D	28.3	Very low	27.5	Very low	145 Å²	145	148.7 Å²	148.7	78%	0.775	76%	0.759	S	S	*	*			cis	-155.2	-176.6	25.5	-146.6	-18.1	0	0	0	114.9
302	V	25.3	Very low	27.6	Very low	122 Å²	122	148.1 Å²	148.1	74%	0.739	76%	0.756	S	S	*	*			trans	-99.9	110.8	-166.2	-179	0	0	0	0	114.6
303	R	25	Very low	27.6	Very low	232 Å²	232	151.5 Å²	151.5	88%	0.875	77%	0.77	S	S	*	*			trans	177	160.9	136.3	-101.3	156.6	-177.2	174.6	1.4	113.6
304	S	25.4	Very low	27.6	Very low	101 Å²	101	152.5 Å²	152.5	71%	0.706	77%	0.771	S	S	*	*			trans	56.7	126.8	174.6	51.3	0	0	0	0	117.6
305	H	30.1	Very low	27.6	Very low	142 Å²	142	153.4 Å²	153.4	66%	0.657	78%	0.775	S	S	*	*				-175.6	86.8	125.6	-98.4	-73.9	0	0	0	109.2	D308	H305-D308 IonicContact CE1-OD1 2.95Å; H305-D308 PolarHBondContact CE1-OD1 3.38Å; H305-D308 IonicContact CE1-OD2 3.17Å; H305-D308 PolarHBondContact CE1-OD2 2.96Å; H305-D308 IonicContact CG-OD1 3.08Å; H305-D308 IonicContact CG-OD2 2.65Å; H305-D308 IonicContact ND1-OD1 3.87Å; H305-D308 PolarHBondContact ND1-OD1 2.9Å; H305-D308 IonicContact ND1-OD2 2.84Å; H305-D308 PolarHBondContact ND1-OD2 3.07Å; H305-D308 VanDerWaalsContact ND1-OD2 3.1Å
306	H	28	Very low	27.6	Very low	197 Å²	197	156.8 Å²	156.8	91%	0.912	79%	0.792	S	S	*	*	S	Bend	trans	-105.1	38.6	171.3	-172.6	72.2	0	0	0	109.7
307	Q	28.1	Very low	27.5	Very low	153 Å²	153	152.8 Å²	152.8	72%	0.715	78%	0.781	S	S	*	*			trans	-146	-1.3	-166.1	-103.8	176.7	-10.5	0	0	115.9
308	D	27.4	Very low	27.6	Very low	82 Å²	82	151 Å²	151	44%	0.439	78%	0.782	S	S	.	*	G	3₁₀ helix	trans	-101.4	-8.1	-163.5	-74.5	24.4	0	0	0	115.2	H305 M310	H305-D308 IonicContact CE1-OD1 2.95Å; H305-D308 PolarHBondContact CE1-OD1 3.38Å; H305-D308 IonicContact CE1-OD2 3.17Å; H305-D308 PolarHBondContact CE1-OD2 2.96Å; H305-D308 IonicContact CG-OD1 3.08Å; H305-D308 IonicContact CG-OD2 2.65Å; H305-D308 IonicContact ND1-OD1 3.87Å; H305-D308 PolarHBondContact ND1-OD1 2.9Å; H305-D308 IonicContact ND1-OD2 2.84Å; H305-D308 PolarHBondContact ND1-OD2 3.07Å; H305-D308 VanDerWaalsContact ND1-OD2 3.1Å; D308-M310 PolarHBondContact O-N 3.29Å
309	F	29.8	Very low	27.3	Very low	213 Å²	213	154.2 Å²	154.2	93%	0.934	79%	0.792	S	S	*	*	G	3₁₀ helix	trans	-81.7	-1.8	170	-144.1	-95.8	0	0	0	113.3
310	M	27.7	Very low	26.9	Very low	186 Å²	186	150.9 Å²	150.9	92%	0.916	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-116.4	26	177.5	-90	-70.9	-169.7	0	0	112.1	D308	D308-M310 PolarHBondContact O-N 3.29Å
311	K	27.7	Very low	27.1	Very low	166 Å²	166	149.8 Å²	149.8	72%	0.722	79%	0.794	S	S	*	*	S	Bend	trans	-141.6	15	-170	-136.9	177.6	-175.7	-178.8	0	116.4
312	L	29.7	Very low	27	Very low	156 Å²	156	147.8 Å²	147.8	82%	0.817	79%	0.792	S	S	*	*	S	Bend	trans	-113.5	12.1	-178.2	-138.2	135.6	0	0	0	113.8
313	C	26.2	Very low	27	Very low	124 Å²	124	149.4 Å²	149.4	84%	0.838	80%	0.796	S	S	*	*	S	Bend	trans	-136.5	62	170.6	-72.5	0	0	0	0	110.3
314	N	27.3	Very low	27.2	Very low	147 Å²	147	144.9 Å²	144.9	79%	0.786	79%	0.794	S	S	*	*	S	Bend	trans	-161.4	130.5	152.4	-103.8	-12.6	0	0	0	112.2
315	E	26.9	Very low	27	Very low	177 Å²	177	146.8 Å²	146.8	83%	0.827	80%	0.796	S	S	*	*			trans	59.2	95	151.2	-55.5	-169.1	135.1	0	0	121
316	L	27	Very low	26.8	Very low	176 Å²	176	145.2 Å²	145.2	92%	0.921	80%	0.801	S	S	*	*				-172.5	114.2	125.2	-96.9	161.6	0	0	0	105.7
317	G	27.2	Very low	26.6	Very low	62 Å²	62	143.1 Å²	143.1	64%	0.639	80%	0.797	S	S	*	*			cis	95.8	126.3	25.1	0	0	0	0	0	109.1
318	T	26.4	Very low	26.4	Very low	137 Å²	137	143.9 Å²	143.9	84%	0.84	81%	0.805	S	S	*	*			cis	-159.6	156.8	9.9	50.2	0	0	0	0	110.8
319	C	25.7	Very low	26.3	Very low	140 Å²	140	145.8 Å²	145.8	95%	0.946	82%	0.819	S	S	*	*			trans	-152.6	132.2	145.2	-123	0	0	0	0	109.8
320	S	21.6	Very low	26	Very low	107 Å²	107	141.6 Å²	141.6	75%	0.748	82%	0.815	S	S	*	*			trans	-124.3	145.5	-164.1	56.7	0	0	0	0	113.2
321	I	28.3	Very low	25.7	Very low	181 Å²	181	137.2 Å²	137.2	93%	0.928	80%	0.803	S	S	*	*			trans	-148.7	161.4	153.4	-101.8	148.2	0	0	0	108.5
322	S	26.5	Very low	25.6	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	81%	0.807	S	S	*	*			trans	-97.5	163.2	-150.2	54.2	0	0	0	0	117.5
323	N	24	Very low	25.3	Very low	155 Å²	155	135 Å²	135	83%	0.829	80%	0.802	S	S	*	*			trans	-24	142.8	164.3	-46.5	-0.6	0	0	0	117.1
324	V	29.2	Very low	25.2	Very low	138 Å²	138	135.3 Å²	135.3	84%	0.836	80%	0.795	S	S	*	*				-163.2	165	120	137	0	0	0	0	109.4
325	D	22.9	Very low	25	Very low	141 Å²	141	133.3 Å²	133.3	75%	0.754	78%	0.781	S	S	*	*			trans	-64.9	175.3	-162.4	-50.6	-83.2	0	0	0	118.5
326	S	24.5	Very low	25	Very low	109 Å²	109	133.2 Å²	133.2	76%	0.762	78%	0.775	S	S	*	*			trans	104.5	118.5	155.3	76.6	0	0	0	0	119.2
327	N	23.4	Very low	25.1	Very low	153 Å²	153	131 Å²	131	82%	0.818	76%	0.762	S	S	*	*			trans	37.3	101.2	143.6	-58.6	-7.1	0	0	0	119.6
328	L	25.9	Very low	25	Very low	168 Å²	168	131.5 Å²	131.5	88%	0.88	76%	0.756	S	S	*	*			trans	-148.1	101.6	133.1	-118.8	160.7	0	0	0	111.3	C330	L328-C330 PolarHBondContact O-N 3.23Å
329	V	23.3	Very low	24.9	Very low	123 Å²	123	129.6 Å²	129.6	75%	0.745	74%	0.741	S	S	*	*			trans	-66.6	116.7	164.4	170.8	0	0	0	0	107.1	S331	V329-S331 VanDerWaalsContact C-N 3.25Å; V329-S331 PolarHBondContact O-N 2.85Å
330	C	24.4	Very low	25	Very low	125 Å²	125	128 Å²	128	85%	0.845	72%	0.723	S	S	*	*			trans	-85.9	73	174.5	-142.1	0	0	0	0	109.7	L328 I332	L328-C330 PolarHBondContact O-N 3.23Å; C330-I332 PolarHBondContact O-N 3.31Å
331	S	21.6	Very low	25.2	Very low	94 Å²	94	124.6 Å²	124.6	66%	0.657	70%	0.696	S	S	*	*			trans	-78.8	107.4	171.4	51.8	0	0	0	0	110.1	V329	V329-S331 VanDerWaalsContact C-N 3.25Å; V329-S331 PolarHBondContact O-N 2.85Å
332	I	26.4	Very low	25.4	Very low	156 Å²	156	119 Å²	119	80%	0.8	68%	0.683	S	S	*	*			trans	-127.4	89.9	152.1	-58.1	-176.4	0	0	0	107.3	C330	C330-I332 PolarHBondContact O-N 3.31Å
333	V	23	Very low	25.5	Very low	119 Å²	119	123 Å²	123	72%	0.721	69%	0.688	S	S	*	*			trans	-99.6	126.5	155.6	168.5	0	0	0	0	104.5
334	D	23.6	Very low	25.8	Very low	130 Å²	130	123.8 Å²	123.8	70%	0.695	69%	0.687	S	S	*	*			trans	58.7	151	159.4	-58.5	-16.6	0	0	0	118.7
335	E	24.1	Very low	25.8	Very low	105 Å²	105	121.3 Å²	121.3	49%	0.491	67%	0.668	S	S	.	*			cis	-155	157.9	-4.6	-122.7	-175.8	172.5	0	0	108.6	N1048	E335-N1048 PolarHBondContact OE1-ND2 3.48Å
336	Y	26.2	Very low	26.4	Very low	176 Å²	176	116.2 Å²	116.2	69%	0.69	64%	0.642	S	S	*	*			trans	29.5	159.1	141.6	-61	-35.2	0	0	0	123.7
337	I	29.1	Very low	26.6	Very low	128 Å²	128	116.6 Å²	116.6	66%	0.656	64%	0.636	S	S	*	*			cis	-161.3	146.3	-7.5	-113.1	165.6	0	0	0	106.6
338	S	24.8	Very low	27.4	Very low	74 Å²	74	118.1 Å²	118.1	52%	0.517	63%	0.632	S	S	.	*				-176.9	158.5	79.5	49.1	0	0	0	0	108.2
339	N	25	Very low	28.3	Very low	97 Å²	97	115 Å²	115	52%	0.519	62%	0.62	S	S	.	*			cis	-147.6	147.6	35.3	-83.3	-85.5	0	0	0	110.8	F1006 T1007	N339-F1006 WeakPolarHBondContact CA-O 3.45Å; N339-F1006 WeakPolarHBondContact CB-O 3.44Å; N339-F1006 PolarHBondContact OD1-O 2.89Å; N339-F1006 VanDerWaalsContact OD1-O 3.11Å; N339-T1007 HydrophobicContact CB-CG2 3.51Å; N339-T1007 PolarHBondContact OD1-N 3.48Å
340	D	27.2	Very low	29.8	Very low	106 Å²	106	115.1 Å²	115.1	57%	0.567	61%	0.61	S	S	*	*			trans	-117.2	92.6	174.5	-114	65.4	0	0	0	118.8	G342 F1006 T1007	D340-G342 PolarHBondContact OD2-N 3.4Å; D340-F1006 PolarHBondContact N-O 3.23Å; D340-F1006 CarbonylContact O-C 3.59Å; D340-F1006 WeakPolarHBondContact O-CA 3.28Å; D340-T1007 VanDerWaalsContact OD1-CG2 3.31Å; D340-T1007 WeakPolarHBondContact OD1-CG2 3.22Å
341	N	25.4	Very low	31.9	Very low	35 Å²	35	110.3 Å²	110.3	19%	0.187	58%	0.578	C	S	.	*			trans	-150.5	128.9	146.1	-92	-38.7	0	0	0	110.5	F1006 T1007 V1009	N341-F1006 WeakPolarHBondContact ND2-CD1 3.25Å; N341-F1006 WeakPolarHBondContact ND2-CE1 3.47Å; N341-T1007 HydrophobicContact CB-CG2 4.38Å; N341-T1007 PolarHBondContact ND2-O 3.35Å; N341-T1007 PolarHBondContact O-OG1 3.49Å; N341-V1009 HydrophobicContact CB-CG2 3.65Å
342	G	32.6	Very low	34.6	Very low	64 Å²	64	108.1 Å²	108.1	66%	0.66	56%	0.562	S	S	*	*			trans	-144.4	50	152.6	0	0	0	0	0	111.5	D340 E344	D340-G342 PolarHBondContact OD2-N 3.4Å; G342-E344 VanDerWaalsContact C-N 3.3Å; G342-E344 PolarHBondContact O-N 3.28Å
343	K	29.4	Very low	37.4	Very low	188 Å²	188	101.5 Å²	101.5	82%	0.817	53%	0.527	S	S	*	.			trans	-70.5	75.5	-172.4	-78.8	-171.4	177.2	176.4	0	114
344	E	30.9	Very low	40.6	Very low	171 Å²	171	96 Å²	96	80%	0.799	49%	0.494	S	S	*	.			trans	-125.5	103.8	145.4	-74.7	-158.4	152.4	0	0	110.6	G342	G342-E344 VanDerWaalsContact C-N 3.3Å; G342-E344 PolarHBondContact O-N 3.28Å
345	N	28.9	Very low	43.5	Very low	85 Å²	85	90 Å²	90	46%	0.455	46%	0.462	S	S	.	.			trans	16.6	122.4	135.3	-79.4	-5.5	0	0	0	116.7	D1060 C1062	N345-D1060 WeakPolarHBondContact ND2-CA 3.48Å; N345-C1062 WeakPolarHBondContact O-CA 3.21Å
346	T	34.5	Very low	45.8	Very low	34 Å²	34	89.3 Å²	89.3	21%	0.209	46%	0.461	C	S	.	.			cis	-153.3	-171.1	28.5	55	0	0	0	0	112.7	D1060 K1061 C1062	T346-D1060 HydrophobicContact CG2-CB 4.32Å; T346-D1060 VanDerWaalsContact CG2-CG 3.46Å; T346-D1060 WeakPolarHBondContact CG2-OD1 3.42Å; T346-K1061 VanDerWaalsContact CG2-CA 3.43Å; T346-K1061 HydrophobicContact CG2-CG 4.38Å; T346-C1062 PolarHBondContact OG1-SG 3.34Å; T346-C1062 VanDerWaalsContact OG1-SG 3.39Å
347	N	29.8	Very low	47.9	Very low	118 Å²	118	84.1 Å²	84.1	63%	0.631	45%	0.445	S	S	*	.			trans	104.4	135.2	154.5	-48.8	-51.5	0	0	0	113.4	T349	N347-T349 PolarHBondContact O-N 3.04Å
348	Y	40.2	Very low	49.7	Very low	185 Å²	185	79.1 Å²	79.1	73%	0.725	42%	0.42	S	S	*	.			trans	-59.3	101.2	164.6	-65.7	-93.3	0	0	0	108.6	F350	Y348-F350 VanDerWaalsContact C-N 3.31Å; Y348-F350 PolarHBondContact O-N 3.21Å
349	T	43.8	Very low	51.9	Low	102 Å²	102	76.2 Å²	76.2	63%	0.626	40%	0.398	S	S	*	.			trans	-65.2	95.2	165.8	48.6	0	0	0	0	107.5	N347 S351	N347-T349 PolarHBondContact O-N 3.04Å; T349-S351 VanDerWaalsContact C-N 3.31Å; T349-S351 PolarHBondContact O-N 3.45Å
350	F	55.7	Low	54.3	Low	125 Å²	125	73.2 Å²	73.2	55%	0.548	38%	0.384	S	S	.	.			trans	-64.6	95.2	171	-89.9	-88.8	0	0	0	108.6	S277 Y348 H353 L480	S277-F350 WeakPolarHBondContact CB-O 3.36Å; Y348-F350 VanDerWaalsContact C-N 3.31Å; Y348-F350 PolarHBondContact O-N 3.21Å; F350-H353 AromaticContact CD1-CE1 3.93Å; F350-L480 HydrophobicContact CD1-CD1 4.01Å; F350-L480 HydrophobicContact CD1-CD2 4.31Å; F350-L480 HydrophobicContact CE1-CD1 4.47Å; F350-L480 HydrophobicContact CE1-CD2 4.03Å
351	S	67	Low	57	Low	24 Å²	24	70.9 Å²	70.9	17%	0.168	37%	0.371	C	S	.	.			trans	-49.8	143.4	172.7	-54	0	0	0	0	110.5	T349 H353 A483	T349-S351 VanDerWaalsContact C-N 3.31Å; T349-S351 PolarHBondContact O-N 3.45Å; S351-H353 PolarHBondContact O-N 3.07Å; S351-H353 VanDerWaalsContact O-N 3.15Å; S351-H353 PolarHBondContact O-ND1 3.17Å; S351-A483 VanDerWaalsContact CB-CB 3.46Å; S351-A483 WeakPolarHBondContact CB-O 3.46Å; S351-A483 PolarHBondContact OG-O 3.49Å
352	P	80	Confident	59.9	Low	49 Å²	49	73.4 Å²	73.4	32%	0.318	38%	0.384	S	S	.	.			trans	-68.3	118.5	-173.6	28.3	-34.8	0	0	0	111	F274 S277 L278 V478	F274-P352 HydrophobicContact CD1-CB 4.35Å; F274-P352 VanDerWaalsContact CD2-C 3.47Å; F274-P352 HydrophobicContact CD2-CB 3.85Å; F274-P352 HydrophobicContact CE1-CB 4.17Å; F274-P352 HydrophobicContact CE2-CB 3.65Å; F274-P352 HydrophobicContact CE2-CG 4.21Å; F274-P352 VanDerWaalsContact CE2-O 3.24Å; F274-P352 WeakPolarHBondContact CE2-O 3.33Å; F274-P352 HydrophobicContact CG-CB 4.21Å; F274-P352 HydrophobicContact CZ-CB 3.82Å; F274-P352 HydrophobicContact CZ-CG 4.18Å; S277-P352 WeakPolarHBondContact OG-CA 3.46Å; L278-P352 HydrophobicContact CD1-CB 3.55Å; L278-P352 HydrophobicContact CD1-CG 3.93Å; P352-V478 WeakPolarHBondContact O-CG1 3.5Å
353	H	85.3	Confident	62.5	Low	16 Å²	16	70.6 Å²	70.6	7%	0.074	36%	0.355	C	S	.	.			trans	-136.1	151.7	-172.8	62.6	-78.6	0	0	0	110.2	N273 F274 F350 S351 L356 L480	N273-H353 CarbonylContact C-O 3.52Å; F274-H353 WeakPolarHBondContact CA-O 3.32Å; F274-H353 PolarHBondContact N-O 3.46Å; F350-H353 AromaticContact CD1-CE1 3.93Å; S351-H353 PolarHBondContact O-N 3.07Å; S351-H353 VanDerWaalsContact O-N 3.15Å; S351-H353 PolarHBondContact O-ND1 3.17Å; H353-L356 WeakPolarHBondContact NE2-CD2 3.35Å; H353-L480 HydrophobicContact CB-CB 4.05Å
354	H	88.9	Confident	65.5	Low	5 Å²	5	62.2 Å²	62.2	2%	0.023	32%	0.318	C	S	.	.	S	Bend	trans	-96	-37.5	173.4	-63.7	95	0	0	0	110.3	L270 N273 F274 K476 V478	L270-H354 HydrophobicContact CD2-CB 4.25Å; L270-H354 WeakPolarHBondContact CD2-O 3.2Å; L270-H354 PolarHBondContact O-CD2 3.24Å; N273-H354 PolarHBondContact ND2-O 3.21Å; F274-H354 AromaticContact CD2-CE1 3.17Å; F274-H354 WeakPolarHBondContact CD2-CE1 3.32Å; F274-H354 AromaticContact CD2-ND1 3.47Å; F274-H354 WeakPolarHBondContact CD2-ND1 3.45Å; F274-H354 AromaticContact CD2-NE2 3.65Å; F274-H354 AromaticContact CE2-CE1 3.58Å; F274-H354 AromaticContact CE2-ND1 3.97Å; F274-H354 AromaticContact CG-CE1 3.61Å; F274-H354 AromaticContact CG-NE2 3.6Å; H354-K476 VanDerWaalsContact CB-O 3.23Å; H354-K476 WeakPolarHBondContact CB-O 3.18Å; H354-K476 VanDerWaalsContact CG-C 3.46Å; H354-V478 PolarHBondContact N-O 3.07Å
355	L	83.9	Confident	68.4	Low	4 Å²	4	55.2 Å²	55.2	2%	0.021	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-121.6	141.4	-169	-53.8	179	0	0	0	109.9	Y261 L270 N477 V478 H479 L480	Y261-L355 HydrophobicContact CD1-CD2 3.16Å; Y261-L355 HydrophobicContact CD2-CD2 4.44Å; Y261-L355 HydrophobicContact CE1-CD2 3.75Å; Y261-L355 HydrophobicContact CG-CD2 3.57Å; L270-L355 HydrophobicContact CD2-CD2 4.09Å; L355-N477 HydrophobicContact CD1-CB 4.45Å; L355-N477 WeakPolarHBondContact CD1-OD1 3.3Å; L355-V478 PolarHBondContact N-O 3.25Å; L355-H479 WeakPolarHBondContact CD1-CE1 3.42Å; L355-H479 VanDerWaalsContact CD1-NE2 3.29Å; L355-H479 WeakPolarHBondContact CD1-NE2 3.5Å; L355-H479 WeakPolarHBondContact O-CA 3.3Å; L355-L480 PolarHBondContact O-N 2.84Å
356	L	73.2	Confident	71.3	Confident	90 Å²	90	52.1 Å²	52.1	47%	0.471	27%	0.269	S	S	.	.	S	Bend	trans	-86.7	-41.5	-176	-71.4	167.9	0	0	0	112.8	H353 L480	H353-L356 WeakPolarHBondContact NE2-CD2 3.35Å; L356-L480 HydrophobicContact CD2-CD2 3.99Å
357	D	70.4	Confident	74.1	Confident	66 Å²	66	50.6 Å²	50.6	35%	0.353	26%	0.259	S	S	.	.			trans	-155.8	170.6	-169.2	-160.3	-10.6	0	0	0	109.6	P360	D357-P360 WeakPolarHBondContact OD2-CB 3.15Å
358	I	66.4	Low	77.1	Confident	24 Å²	24	46.1 Å²	46.1	12%	0.123	24%	0.235	C	C	.	.	S	Bend	trans	-120.2	108.2	167.6	-61.1	-174.5	0	0	0	108.9	I239 L467 H479 V494	I239-I358 HydrophobicContact CD1-CG2 3.88Å; I239-I358 HydrophobicContact CG2-CG2 4.45Å; I358-L467 HydrophobicContact CD1-CD2 4.5Å; I358-H479 WeakPolarHBondContact CG1-CE1 3.47Å; I358-H479 WeakPolarHBondContact CG1-ND1 3.41Å; I358-V494 HydrophobicContact CB-CG2 4.13Å; I358-V494 HydrophobicContact CD1-CB 4.44Å; I358-V494 HydrophobicContact CD1-CG1 3.76Å; I358-V494 HydrophobicContact CD1-CG2 3.99Å; I358-V494 HydrophobicContact CG1-CG1 4.48Å; I358-V494 HydrophobicContact CG1-CG2 4.1Å
359	M	71.7	Confident	79.6	Confident	12 Å²	12	37.3 Å²	37.3	6%	0.059	20%	0.2	C	C	.	.	S	Bend	trans	56.9	66.3	177.9	-165.3	79.5	76.3	0	0	112.9	I239 A363 Y367 D403 E404 I406	I239-M359 HydrophobicContact CB-CE 4.46Å; I239-M359 HydrophobicContact CG2-CB 4.06Å; I239-M359 HydrophobicContact CG2-CE 3.67Å; I239-M359 HydrophobicContact CG2-CG 4.45Å; M359-A363 HydrophobicContact SD-CB 3.91Å; M359-Y367 HydrophobicContact CE-CE2 3.99Å; M359-Y367 HydrophobicContact SD-CD2 4.12Å; M359-Y367 HydrophobicContact SD-CE2 3.61Å; M359-D403 HydrophobicContact SD-CB 4.18Å; M359-E404 WeakPolarHBondContact CE-O 3.27Å; M359-I406 HydrophobicContact CE-CG2 3.61Å; M359-I406 HydrophobicContact SD-CG2 4.16Å
360	P	74.9	Confident	81.9	Confident	35 Å²	35	32.6 Å²	32.6	23%	0.227	17%	0.171	C	C	.	.			trans	-57.9	156.7	174.8	25.4	-34.9	0	0	0	111.6	D357 L362 A363 Y364	D357-P360 WeakPolarHBondContact OD2-CB 3.15Å; P360-L362 HydrophobicContact CB-CB 4.49Å; P360-L362 PolarHBondContact O-N 3.45Å; P360-A363 HydrophobicContact CG-CB 4.15Å; P360-A363 WeakPolarHBondContact O-CA 3.49Å; P360-A363 WeakPolarHBondContact O-CB 3.39Å; P360-A363 PolarHBondContact O-N 3.13Å; P360-Y364 PolarHBondContact O-N 3.3Å
361	D	83.3	Confident	83.6	Confident	56 Å²	56	29.4 Å²	29.4	30%	0.299	16%	0.157	S	C	.	.	H	α-helix	trans	-42.2	-43	172.4	-87.3	-44.5	0	0	0	112.1	P234 A363 Y364 Y365 F380	P234-D361 VanDerWaalsContact CB-OD1 3.32Å; P234-D361 WeakPolarHBondContact CB-OD1 3.14Å; D361-A363 VanDerWaalsContact C-N 3.32Å; D361-A363 PolarHBondContact O-N 3.3Å; D361-Y364 PolarHBondContact O-N 2.86Å; D361-Y365 HydrophobicContact CB-CD2 4.07Å; D361-Y365 HydrophobicContact CB-CE2 4.12Å; D361-Y365 WeakPolarHBondContact O-CB 3.44Å; D361-Y365 WeakPolarHBondContact O-CD2 3.27Å; D361-Y365 PolarHBondContact O-N 3.49Å; D361-F380 HydrophobicContact CB-CD1 3.66Å; D361-F380 HydrophobicContact CB-CE1 4.24Å; D361-F380 HydrophobicContact CB-CG 4.38Å; D361-F380 VanDerWaalsContact OD2-CE1 3.31Å; D361-F380 WeakPolarHBondContact OD2-CE1 3.49Å
362	L	87.5	Confident	84.8	Confident	89 Å²	89	28.7 Å²	28.7	47%	0.466	15%	0.152	S	C	.	.	H	α-helix	trans	-51.8	-44.9	176.1	173.2	61.9	0	0	0	113.1	P360 T366 V381	P360-L362 HydrophobicContact CB-CB 4.49Å; P360-L362 PolarHBondContact O-N 3.45Å; L362-T366 WeakPolarHBondContact O-CB 3.48Å; L362-T366 PolarHBondContact O-N 3.23Å; L362-T366 PolarHBondContact O-OG1 3.39Å; L362-V381 HydrophobicContact CD1-CB 4.19Å; L362-V381 HydrophobicContact CD1-CG1 3.9Å; L362-V381 HydrophobicContact CD1-CG2 4.37Å
363	A	87.4	Confident	85.4	Confident	4 Å²	4	29.3 Å²	29.3	3%	0.033	16%	0.155	C	C	.	.	H	α-helix	trans	-71.3	-48.1	179.2	0	0	0	0	0	110.8	M359 P360 D361 Y365 T366 Y367 D403	M359-A363 HydrophobicContact SD-CB 3.91Å; P360-A363 HydrophobicContact CG-CB 4.15Å; P360-A363 WeakPolarHBondContact O-CA 3.49Å; P360-A363 WeakPolarHBondContact O-CB 3.39Å; P360-A363 PolarHBondContact O-N 3.13Å; D361-A363 VanDerWaalsContact C-N 3.32Å; D361-A363 PolarHBondContact O-N 3.3Å; A363-Y365 PolarHBondContact O-N 3.4Å; A363-T366 PolarHBondContact O-N 3.13Å; A363-T366 VanDerWaalsContact O-N 3.11Å; A363-Y367 PolarHBondContact O-N 2.8Å; A363-D403 HydrophobicContact CB-CB 4.04Å
364	Y	91	Very high	85.7	Confident	12 Å²	12	32.2 Å²	32.2	5%	0.047	17%	0.171	C	C	.	.	H	α-helix	trans	-57.9	-50	178.4	-176.6	-94.3	0	0	0	112.1	G232 P234 S237 P360 D361 T366 Y367 M368 I406	G232-Y364 WeakPolarHBondContact CA-OH 3.23Å; P234-Y364 HydrophobicContact CB-CD1 3.68Å; P234-Y364 HydrophobicContact CB-CE1 4.08Å; P234-Y364 HydrophobicContact CB-CG 4.32Å; P234-Y364 HydrophobicContact CG-CD1 3.89Å; P234-Y364 HydrophobicContact CG-CE1 3.77Å; S237-Y364 WeakPolarHBondContact OG-CD2 3.16Å; P360-Y364 PolarHBondContact O-N 3.3Å; D361-Y364 PolarHBondContact O-N 2.86Å; Y364-T366 VanDerWaalsContact C-N 3.29Å; Y364-T366 PolarHBondContact O-N 2.69Å; Y364-Y367 PolarHBondContact O-N 3.46Å; Y364-M368 HydrophobicContact CD1-CG 4.37Å; Y364-M368 HydrophobicContact CE1-CB 4.4Å; Y364-M368 HydrophobicContact CE1-CG 3.87Å; Y364-M368 HydrophobicContact CE2-CG 4.12Å; Y364-M368 WeakPolarHBondContact O-CB 3.41Å; Y364-M368 PolarHBondContact O-N 2.75Å; Y364-I406 HydrophobicContact CD2-CG2 4.22Å
365	Y	91.9	Very high	85.8	Confident	25 Å²	25	35.7 Å²	35.7	10%	0.098	20%	0.196	C	C	.	.	H	α-helix	trans	-70.9	-20.8	177.4	-69.8	-61	0	0	0	113.7	P234 D361 A363 A369 T372 L376 L377 F380	P234-Y365 HydrophobicContact CB-CE2 3.97Å; P234-Y365 HydrophobicContact CG-CE1 4.15Å; P234-Y365 HydrophobicContact CG-CE2 4.37Å; P234-Y365 WeakPolarHBondContact CG-OH 3.04Å; D361-Y365 HydrophobicContact CB-CD2 4.07Å; D361-Y365 HydrophobicContact CB-CE2 4.12Å; D361-Y365 WeakPolarHBondContact O-CB 3.44Å; D361-Y365 WeakPolarHBondContact O-CD2 3.27Å; D361-Y365 PolarHBondContact O-N 3.49Å; A363-Y365 PolarHBondContact O-N 3.4Å; Y365-A369 VanDerWaalsContact O-CA 3.3Å; Y365-A369 WeakPolarHBondContact O-CA 3.4Å; Y365-A369 WeakPolarHBondContact O-CB 3.4Å; Y365-A369 PolarHBondContact O-N 3.42Å; Y365-T372 HydrophobicContact CD1-CG2 3.48Å; Y365-T372 VanDerWaalsContact CD1-CG2 3.48Å; Y365-T372 HydrophobicContact CE1-CG2 3.94Å; Y365-T372 HydrophobicContact CG-CG2 4.4Å; Y365-L376 HydrophobicContact CE1-CB 4.36Å; Y365-L376 HydrophobicContact CE1-CD1 4.23Å; Y365-L377 WeakPolarHBondContact O-CD2 3.25Å; Y365-F380 HydrophobicContact CD2-CB 3.42Å; Y365-F380 VanDerWaalsContact CD2-CB 3.42Å; Y365-F380 HydrophobicContact CD2-CD1 4.26Å; Y365-F380 AromaticContact CD2-CD2 3.92Å; Y365-F380 HydrophobicContact CD2-CD2 3.92Å; Y365-F380 AromaticContact CD2-CG 3.63Å; Y365-F380 HydrophobicContact CD2-CG 3.63Å; Y365-F380 HydrophobicContact CE2-CB 3.84Å; Y365-F380 AromaticContact CE2-CD1 3.9Å; Y365-F380 HydrophobicContact CE2-CD1 3.9Å; Y365-F380 AromaticContact CE2-CD2 3.44Å; Y365-F380 HydrophobicContact CE2-CD2 3.44Å; Y365-F380 VanDerWaalsContact CE2-CD2 3.44Å; Y365-F380 HydrophobicContact CE2-CE1 4.28Å; Y365-F380 AromaticContact CE2-CE2 3.89Å; Y365-F380 HydrophobicContact CE2-CE2 3.89Å; Y365-F380 AromaticContact CE2-CG 3.45Å; Y365-F380 HydrophobicContact CE2-CG 3.45Å; Y365-F380 VanDerWaalsContact CE2-CG 3.45Å; Y365-F380 HydrophobicContact CE2-CZ 4.28Å; Y365-F380 HydrophobicContact CG-CB 4.27Å; Y365-F380 AromaticContact CZ-CD2 3.96Å
366	T	90.8	Very high	86.1	Confident	20 Å²	20	38 Å²	38	12%	0.123	21%	0.208	C	C	.	.	H	α-helix	trans	-73.7	-40.8	170.2	-65	0	0	0	0	111.4	L362 A363 Y364 A369 L397	L362-T366 WeakPolarHBondContact O-CB 3.48Å; L362-T366 PolarHBondContact O-N 3.23Å; L362-T366 PolarHBondContact O-OG1 3.39Å; A363-T366 PolarHBondContact O-N 3.13Å; A363-T366 VanDerWaalsContact O-N 3.11Å; Y364-T366 VanDerWaalsContact C-N 3.29Å; Y364-T366 PolarHBondContact O-N 2.69Å; T366-A369 WeakPolarHBondContact O-CB 3.38Å; T366-L397 HydrophobicContact CG2-CD1 4.34Å
367	Y	92.6	Very high	87	Confident	1 Å²	1	33.7 Å²	33.7	0%	0.004	19%	0.185	C	C	.	.	H	α-helix	trans	-65.7	-47.3	173.2	-64.5	-22.5	0	0	0	111.7	W242 M359 A363 Y364 A369 L397 T401 D403 E404 I406 F409	W242-Y367 HydrophobicContact CZ2-CE1 4Å; W242-Y367 HydrophobicContact CZ2-CE2 4.47Å; W242-Y367 AromaticContact CZ2-CZ 3.81Å; W242-Y367 PolarHBondContact NE1-OH 2.81Å; M359-Y367 HydrophobicContact CE-CE2 3.99Å; M359-Y367 HydrophobicContact SD-CD2 4.12Å; M359-Y367 HydrophobicContact SD-CE2 3.61Å; A363-Y367 PolarHBondContact O-N 2.8Å; Y364-Y367 PolarHBondContact O-N 3.46Å; Y367-A369 VanDerWaalsContact C-N 3.26Å; Y367-A369 PolarHBondContact O-N 2.79Å; Y367-L397 HydrophobicContact CD1-CD1 3.89Å; Y367-L397 HydrophobicContact CD1-CD2 3.8Å; Y367-L397 HydrophobicContact CD1-CG 3.96Å; Y367-L397 HydrophobicContact CE1-CD1 4.06Å; Y367-L397 HydrophobicContact CE1-CD2 4.24Å; Y367-L397 HydrophobicContact CE1-CG 3.98Å; Y367-T401 HydrophobicContact CE1-CG2 3.72Å; Y367-T401 WeakPolarHBondContact CE1-OG1 3.48Å; Y367-T401 PolarHBondContact OH-OG1 2.93Å; Y367-D403 PolarHBondContact OH-O 3.46Å; Y367-D403 VanDerWaalsContact OH-O 3.07Å; Y367-E404 VanDerWaalsContact CE2-O 3.22Å; Y367-E404 WeakPolarHBondContact CE2-O 3.34Å; Y367-E404 PolarHBondContact OH-O 2.84Å; Y367-I406 HydrophobicContact CD2-CD1 4.12Å; Y367-I406 HydrophobicContact CD2-CG1 4.04Å; Y367-I406 HydrophobicContact CD2-CG2 3.79Å; Y367-I406 HydrophobicContact CE2-CG2 4.25Å; Y367-I406 HydrophobicContact CG-CD1 4.36Å; Y367-F409 HydrophobicContact CD1-CE2 4.16Å; Y367-F409 HydrophobicContact CD2-CE2 4.3Å; Y367-F409 AromaticContact CG-CE2 3.89Å; Y367-F409 HydrophobicContact CG-CE2 3.89Å; Y367-F409 HydrophobicContact CG-CZ 4.3Å
368	M	92.8	Very high	87.9	Confident	24 Å²	24	32.9 Å²	32.9	12%	0.118	18%	0.183	C	C	.	.	S	Bend	trans	-81.5	5.4	-179.3	-67.4	-64.4	-76.3	0	0	114.2	Y364 R370 K371 T372 I406 E408 V415	Y364-M368 HydrophobicContact CD1-CG 4.37Å; Y364-M368 HydrophobicContact CE1-CB 4.4Å; Y364-M368 HydrophobicContact CE1-CG 3.87Å; Y364-M368 HydrophobicContact CE2-CG 4.12Å; Y364-M368 WeakPolarHBondContact O-CB 3.41Å; Y364-M368 PolarHBondContact O-N 2.75Å; M368-R370 PolarHBondContact O-N 2.68Å; M368-K371 HydrophobicContact CE-CB 4.47Å; M368-K371 WeakPolarHBondContact O-CA 3.43Å; M368-K371 PolarHBondContact O-N 2.53Å; M368-T372 PolarHBondContact O-N 2.97Å; M368-T372 PolarHBondContact O-OG1 3.42Å; M368-T372 VanDerWaalsContact O-OG1 3.05Å; M368-I406 HydrophobicContact CG-CD1 4.09Å; M368-I406 HydrophobicContact SD-CD1 4Å; M368-E408 HydrophobicContact CE-CG 4.32Å; M368-E408 HydrophobicContact SD-CB 4.37Å; M368-E408 HydrophobicContact SD-CG 4Å; M368-V415 HydrophobicContact CE-CG2 4.02Å; M368-V415 HydrophobicContact SD-CB 4.4Å; M368-V415 HydrophobicContact SD-CG1 3.76Å; M368-V415 HydrophobicContact SD-CG2 3.65Å
369	A	92.4	Very high	89	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-26.4	-170.6	0	0	0	0	0	115.3	Y365 T366 Y367 K371 L377 F390 H420 M423	Y365-A369 VanDerWaalsContact O-CA 3.3Å; Y365-A369 WeakPolarHBondContact O-CA 3.4Å; Y365-A369 WeakPolarHBondContact O-CB 3.4Å; Y365-A369 PolarHBondContact O-N 3.42Å; T366-A369 WeakPolarHBondContact O-CB 3.38Å; Y367-A369 VanDerWaalsContact C-N 3.26Å; Y367-A369 PolarHBondContact O-N 2.79Å; A369-K371 VanDerWaalsContact C-N 3.29Å; A369-K371 PolarHBondContact O-N 2.78Å; A369-L377 HydrophobicContact CB-CD1 4.37Å; A369-L377 HydrophobicContact CB-CD2 4.03Å; A369-F390 HydrophobicContact CB-CD1 3.73Å; A369-F390 HydrophobicContact CB-CE1 3.67Å; A369-H420 PolarHBondContact O-CD2 3.49Å; A369-H420 PolarHBondContact O-NE2 3.18Å; A369-M423 HydrophobicContact CB-CE 4.23Å; A369-M423 HydrophobicContact CB-SD 4.27Å
370	R	92.7	Very high	89.7	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.015	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-19.5	175.3	-86.1	70.2	-179.1	-166.3	-2.2	113.5	M368 P391 V415 S418 I419 M423 A424	M368-R370 PolarHBondContact O-N 2.68Å; R370-P391 PolarHBondContact NH1-O 3.47Å; R370-P391 PolarHBondContact NH2-O 2.81Å; R370-V415 VanDerWaalsContact CB-O 3.27Å; R370-V415 WeakPolarHBondContact CB-O 3.47Å; R370-S418 CarbonylContact O-C 3.55Å; R370-S418 WeakPolarHBondContact O-CA 3.05Å; R370-I419 WeakPolarHBondContact O-CG1 3.47Å; R370-I419 PolarHBondContact O-N 2.99Å; R370-M423 HydrophobicContact CG-SD 4.29Å; R370-A424 PolarHBondContact NE-O 3.5Å; R370-A424 VanDerWaalsContact NE-O 3.08Å; R370-A424 PolarHBondContact NH2-O 2.83Å
371	K	92.4	Very high	90.2	Very high	57 Å²	57	40.4 Å²	40.4	25%	0.248	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-21.7	176.9	-64.8	-50.5	-168	-146	0	114.3	M368 A369 S414 S417 I419	M368-K371 HydrophobicContact CE-CB 4.47Å; M368-K371 WeakPolarHBondContact O-CA 3.43Å; M368-K371 PolarHBondContact O-N 2.53Å; A369-K371 VanDerWaalsContact C-N 3.29Å; A369-K371 PolarHBondContact O-N 2.78Å; K371-S414 VanDerWaalsContact CE-C 3.46Å; K371-S414 WeakPolarHBondContact CE-O 3.5Å; K371-S414 WeakPolarHBondContact CE-OG 3.22Å; K371-S414 PolarHBondContact NZ-O 2.92Å; K371-S414 VanDerWaalsContact NZ-O 3.09Å; K371-S417 WeakPolarHBondContact CE-O 3.08Å; K371-S417 PolarHBondContact NZ-O 2.95Å; K371-S417 PolarHBondContact NZ-OG 2.84Å; K371-I419 HydrophobicContact CD-CG2 3.84Å; K371-I419 VanDerWaalsContact O-CD1 3.32Å; K371-I419 WeakPolarHBondContact O-CD1 3.49Å
372	T	92.1	Very high	90.1	Very high	10 Å²	10	39.6 Å²	39.6	6%	0.061	21%	0.209	C	C	.	.	S	Bend	trans	-68.7	129.2	177.2	-54.8	0	0	0	0	111.1	Y365 M368 L376 L377 H420	Y365-T372 HydrophobicContact CD1-CG2 3.48Å; Y365-T372 VanDerWaalsContact CD1-CG2 3.48Å; Y365-T372 HydrophobicContact CE1-CG2 3.94Å; Y365-T372 HydrophobicContact CG-CG2 4.4Å; M368-T372 PolarHBondContact O-N 2.97Å; M368-T372 PolarHBondContact O-OG1 3.42Å; M368-T372 VanDerWaalsContact O-OG1 3.05Å; T372-L376 HydrophobicContact CG2-CB 3.62Å; T372-L376 HydrophobicContact CG2-CD1 4.37Å; T372-L377 HydrophobicContact CG2-CD2 3.8Å; T372-L377 HydrophobicContact CG2-CG 3.79Å; T372-H420 PolarHBondContact O-CE1 2.94Å; T372-H420 PolarHBondContact O-NE2 2.88Å
373	P	92.8	Very high	90.1	Very high	61 Å²	61	41.1 Å²	41.1	40%	0.396	22%	0.224	S	C	.	.			trans	-64.7	150.8	175.9	27.6	-35.8	0	0	0	112.2	S375 L376 L377	P373-S375 PolarHBondContact O-N 3.48Å; P373-S375 VanDerWaalsContact O-N 3.09Å; P373-L376 HydrophobicContact CG-CB 4.47Å; P373-L376 HydrophobicContact CG-CD1 3.87Å; P373-L376 HydrophobicContact CG-CG 4.11Å; P373-L376 PolarHBondContact O-N 2.84Å; P373-L376 VanDerWaalsContact O-N 3.09Å; P373-L377 PolarHBondContact O-N 2.87Å
374	L	90.4	Very high	90.1	Very high	78 Å²	78	45.7 Å²	45.7	41%	0.408	25%	0.251	S	S	.	.	H	α-helix	trans	-53.5	-35.8	-173.9	-68.7	176	0	0	0	113.8	L376 L377 T378 Y385	L374-L376 PolarHBondContact O-N 3.39Å; L374-L377 PolarHBondContact O-N 3.28Å; L374-T378 PolarHBondContact O-N 2.92Å; L374-T378 PolarHBondContact O-OG1 3.31Å; L374-T378 VanDerWaalsContact O-OG1 3.08Å; L374-Y385 HydrophobicContact CD2-CD1 4.05Å; L374-Y385 HydrophobicContact CD2-CD2 3.77Å; L374-Y385 HydrophobicContact CD2-CE1 3.73Å; L374-Y385 HydrophobicContact CD2-CE2 3.43Å; L374-Y385 VanDerWaalsContact CD2-CE2 3.43Å; L374-Y385 HydrophobicContact CD2-CG 4.05Å
375	S	90.9	Very high	89.9	Confident	77 Å²	77	47.1 Å²	47.1	54%	0.538	26%	0.257	S	S	.	.	H	α-helix	trans	-58.2	-47.3	178.3	46.9	0	0	0	0	112.8	P373 T378 Q379	P373-S375 PolarHBondContact O-N 3.48Å; P373-S375 VanDerWaalsContact O-N 3.09Å; S375-T378 WeakPolarHBondContact CA-OG1 3.41Å; S375-T378 PolarHBondContact O-N 3.07Å; S375-T378 PolarHBondContact O-OG1 3.29Å; S375-Q379 WeakPolarHBondContact O-CB 3.24Å; S375-Q379 PolarHBondContact O-N 3.1Å
376	L	91.3	Very high	89.8	Confident	52 Å²	52	50.2 Å²	50.2	27%	0.272	27%	0.272	S	S	.	.	H	α-helix	trans	-70.1	-36.7	178	-64.1	177.7	0	0	0	111.2	Y365 T372 P373 L374 T378 Q379 F380	Y365-L376 HydrophobicContact CE1-CB 4.36Å; Y365-L376 HydrophobicContact CE1-CD1 4.23Å; T372-L376 HydrophobicContact CG2-CB 3.62Å; T372-L376 HydrophobicContact CG2-CD1 4.37Å; P373-L376 HydrophobicContact CG-CB 4.47Å; P373-L376 HydrophobicContact CG-CD1 3.87Å; P373-L376 HydrophobicContact CG-CG 4.11Å; P373-L376 PolarHBondContact O-N 2.84Å; P373-L376 VanDerWaalsContact O-N 3.09Å; L374-L376 PolarHBondContact O-N 3.39Å; L376-T378 VanDerWaalsContact C-N 3.33Å; L376-T378 PolarHBondContact O-N 3.5Å; L376-Q379 PolarHBondContact O-N 2.7Å; L376-Q379 VanDerWaalsContact O-N 3.15Å; L376-F380 HydrophobicContact CB-CD2 4.45Å; L376-F380 HydrophobicContact CD2-CD2 4.38Å; L376-F380 HydrophobicContact CD2-CE2 3.96Å; L376-F380 WeakPolarHBondContact O-CD2 3.31Å; L376-F380 PolarHBondContact O-N 3.04Å
377	L	91	Very high	89.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.7	-38.4	172.7	-67.4	178.7	0	0	0	112.4	Y365 A369 T372 P373 L374 Q379 V381 R382 Y385 F390	Y365-L377 WeakPolarHBondContact O-CD2 3.25Å; A369-L377 HydrophobicContact CB-CD1 4.37Å; A369-L377 HydrophobicContact CB-CD2 4.03Å; T372-L377 HydrophobicContact CG2-CD2 3.8Å; T372-L377 HydrophobicContact CG2-CG 3.79Å; P373-L377 PolarHBondContact O-N 2.87Å; L374-L377 PolarHBondContact O-N 3.28Å; L377-Q379 VanDerWaalsContact C-N 3.31Å; L377-V381 HydrophobicContact CD2-CG2 3.88Å; L377-V381 WeakPolarHBondContact O-CB 3.29Å; L377-V381 PolarHBondContact O-N 3.08Å; L377-V381 VanDerWaalsContact O-N 3.09Å; L377-R382 PolarHBondContact O-N 3.4Å; L377-Y385 HydrophobicContact CB-CD2 4.44Å; L377-Y385 HydrophobicContact CD1-CD2 4.41Å; L377-Y385 HydrophobicContact CD1-CE2 3.93Å; L377-F390 HydrophobicContact CD1-CZ 4.44Å; L377-F390 HydrophobicContact CD2-CE1 4.36Å; L377-F390 HydrophobicContact CD2-CZ 4.4Å
378	T	90.1	Very high	89.2	Confident	50 Å²	50	59.3 Å²	59.3	31%	0.307	32%	0.316	S	S	.	.	H	α-helix	trans	-71	-26	174.2	49.1	0	0	0	0	113.8	L374 S375 L376 R382 P383	L374-T378 PolarHBondContact O-N 2.92Å; L374-T378 PolarHBondContact O-OG1 3.31Å; L374-T378 VanDerWaalsContact O-OG1 3.08Å; S375-T378 WeakPolarHBondContact CA-OG1 3.41Å; S375-T378 PolarHBondContact O-N 3.07Å; S375-T378 PolarHBondContact O-OG1 3.29Å; L376-T378 VanDerWaalsContact C-N 3.33Å; L376-T378 PolarHBondContact O-N 3.5Å; T378-R382 WeakPolarHBondContact CA-O 3.46Å; T378-R382 CarbonylContact O-C 3.55Å; T378-P383 WeakPolarHBondContact O-CA 3.33Å
379	Q	89.3	Confident	88.9	Confident	132 Å²	132	64.4 Å²	64.4	62%	0.617	34%	0.339	S	S	*	.	H	α-helix	trans	-80.5	-49	179	179.9	176.6	-10.8	0	0	112.6	S375 L376 L377	S375-Q379 WeakPolarHBondContact O-CB 3.24Å; S375-Q379 PolarHBondContact O-N 3.1Å; L376-Q379 PolarHBondContact O-N 2.7Å; L376-Q379 VanDerWaalsContact O-N 3.15Å; L377-Q379 VanDerWaalsContact C-N 3.31Å
380	F	86.1	Confident	88.7	Confident	63 Å²	63	64.8 Å²	64.8	28%	0.276	34%	0.341	S	S	.	.	H	α-helix	trans	-103.7	-24.7	-168.7	-67.9	-83.8	0	0	0	114.7	D361 Y365 L376	D361-F380 HydrophobicContact CB-CD1 3.66Å; D361-F380 HydrophobicContact CB-CE1 4.24Å; D361-F380 HydrophobicContact CB-CG 4.38Å; D361-F380 VanDerWaalsContact OD2-CE1 3.31Å; D361-F380 WeakPolarHBondContact OD2-CE1 3.49Å; Y365-F380 HydrophobicContact CD2-CB 3.42Å; Y365-F380 VanDerWaalsContact CD2-CB 3.42Å; Y365-F380 HydrophobicContact CD2-CD1 4.26Å; Y365-F380 AromaticContact CD2-CD2 3.92Å; Y365-F380 HydrophobicContact CD2-CD2 3.92Å; Y365-F380 AromaticContact CD2-CG 3.63Å; Y365-F380 HydrophobicContact CD2-CG 3.63Å; Y365-F380 HydrophobicContact CE2-CB 3.84Å; Y365-F380 AromaticContact CE2-CD1 3.9Å; Y365-F380 HydrophobicContact CE2-CD1 3.9Å; Y365-F380 AromaticContact CE2-CD2 3.44Å; Y365-F380 HydrophobicContact CE2-CD2 3.44Å; Y365-F380 VanDerWaalsContact CE2-CD2 3.44Å; Y365-F380 HydrophobicContact CE2-CE1 4.28Å; Y365-F380 AromaticContact CE2-CE2 3.89Å; Y365-F380 HydrophobicContact CE2-CE2 3.89Å; Y365-F380 AromaticContact CE2-CG 3.45Å; Y365-F380 HydrophobicContact CE2-CG 3.45Å; Y365-F380 VanDerWaalsContact CE2-CG 3.45Å; Y365-F380 HydrophobicContact CE2-CZ 4.28Å; Y365-F380 HydrophobicContact CG-CB 4.27Å; Y365-F380 AromaticContact CZ-CD2 3.96Å; L376-F380 HydrophobicContact CB-CD2 4.45Å; L376-F380 HydrophobicContact CD2-CD2 4.38Å; L376-F380 HydrophobicContact CD2-CE2 3.96Å; L376-F380 WeakPolarHBondContact O-CD2 3.31Å; L376-F380 PolarHBondContact O-N 3.04Å
381	V	85	Confident	88.6	Confident	34 Å²	34	65.5 Å²	65.5	21%	0.206	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-51.5	-178.1	-174.1	0	0	0	0	111.9	L362 L377 F390	L362-V381 HydrophobicContact CD1-CB 4.19Å; L362-V381 HydrophobicContact CD1-CG1 3.9Å; L362-V381 HydrophobicContact CD1-CG2 4.37Å; L377-V381 HydrophobicContact CD2-CG2 3.88Å; L377-V381 WeakPolarHBondContact O-CB 3.29Å; L377-V381 PolarHBondContact O-N 3.08Å; L377-V381 VanDerWaalsContact O-N 3.09Å; V381-F390 HydrophobicContact CG1-CE1 3.94Å; V381-F390 HydrophobicContact CG1-CZ 4.09Å
382	R	82.5	Confident	88.5	Confident	39 Å²	39	66.6 Å²	66.6	15%	0.147	36%	0.357	C	S	.	.			trans	-163.9	115.6	-168.9	49.7	-177.3	-58.7	141.3	18.5	113.8	L377 T378 V384 Q386 E389 F390	L377-R382 PolarHBondContact O-N 3.4Å; T378-R382 WeakPolarHBondContact CA-O 3.46Å; T378-R382 CarbonylContact O-C 3.55Å; R382-V384 VanDerWaalsContact CZ-O 3.31Å; R382-V384 PolarHBondContact NE-O 2.72Å; R382-V384 PolarHBondContact NH2-O 3.06Å; R382-V384 PolarHBondContact O-N 3.29Å; R382-Q386 PolarHBondContact NH1-O 2.63Å; R382-Q386 VanDerWaalsContact NH2-OE1 3.08Å; R382-E389 IonicContact CZ-OE2 3.78Å; R382-E389 IonicContact NH1-OE2 3.4Å; R382-E389 PolarHBondContact NH1-OE2 3.19Å; R382-E389 IonicContact NH2-OE2 3.63Å; R382-E389 PolarHBondContact NH2-OE2 2.99Å; R382-F390 HydrophobicContact CG-CZ 4.38Å
383	P	86	Confident	88.4	Confident	121 Å²	121	68.7 Å²	68.7	79%	0.786	37%	0.37	S	S	*	.	S	Bend	trans	-55	-30.6	-179.1	-29.7	36.3	0	0	0	115.3	T378	T378-P383 WeakPolarHBondContact O-CA 3.33Å
384	V	88.3	Confident	88.4	Confident	100 Å²	100	65.8 Å²	65.8	61%	0.606	35%	0.352	S	S	*	.	S	Bend	trans	-108.6	101.6	171.4	-179	0	0	0	0	108.6	R382 Q386	R382-V384 VanDerWaalsContact CZ-O 3.31Å; R382-V384 PolarHBondContact NE-O 2.72Å; R382-V384 PolarHBondContact NH2-O 3.06Å; R382-V384 PolarHBondContact O-N 3.29Å; V384-Q386 PolarHBondContact O-N 3.31Å
385	Y	87.4	Confident	88.4	Confident	42 Å²	42	62.9 Å²	62.9	17%	0.165	34%	0.339	C	S	.	.			trans	-62.9	129.7	176	176.6	-95.2	0	0	0	111.6	L374 L377 P387 F390 M423	L374-Y385 HydrophobicContact CD2-CD1 4.05Å; L374-Y385 HydrophobicContact CD2-CD2 3.77Å; L374-Y385 HydrophobicContact CD2-CE1 3.73Å; L374-Y385 HydrophobicContact CD2-CE2 3.43Å; L374-Y385 VanDerWaalsContact CD2-CE2 3.43Å; L374-Y385 HydrophobicContact CD2-CG 4.05Å; L377-Y385 HydrophobicContact CB-CD2 4.44Å; L377-Y385 HydrophobicContact CD1-CD2 4.41Å; L377-Y385 HydrophobicContact CD1-CE2 3.93Å; Y385-P387 HydrophobicContact CE1-CB 4.22Å; Y385-P387 HydrophobicContact CE1-CG 4.26Å; Y385-F390 HydrophobicContact CD2-CE2 4.08Å; Y385-F390 HydrophobicContact CD2-CZ 4.46Å; Y385-F390 AromaticContact CE2-CE2 3.91Å; Y385-F390 HydrophobicContact CE2-CE2 3.91Å; Y385-F390 HydrophobicContact CE2-CZ 4.38Å; Y385-M423 HydrophobicContact CE2-CE 3.98Å
386	Q	89	Confident	88.3	Confident	89 Å²	89	65.1 Å²	65.1	42%	0.416	34%	0.336	S	S	.	.			trans	-141.2	120.8	168.5	-60.9	171.3	-18.1	0	0	107.2	R382 V384 Q388 E389 F390	R382-Q386 PolarHBondContact NH1-O 2.63Å; R382-Q386 VanDerWaalsContact NH2-OE1 3.08Å; V384-Q386 PolarHBondContact O-N 3.31Å; Q386-Q388 PolarHBondContact O-N 3.02Å; Q386-E389 PolarHBondContact OE1-OE2 3.49Å; Q386-F390 WeakPolarHBondContact O-CD2 3.38Å
387	P	85.6	Confident	88.4	Confident	29 Å²	29	62.7 Å²	62.7	19%	0.188	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-70.6	-19.6	-174.4	25.9	-33.2	0	0	0	113.4	Y385 E389 D422 M423	Y385-P387 HydrophobicContact CE1-CB 4.22Å; Y385-P387 HydrophobicContact CE1-CG 4.26Å; P387-E389 PolarHBondContact O-N 3.46Å; P387-D422 WeakPolarHBondContact CB-O 3.43Å; P387-D422 HydrophobicContact CG-CB 4.31Å; P387-D422 VanDerWaalsContact CG-O 3.31Å; P387-D422 WeakPolarHBondContact CG-O 3.22Å; P387-M423 HydrophobicContact CB-CB 3.96Å; P387-M423 HydrophobicContact CB-CG 4.42Å
388	Q	85.3	Confident	88.3	Confident	183 Å²	183	64.3 Å²	64.3	86%	0.855	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-75.6	-20.6	-171.8	-63.4	-177.8	6.8	0	0	115	Q386	Q386-Q388 PolarHBondContact O-N 3.02Å
389	E	85.7	Confident	88.2	Confident	132 Å²	132	67.6 Å²	67.6	62%	0.617	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-92.2	-8	179.2	-50	-174.9	127.9	0	0	112.7	R382 Q386 P387	R382-E389 IonicContact CZ-OE2 3.78Å; R382-E389 IonicContact NH1-OE2 3.4Å; R382-E389 PolarHBondContact NH1-OE2 3.19Å; R382-E389 IonicContact NH2-OE2 3.63Å; R382-E389 PolarHBondContact NH2-OE2 2.99Å; Q386-E389 PolarHBondContact OE1-OE2 3.49Å; P387-E389 PolarHBondContact O-N 3.46Å
390	F	89.4	Confident	88	Confident	7 Å²	7	64 Å²	64	3%	0.031	33%	0.331	C	S	.	.	S	Bend	trans	-73.2	135.5	170.6	-71.1	-92.4	0	0	0	109.7	A369 L377 V381 R382 Y385 Q386 T392 M423	A369-F390 HydrophobicContact CB-CD1 3.73Å; A369-F390 HydrophobicContact CB-CE1 3.67Å; L377-F390 HydrophobicContact CD1-CZ 4.44Å; L377-F390 HydrophobicContact CD2-CE1 4.36Å; L377-F390 HydrophobicContact CD2-CZ 4.4Å; V381-F390 HydrophobicContact CG1-CE1 3.94Å; V381-F390 HydrophobicContact CG1-CZ 4.09Å; R382-F390 HydrophobicContact CG-CZ 4.38Å; Y385-F390 HydrophobicContact CD2-CE2 4.08Å; Y385-F390 HydrophobicContact CD2-CZ 4.46Å; Y385-F390 AromaticContact CE2-CE2 3.91Å; Y385-F390 HydrophobicContact CE2-CE2 3.91Å; Y385-F390 HydrophobicContact CE2-CZ 4.38Å; Q386-F390 WeakPolarHBondContact O-CD2 3.38Å; F390-T392 PolarHBondContact O-N 2.96Å; F390-M423 HydrophobicContact CB-CE 4.12Å; F390-M423 HydrophobicContact CD1-CE 4.08Å; F390-M423 HydrophobicContact CD2-CE 3.43Å; F390-M423 VanDerWaalsContact CD2-CE 3.43Å; F390-M423 HydrophobicContact CE1-CE 4.33Å; F390-M423 HydrophobicContact CE2-CE 3.7Å; F390-M423 HydrophobicContact CG-CE 3.62Å; F390-M423 HydrophobicContact CZ-CE 4.15Å
391	P	90.1	Very high	88.1	Confident	19 Å²	19	61.6 Å²	61.6	12%	0.123	32%	0.321	C	S	.	.			trans	-56.1	127.7	-179.2	-28.7	37	0	0	0	112.5	R370 R396 L397 S400	R370-P391 PolarHBondContact NH1-O 3.47Å; R370-P391 PolarHBondContact NH2-O 2.81Å; P391-R396 HydrophobicContact CB-CG 4.37Å; P391-L397 HydrophobicContact CB-CB 3.99Å; P391-L397 HydrophobicContact CB-CD1 3.85Å; P391-L397 HydrophobicContact CG-CD1 3.71Å; P391-S400 WeakPolarHBondContact CG-OG 3.36Å
392	T	89.3	Confident	88.2	Confident	80 Å²	80	61.1 Å²	61.1	49%	0.491	32%	0.319	S	S	.	.	S	Bend	trans	-85.9	-16.8	-171.4	50.8	0	0	0	0	113.9	F390 G427	F390-T392 PolarHBondContact O-N 2.96Å; T392-G427 PolarHBondContact O-N 3.49Å
393	T	91.2	Very high	88.6	Confident	54 Å²	54	60.6 Å²	60.6	33%	0.331	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-133.8	156	177.3	68.9	0	0	0	0	111.3	A395 R396 L397 L426 G427	T393-A395 VanDerWaalsContact C-N 3.31Å; T393-A395 PolarHBondContact O-N 3.35Å; T393-R396 PolarHBondContact O-N 2.66Å; T393-R396 WeakPolarHBondContact OG1-CB 3.3Å; T393-R396 PolarHBondContact OG1-N 3.31Å; T393-L397 WeakPolarHBondContact O-CB 3.19Å; T393-L397 PolarHBondContact O-N 2.78Å; T393-L426 VanDerWaalsContact C-CD1 3.49Å; T393-G427 CarbonylContact C-O 3.59Å; T393-G427 WeakPolarHBondContact CA-O 3.26Å; T393-G427 WeakPolarHBondContact CB-O 3.17Å
394	I	92.1	Very high	88.9	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-63.7	-34.9	178.5	-171.4	61.8	0	0	0	112.5	W242 F246 L397 Y398 F409 F416 L426 G427 P429 F438	W242-I394 HydrophobicContact CH2-CD1 3.96Å; W242-I394 HydrophobicContact CZ3-CD1 4.04Å; F246-I394 HydrophobicContact CB-CG2 4.46Å; F246-I394 HydrophobicContact CD2-CG1 4.26Å; F246-I394 HydrophobicContact CE2-CG1 4.19Å; F246-I394 HydrophobicContact CG-CG2 4.47Å; I394-L397 HydrophobicContact CD1-CD2 4.06Å; I394-L397 WeakPolarHBondContact O-CB 3.17Å; I394-L397 PolarHBondContact O-N 2.77Å; I394-Y398 PolarHBondContact O-N 3.48Å; I394-F409 HydrophobicContact CD1-CE1 4.38Å; I394-F409 HydrophobicContact CD1-CZ 4.39Å; I394-F416 HydrophobicContact CD1-CE1 4.45Å; I394-L426 HydrophobicContact CB-CG 4.49Å; I394-L426 HydrophobicContact CD1-CD2 4.06Å; I394-G427 PolarHBondContact N-O 3.01Å; I394-P429 HydrophobicContact CG2-CG 3.84Å; I394-F438 HydrophobicContact CG1-CE1 4.46Å; I394-F438 HydrophobicContact CG1-CE2 4.26Å; I394-F438 HydrophobicContact CG1-CZ 3.8Å; I394-F438 HydrophobicContact CG2-CE2 3.98Å; I394-F438 HydrophobicContact CG2-CZ 4.36Å
395	A	90.1	Very high	89.1	Confident	17 Å²	17	50.7 Å²	50.7	14%	0.14	26%	0.255	C	S	.	.	H	α-helix	trans	-63	-46.4	173.3	0	0	0	0	0	111.4	F246 T393 L397 Y398 E399	F246-A395 HydrophobicContact CB-CB 4.09Å; T393-A395 VanDerWaalsContact C-N 3.31Å; T393-A395 PolarHBondContact O-N 3.35Å; A395-L397 VanDerWaalsContact C-N 3.32Å; A395-L397 PolarHBondContact O-N 3.01Å; A395-Y398 PolarHBondContact O-N 3Å; A395-E399 PolarHBondContact O-N 3.17Å
396	R	90.1	Very high	89.4	Confident	124 Å²	124	48.7 Å²	48.7	47%	0.468	25%	0.247	S	C	.	.	H	α-helix	trans	-68.3	-32	177.2	-173.6	58	-178.7	-175.4	9.7	112.3	P391 T393 E399 S400	P391-R396 HydrophobicContact CB-CG 4.37Å; T393-R396 PolarHBondContact O-N 2.66Å; T393-R396 WeakPolarHBondContact OG1-CB 3.3Å; T393-R396 PolarHBondContact OG1-N 3.31Å; R396-E399 WeakPolarHBondContact CD-OE2 3.29Å; R396-E399 IonicContact CZ-OE1 3.95Å; R396-E399 IonicContact CZ-OE2 3.28Å; R396-E399 IonicContact NE-OE2 3.15Å; R396-E399 IonicContact NH1-OE1 3.98Å; R396-E399 PolarHBondContact NH1-OE1 3.08Å; R396-E399 IonicContact NH1-OE2 2.7Å; R396-E399 PolarHBondContact NH1-OE2 2.85Å; R396-E399 PolarHBondContact O-N 2.94Å; R396-S400 WeakPolarHBondContact O-CB 3.35Å; R396-S400 PolarHBondContact O-N 2.97Å; R396-S400 PolarHBondContact O-OG 2.88Å
397	L	91.8	Very high	89.7	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.1	-56.3	172.9	-171.7	61.3	0	0	0	109.8	T366 Y367 P391 T393 I394 A395 E399 S400 T401 F409 L426	T366-L397 HydrophobicContact CG2-CD1 4.34Å; Y367-L397 HydrophobicContact CD1-CD1 3.89Å; Y367-L397 HydrophobicContact CD1-CD2 3.8Å; Y367-L397 HydrophobicContact CD1-CG 3.96Å; Y367-L397 HydrophobicContact CE1-CD1 4.06Å; Y367-L397 HydrophobicContact CE1-CD2 4.24Å; Y367-L397 HydrophobicContact CE1-CG 3.98Å; P391-L397 HydrophobicContact CB-CB 3.99Å; P391-L397 HydrophobicContact CB-CD1 3.85Å; P391-L397 HydrophobicContact CG-CD1 3.71Å; T393-L397 WeakPolarHBondContact O-CB 3.19Å; T393-L397 PolarHBondContact O-N 2.78Å; I394-L397 HydrophobicContact CD1-CD2 4.06Å; I394-L397 WeakPolarHBondContact O-CB 3.17Å; I394-L397 PolarHBondContact O-N 2.77Å; A395-L397 VanDerWaalsContact C-N 3.32Å; A395-L397 PolarHBondContact O-N 3.01Å; L397-E399 VanDerWaalsContact C-N 3.31Å; L397-E399 PolarHBondContact O-N 3.25Å; L397-S400 PolarHBondContact O-N 3.14Å; L397-S400 PolarHBondContact O-OG 2.88Å; L397-T401 HydrophobicContact CD1-CG2 4.22Å; L397-T401 PolarHBondContact O-N 3.03Å; L397-T401 PolarHBondContact O-OG1 3.45Å; L397-F409 HydrophobicContact CD2-CE2 4.12Å; L397-F409 HydrophobicContact CD2-CZ 3.75Å; L397-L426 HydrophobicContact CD2-CD2 4.06Å
398	Y	90.7	Very high	90	Very high	34 Å²	34	43.4 Å²	43.4	13%	0.133	22%	0.22	C	C	.	.	H	α-helix	trans	-53.8	-42.9	174.1	167.7	-92.9	0	0	0	112.9	W242 N245 K260 I394 A395 S400	W242-Y398 HydrophobicContact CB-CD2 3.74Å; W242-Y398 HydrophobicContact CB-CE2 3.6Å; W242-Y398 AromaticContact CD2-CD2 3.75Å; W242-Y398 HydrophobicContact CD2-CD2 3.75Å; W242-Y398 HydrophobicContact CE3-CD2 4.03Å; W242-Y398 AromaticContact CG-CD2 3.63Å; W242-Y398 HydrophobicContact CG-CD2 3.63Å; W242-Y398 AromaticContact CG-CE2 3.96Å; W242-Y398 HydrophobicContact CG-CE2 3.96Å; N245-Y398 HydrophobicContact CB-CD1 4.08Å; N245-Y398 HydrophobicContact CB-CE1 3.64Å; K260-Y398 HydrophobicContact CD-CE2 4.05Å; K260-Y398 WeakPolarHBondContact CE-O 3.38Å; K260-Y398 PolarHBondContact NZ-O 3.37Å; I394-Y398 PolarHBondContact O-N 3.48Å; A395-Y398 PolarHBondContact O-N 3Å; Y398-S400 VanDerWaalsContact C-N 3.32Å; Y398-S400 PolarHBondContact O-N 2.88Å
399	E	87.3	Confident	90.5	Very high	120 Å²	120	34.7 Å²	34.7	56%	0.561	18%	0.179	S	C	*	.	H	α-helix	trans	-64.8	-37.3	178.1	-165.8	-158.4	152.4	0	0	112.1	A395 R396 L397	A395-E399 PolarHBondContact O-N 3.17Å; R396-E399 WeakPolarHBondContact CD-OE2 3.29Å; R396-E399 IonicContact CZ-OE1 3.95Å; R396-E399 IonicContact CZ-OE2 3.28Å; R396-E399 IonicContact NE-OE2 3.15Å; R396-E399 IonicContact NH1-OE1 3.98Å; R396-E399 PolarHBondContact NH1-OE1 3.08Å; R396-E399 IonicContact NH1-OE2 2.7Å; R396-E399 PolarHBondContact NH1-OE2 2.85Å; R396-E399 PolarHBondContact O-N 2.94Å; L397-E399 VanDerWaalsContact C-N 3.31Å; L397-E399 PolarHBondContact O-N 3.25Å
400	S	85.2	Confident	90.8	Very high	57 Å²	57	28.8 Å²	28.8	40%	0.399	15%	0.152	S	C	.	.	H	α-helix	trans	-84	-32.9	-171.8	68	0	0	0	0	115.3	P391 R396 L397 Y398	P391-S400 WeakPolarHBondContact CG-OG 3.36Å; R396-S400 WeakPolarHBondContact O-CB 3.35Å; R396-S400 PolarHBondContact O-N 2.97Å; R396-S400 PolarHBondContact O-OG 2.88Å; L397-S400 PolarHBondContact O-N 3.14Å; L397-S400 PolarHBondContact O-OG 2.88Å; Y398-S400 VanDerWaalsContact C-N 3.32Å; Y398-S400 PolarHBondContact O-N 2.88Å
401	T	87.6	Confident	91	Very high	12 Å²	12	31.2 Å²	31.2	7%	0.074	17%	0.167	C	C	.	.			trans	-93.4	134.6	-176.8	58.4	0	0	0	0	111.8	K260 Y367 L397 D403	K260-T401 WeakPolarHBondContact CE-O 3.4Å; Y367-T401 HydrophobicContact CE1-CG2 3.72Å; Y367-T401 WeakPolarHBondContact CE1-OG1 3.48Å; Y367-T401 PolarHBondContact OH-OG1 2.93Å; L397-T401 HydrophobicContact CD1-CG2 4.22Å; L397-T401 PolarHBondContact O-N 3.03Å; L397-T401 PolarHBondContact O-OG1 3.45Å; T401-D403 VanDerWaalsContact C-N 3.3Å
402	P	88.6	Confident	91	Very high	24 Å²	24	32.5 Å²	32.5	16%	0.156	17%	0.173	C	C	.	.			trans	-84.1	-7.1	173.7	37.7	-37.9	0	0	0	112.8	K260 Y261 C264	K260-P402 CarbonylContact C-O 3.57Å; K260-P402 VanDerWaalsContact C-O 3.24Å; K260-P402 WeakPolarHBondContact CG-O 3.48Å; Y261-P402 WeakPolarHBondContact CA-O 3.36Å; Y261-P402 WeakPolarHBondContact CB-O 3.41Å; Y261-P402 HydrophobicContact CD2-CB 3.56Å; Y261-P402 HydrophobicContact CD2-CG 3.92Å; Y261-P402 HydrophobicContact CE2-CB 4.16Å; Y261-P402 HydrophobicContact CE2-CG 4.19Å; Y261-P402 HydrophobicContact CG-CB 4.09Å; Y261-P402 PolarHBondContact N-O 2.91Å; C264-P402 HydrophobicContact CB-CB 4.1Å
403	D	90	Very high	91.2	Very high	27 Å²	27	30.8 Å²	30.8	14%	0.144	16%	0.163	C	C	.	.	S	Bend	trans	-87.3	157.1	-175.8	-47.5	-81.3	0	0	0	112	W242 K260 M359 A363 Y367 T401	W242-D403 PolarHBondContact NE1-O 3.38Å; K260-D403 WeakPolarHBondContact CG-O 3.33Å; M359-D403 HydrophobicContact SD-CB 4.18Å; A363-D403 HydrophobicContact CB-CB 4.04Å; Y367-D403 PolarHBondContact OH-O 3.46Å; Y367-D403 VanDerWaalsContact OH-O 3.07Å; T401-D403 VanDerWaalsContact C-N 3.3Å
404	E	92.2	Very high	91.1	Very high	13 Å²	13	30.1 Å²	30.1	6%	0.061	16%	0.161	C	C	.	.			trans	-68.2	-173.4	179.1	-66.9	-68.7	180	0	0	112.6	W242 R254 K260 M359 Y367 W458	W242-E404 PolarHBondContact N-OE2 2.83Å; W242-E404 PolarHBondContact NE1-O 3.42Å; W242-E404 VanDerWaalsContact NE1-O 3.13Å; R254-E404 IonicContact CZ-OE1 2.67Å; R254-E404 IonicContact CZ-OE2 3.23Å; R254-E404 IonicContact NH2-OE1 2.74Å; R254-E404 PolarHBondContact NH2-OE1 3.17Å; R254-E404 IonicContact NH2-OE2 2.69Å; R254-E404 PolarHBondContact NH2-OE2 2.99Å; K260-E404 VanDerWaalsContact CB-CD 3.46Å; K260-E404 HydrophobicContact CB-CG 4.2Å; K260-E404 WeakPolarHBondContact CB-OE1 3.14Å; K260-E404 PolarHBondContact N-OE1 3.29Å; M359-E404 WeakPolarHBondContact CE-O 3.27Å; Y367-E404 VanDerWaalsContact CE2-O 3.22Å; Y367-E404 WeakPolarHBondContact CE2-O 3.34Å; Y367-E404 PolarHBondContact OH-O 2.84Å; E404-W458 HydrophobicContact CB-CZ2 4.4Å; E404-W458 HydrophobicContact CG-CZ2 4.12Å; E404-W458 PolarHBondContact OE1-NE1 3.3Å
405	C	92.8	Very high	91.1	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-93.1	161.7	-176.1	-164.8	0	0	0	0	111.6	I239 L240 W242 F410	I239-C405 WeakPolarHBondContact CA-O 3.17Å; L240-C405 PolarHBondContact N-O 2.83Å; L240-C405 WeakPolarHBondContact O-CA 3.38Å; L240-C405 WeakPolarHBondContact O-CB 3.48Å; L240-C405 PolarHBondContact O-N 2.85Å; W242-C405 HydrophobicContact CD2-CB 3.67Å; W242-C405 HydrophobicContact CE3-CB 4.06Å; W242-C405 HydrophobicContact CG-CB 3.93Å; W242-C405 HydrophobicContact CZ2-CB 4.3Å; C405-F410 HydrophobicContact CB-CE2 4.29Å
406	I	93.8	Very high	91.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.154	C	C	.	.			trans	-109.7	148.7	175.8	57.2	168.8	0	0	0	112.1	M359 Y364 Y367 M368 E408 F409	M359-I406 HydrophobicContact CE-CG2 3.61Å; M359-I406 HydrophobicContact SD-CG2 4.16Å; Y364-I406 HydrophobicContact CD2-CG2 4.22Å; Y367-I406 HydrophobicContact CD2-CD1 4.12Å; Y367-I406 HydrophobicContact CD2-CG1 4.04Å; Y367-I406 HydrophobicContact CD2-CG2 3.79Å; Y367-I406 HydrophobicContact CE2-CG2 4.25Å; Y367-I406 HydrophobicContact CG-CD1 4.36Å; M368-I406 HydrophobicContact CG-CD1 4.09Å; M368-I406 HydrophobicContact SD-CD1 4Å; I406-E408 HydrophobicContact CD1-CB 4.01Å; I406-E408 HydrophobicContact CD1-CG 4.42Å; I406-E408 HydrophobicContact CG1-CB 4.28Å; I406-E408 PolarHBondContact O-N 3.15Å; I406-E408 VanDerWaalsContact O-N 3.14Å; I406-F409 HydrophobicContact CD1-CD2 4.38Å; I406-F409 HydrophobicContact CD1-CE2 4.18Å; I406-F409 HydrophobicContact CG1-CD2 3.62Å; I406-F409 HydrophobicContact CG1-CE2 3.81Å; I406-F409 HydrophobicContact CG1-CG 4.27Å; I406-F409 PolarHBondContact O-N 2.83Å; I406-F409 VanDerWaalsContact O-N 3.17Å
407	P	94.1	Very high	91.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-58.7	-26.8	-177.1	-14.6	19.2	0	0	0	114.7	Y217 M221 K231 A238 L240 F409 F410 T411	Y217-P407 HydrophobicContact CE2-CB 4.15Å; M221-P407 HydrophobicContact CE-CG 4.41Å; M221-P407 HydrophobicContact SD-CB 3.77Å; M221-P407 HydrophobicContact SD-CG 3.65Å; K231-P407 HydrophobicContact CB-CG 4.24Å; K231-P407 HydrophobicContact CD-CB 4.02Å; K231-P407 HydrophobicContact CG-CB 4.06Å; K231-P407 HydrophobicContact CG-CG 4.11Å; A238-P407 HydrophobicContact CB-CG 3.64Å; A238-P407 VanDerWaalsContact O-CD 3.25Å; A238-P407 WeakPolarHBondContact O-CD 3.34Å; L240-P407 HydrophobicContact CD1-CB 3.82Å; L240-P407 HydrophobicContact CD1-CG 3.56Å; P407-F409 VanDerWaalsContact C-N 3.29Å; P407-F409 PolarHBondContact O-N 3.26Å; P407-F410 PolarHBondContact O-N 2.86Å; P407-T411 PolarHBondContact O-N 2.86Å; P407-T411 PolarHBondContact O-OG1 3.23Å
408	E	93.7	Very high	91.3	Very high	7 Å²	7	26.8 Å²	26.8	3%	0.033	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-54.9	-42	176.2	-73.7	73.4	-169.1	0	0	111.8	K231 G232 M368 I406 F410 T411 D412 V415	K231-E408 VanDerWaalsContact CE-OE1 3.22Å; K231-E408 WeakPolarHBondContact CE-OE1 3.17Å; K231-E408 WeakPolarHBondContact CG-OE1 3.45Å; G232-E408 PolarHBondContact N-OE1 2.98Å; M368-E408 HydrophobicContact CE-CG 4.32Å; M368-E408 HydrophobicContact SD-CB 4.37Å; M368-E408 HydrophobicContact SD-CG 4Å; I406-E408 HydrophobicContact CD1-CB 4.01Å; I406-E408 HydrophobicContact CD1-CG 4.42Å; I406-E408 HydrophobicContact CG1-CB 4.28Å; I406-E408 PolarHBondContact O-N 3.15Å; I406-E408 VanDerWaalsContact O-N 3.14Å; E408-F410 PolarHBondContact O-N 3.26Å; E408-T411 PolarHBondContact O-N 3.28Å; E408-D412 PolarHBondContact O-N 3Å; E408-V415 HydrophobicContact CB-CG2 3.92Å; E408-V415 HydrophobicContact CG-CG2 4.25Å
409	F	93.8	Very high	91.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-69.5	0.2	177	-66.2	-43.2	0	0	0	114.4	W242 Y367 I394 L397 I406 P407 V415 F416 L426 H442	W242-F409 AromaticContact CH2-CD2 3.81Å; W242-F409 HydrophobicContact CH2-CD2 3.81Å; W242-F409 AromaticContact CH2-CE2 3.85Å; W242-F409 HydrophobicContact CH2-CE2 3.85Å; W242-F409 HydrophobicContact CZ2-CD2 4.49Å; W242-F409 HydrophobicContact CZ2-CE2 4.37Å; W242-F409 HydrophobicContact CZ3-CD2 4.41Å; Y367-F409 HydrophobicContact CD1-CE2 4.16Å; Y367-F409 HydrophobicContact CD2-CE2 4.3Å; Y367-F409 AromaticContact CG-CE2 3.89Å; Y367-F409 HydrophobicContact CG-CE2 3.89Å; Y367-F409 HydrophobicContact CG-CZ 4.3Å; I394-F409 HydrophobicContact CD1-CE1 4.38Å; I394-F409 HydrophobicContact CD1-CZ 4.39Å; L397-F409 HydrophobicContact CD2-CE2 4.12Å; L397-F409 HydrophobicContact CD2-CZ 3.75Å; I406-F409 HydrophobicContact CD1-CD2 4.38Å; I406-F409 HydrophobicContact CD1-CE2 4.18Å; I406-F409 HydrophobicContact CG1-CD2 3.62Å; I406-F409 HydrophobicContact CG1-CE2 3.81Å; I406-F409 HydrophobicContact CG1-CG 4.27Å; I406-F409 PolarHBondContact O-N 2.83Å; I406-F409 VanDerWaalsContact O-N 3.17Å; P407-F409 VanDerWaalsContact C-N 3.29Å; P407-F409 PolarHBondContact O-N 3.26Å; F409-V415 HydrophobicContact CD1-CG1 4.37Å; F409-V415 HydrophobicContact CE1-CG1 3.74Å; F409-V415 HydrophobicContact CZ-CG1 4.44Å; F409-F416 HydrophobicContact CD1-CE1 4.17Å; F409-F416 HydrophobicContact CD1-CE2 4.15Å; F409-F416 AromaticContact CD1-CZ 3.63Å; F409-F416 HydrophobicContact CD1-CZ 3.63Å; F409-F416 HydrophobicContact CE1-CE1 4.42Å; F409-F416 HydrophobicContact CE1-CZ 4.28Å; F409-L426 HydrophobicContact CE1-CD2 4.03Å; F409-L426 HydrophobicContact CZ-CD2 4.36Å; F409-H442 PolarHBondContact O-ND1 2.89Å
410	F	93.6	Very high	91.6	Very high	8 Å²	8	24.5 Å²	24.5	4%	0.035	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-115.9	-5.6	171	-61.8	-85.9	0	0	0	113.4	Y217 L240 I243 C405 P407 E408 I439 H442 L446	Y217-F410 HydrophobicContact CD2-CB 3.98Å; Y217-F410 HydrophobicContact CD2-CG 4.45Å; Y217-F410 HydrophobicContact CE2-CB 3.89Å; L240-F410 HydrophobicContact CB-CD2 4.38Å; L240-F410 HydrophobicContact CB-CE2 3.75Å; L240-F410 HydrophobicContact CB-CZ 4.48Å; L240-F410 HydrophobicContact CD2-CD2 3.88Å; L240-F410 HydrophobicContact CD2-CE2 3.87Å; L240-F410 HydrophobicContact CD2-CG 4.47Å; L240-F410 HydrophobicContact CD2-CZ 4.46Å; L240-F410 HydrophobicContact CG-CE2 4.4Å; I243-F410 HydrophobicContact CG1-CE1 4.49Å; I243-F410 HydrophobicContact CG1-CZ 4.41Å; C405-F410 HydrophobicContact CB-CE2 4.29Å; P407-F410 PolarHBondContact O-N 2.86Å; E408-F410 PolarHBondContact O-N 3.26Å; F410-I439 VanDerWaalsContact O-CG2 3.29Å; F410-I439 WeakPolarHBondContact O-CG2 3.37Å; F410-H442 HydrophobicContact CD1-CB 4.49Å; F410-H442 AromaticContact CD1-CG 3.97Å; F410-H442 AromaticContact CD1-ND1 3.66Å; F410-H442 HydrophobicContact CE1-CB 4.49Å; F410-H442 AromaticContact CE1-CD2 3.68Å; F410-H442 AromaticContact CE1-CE1 3.3Å; F410-H442 WeakPolarHBondContact CE1-CE1 3.5Å; F410-H442 AromaticContact CE1-CG 3.6Å; F410-H442 AromaticContact CE1-ND1 3.36Å; F410-H442 WeakPolarHBondContact CE1-ND1 3.21Å; F410-H442 AromaticContact CE1-NE2 3.51Å; F410-H442 AromaticContact CE2-CE1 3.79Å; F410-H442 AromaticContact CZ-CE1 3.19Å; F410-H442 WeakPolarHBondContact CZ-CE1 3.39Å; F410-H442 AromaticContact CZ-ND1 3.71Å; F410-H442 AromaticContact CZ-NE2 3.51Å; F410-L446 HydrophobicContact CD1-CB 4.43Å; F410-L446 HydrophobicContact CD1-CD2 3.94Å; F410-L446 HydrophobicContact CE1-CB 3.91Å; F410-L446 HydrophobicContact CE1-CD2 3.83Å; F410-L446 HydrophobicContact CE1-CG 4.4Å; F410-L446 HydrophobicContact CZ-CD2 4.31Å
411	T	92.2	Very high	91.7	Very high	58 Å²	58	28.4 Å²	28.4	36%	0.356	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-145.1	-25.9	-169.1	52.1	0	0	0	0	116.9	Y217 K231 P407 E408	Y217-T411 HydrophobicContact CE1-CG2 3.99Å; Y217-T411 HydrophobicContact CE2-CG2 3.8Å; Y217-T411 VanDerWaalsContact CZ-CG2 3.44Å; Y217-T411 WeakPolarHBondContact OH-CG2 3.32Å; K231-T411 PolarHBondContact NZ-OG1 2.93Å; P407-T411 PolarHBondContact O-N 2.86Å; P407-T411 PolarHBondContact O-OG1 3.23Å; E408-T411 PolarHBondContact O-N 3.28Å
412	D	91.6	Very high	91.8	Very high	46 Å²	46	32.1 Å²	32.1	25%	0.246	19%	0.191	C	C	.	.			trans	-114.8	107	179.5	-179.7	24.5	0	0	0	112.1	E408 S414 V415 I439	E408-D412 PolarHBondContact O-N 3Å; D412-S414 PolarHBondContact O-N 2.96Å; D412-S414 WeakPolarHBondContact OD1-CB 3.23Å; D412-S414 PolarHBondContact OD1-N 2.75Å; D412-S414 PolarHBondContact OD1-OG 3.19Å; D412-S414 WeakPolarHBondContact OD2-CB 3.17Å; D412-S414 PolarHBondContact OD2-OG 3.4Å; D412-V415 HydrophobicContact CB-CG2 4.29Å; D412-V415 WeakPolarHBondContact OD2-CG2 3.07Å; D412-I439 VanDerWaalsContact C-CD1 3.41Å
413	P	92.3	Very high	91.9	Very high	44 Å²	44	31.4 Å²	31.4	29%	0.286	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-65.9	-16.3	174.6	28.3	-34.4	0	0	0	112.7	V415 P435 E436 I439	P413-V415 VanDerWaalsContact C-N 3.32Å; P413-V415 PolarHBondContact O-N 3.33Å; P413-P435 HydrophobicContact CB-CB 3.74Å; P413-E436 HydrophobicContact CB-CG 4.09Å; P413-E436 HydrophobicContact CG-CG 4.35Å; P413-I439 HydrophobicContact CB-CD1 4.03Å; P413-I439 VanDerWaalsContact N-CD1 3.29Å
414	S	90.5	Very high	91.8	Very high	40 Å²	40	33.3 Å²	33.3	28%	0.28	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-63.3	-36.9	-177.2	100.7	0	0	0	0	112.3	K371 D412 F416 S417	K371-S414 VanDerWaalsContact CE-C 3.46Å; K371-S414 WeakPolarHBondContact CE-O 3.5Å; K371-S414 WeakPolarHBondContact CE-OG 3.22Å; K371-S414 PolarHBondContact NZ-O 2.92Å; K371-S414 VanDerWaalsContact NZ-O 3.09Å; D412-S414 PolarHBondContact O-N 2.96Å; D412-S414 WeakPolarHBondContact OD1-CB 3.23Å; D412-S414 PolarHBondContact OD1-N 2.75Å; D412-S414 PolarHBondContact OD1-OG 3.19Å; D412-S414 WeakPolarHBondContact OD2-CB 3.17Å; D412-S414 PolarHBondContact OD2-OG 3.4Å; S414-F416 PolarHBondContact O-N 2.71Å; S414-S417 PolarHBondContact O-N 2.83Å; S414-S417 PolarHBondContact O-OG 2.94Å
415	V	91.7	Very high	91.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-58.4	-25.7	-173.3	-177.4	0	0	0	0	113.4	M368 R370 E408 F409 D412 P413 S417	M368-V415 HydrophobicContact CE-CG2 4.02Å; M368-V415 HydrophobicContact SD-CB 4.4Å; M368-V415 HydrophobicContact SD-CG1 3.76Å; M368-V415 HydrophobicContact SD-CG2 3.65Å; R370-V415 VanDerWaalsContact CB-O 3.27Å; R370-V415 WeakPolarHBondContact CB-O 3.47Å; E408-V415 HydrophobicContact CB-CG2 3.92Å; E408-V415 HydrophobicContact CG-CG2 4.25Å; F409-V415 HydrophobicContact CD1-CG1 4.37Å; F409-V415 HydrophobicContact CE1-CG1 3.74Å; F409-V415 HydrophobicContact CZ-CG1 4.44Å; D412-V415 HydrophobicContact CB-CG2 4.29Å; D412-V415 WeakPolarHBondContact OD2-CG2 3.07Å; P413-V415 VanDerWaalsContact C-N 3.32Å; P413-V415 PolarHBondContact O-N 3.33Å; V415-S417 VanDerWaalsContact C-N 3.28Å; V415-S417 PolarHBondContact O-N 2.99Å
416	F	93.3	Very high	91.7	Very high	3 Å²	3	37.6 Å²	37.6	1%	0.013	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-74.1	-17.8	177	-60.4	-88.7	0	0	0	113.5	I394 F409 S414 D425 L426 L428 P435 F438 I439	I394-F416 HydrophobicContact CD1-CE1 4.45Å; F409-F416 HydrophobicContact CD1-CE1 4.17Å; F409-F416 HydrophobicContact CD1-CE2 4.15Å; F409-F416 AromaticContact CD1-CZ 3.63Å; F409-F416 HydrophobicContact CD1-CZ 3.63Å; F409-F416 HydrophobicContact CE1-CE1 4.42Å; F409-F416 HydrophobicContact CE1-CZ 4.28Å; S414-F416 PolarHBondContact O-N 2.71Å; F416-D425 CarbonylContact O-C 3.57Å; F416-D425 WeakPolarHBondContact O-CA 3.45Å; F416-D425 WeakPolarHBondContact O-CB 3.19Å; F416-L426 HydrophobicContact CD1-CB 4.2Å; F416-L426 HydrophobicContact CD1-CD2 3.95Å; F416-L426 HydrophobicContact CD1-CG 4.24Å; F416-L426 HydrophobicContact CE1-CD2 4.11Å; F416-L426 PolarHBondContact O-N 3.22Å; F416-L428 HydrophobicContact CD1-CD2 3.42Å; F416-L428 VanDerWaalsContact CD1-CD2 3.42Å; F416-L428 HydrophobicContact CE1-CD2 3.81Å; F416-L428 HydrophobicContact CG-CD2 4.08Å; F416-P435 HydrophobicContact CB-CB 4.11Å; F416-P435 HydrophobicContact CB-CG 3.98Å; F416-P435 HydrophobicContact CD2-CB 3.84Å; F416-P435 HydrophobicContact CG-CB 4.12Å; F416-P435 HydrophobicContact CG-CG 4.48Å; F416-F438 AromaticContact CE1-CD1 3.8Å; F416-F438 HydrophobicContact CE1-CD1 3.8Å; F416-F438 AromaticContact CE1-CE1 3.91Å; F416-F438 HydrophobicContact CE1-CE1 3.91Å; F416-F438 HydrophobicContact CE2-CD1 4.18Å; F416-F438 AromaticContact CZ-CD1 3.41Å; F416-F438 HydrophobicContact CZ-CD1 3.41Å; F416-F438 VanDerWaalsContact CZ-CD1 3.41Å; F416-F438 AromaticContact CZ-CE1 3.53Å; F416-F438 HydrophobicContact CZ-CE1 3.53Å; F416-F438 HydrophobicContact CZ-CG 4.45Å; F416-I439 HydrophobicContact CE2-CD1 4.19Å; F416-I439 HydrophobicContact CE2-CG1 4.21Å
417	S	91.5	Very high	91.5	Very high	42 Å²	42	38.8 Å²	38.8	29%	0.294	24%	0.241	S	C	.	.	S	Bend	trans	-101.9	130.5	-178	60.2	0	0	0	0	112.6	K371 S414 V415 D425	K371-S417 WeakPolarHBondContact CE-O 3.08Å; K371-S417 PolarHBondContact NZ-O 2.95Å; K371-S417 PolarHBondContact NZ-OG 2.84Å; S414-S417 PolarHBondContact O-N 2.83Å; S414-S417 PolarHBondContact O-OG 2.94Å; V415-S417 VanDerWaalsContact C-N 3.28Å; V415-S417 PolarHBondContact O-N 2.99Å; S417-D425 WeakPolarHBondContact CA-OD1 3.48Å
418	S	91.6	Very high	91.4	Very high	27 Å²	27	41.1 Å²	41.1	19%	0.189	25%	0.253	C	S	.	.			trans	-78.2	141.2	-177	-169.9	0	0	0	0	113.1	R370 H420 M423 D425	R370-S418 CarbonylContact O-C 3.55Å; R370-S418 WeakPolarHBondContact O-CA 3.05Å; S418-H420 PolarHBondContact OG-N 3.17Å; S418-H420 PolarHBondContact OG-O 2.9Å; S418-M423 WeakPolarHBondContact CB-O 3.31Å; S418-M423 PolarHBondContact OG-O 2.78Å; S418-D425 PolarHBondContact N-OD1 2.84Å
419	I	92.9	Very high	91.2	Very high	93 Å²	93	41.2 Å²	41.2	48%	0.477	26%	0.255	S	S	.	.	S	Bend	trans	-89.8	-14.6	162.5	68.6	173.6	0	0	0	112.6	R370 K371	R370-I419 WeakPolarHBondContact O-CG1 3.47Å; R370-I419 PolarHBondContact O-N 2.99Å; K371-I419 HydrophobicContact CD-CG2 3.84Å; K371-I419 VanDerWaalsContact O-CD1 3.32Å; K371-I419 WeakPolarHBondContact O-CD1 3.49Å
420	H	91.1	Very high	90.8	Very high	13 Å²	13	47.1 Å²	47.1	6%	0.06	30%	0.296	C	S	.	.	S	Bend	trans	-95.7	124.5	-176.8	-51	-62.1	0	0	0	109.7	A369 T372 S418 D422 M423	A369-H420 PolarHBondContact O-CD2 3.49Å; A369-H420 PolarHBondContact O-NE2 3.18Å; T372-H420 PolarHBondContact O-CE1 2.94Å; T372-H420 PolarHBondContact O-NE2 2.88Å; S418-H420 PolarHBondContact OG-N 3.17Å; S418-H420 PolarHBondContact OG-O 2.9Å; H420-D422 PolarHBondContact O-N 2.87Å; H420-D422 VanDerWaalsContact O-N 3.16Å; H420-M423 HydrophobicContact CB-CB 4.07Å; H420-M423 PolarHBondContact O-N 3.15Å; H420-M423 VanDerWaalsContact O-O 3.08Å
421	P	87	Confident	90.6	Very high	140 Å²	140	49.9 Å²	49.9	91%	0.909	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-10.1	-174.1	30.3	-36.6	0	0	0	114.1
422	D	90.4	Very high	90.3	Very high	90 Å²	90	47.6 Å²	47.6	48%	0.481	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-7.2	179.3	62	-23.3	0	0	0	113.9	P387 H420	P387-D422 WeakPolarHBondContact CB-O 3.43Å; P387-D422 HydrophobicContact CG-CB 4.31Å; P387-D422 VanDerWaalsContact CG-O 3.31Å; P387-D422 WeakPolarHBondContact CG-O 3.22Å; H420-D422 PolarHBondContact O-N 2.87Å; H420-D422 VanDerWaalsContact O-N 3.16Å
423	M	90.2	Very high	90	Very high	9 Å²	9	50.7 Å²	50.7	4%	0.044	32%	0.317	C	S	.	.	S	Bend	trans	-103.7	127.5	169.1	-174.4	-176.3	-69	0	0	110.3	A369 R370 Y385 P387 F390 S418 H420	A369-M423 HydrophobicContact CB-CE 4.23Å; A369-M423 HydrophobicContact CB-SD 4.27Å; R370-M423 HydrophobicContact CG-SD 4.29Å; Y385-M423 HydrophobicContact CE2-CE 3.98Å; P387-M423 HydrophobicContact CB-CB 3.96Å; P387-M423 HydrophobicContact CB-CG 4.42Å; F390-M423 HydrophobicContact CB-CE 4.12Å; F390-M423 HydrophobicContact CD1-CE 4.08Å; F390-M423 HydrophobicContact CD2-CE 3.43Å; F390-M423 VanDerWaalsContact CD2-CE 3.43Å; F390-M423 HydrophobicContact CE1-CE 4.33Å; F390-M423 HydrophobicContact CE2-CE 3.7Å; F390-M423 HydrophobicContact CG-CE 3.62Å; F390-M423 HydrophobicContact CZ-CE 4.15Å; S418-M423 WeakPolarHBondContact CB-O 3.31Å; S418-M423 PolarHBondContact OG-O 2.78Å; H420-M423 HydrophobicContact CB-CB 4.07Å; H420-M423 PolarHBondContact O-N 3.15Å; H420-M423 VanDerWaalsContact O-O 3.08Å
424	A	87.5	Confident	90	Very high	67 Å²	67	50.4 Å²	50.4	55%	0.554	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-71.9	148.3	175.6	0	0	0	0	0	112.7	R370	R370-A424 PolarHBondContact NE-O 3.5Å; R370-A424 VanDerWaalsContact NE-O 3.08Å; R370-A424 PolarHBondContact NH2-O 2.83Å
425	D	91.1	Very high	90.1	Very high	97 Å²	97	50 Å²	50	52%	0.519	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-47.3	147.9	165.3	-68.9	-9.8	0	0	0	111.2	F416 S417 S418 G427	F416-D425 CarbonylContact O-C 3.57Å; F416-D425 WeakPolarHBondContact O-CA 3.45Å; F416-D425 WeakPolarHBondContact O-CB 3.19Å; S417-D425 WeakPolarHBondContact CA-OD1 3.48Å; S418-D425 PolarHBondContact N-OD1 2.84Å; D425-G427 PolarHBondContact O-N 2.89Å; D425-G427 VanDerWaalsContact O-N 3.13Å
426	L	92.4	Very high	90.2	Very high	5 Å²	5	55.1 Å²	55.1	3%	0.026	34%	0.337	C	S	.	.			trans	-74.2	105.7	-178	-177.1	61	0	0	0	109.8	T393 I394 L397 F409 F416 L428	T393-L426 VanDerWaalsContact C-CD1 3.49Å; I394-L426 HydrophobicContact CB-CG 4.49Å; I394-L426 HydrophobicContact CD1-CD2 4.06Å; L397-L426 HydrophobicContact CD2-CD2 4.06Å; F409-L426 HydrophobicContact CE1-CD2 4.03Å; F409-L426 HydrophobicContact CZ-CD2 4.36Å; F416-L426 HydrophobicContact CD1-CB 4.2Å; F416-L426 HydrophobicContact CD1-CD2 3.95Å; F416-L426 HydrophobicContact CD1-CG 4.24Å; F416-L426 HydrophobicContact CE1-CD2 4.11Å; F416-L426 PolarHBondContact O-N 3.22Å; L426-L428 PolarHBondContact O-N 3.42Å
427	G	89.6	Confident	90.1	Very high	25 Å²	25	59 Å²	59	26%	0.258	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-57.3	123.7	-174.9	0	0	0	0	0	113	T392 T393 I394 D425	T392-G427 PolarHBondContact O-N 3.49Å; T393-G427 CarbonylContact C-O 3.59Å; T393-G427 WeakPolarHBondContact CA-O 3.26Å; T393-G427 WeakPolarHBondContact CB-O 3.17Å; I394-G427 PolarHBondContact N-O 3.01Å; D425-G427 PolarHBondContact O-N 2.89Å; D425-G427 VanDerWaalsContact O-N 3.13Å
428	L	91.8	Very high	90.1	Very high	49 Å²	49	57 Å²	57	26%	0.257	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-80.4	162	179.9	-58.1	178.6	0	0	0	111.8	F416 L426 C432 S434 P435 F438	F416-L428 HydrophobicContact CD1-CD2 3.42Å; F416-L428 VanDerWaalsContact CD1-CD2 3.42Å; F416-L428 HydrophobicContact CE1-CD2 3.81Å; F416-L428 HydrophobicContact CG-CD2 4.08Å; L426-L428 PolarHBondContact O-N 3.42Å; L428-C432 HydrophobicContact CB-CB 4.44Å; L428-S434 WeakPolarHBondContact CD1-O 3.32Å; L428-P435 HydrophobicContact CD1-CG 4.28Å; L428-F438 HydrophobicContact CD2-CB 3.97Å; L428-F438 HydrophobicContact CD2-CD2 4.49Å; L428-F438 HydrophobicContact CD2-CG 4.08Å
429	P	88.6	Confident	90.3	Very high	10 Å²	10	56.7 Å²	56.7	7%	0.065	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-65.4	149.7	172.7	-16.4	32.7	0	0	0	110.7	F246 I394 W431 C432 F438	F246-P429 HydrophobicContact CB-CG 3.99Å; I394-P429 HydrophobicContact CG2-CG 3.84Å; P429-W431 HydrophobicContact CB-CD2 3.97Å; P429-W431 HydrophobicContact CB-CE3 4.11Å; P429-W431 HydrophobicContact CB-CH2 3.55Å; P429-W431 HydrophobicContact CB-CZ2 3.38Å; P429-W431 HydrophobicContact CB-CZ3 3.92Å; P429-W431 HydrophobicContact CG-CZ2 4.18Å; P429-W431 PolarHBondContact O-N 3.5Å; P429-C432 PolarHBondContact O-N 3.22Å; P429-F438 HydrophobicContact CG-CD2 3.92Å; P429-F438 HydrophobicContact CG-CE2 3.93Å
430	S	86.5	Confident	90.1	Very high	123 Å²	123	60 Å²	60	86%	0.86	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-6.4	-167.3	57.7	0	0	0	0	116.3
431	W	87.8	Confident	90.2	Very high	66 Å²	66	61.3 Å²	61.3	25%	0.25	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	4.6	173.9	58.2	87.9	0	0	0	113.7	F246 T248 P249 P429 Y441	F246-W431 WeakPolarHBondContact O-CH2 3.44Å; T248-W431 VanDerWaalsContact C-CZ2 3.4Å; T248-W431 WeakPolarHBondContact O-CZ2 3.31Å; P249-W431 HydrophobicContact CB-CD2 3.77Å; P249-W431 HydrophobicContact CB-CE3 4.31Å; P249-W431 HydrophobicContact CB-CG 3.93Å; P249-W431 HydrophobicContact CB-CZ2 4.32Å; P249-W431 HydrophobicContact CG-CD2 4.31Å; P249-W431 HydrophobicContact CG-CE3 4.39Å; P429-W431 HydrophobicContact CB-CD2 3.97Å; P429-W431 HydrophobicContact CB-CE3 4.11Å; P429-W431 HydrophobicContact CB-CH2 3.55Å; P429-W431 HydrophobicContact CB-CZ2 3.38Å; P429-W431 HydrophobicContact CB-CZ3 3.92Å; P429-W431 HydrophobicContact CG-CZ2 4.18Å; P429-W431 PolarHBondContact O-N 3.5Å; W431-Y441 AromaticContact NE1-CE1 3.72Å; W431-Y441 AromaticContact NE1-CE2 3.82Å; W431-Y441 AromaticContact NE1-CZ 3.52Å
432	C	87.6	Confident	90.4	Very high	10 Å²	10	54.7 Å²	54.7	7%	0.068	31%	0.31	C	S	.	.			trans	-115	108.3	174.2	-64.3	0	0	0	0	109.2	L428 P429 F438	L428-C432 HydrophobicContact CB-CB 4.44Å; P429-C432 PolarHBondContact O-N 3.22Å; C432-F438 HydrophobicContact CB-CB 4Å
433	S	84.9	Confident	90.5	Very high	111 Å²	111	52.4 Å²	52.4	78%	0.776	30%	0.301	S	S	*	.			trans	-80	-20	-171.6	-37.1	0	0	0	0	113.4	E437	S433-E437 WeakPolarHBondContact CB-OE2 3.37Å; S433-E437 PolarHBondContact N-OE2 2.64Å; S433-E437 PolarHBondContact OG-OE2 2.8Å
434	S	92.1	Very high	90.5	Very high	38 Å²	38	59.7 Å²	59.7	27%	0.266	33%	0.332	S	S	.	.	S	Bend	trans	-148.9	162.2	179.1	84.3	0	0	0	0	111.8	L428 E436 E437 F438	L428-S434 WeakPolarHBondContact CD1-O 3.32Å; S434-E436 WeakPolarHBondContact CB-OE2 3.29Å; S434-E436 PolarHBondContact O-N 3.02Å; S434-E436 PolarHBondContact OG-N 2.73Å; S434-E436 PolarHBondContact OG-OE2 2.94Å; S434-E437 PolarHBondContact O-N 2.65Å; S434-E437 VanDerWaalsContact O-N 3.11Å; S434-E437 PolarHBondContact OG-N 3.41Å; S434-F438 PolarHBondContact O-N 2.69Å
435	P	92.3	Very high	90.7	Very high	33 Å²	33	58.3 Å²	58.3	21%	0.214	32%	0.315	C	S	.	.	H	α-helix	trans	-58.6	-33.4	178.1	-26.4	36.8	0	0	0	113.5	P413 F416 L428 F438 I439	P413-P435 HydrophobicContact CB-CB 3.74Å; F416-P435 HydrophobicContact CB-CB 4.11Å; F416-P435 HydrophobicContact CB-CG 3.98Å; F416-P435 HydrophobicContact CD2-CB 3.84Å; F416-P435 HydrophobicContact CG-CB 4.12Å; F416-P435 HydrophobicContact CG-CG 4.48Å; L428-P435 HydrophobicContact CD1-CG 4.28Å; P435-F438 PolarHBondContact O-N 3.4Å; P435-I439 WeakPolarHBondContact O-CB 3.41Å; P435-I439 WeakPolarHBondContact O-CG1 3.44Å; P435-I439 PolarHBondContact O-N 2.81Å
436	E	93	Very high	90.8	Very high	106 Å²	106	53.7 Å²	53.7	50%	0.495	29%	0.29	S	S	.	.	H	α-helix	trans	-70.6	-35.9	177.2	-51.2	75.2	-163.8	0	0	111.6	P413 S434 K440	P413-E436 HydrophobicContact CB-CG 4.09Å; P413-E436 HydrophobicContact CG-CG 4.35Å; S434-E436 WeakPolarHBondContact CB-OE2 3.29Å; S434-E436 PolarHBondContact O-N 3.02Å; S434-E436 PolarHBondContact OG-N 2.73Å; S434-E436 PolarHBondContact OG-OE2 2.94Å; E436-K440 WeakPolarHBondContact O-CB 3.47Å; E436-K440 PolarHBondContact O-N 3.1Å
437	E	91.8	Very high	90.7	Very high	84 Å²	84	55.9 Å²	55.9	39%	0.393	30%	0.301	S	S	.	.	H	α-helix	trans	-67.9	-39.8	172.3	-176.3	161.9	-121.5	0	0	111.2	S433 S434 Y441	S433-E437 WeakPolarHBondContact CB-OE2 3.37Å; S433-E437 PolarHBondContact N-OE2 2.64Å; S433-E437 PolarHBondContact OG-OE2 2.8Å; S434-E437 PolarHBondContact O-N 2.65Å; S434-E437 VanDerWaalsContact O-N 3.11Å; S434-E437 PolarHBondContact OG-N 3.41Å; E437-Y441 WeakPolarHBondContact O-CB 3.3Å; E437-Y441 PolarHBondContact O-N 2.81Å
438	F	92.9	Very high	90.7	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-50.4	172.8	175.5	-92.5	0	0	0	112.3	F246 I394 F416 L428 P429 C432 S434 P435 K440 Y441 H442	F246-F438 AromaticContact CD1-CE2 3.71Å; F246-F438 HydrophobicContact CD1-CE2 3.71Å; F246-F438 HydrophobicContact CD1-CZ 4.1Å; F246-F438 AromaticContact CE1-CE2 3.68Å; F246-F438 HydrophobicContact CE1-CE2 3.68Å; F246-F438 AromaticContact CE1-CZ 3.61Å; F246-F438 HydrophobicContact CE1-CZ 3.61Å; F246-F438 HydrophobicContact CG-CE2 4.47Å; F246-F438 HydrophobicContact CZ-CE2 4.43Å; F246-F438 AromaticContact CZ-CZ 3.98Å; F246-F438 HydrophobicContact CZ-CZ 3.98Å; I394-F438 HydrophobicContact CG1-CE1 4.46Å; I394-F438 HydrophobicContact CG1-CE2 4.26Å; I394-F438 HydrophobicContact CG1-CZ 3.8Å; I394-F438 HydrophobicContact CG2-CE2 3.98Å; I394-F438 HydrophobicContact CG2-CZ 4.36Å; F416-F438 AromaticContact CE1-CD1 3.8Å; F416-F438 HydrophobicContact CE1-CD1 3.8Å; F416-F438 AromaticContact CE1-CE1 3.91Å; F416-F438 HydrophobicContact CE1-CE1 3.91Å; F416-F438 HydrophobicContact CE2-CD1 4.18Å; F416-F438 AromaticContact CZ-CD1 3.41Å; F416-F438 HydrophobicContact CZ-CD1 3.41Å; F416-F438 VanDerWaalsContact CZ-CD1 3.41Å; F416-F438 AromaticContact CZ-CE1 3.53Å; F416-F438 HydrophobicContact CZ-CE1 3.53Å; F416-F438 HydrophobicContact CZ-CG 4.45Å; L428-F438 HydrophobicContact CD2-CB 3.97Å; L428-F438 HydrophobicContact CD2-CD2 4.49Å; L428-F438 HydrophobicContact CD2-CG 4.08Å; P429-F438 HydrophobicContact CG-CD2 3.92Å; P429-F438 HydrophobicContact CG-CE2 3.93Å; C432-F438 HydrophobicContact CB-CB 4Å; S434-F438 PolarHBondContact O-N 2.69Å; P435-F438 PolarHBondContact O-N 3.4Å; F438-K440 VanDerWaalsContact C-N 3.3Å; F438-K440 PolarHBondContact O-N 3.36Å; F438-Y441 WeakPolarHBondContact O-CB 3.45Å; F438-Y441 PolarHBondContact O-N 3.08Å; F438-Y441 VanDerWaalsContact O-N 3.11Å; F438-H442 HydrophobicContact CE1-CB 4.11Å; F438-H442 HydrophobicContact CZ-CB 4.17Å; F438-H442 WeakPolarHBondContact O-CB 3.29Å; F438-H442 PolarHBondContact O-N 3.23Å
439	I	93.9	Very high	90.4	Very high	21 Å²	21	55.1 Å²	55.1	11%	0.108	29%	0.293	C	S	.	.	H	α-helix	trans	-58.6	-44.4	178.5	-78.9	169.8	0	0	0	110.7	F410 D412 P413 F416 P435 Y441 H442 S443	F410-I439 VanDerWaalsContact O-CG2 3.29Å; F410-I439 WeakPolarHBondContact O-CG2 3.37Å; D412-I439 VanDerWaalsContact C-CD1 3.41Å; P413-I439 HydrophobicContact CB-CD1 4.03Å; P413-I439 VanDerWaalsContact N-CD1 3.29Å; F416-I439 HydrophobicContact CE2-CD1 4.19Å; F416-I439 HydrophobicContact CE2-CG1 4.21Å; P435-I439 WeakPolarHBondContact O-CB 3.41Å; P435-I439 WeakPolarHBondContact O-CG1 3.44Å; P435-I439 PolarHBondContact O-N 2.81Å; I439-Y441 VanDerWaalsContact C-N 3.32Å; I439-Y441 PolarHBondContact O-N 2.92Å; I439-H442 PolarHBondContact O-N 3.27Å; I439-S443 VanDerWaalsContact O-CB 3.22Å; I439-S443 WeakPolarHBondContact O-CB 3.11Å; I439-S443 PolarHBondContact O-N 2.82Å
440	K	90.4	Very high	90.3	Very high	162 Å²	162	59.9 Å²	59.9	70%	0.704	31%	0.314	S	S	*	.	H	α-helix	trans	-64.2	-34.7	177.2	-173.8	176.4	-178	178.5	0	112.8	E436 F438 K444	E436-K440 WeakPolarHBondContact O-CB 3.47Å; E436-K440 PolarHBondContact O-N 3.1Å; F438-K440 VanDerWaalsContact C-N 3.3Å; F438-K440 PolarHBondContact O-N 3.36Å; K440-K444 WeakPolarHBondContact O-CB 3.46Å; K440-K444 PolarHBondContact O-N 2.84Å
441	Y	91.9	Very high	90.4	Very high	42 Å²	42	54.2 Å²	54.2	17%	0.165	27%	0.274	C	S	.	.	H	α-helix	trans	-68	-49.4	172	167.8	-102.6	0	0	0	111.5	F246 P249 W431 E437 F438 I439 K444 L445	F246-Y441 HydrophobicContact CD1-CE1 4.39Å; P249-Y441 PolarHBondContact O-OH 2.78Å; W431-Y441 AromaticContact NE1-CE1 3.72Å; W431-Y441 AromaticContact NE1-CE2 3.82Å; W431-Y441 AromaticContact NE1-CZ 3.52Å; E437-Y441 WeakPolarHBondContact O-CB 3.3Å; E437-Y441 PolarHBondContact O-N 2.81Å; F438-Y441 WeakPolarHBondContact O-CB 3.45Å; F438-Y441 PolarHBondContact O-N 3.08Å; F438-Y441 VanDerWaalsContact O-N 3.11Å; I439-Y441 VanDerWaalsContact C-N 3.32Å; I439-Y441 PolarHBondContact O-N 2.92Å; Y441-K444 PolarHBondContact O-N 2.93Å; Y441-L445 HydrophobicContact CD1-CD1 4.31Å; Y441-L445 HydrophobicContact CE1-CD1 3.7Å; Y441-L445 HydrophobicContact CE2-CD1 4.08Å; Y441-L445 HydrophobicContact CE2-CG 4.41Å; Y441-L445 PolarHBondContact O-N 2.83Å
442	H	92.2	Very high	90.5	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.8	-43	-175.5	-167.5	-153.9	0	0	0	112.6	F246 F409 F410 F438 I439 L445 L446	F246-H442 AromaticContact CE1-CD2 3.78Å; F246-H442 AromaticContact CE1-NE2 3.99Å; F246-H442 AromaticContact CZ-CD2 3.87Å; F246-H442 AromaticContact CZ-CE1 3.92Å; F246-H442 AromaticContact CZ-NE2 3.56Å; F409-H442 PolarHBondContact O-ND1 2.89Å; F410-H442 HydrophobicContact CD1-CB 4.49Å; F410-H442 AromaticContact CD1-CG 3.97Å; F410-H442 AromaticContact CD1-ND1 3.66Å; F410-H442 HydrophobicContact CE1-CB 4.49Å; F410-H442 AromaticContact CE1-CD2 3.68Å; F410-H442 AromaticContact CE1-CE1 3.3Å; F410-H442 WeakPolarHBondContact CE1-CE1 3.5Å; F410-H442 AromaticContact CE1-CG 3.6Å; F410-H442 AromaticContact CE1-ND1 3.36Å; F410-H442 WeakPolarHBondContact CE1-ND1 3.21Å; F410-H442 AromaticContact CE1-NE2 3.51Å; F410-H442 AromaticContact CE2-CE1 3.79Å; F410-H442 AromaticContact CZ-CE1 3.19Å; F410-H442 WeakPolarHBondContact CZ-CE1 3.39Å; F410-H442 AromaticContact CZ-ND1 3.71Å; F410-H442 AromaticContact CZ-NE2 3.51Å; F438-H442 HydrophobicContact CE1-CB 4.11Å; F438-H442 HydrophobicContact CZ-CB 4.17Å; F438-H442 WeakPolarHBondContact O-CB 3.29Å; F438-H442 PolarHBondContact O-N 3.23Å; I439-H442 PolarHBondContact O-N 3.27Å; H442-L445 PolarHBondContact O-N 3.46Å; H442-L446 PolarHBondContact O-N 2.56Å
443	S	92	Very high	90.5	Very high	42 Å²	42	51.8 Å²	51.8	29%	0.294	27%	0.268	S	S	.	.	H	α-helix	trans	-60	-43	170.8	169.7	0	0	0	0	111.7	I439 L445 L446 E447	I439-S443 VanDerWaalsContact O-CB 3.22Å; I439-S443 WeakPolarHBondContact O-CB 3.11Å; I439-S443 PolarHBondContact O-N 2.82Å; S443-L445 VanDerWaalsContact C-N 3.28Å; S443-L445 PolarHBondContact O-N 3Å; S443-L446 WeakPolarHBondContact O-CB 3.46Å; S443-L446 PolarHBondContact O-N 3.27Å; S443-E447 PolarHBondContact O-N 2.85Å
444	K	90.6	Very high	90.8	Very high	163 Å²	163	49.9 Å²	49.9	71%	0.709	25%	0.249	S	C	*	.	H	α-helix	trans	-64.1	-30.4	175.6	-175.8	-175.1	174.7	-164.9	0	113	K440 Y441 S448	K440-K444 WeakPolarHBondContact O-CB 3.46Å; K440-K444 PolarHBondContact O-N 2.84Å; Y441-K444 PolarHBondContact O-N 2.93Å; K444-S448 PolarHBondContact O-N 3.48Å
445	L	91.3	Very high	90.8	Very high	37 Å²	37	48 Å²	48	19%	0.194	24%	0.236	C	C	.	.	H	α-helix	trans	-72.7	-42.5	172.3	-70.9	178.8	0	0	0	111.7	I243 T244 Y441 H442 S443 E447 S448 V451	I243-L445 HydrophobicContact CG2-CB 3.73Å; T244-L445 HydrophobicContact CG2-CD1 3.72Å; Y441-L445 HydrophobicContact CD1-CD1 4.31Å; Y441-L445 HydrophobicContact CE1-CD1 3.7Å; Y441-L445 HydrophobicContact CE2-CD1 4.08Å; Y441-L445 HydrophobicContact CE2-CG 4.41Å; Y441-L445 PolarHBondContact O-N 2.83Å; H442-L445 PolarHBondContact O-N 3.46Å; S443-L445 VanDerWaalsContact C-N 3.28Å; S443-L445 PolarHBondContact O-N 3Å; L445-E447 VanDerWaalsContact C-N 3.29Å; L445-E447 PolarHBondContact O-N 2.88Å; L445-S448 WeakPolarHBondContact O-CB 3.26Å; L445-S448 PolarHBondContact O-N 3.32Å; L445-S448 PolarHBondContact O-OG 3.12Å; L445-V451 WeakPolarHBondContact O-CG2 3.26Å
446	L	92.9	Very high	90.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56.6	-42.9	173.6	174.6	63.7	0	0	0	111.4	N216 Y217 L220 L240 P241 I243 F410 H442 S443 S448 V451	N216-L446 HydrophobicContact CB-CD1 4.12Å; N216-L446 HydrophobicContact CB-CG 4.07Å; N216-L446 PolarHBondContact ND2-O 3.17Å; Y217-L446 HydrophobicContact CD2-CD2 4.26Å; L220-L446 HydrophobicContact CD1-CD1 4.32Å; L240-L446 HydrophobicContact CD2-CD2 3.92Å; P241-L446 HydrophobicContact CG-CD1 4.33Å; I243-L446 HydrophobicContact CD1-CD1 3.93Å; I243-L446 HydrophobicContact CG1-CB 4.29Å; I243-L446 HydrophobicContact CG1-CD1 4.49Å; F410-L446 HydrophobicContact CD1-CB 4.43Å; F410-L446 HydrophobicContact CD1-CD2 3.94Å; F410-L446 HydrophobicContact CE1-CB 3.91Å; F410-L446 HydrophobicContact CE1-CD2 3.83Å; F410-L446 HydrophobicContact CE1-CG 4.4Å; F410-L446 HydrophobicContact CZ-CD2 4.31Å; H442-L446 PolarHBondContact O-N 2.56Å; S443-L446 WeakPolarHBondContact O-CB 3.46Å; S443-L446 PolarHBondContact O-N 3.27Å; L446-S448 VanDerWaalsContact C-N 3.27Å; L446-S448 PolarHBondContact O-N 3.37Å; L446-V451 HydrophobicContact CD1-CG1 4.39Å; L446-V451 WeakPolarHBondContact O-CG1 3.43Å
447	E	91.7	Very high	90.9	Very high	52 Å²	52	44.9 Å²	44.9	24%	0.243	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	7.7	176.7	-62.2	-52	139.9	0	0	115	T215 N216 Y217 S443 L445 R505	T215-E447 WeakPolarHBondContact CB-OE1 3.3Å; N216-E447 WeakPolarHBondContact CA-OE1 3.37Å; N216-E447 VanDerWaalsContact CB-OE1 3.28Å; N216-E447 WeakPolarHBondContact CB-OE1 3.34Å; N216-E447 VanDerWaalsContact N-CD 3.25Å; N216-E447 PolarHBondContact N-OE1 2.78Å; N216-E447 PolarHBondContact N-OE2 2.97Å; Y217-E447 PolarHBondContact N-OE1 3.06Å; S443-E447 PolarHBondContact O-N 2.85Å; L445-E447 VanDerWaalsContact C-N 3.29Å; L445-E447 PolarHBondContact O-N 2.88Å; E447-R505 IonicContact OE2-NH1 3.42Å; E447-R505 PolarHBondContact OE2-NH1 3.29Å; E447-R505 IonicContact OE2-NH2 2.68Å
448	S	89.5	Confident	91	Very high	26 Å²	26	40.9 Å²	40.9	18%	0.182	20%	0.2	C	C	.	.	S	Bend	trans	-69.3	153.8	179	69.1	0	0	0	0	112.6	K444 L445 L446 E450 V451 S452	K444-S448 PolarHBondContact O-N 3.48Å; L445-S448 WeakPolarHBondContact O-CB 3.26Å; L445-S448 PolarHBondContact O-N 3.32Å; L445-S448 PolarHBondContact O-OG 3.12Å; L446-S448 VanDerWaalsContact C-N 3.27Å; L446-S448 PolarHBondContact O-N 3.37Å; S448-E450 PolarHBondContact O-N 2.93Å; S448-V451 PolarHBondContact O-N 3.29Å; S448-V451 WeakPolarHBondContact OG-CB 3.48Å; S448-V451 WeakPolarHBondContact OG-CG2 2.97Å; S448-V451 PolarHBondContact OG-N 3.24Å; S448-S452 WeakPolarHBondContact O-CB 3.13Å; S448-S452 PolarHBondContact O-N 3.13Å; S448-S452 PolarHBondContact O-OG 3.48Å
449	D	85.1	Confident	91.1	Very high	31 Å²	31	40.9 Å²	40.9	17%	0.166	20%	0.2	C	C	.	.	H	α-helix	trans	-55.2	-39.3	173.2	-84.7	-44.9	0	0	0	112.3	S452 S453 C507 S508 K509	D449-S452 PolarHBondContact O-N 2.85Å; D449-S453 PolarHBondContact O-N 3.17Å; D449-S453 PolarHBondContact O-OG 2.84Å; D449-C507 VanDerWaalsContact CG-SG 3.59Å; D449-C507 PolarHBondContact OD1-SG 2.69Å; D449-S508 WeakPolarHBondContact OD1-CB 3.16Å; D449-S508 PolarHBondContact OD1-N 2.65Å; D449-K509 WeakPolarHBondContact OD2-CD 3.37Å; D449-K509 WeakPolarHBondContact OD2-CE 3.45Å; D449-K509 WeakPolarHBondContact OD2-CG 3.38Å; D449-K509 IonicContact OD2-NZ 3.98Å; D449-K509 PolarHBondContact OD2-NZ 3.01Å
450	E	85.5	Confident	91	Very high	110 Å²	110	40 Å²	40	51%	0.514	20%	0.195	S	C	.	.	H	α-helix	trans	-77	-33.7	-171.7	-71.5	145.2	-144.2	0	0	112.2	L253 S448 S453 N454 K509	L253-E450 HydrophobicContact CD1-CB 3.58Å; S448-E450 PolarHBondContact O-N 2.93Å; E450-S453 PolarHBondContact O-OG 3.42Å; E450-N454 PolarHBondContact O-ND2 3.12Å; E450-K509 IonicContact OE1-NZ 3.06Å
451	V	90	Very high	91.1	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.024	16%	0.161	C	C	.	.	H	α-helix	trans	-72	-48.1	166.4	170.7	0	0	0	0	110	I243 L253 L256 L445 L446 S448 S453 N454 L455	I243-V451 HydrophobicContact CD1-CG1 3.84Å; I243-V451 HydrophobicContact CD1-CG2 4.21Å; I243-V451 HydrophobicContact CG2-CG2 3.62Å; L253-V451 HydrophobicContact CD1-CG2 4.42Å; L253-V451 HydrophobicContact CD2-CG2 4.02Å; L256-V451 HydrophobicContact CD1-CG1 4.22Å; L445-V451 WeakPolarHBondContact O-CG2 3.26Å; L446-V451 HydrophobicContact CD1-CG1 4.39Å; L446-V451 WeakPolarHBondContact O-CG1 3.43Å; S448-V451 PolarHBondContact O-N 3.29Å; S448-V451 WeakPolarHBondContact OG-CB 3.48Å; S448-V451 WeakPolarHBondContact OG-CG2 2.97Å; S448-V451 PolarHBondContact OG-N 3.24Å; V451-S453 VanDerWaalsContact C-N 3.3Å; V451-S453 PolarHBondContact O-N 2.96Å; V451-N454 CarbonylContact O-C 3.53Å; V451-N454 PolarHBondContact O-N 3.14Å; V451-L455 WeakPolarHBondContact O-CB 3.49Å; V451-L455 PolarHBondContact O-N 3.15Å
452	S	89.8	Confident	91	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-52.3	-45	-178.8	-67.7	0	0	0	0	113.1	N216 S448 D449 N454 R505	N216-S452 PolarHBondContact ND2-OG 2.83Å; S448-S452 WeakPolarHBondContact O-CB 3.13Å; S448-S452 PolarHBondContact O-N 3.13Å; S448-S452 PolarHBondContact O-OG 3.48Å; D449-S452 PolarHBondContact O-N 2.85Å; S452-N454 VanDerWaalsContact C-N 3.26Å; S452-N454 PolarHBondContact O-N 3.15Å; S452-R505 PolarHBondContact OG-NH1 2.89Å
453	S	86.7	Confident	90.9	Very high	26 Å²	26	30.5 Å²	30.5	18%	0.182	16%	0.155	C	C	.	.	H	α-helix	trans	-66.6	-25.1	179.4	59.3	0	0	0	0	113.5	D449 E450 V451 H456 Q504	D449-S453 PolarHBondContact O-N 3.17Å; D449-S453 PolarHBondContact O-OG 2.84Å; E450-S453 PolarHBondContact O-OG 3.42Å; V451-S453 VanDerWaalsContact C-N 3.3Å; V451-S453 PolarHBondContact O-N 2.96Å; S453-H456 PolarHBondContact O-CE1 3.37Å; S453-H456 PolarHBondContact O-ND1 3.09Å; S453-Q504 WeakPolarHBondContact O-CG 3.24Å; S453-Q504 PolarHBondContact O-NE2 3.26Å
454	N	90.5	Very high	90.7	Very high	70 Å²	70	28.6 Å²	28.6	37%	0.374	14%	0.142	S	C	.	.	H	α-helix	trans	-106.2	-13	-176.8	-65.3	-65.3	0	0	0	113.8	L256 E450 V451 S452 H456 H457	L256-N454 HydrophobicContact CB-CB 4.31Å; L256-N454 HydrophobicContact CD1-CB 4.16Å; E450-N454 PolarHBondContact O-ND2 3.12Å; V451-N454 CarbonylContact O-C 3.53Å; V451-N454 PolarHBondContact O-N 3.14Å; S452-N454 VanDerWaalsContact C-N 3.26Å; S452-N454 PolarHBondContact O-N 3.15Å; N454-H456 VanDerWaalsContact C-N 3.26Å; N454-H456 PolarHBondContact O-N 3.49Å; N454-H457 WeakPolarHBondContact O-CB 3.4Å; N454-H457 PolarHBondContact O-N 3.43Å
455	L	93.8	Very high	90.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.1	-32.2	-173.5	-176.5	56.6	0	0	0	113.7	W209 N216 L220 P241 L256 V451 H457 W458 I459	W209-L455 HydrophobicContact CZ2-CB 4.39Å; W209-L455 HydrophobicContact CZ2-CD2 4.11Å; W209-L455 HydrophobicContact CZ2-CG 4.36Å; N216-L455 HydrophobicContact CB-CD2 3.7Å; L220-L455 HydrophobicContact CD1-CD1 4.22Å; L220-L455 HydrophobicContact CD1-CD2 4.24Å; L220-L455 HydrophobicContact CD2-CD2 4.49Å; L220-L455 HydrophobicContact CG-CD2 4.38Å; P241-L455 HydrophobicContact CG-CD1 3.78Å; L256-L455 HydrophobicContact CD1-CB 4.5Å; L256-L455 HydrophobicContact CD1-CD1 4.44Å; V451-L455 WeakPolarHBondContact O-CB 3.49Å; V451-L455 PolarHBondContact O-N 3.15Å; L455-H457 PolarHBondContact O-N 3.39Å; L455-W458 HydrophobicContact CD1-CB 4.37Å; L455-W458 HydrophobicContact CD1-CE3 4.14Å; L455-W458 WeakPolarHBondContact O-CB 3.46Å; L455-W458 PolarHBondContact O-N 3.12Å; L455-I459 HydrophobicContact CG-CD1 4.31Å; L455-I459 PolarHBondContact O-N 3.37Å
456	H	92.2	Very high	90.5	Very high	19 Å²	19	23.8 Å²	23.8	9%	0.088	12%	0.118	C	C	.	.	H	α-helix	trans	-56.6	-34.5	175.4	72.6	-68.6	0	0	0	113.3	W209 S453 N454 W458 I459 D460 H502 P503	W209-H456 HydrophobicContact CH2-CB 4.35Å; S453-H456 PolarHBondContact O-CE1 3.37Å; S453-H456 PolarHBondContact O-ND1 3.09Å; N454-H456 VanDerWaalsContact C-N 3.26Å; N454-H456 PolarHBondContact O-N 3.49Å; H456-W458 VanDerWaalsContact C-N 3.32Å; H456-W458 PolarHBondContact O-N 2.92Å; H456-I459 PolarHBondContact O-N 3.14Å; H456-D460 VanDerWaalsContact O-CG 3.29Å; H456-D460 PolarHBondContact O-N 3.32Å; H456-H502 HydrophobicContact CB-CB 4.3Å; H456-H502 PolarHBondContact CD2-O 3Å; H456-H502 VanDerWaalsContact CD2-O 3.26Å; H456-P503 VanDerWaalsContact CB-O 3.24Å; H456-P503 WeakPolarHBondContact CB-O 3.24Å
457	H	93.9	Very high	90.1	Very high	53 Å²	53	23.8 Å²	23.8	25%	0.245	12%	0.118	C	C	.	.	H	α-helix	trans	-69.1	-28.2	175.2	-65.6	-32.5	0	0	0	113.9	L256 T257 N454 L455 D460 L461	L256-H457 CarbonylContact O-C 3.54Å; T257-H457 HydrophobicContact CG2-CB 4.29Å; N454-H457 WeakPolarHBondContact O-CB 3.4Å; N454-H457 PolarHBondContact O-N 3.43Å; L455-H457 PolarHBondContact O-N 3.39Å; H457-D460 WeakPolarHBondContact CA-OD2 3.18Å; H457-D460 IonicContact ND1-OD2 3.93Å; H457-D460 PolarHBondContact ND1-OD2 3.14Å; H457-L461 WeakPolarHBondContact O-CG 3.14Å; H457-L461 PolarHBondContact O-N 3.41Å
458	W	94.9	Very high	89.6	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-77.3	-33.7	172.8	-177.8	85	0	0	0	111.4	L220 I239 P241 L256 E404 L455 H456 L461 N462 F463	L220-W458 HydrophobicContact CD1-CZ3 4.24Å; L220-W458 HydrophobicContact CD2-CE3 4.27Å; L220-W458 HydrophobicContact CD2-CZ3 3.83Å; I239-W458 HydrophobicContact CD1-CH2 4.23Å; I239-W458 HydrophobicContact CD1-CZ2 4.2Å; I239-W458 HydrophobicContact CG1-CH2 4.07Å; I239-W458 HydrophobicContact CG1-CZ2 4.41Å; P241-W458 HydrophobicContact CB-CD2 3.83Å; P241-W458 HydrophobicContact CB-CE3 4.4Å; P241-W458 HydrophobicContact CB-CG 4.03Å; P241-W458 HydrophobicContact CB-CZ2 4.26Å; P241-W458 HydrophobicContact CG-CD2 4.19Å; P241-W458 HydrophobicContact CG-CE3 4.26Å; L256-W458 HydrophobicContact CB-CB 4.14Å; L256-W458 HydrophobicContact CD2-CB 4.38Å; L256-W458 PolarHBondContact O-N 3.42Å; E404-W458 HydrophobicContact CB-CZ2 4.4Å; E404-W458 HydrophobicContact CG-CZ2 4.12Å; E404-W458 PolarHBondContact OE1-NE1 3.3Å; L455-W458 HydrophobicContact CD1-CB 4.37Å; L455-W458 HydrophobicContact CD1-CE3 4.14Å; L455-W458 WeakPolarHBondContact O-CB 3.46Å; L455-W458 PolarHBondContact O-N 3.12Å; H456-W458 VanDerWaalsContact C-N 3.32Å; H456-W458 PolarHBondContact O-N 2.92Å; W458-L461 PolarHBondContact O-N 3.26Å; W458-N462 HydrophobicContact CH2-CB 4.35Å; W458-N462 HydrophobicContact CZ2-CB 4.3Å; W458-N462 PolarHBondContact NE1-ND2 3.35Å; W458-N462 VanDerWaalsContact NE1-ND2 3.15Å; W458-N462 PolarHBondContact O-N 3.15Å; W458-N462 PolarHBondContact O-ND2 3.4Å; W458-F463 HydrophobicContact CH2-CE2 4.04Å; W458-F463 HydrophobicContact CZ3-CD2 4.5Å; W458-F463 AromaticContact CZ3-CE2 3.82Å; W458-F463 HydrophobicContact CZ3-CE2 3.82Å
459	I	94.2	Very high	89.2	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.6	-44.8	171.5	-62.3	167.5	0	0	0	110.1	W209 Y219 L220 L223 L455 H456 L461 N462 F463 G464 F498 H502	W209-I459 HydrophobicContact CH2-CD1 4.25Å; W209-I459 HydrophobicContact CZ2-CD1 4.34Å; Y219-I459 HydrophobicContact CD1-CD1 4.24Å; Y219-I459 HydrophobicContact CE1-CD1 3.94Å; L220-I459 HydrophobicContact CD2-CD1 4.05Å; L220-I459 HydrophobicContact CD2-CG1 3.93Å; L223-I459 HydrophobicContact CD1-CD1 4.03Å; L223-I459 HydrophobicContact CD1-CG1 4.18Å; L223-I459 HydrophobicContact CD1-CG2 3.67Å; L455-I459 HydrophobicContact CG-CD1 4.31Å; L455-I459 PolarHBondContact O-N 3.37Å; H456-I459 PolarHBondContact O-N 3.14Å; I459-L461 PolarHBondContact O-N 2.98Å; I459-L461 VanDerWaalsContact O-N 3.12Å; I459-N462 PolarHBondContact O-N 2.95Å; I459-N462 VanDerWaalsContact O-N 3.15Å; I459-F463 HydrophobicContact CG2-CB 4.24Å; I459-F463 HydrophobicContact CG2-CD2 4.42Å; I459-F463 PolarHBondContact O-N 2.76Å; I459-G464 PolarHBondContact O-N 3.19Å; I459-F498 HydrophobicContact CG2-CD2 4.35Å; I459-F498 HydrophobicContact CG2-CE2 4.11Å; I459-H502 HydrophobicContact CG2-CB 4.3Å
460	D	92.9	Very high	89.2	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.011	17%	0.173	C	C	.	.	H	α-helix	trans	-52	-35.6	173.4	-64.7	-34.3	0	0	0	112.7	H456 H457 G464 Y465 K466 H502	H456-D460 VanDerWaalsContact O-CG 3.29Å; H456-D460 PolarHBondContact O-N 3.32Å; H457-D460 WeakPolarHBondContact CA-OD2 3.18Å; H457-D460 IonicContact ND1-OD2 3.93Å; H457-D460 PolarHBondContact ND1-OD2 3.14Å; D460-G464 CarbonylContact O-C 3.28Å; D460-G464 WeakPolarHBondContact O-CA 3.26Å; D460-G464 PolarHBondContact O-N 3.22Å; D460-Y465 HydrophobicContact CB-CD1 4.15Å; D460-Y465 HydrophobicContact CB-CE1 3.99Å; D460-K466 HydrophobicContact CB-CB 4.47Å; D460-K466 HydrophobicContact CB-CD 3.65Å; D460-K466 HydrophobicContact CB-CG 4.02Å; D460-K466 WeakPolarHBondContact O-CA 3.48Å; D460-K466 WeakPolarHBondContact O-CB 3.36Å; D460-K466 PolarHBondContact O-N 3.18Å; D460-K466 IonicContact OD2-NZ 3.2Å; D460-K466 PolarHBondContact OD2-NZ 2.98Å; D460-H502 PolarHBondContact OD1-N 3.11Å
461	L	91.5	Very high	89.3	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-82.7	-25.3	-177.3	-71.2	167.4	0	0	0	114.5	H457 W458 I459 K466 L467 A475 N477	H457-L461 WeakPolarHBondContact O-CG 3.14Å; H457-L461 PolarHBondContact O-N 3.41Å; W458-L461 PolarHBondContact O-N 3.26Å; I459-L461 PolarHBondContact O-N 2.98Å; I459-L461 VanDerWaalsContact O-N 3.12Å; L461-K466 HydrophobicContact CD2-CB 3.92Å; L461-K466 HydrophobicContact CD2-CD 3.99Å; L461-K466 HydrophobicContact CG-CD 4.25Å; L461-L467 VanDerWaalsContact O-CD2 3.24Å; L461-L467 WeakPolarHBondContact O-CD2 3.28Å; L461-A475 HydrophobicContact CD2-CB 3.84Å; L461-N477 HydrophobicContact CD2-CB 3.85Å; L461-N477 PolarHBondContact O-ND2 3.34Å
462	N	89.9	Confident	89.3	Confident	6 Å²	6	25.6 Å²	25.6	3%	0.032	16%	0.155	C	C	.	.	H	α-helix	trans	-117.6	-15	-168.4	-70.8	-91.5	0	0	0	114.1	R229 I239 W458 I459	R229-N462 PolarHBondContact NH1-O 2.93Å; I239-N462 HydrophobicContact CD1-CB 4.08Å; I239-N462 WeakPolarHBondContact CD1-OD1 3.44Å; W458-N462 HydrophobicContact CH2-CB 4.35Å; W458-N462 HydrophobicContact CZ2-CB 4.3Å; W458-N462 PolarHBondContact NE1-ND2 3.35Å; W458-N462 VanDerWaalsContact NE1-ND2 3.15Å; W458-N462 PolarHBondContact O-N 3.15Å; W458-N462 PolarHBondContact O-ND2 3.4Å; I459-N462 PolarHBondContact O-N 2.95Å; I459-N462 VanDerWaalsContact O-N 3.15Å
463	F	90.2	Very high	89.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-144.7	-10.2	-179.1	-56.9	-84.9	0	0	0	113.3	L223 A227 I239 W458 I459 C496 L497 F498	L223-F463 HydrophobicContact CB-CD1 4.43Å; L223-F463 HydrophobicContact CB-CE1 4.42Å; A227-F463 HydrophobicContact CB-CD1 3.93Å; A227-F463 HydrophobicContact CB-CE1 3.85Å; I239-F463 HydrophobicContact CG1-CZ 4.13Å; W458-F463 HydrophobicContact CH2-CE2 4.04Å; W458-F463 HydrophobicContact CZ3-CD2 4.5Å; W458-F463 AromaticContact CZ3-CE2 3.82Å; W458-F463 HydrophobicContact CZ3-CE2 3.82Å; I459-F463 HydrophobicContact CG2-CB 4.24Å; I459-F463 HydrophobicContact CG2-CD2 4.42Å; I459-F463 PolarHBondContact O-N 2.76Å; F463-C496 CarbonylContact O-C 3.57Å; F463-L497 HydrophobicContact CB-CD1 4.26Å; F463-L497 HydrophobicContact CB-CG 4.45Å; F463-L497 HydrophobicContact CD1-CD1 3.95Å; F463-L497 HydrophobicContact CD1-CG 4.49Å; F463-L497 HydrophobicContact CG-CD1 4.49Å; F463-L497 WeakPolarHBondContact O-CA 3.38Å; F463-L497 WeakPolarHBondContact O-CB 3.21Å; F463-L497 PolarHBondContact O-N 2.69Å; F463-F498 HydrophobicContact CB-CE2 4.48Å; F463-F498 PolarHBondContact O-N 2.95Å
464	G	87.3	Confident	89.3	Confident	1 Å²	1	32 Å²	32	1%	0.01	20%	0.196	C	C	.	.	S	Bend	trans	-122.9	-161.9	-172.3	0	0	0	0	0	114.8	I459 D460 K466 L467 C496 F498	I459-G464 PolarHBondContact O-N 3.19Å; D460-G464 CarbonylContact O-C 3.28Å; D460-G464 WeakPolarHBondContact O-CA 3.26Å; D460-G464 PolarHBondContact O-N 3.22Å; G464-K466 PolarHBondContact O-N 3.43Å; G464-L467 WeakPolarHBondContact O-CB 3.29Å; G464-L467 PolarHBondContact O-N 3.24Å; G464-C496 PolarHBondContact O-SG 3Å; G464-C496 VanDerWaalsContact O-SG 3.4Å; G464-F498 CarbonylContact C-O 3.55Å; G464-F498 VanDerWaalsContact C-O 3.31Å; G464-F498 WeakPolarHBondContact CA-O 3.44Å
465	Y	87.3	Confident	89.3	Confident	72 Å²	72	29.5 Å²	29.5	28%	0.282	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-60.7	-12.9	-164.6	85.4	-76.8	0	0	0	116.5	D460 L467 A471 F498 S499 P501	D460-Y465 HydrophobicContact CB-CD1 4.15Å; D460-Y465 HydrophobicContact CB-CE1 3.99Å; Y465-L467 VanDerWaalsContact C-N 3.31Å; Y465-A471 HydrophobicContact CD2-CB 3.55Å; Y465-A471 HydrophobicContact CE2-CB 3.65Å; Y465-A471 WeakPolarHBondContact O-CB 3.47Å; Y465-F498 PolarHBondContact N-O 2.94Å; Y465-S499 WeakPolarHBondContact CB-O 3.36Å; Y465-P501 HydrophobicContact CD1-CB 4.21Å; Y465-P501 HydrophobicContact CD1-CG 4.13Å; Y465-P501 HydrophobicContact CE1-CB 3.7Å; Y465-P501 HydrophobicContact CE1-CG 3.69Å
466	K	91	Very high	89.2	Confident	27 Å²	27	31 Å²	31	12%	0.117	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-89.9	9.6	175.3	-56.6	170.3	-174.1	147.5	0	113.1	D460 L461 G464 A471 A472 A475 N477	D460-K466 HydrophobicContact CB-CB 4.47Å; D460-K466 HydrophobicContact CB-CD 3.65Å; D460-K466 HydrophobicContact CB-CG 4.02Å; D460-K466 WeakPolarHBondContact O-CA 3.48Å; D460-K466 WeakPolarHBondContact O-CB 3.36Å; D460-K466 PolarHBondContact O-N 3.18Å; D460-K466 IonicContact OD2-NZ 3.2Å; D460-K466 PolarHBondContact OD2-NZ 2.98Å; L461-K466 HydrophobicContact CD2-CB 3.92Å; L461-K466 HydrophobicContact CD2-CD 3.99Å; L461-K466 HydrophobicContact CG-CD 4.25Å; G464-K466 PolarHBondContact O-N 3.43Å; K466-A471 HydrophobicContact CG-CB 4.42Å; K466-A472 VanDerWaalsContact O-CA 3.29Å; K466-A472 WeakPolarHBondContact O-CA 3.44Å; K466-A472 WeakPolarHBondContact O-CB 3.09Å; K466-A475 HydrophobicContact CB-CB 4.28Å; K466-A475 HydrophobicContact CD-CB 4.41Å; K466-N477 PolarHBondContact O-ND2 3.48Å
467	L	84.1	Confident	89.1	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-80.4	-28.1	163.1	-75.8	171	0	0	0	112.9	I358 L461 G464 Y465 A472 L482 C496	I358-L467 HydrophobicContact CD1-CD2 4.5Å; L461-L467 VanDerWaalsContact O-CD2 3.24Å; L461-L467 WeakPolarHBondContact O-CD2 3.28Å; G464-L467 WeakPolarHBondContact O-CB 3.29Å; G464-L467 PolarHBondContact O-N 3.24Å; Y465-L467 VanDerWaalsContact C-N 3.31Å; L467-A472 VanDerWaalsContact C-CB 3.46Å; L467-A472 WeakPolarHBondContact O-CB 3.49Å; L467-L482 HydrophobicContact CB-CD1 3.86Å; L467-L482 HydrophobicContact CD2-CD1 4.15Å; L467-L482 HydrophobicContact CG-CD1 4.46Å; L467-C496 HydrophobicContact CB-CB 4.37Å; L467-C496 HydrophobicContact CD1-CB 4.03Å
468	L	80.7	Confident	88.8	Confident	80 Å²	80	28.4 Å²	28.4	42%	0.419	18%	0.181	S	C	.	.	S	Bend	trans	-123.6	163.4	-172.1	-64.3	175.1	0	0	0	114	A472 L482 C496	L468-A472 WeakPolarHBondContact O-CB 3.35Å; L468-A472 PolarHBondContact O-N 3.08Å; L468-L482 HydrophobicContact CD2-CB 3.95Å; L468-L482 HydrophobicContact CD2-CD1 3.96Å; L468-L482 HydrophobicContact CD2-CD2 4.45Å; L468-L482 HydrophobicContact CD2-CG 4.36Å; L468-C496 HydrophobicContact CD1-CB 3.8Å; L468-C496 HydrophobicContact CG-CB 4.3Å
469	G	83	Confident	88.2	Confident	57 Å²	57	28.9 Å²	28.9	59%	0.588	18%	0.183	S	C	*	.	H	α-helix	trans	59.6	-156.4	169	0	0	0	0	0	116.2	A471 A472 V473	G469-A471 PolarHBondContact O-N 2.83Å; G469-A472 PolarHBondContact O-N 3.2Å; G469-V473 PolarHBondContact O-N 3.45Å
470	S	84.5	Confident	87.3	Confident	105 Å²	105	31 Å²	31	73%	0.734	20%	0.195	S	C	*	.	H	α-helix	trans	-65	-24.5	179.6	56.2	0	0	0	0	113.4	V473 S474	S470-V473 PolarHBondContact O-N 3.34Å; S470-S474 PolarHBondContact O-N 2.94Å; S470-S474 PolarHBondContact O-OG 2.82Å
471	A	88	Confident	86.1	Confident	18 Å²	18	32.3 Å²	32.3	15%	0.149	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-47.5	173	0	0	0	0	0	111.4	Y465 K466 G469 V473 S474 A475	Y465-A471 HydrophobicContact CD2-CB 3.55Å; Y465-A471 HydrophobicContact CE2-CB 3.65Å; Y465-A471 WeakPolarHBondContact O-CB 3.47Å; K466-A471 HydrophobicContact CG-CB 4.42Å; G469-A471 PolarHBondContact O-N 2.83Å; A471-V473 VanDerWaalsContact C-N 3.34Å; A471-V473 PolarHBondContact O-N 3.08Å; A471-S474 PolarHBondContact O-N 2.64Å; A471-S474 PolarHBondContact O-OG 2.9Å; A471-A475 WeakPolarHBondContact O-CB 3.43Å; A471-A475 PolarHBondContact O-N 3.38Å
472	A	88.2	Confident	84.9	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-36.4	174.5	0	0	0	0	0	113.1	K466 L467 L468 G469 K476 N477 V478	K466-A472 VanDerWaalsContact O-CA 3.29Å; K466-A472 WeakPolarHBondContact O-CA 3.44Å; K466-A472 WeakPolarHBondContact O-CB 3.09Å; L467-A472 VanDerWaalsContact C-CB 3.46Å; L467-A472 WeakPolarHBondContact O-CB 3.49Å; L468-A472 WeakPolarHBondContact O-CB 3.35Å; L468-A472 PolarHBondContact O-N 3.08Å; G469-A472 PolarHBondContact O-N 3.2Å; A472-K476 PolarHBondContact O-N 3.47Å; A472-K476 VanDerWaalsContact O-N 3.08Å; A472-N477 PolarHBondContact O-N 2.88Å; A472-V478 HydrophobicContact CB-CG2 3.74Å
473	V	88.1	Confident	83.3	Confident	62 Å²	62	33.9 Å²	33.9	38%	0.376	21%	0.21	S	C	.	.	H	α-helix	trans	-63.9	-46.2	174.1	178.1	0	0	0	0	110.8	F274 G469 S470 A471 A475 K476 V478	F274-V473 HydrophobicContact CE1-CG1 4.46Å; F274-V473 HydrophobicContact CE2-CG2 4.22Å; F274-V473 HydrophobicContact CZ-CG1 4.15Å; F274-V473 HydrophobicContact CZ-CG2 3.98Å; G469-V473 PolarHBondContact O-N 3.45Å; S470-V473 PolarHBondContact O-N 3.34Å; A471-V473 VanDerWaalsContact C-N 3.34Å; A471-V473 PolarHBondContact O-N 3.08Å; V473-A475 VanDerWaalsContact C-N 3.35Å; V473-A475 PolarHBondContact O-N 2.71Å; V473-K476 PolarHBondContact O-N 3.23Å; V473-K476 VanDerWaalsContact O-N 3.11Å; V473-V478 HydrophobicContact CB-CG2 4.48Å; V473-V478 HydrophobicContact CG2-CG2 3.76Å
474	S	89.7	Confident	81.4	Confident	98 Å²	98	35.6 Å²	35.6	69%	0.685	23%	0.228	S	C	*	.	H	α-helix	trans	-67.1	-33.4	179.6	67.7	0	0	0	0	113.3	S470 A471 K476	S470-S474 PolarHBondContact O-N 2.94Å; S470-S474 PolarHBondContact O-OG 2.82Å; A471-S474 PolarHBondContact O-N 2.64Å; A471-S474 PolarHBondContact O-OG 2.9Å; S474-K476 VanDerWaalsContact C-N 3.28Å; S474-K476 PolarHBondContact O-N 2.72Å
475	A	90.2	Very high	79.3	Confident	18 Å²	18	43.8 Å²	43.8	15%	0.149	27%	0.272	C	S	.	.	H	α-helix	trans	-77	-9.3	173.2	0	0	0	0	0	114.5	H262 L461 K466 A471 V473 N477	H262-A475 PolarHBondContact ND1-O 3.25Å; L461-A475 HydrophobicContact CD2-CB 3.84Å; K466-A475 HydrophobicContact CB-CB 4.28Å; K466-A475 HydrophobicContact CD-CB 4.41Å; A471-A475 WeakPolarHBondContact O-CB 3.43Å; A471-A475 PolarHBondContact O-N 3.38Å; V473-A475 VanDerWaalsContact C-N 3.35Å; V473-A475 PolarHBondContact O-N 2.71Å; A475-N477 VanDerWaalsContact C-N 3.31Å; A475-N477 HydrophobicContact CB-CB 3.91Å
476	K	91.2	Very high	77.2	Confident	31 Å²	31	43.8 Å²	43.8	14%	0.135	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	42.5	-171.2	-49.5	-174.9	-177.8	-175.4	0	112.3	E267 L270 N271 H354 A472 V473 S474	E267-K476 HydrophobicContact CB-CD 4.48Å; E267-K476 HydrophobicContact CG-CD 4.24Å; E267-K476 IonicContact OE2-NZ 3.17Å; E267-K476 PolarHBondContact OE2-NZ 3.31Å; L270-K476 HydrophobicContact CB-CB 4.34Å; L270-K476 HydrophobicContact CB-CD 4.48Å; L270-K476 HydrophobicContact CD1-CB 3.77Å; L270-K476 WeakPolarHBondContact CD1-O 3.42Å; N271-K476 PolarHBondContact ND2-NZ 3.39Å; N271-K476 WeakPolarHBondContact OD1-CD 3.21Å; N271-K476 WeakPolarHBondContact OD1-CE 3.32Å; N271-K476 PolarHBondContact OD1-NZ 2.96Å; H354-K476 VanDerWaalsContact CB-O 3.23Å; H354-K476 WeakPolarHBondContact CB-O 3.18Å; H354-K476 VanDerWaalsContact CG-C 3.46Å; A472-K476 PolarHBondContact O-N 3.47Å; A472-K476 VanDerWaalsContact O-N 3.08Å; V473-K476 PolarHBondContact O-N 3.23Å; V473-K476 VanDerWaalsContact O-N 3.11Å; S474-K476 VanDerWaalsContact C-N 3.28Å; S474-K476 PolarHBondContact O-N 2.72Å
477	N	90.5	Very high	74.5	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	30%	0.299	C	S	.	.			trans	-127.3	22.4	-167.1	-159.5	75.5	0	0	0	112.8	S259 L355 L461 K466 A472 A475 H479	S259-N477 VanDerWaalsContact CB-OD1 3.32Å; S259-N477 WeakPolarHBondContact CB-OD1 3.3Å; S259-N477 PolarHBondContact OG-OD1 2.69Å; L355-N477 HydrophobicContact CD1-CB 4.45Å; L355-N477 WeakPolarHBondContact CD1-OD1 3.3Å; L461-N477 HydrophobicContact CD2-CB 3.85Å; L461-N477 PolarHBondContact O-ND2 3.34Å; K466-N477 PolarHBondContact O-ND2 3.48Å; A472-N477 PolarHBondContact O-N 2.88Å; A475-N477 VanDerWaalsContact C-N 3.31Å; A475-N477 HydrophobicContact CB-CB 3.91Å; N477-H479 PolarHBondContact O-CD2 2.96Å; N477-H479 PolarHBondContact O-N 2.83Å
478	V	87.4	Confident	72.3	Confident	17 Å²	17	48.9 Å²	48.9	10%	0.103	31%	0.311	C	S	.	.			trans	-74.2	118.4	175.3	-176.4	0	0	0	0	109.6	F274 P352 H354 L355 A472 V473 A483	F274-V478 HydrophobicContact CE2-CG2 4.19Å; P352-V478 WeakPolarHBondContact O-CG1 3.5Å; H354-V478 PolarHBondContact N-O 3.07Å; L355-V478 PolarHBondContact N-O 3.25Å; A472-V478 HydrophobicContact CB-CG2 3.74Å; V473-V478 HydrophobicContact CB-CG2 4.48Å; V473-V478 HydrophobicContact CG2-CG2 3.76Å; V478-A483 HydrophobicContact CG1-CB 4.13Å
479	H	81.5	Confident	70.3	Confident	9 Å²	9	49.1 Å²	49.1	4%	0.042	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-84.1	138.9	173.2	-74.2	-84.2	0	0	0	111.7	L355 I358 N477 E481 L482 A483	L355-H479 WeakPolarHBondContact CD1-CE1 3.42Å; L355-H479 VanDerWaalsContact CD1-NE2 3.29Å; L355-H479 WeakPolarHBondContact CD1-NE2 3.5Å; L355-H479 WeakPolarHBondContact O-CA 3.3Å; I358-H479 WeakPolarHBondContact CG1-CE1 3.47Å; I358-H479 WeakPolarHBondContact CG1-ND1 3.41Å; N477-H479 PolarHBondContact O-CD2 2.96Å; N477-H479 PolarHBondContact O-N 2.83Å; H479-E481 PolarHBondContact O-N 3.47Å; H479-L482 HydrophobicContact CB-CG 4.48Å; H479-L482 PolarHBondContact O-N 2.98Å; H479-L482 VanDerWaalsContact O-N 3.12Å; H479-A483 WeakPolarHBondContact O-CB 3.43Å; H479-A483 PolarHBondContact O-N 3.29Å; H479-A483 VanDerWaalsContact O-N 3.13Å
480	L	76.9	Confident	68.8	Low	45 Å²	45	50.4 Å²	50.4	24%	0.236	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-54.3	-36.7	175.2	175.5	58.5	0	0	0	112.4	F350 H353 L355 L356 L482 A483	F350-L480 HydrophobicContact CD1-CD1 4.01Å; F350-L480 HydrophobicContact CD1-CD2 4.31Å; F350-L480 HydrophobicContact CE1-CD1 4.47Å; F350-L480 HydrophobicContact CE1-CD2 4.03Å; H353-L480 HydrophobicContact CB-CB 4.05Å; L355-L480 PolarHBondContact O-N 2.84Å; L356-L480 HydrophobicContact CD2-CD2 3.99Å; L480-L482 VanDerWaalsContact C-N 3.35Å; L480-L482 PolarHBondContact O-N 3.45Å; L480-A483 PolarHBondContact O-N 3.05Å
481	E	68.1	Low	67.1	Low	30 Å²	30	56 Å²	56	14%	0.14	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-67.8	-31.7	179.8	-58	-132.9	104.6	0	0	114	H479 R490 T492	H479-E481 PolarHBondContact O-N 3.47Å; E481-R490 WeakPolarHBondContact OE1-CD 3.29Å; E481-R490 IonicContact OE1-CZ 2.83Å; E481-R490 IonicContact OE1-NH1 3.58Å; E481-R490 PolarHBondContact OE1-NH1 3.11Å; E481-T492 WeakPolarHBondContact OE2-CB 3.21Å; E481-T492 WeakPolarHBondContact OE2-CG2 3.38Å; E481-T492 PolarHBondContact OE2-OG1 3.29Å
482	L	66.3	Low	65.5	Low	28 Å²	28	57.6 Å²	57.6	15%	0.147	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-92	-4.2	177	-65.1	-178.7	0	0	0	112.8	L467 L468 H479 L480 G484 V494	L467-L482 HydrophobicContact CB-CD1 3.86Å; L467-L482 HydrophobicContact CD2-CD1 4.15Å; L467-L482 HydrophobicContact CG-CD1 4.46Å; L468-L482 HydrophobicContact CD2-CB 3.95Å; L468-L482 HydrophobicContact CD2-CD1 3.96Å; L468-L482 HydrophobicContact CD2-CD2 4.45Å; L468-L482 HydrophobicContact CD2-CG 4.36Å; H479-L482 HydrophobicContact CB-CG 4.48Å; H479-L482 PolarHBondContact O-N 2.98Å; H479-L482 VanDerWaalsContact O-N 3.12Å; L480-L482 VanDerWaalsContact C-N 3.35Å; L480-L482 PolarHBondContact O-N 3.45Å; L482-G484 PolarHBondContact O-N 2.94Å; L482-V494 HydrophobicContact CD1-CG1 3.84Å; L482-V494 HydrophobicContact CD2-CG1 4.31Å; L482-V494 HydrophobicContact CG-CG1 3.9Å
483	A	56	Low	64.2	Low	10 Å²	10	58 Å²	58	8%	0.083	32%	0.317	C	S	.	.	S	Bend	trans	-88	93.1	-173	0	0	0	0	0	111.3	S351 V478 H479 L480	S351-A483 VanDerWaalsContact CB-CB 3.46Å; S351-A483 WeakPolarHBondContact CB-O 3.46Å; S351-A483 PolarHBondContact OG-O 3.49Å; V478-A483 HydrophobicContact CG1-CB 4.13Å; H479-A483 WeakPolarHBondContact O-CB 3.43Å; H479-A483 PolarHBondContact O-N 3.29Å; H479-A483 VanDerWaalsContact O-N 3.13Å; L480-A483 PolarHBondContact O-N 3.05Å
484	G	49.8	Very low	63.4	Low	37 Å²	37	55.7 Å²	55.7	38%	0.381	30%	0.303	S	S	.	.	S	Bend	trans	119.1	170.7	166.5	0	0	0	0	0	114.7	L482 Q486	L482-G484 PolarHBondContact O-N 2.94Å; G484-Q486 PolarHBondContact O-N 3Å
485	D	42.5	Very low	62.7	Low	172 Å²	172	54 Å²	54	92%	0.92	29%	0.288	S	S	*	.			trans	-76.1	47.1	-172	-52.5	-47	0	0	0	113	T487	D485-T487 PolarHBondContact O-N 3.09Å
486	Q	42.8	Very low	62.5	Low	73 Å²	73	55 Å²	55	34%	0.341	29%	0.294	S	S	.	.			trans	-81.4	103.8	-175.3	-67.7	-162.8	12.5	0	0	111.5	G484 A488	G484-Q486 PolarHBondContact O-N 3Å; Q486-A488 HydrophobicContact CB-CB 4.37Å; Q486-A488 PolarHBondContact O-N 3.38Å
487	T	36.2	Very low	62.1	Low	104 Å²	104	55.5 Å²	55.5	64%	0.638	30%	0.297	S	S	*	.			trans	-70.2	29.7	158.3	54.8	0	0	0	0	112.3	D485 S1052 S1053	D485-T487 PolarHBondContact O-N 3.09Å; T487-S1052 CarbonylContact O-C 3.6Å; T487-S1052 WeakPolarHBondContact O-CA 3.36Å; T487-S1052 WeakPolarHBondContact O-CB 3.49Å; T487-S1053 PolarHBondContact O-N 2.74Å
488	A	37.8	Very low	61.9	Low	31 Å²	31	55.5 Å²	55.5	26%	0.256	30%	0.298	S	S	.	.			trans	-105.4	118.5	173.1	0	0	0	0	0	114.9	Q486 S1052 S1053	Q486-A488 HydrophobicContact CB-CB 4.37Å; Q486-A488 PolarHBondContact O-N 3.38Å; A488-S1052 WeakPolarHBondContact O-CB 3.45Å; A488-S1052 PolarHBondContact O-OG 2.91Å; A488-S1052 VanDerWaalsContact O-OG 3.08Å; A488-S1053 WeakPolarHBondContact CA-O 3.34Å
489	L	37.5	Very low	61.5	Low	85 Å²	85	58.5 Å²	58.5	45%	0.445	32%	0.319	S	S	.	.			trans	-83.1	157.2	-166.1	-126.2	-171.4	0	0	0	112.8	S1052 H1054	L489-S1052 WeakPolarHBondContact CA-OG 3.42Å; L489-S1052 VanDerWaalsContact CB-C 3.42Å; L489-S1052 WeakPolarHBondContact CB-O 3.42Å; L489-S1052 VanDerWaalsContact CD1-O 3.29Å; L489-S1052 WeakPolarHBondContact CD1-O 3.33Å; L489-S1052 WeakPolarHBondContact CG-O 3.36Å; L489-S1052 WeakPolarHBondContact CG-OG 3.18Å; L489-S1052 PolarHBondContact N-OG 3.35Å; L489-H1054 PolarHBondContact O-CD2 3.04Å; L489-H1054 PolarHBondContact O-NE2 2.97Å
490	R	51.2	Low	61.7	Low	83 Å²	83	59.1 Å²	59.1	31%	0.313	32%	0.324	S	S	.	.			trans	-140.6	138	-170.7	-53.1	-172.7	173.2	-101	-10.5	110	E481 T492	E481-R490 WeakPolarHBondContact OE1-CD 3.29Å; E481-R490 IonicContact OE1-CZ 2.83Å; E481-R490 IonicContact OE1-NH1 3.58Å; E481-R490 PolarHBondContact OE1-NH1 3.11Å; R490-T492 VanDerWaalsContact CB-OG1 3.3Å; R490-T492 WeakPolarHBondContact CB-OG1 3.33Å; R490-T492 PolarHBondContact O-N 3.49Å
491	R	49.1	Very low	62.1	Low	223 Å²	223	60.6 Å²	60.6	84%	0.842	34%	0.336	S	S	*	.	S	Bend	trans	-85.6	24.2	170.2	-64.7	178.7	174.3	168	-1.9	111.1	N236	N236-R491 PolarHBondContact ND2-O 3.11Å; N236-R491 PolarHBondContact OD1-O 2.65Å; N236-R491 VanDerWaalsContact OD1-O 3.08Å
492	T	54.2	Low	63.2	Low	51 Å²	51	59.4 Å²	59.4	31%	0.313	33%	0.33	S	S	.	.	S	Bend	trans	-107.6	121.8	-175.6	55.7	0	0	0	0	108.2	E481 R490 V494	E481-T492 WeakPolarHBondContact OE2-CB 3.21Å; E481-T492 WeakPolarHBondContact OE2-CG2 3.38Å; E481-T492 PolarHBondContact OE2-OG1 3.29Å; R490-T492 VanDerWaalsContact CB-OG1 3.3Å; R490-T492 WeakPolarHBondContact CB-OG1 3.33Å; R490-T492 PolarHBondContact O-N 3.49Å; T492-V494 PolarHBondContact O-N 3.2Å
493	G	60.9	Low	64.3	Low	10 Å²	10	58.3 Å²	58.3	10%	0.103	33%	0.325	C	S	.	.			trans	-71.5	36.5	-175.1	0	0	0	0	0	114.6	R229 N236 V495	R229-G493 PolarHBondContact NE-O 3.05Å; R229-G493 PolarHBondContact NH2-O 3.33Å; N236-G493 WeakPolarHBondContact OD1-CA 3.24Å; N236-G493 PolarHBondContact OD1-N 3Å; G493-V495 VanDerWaalsContact C-N 3.34Å; G493-V495 PolarHBondContact O-N 3.22Å; G493-V495 VanDerWaalsContact O-N 3.17Å
494	V	72	Confident	65.7	Low	14 Å²	14	61.4 Å²	61.4	9%	0.085	34%	0.338	C	S	.	.			trans	-87.1	74.3	179.5	-173.6	0	0	0	0	109	I358 L482 T492	I358-V494 HydrophobicContact CB-CG2 4.13Å; I358-V494 HydrophobicContact CD1-CB 4.44Å; I358-V494 HydrophobicContact CD1-CG1 3.76Å; I358-V494 HydrophobicContact CD1-CG2 3.99Å; I358-V494 HydrophobicContact CG1-CG1 4.48Å; I358-V494 HydrophobicContact CG1-CG2 4.1Å; L482-V494 HydrophobicContact CD1-CG1 3.84Å; L482-V494 HydrophobicContact CD2-CG1 4.31Å; L482-V494 HydrophobicContact CG-CG1 3.9Å; T492-V494 PolarHBondContact O-N 3.2Å
495	V	75.3	Confident	67.5	Low	61 Å²	61	60 Å²	60	37%	0.37	32%	0.321	S	S	.	.			trans	-107.7	131.3	-175.6	-173.4	0	0	0	0	111.2	A227 G493 L497	A227-V495 HydrophobicContact CB-CB 4.34Å; G493-V495 VanDerWaalsContact C-N 3.34Å; G493-V495 PolarHBondContact O-N 3.22Å; G493-V495 VanDerWaalsContact O-N 3.17Å; V495-L497 HydrophobicContact CB-CD2 4.45Å; V495-L497 HydrophobicContact CG1-CD2 3.94Å; V495-L497 PolarHBondContact O-N 2.85Å
496	C	84.9	Confident	69.2	Low	40 Å²	40	53 Å²	53	27%	0.27	28%	0.283	S	S	.	.			trans	-83.4	94.6	167.2	-168.9	0	0	0	0	109.1	F463 G464 L467 L468 F498	F463-C496 CarbonylContact O-C 3.57Å; G464-C496 PolarHBondContact O-SG 3Å; G464-C496 VanDerWaalsContact O-SG 3.4Å; L467-C496 HydrophobicContact CB-CB 4.37Å; L467-C496 HydrophobicContact CD1-CB 4.03Å; L468-C496 HydrophobicContact CD1-CB 3.8Å; L468-C496 HydrophobicContact CG-CB 4.3Å; C496-F498 VanDerWaalsContact C-N 3.34Å; C496-F498 PolarHBondContact SG-O 3.25Å; C496-F498 VanDerWaalsContact SG-O 3.36Å
497	L	83.1	Confident	70.6	Confident	41 Å²	41	50.8 Å²	50.8	22%	0.215	28%	0.276	C	S	.	.			trans	-70.5	-27.2	177.4	-61.7	-178.3	0	0	0	113.2	L223 L226 A227 F463 V495	L223-L497 HydrophobicContact CD2-CD1 4.4Å; L223-L497 WeakPolarHBondContact O-CD1 3.27Å; L226-L497 HydrophobicContact CB-CD1 3.91Å; L226-L497 HydrophobicContact CB-CD2 4.25Å; A227-L497 HydrophobicContact CB-CD1 4.26Å; A227-L497 HydrophobicContact CB-CD2 4.38Å; A227-L497 HydrophobicContact CB-CG 4.42Å; F463-L497 HydrophobicContact CB-CD1 4.26Å; F463-L497 HydrophobicContact CB-CG 4.45Å; F463-L497 HydrophobicContact CD1-CD1 3.95Å; F463-L497 HydrophobicContact CD1-CG 4.49Å; F463-L497 HydrophobicContact CG-CD1 4.49Å; F463-L497 WeakPolarHBondContact O-CA 3.38Å; F463-L497 WeakPolarHBondContact O-CB 3.21Å; F463-L497 PolarHBondContact O-N 2.69Å; V495-L497 HydrophobicContact CB-CD2 4.45Å; V495-L497 HydrophobicContact CG1-CD2 3.94Å; V495-L497 PolarHBondContact O-N 2.85Å
498	F	85.7	Confident	72	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.009	27%	0.265	C	S	.	.			trans	-131	128.9	-172.5	-47	-56.1	0	0	0	113.2	L202 L223 I459 F463 G464 Y465 C496 H502 F608 E612	L202-F498 HydrophobicContact CD1-CE1 4.05Å; L202-F498 HydrophobicContact CD1-CZ 4.13Å; L202-F498 HydrophobicContact CD2-CE1 4.07Å; L223-F498 HydrophobicContact CD1-CE2 4.24Å; L223-F498 HydrophobicContact CD2-CE2 3.99Å; L223-F498 HydrophobicContact CD2-CZ 3.63Å; I459-F498 HydrophobicContact CG2-CD2 4.35Å; I459-F498 HydrophobicContact CG2-CE2 4.11Å; F463-F498 HydrophobicContact CB-CE2 4.48Å; F463-F498 PolarHBondContact O-N 2.95Å; G464-F498 CarbonylContact C-O 3.55Å; G464-F498 VanDerWaalsContact C-O 3.31Å; G464-F498 WeakPolarHBondContact CA-O 3.44Å; Y465-F498 PolarHBondContact N-O 2.94Å; C496-F498 VanDerWaalsContact C-N 3.34Å; C496-F498 PolarHBondContact SG-O 3.25Å; C496-F498 VanDerWaalsContact SG-O 3.36Å; F498-H502 AromaticContact CD2-CD2 3.93Å; F498-H502 AromaticContact CE2-CD2 3.73Å; F498-F608 HydrophobicContact CB-CE2 3.94Å; F498-F608 HydrophobicContact CB-CZ 4.38Å; F498-F608 HydrophobicContact CD1-CE1 4.49Å; F498-F608 AromaticContact CD1-CE2 3.91Å; F498-F608 HydrophobicContact CD1-CE2 3.91Å; F498-F608 AromaticContact CD1-CZ 3.49Å; F498-F608 HydrophobicContact CD1-CZ 3.49Å; F498-F608 VanDerWaalsContact CD1-CZ 3.49Å; F498-F608 HydrophobicContact CD2-CE2 4.25Å; F498-F608 HydrophobicContact CD2-CZ 4.09Å; F498-F608 HydrophobicContact CE1-CE1 4.44Å; F498-F608 AromaticContact CE1-CZ 3.69Å; F498-F608 HydrophobicContact CE1-CZ 3.69Å; F498-F608 HydrophobicContact CE2-CZ 4.24Å; F498-F608 AromaticContact CG-CE2 3.76Å; F498-F608 HydrophobicContact CG-CE2 3.76Å; F498-F608 AromaticContact CG-CZ 3.71Å; F498-F608 HydrophobicContact CG-CZ 3.71Å; F498-F608 HydrophobicContact CZ-CZ 4.05Å; F498-E612 WeakPolarHBondContact CA-OE2 3.02Å; F498-E612 HydrophobicContact CB-CG 4.3Å; F498-E612 HydrophobicContact CD1-CB 4.18Å; F498-E612 HydrophobicContact CD1-CG 4.08Å
499	S	79.8	Confident	73.3	Confident	80 Å²	80	53.2 Å²	53.2	56%	0.559	28%	0.279	S	S	*	.	S	Bend	trans	-81.1	-21	174.9	77.1	0	0	0	0	113.9	Y465 E612	Y465-S499 WeakPolarHBondContact CB-O 3.36Å; S499-E612 WeakPolarHBondContact CA-OE1 3.14Å; S499-E612 VanDerWaalsContact N-CD 3.26Å; S499-E612 PolarHBondContact N-OE1 3.42Å; S499-E612 PolarHBondContact N-OE2 3.25Å; S499-E612 PolarHBondContact OG-OE1 2.76Å
500	T	84.8	Confident	74.6	Confident	21 Å²	21	52.4 Å²	52.4	13%	0.129	27%	0.272	C	S	.	.	S	Bend	trans	-111.6	163.2	-175.6	55.6	0	0	0	0	113.3	H502 F608 I611 E612	T500-H502 PolarHBondContact O-N 3.13Å; T500-F608 WeakPolarHBondContact OG1-CD2 3.34Å; T500-I611 HydrophobicContact CG2-CB 4.22Å; T500-I611 HydrophobicContact CG2-CD1 3.77Å; T500-I611 HydrophobicContact CG2-CG2 3.81Å; T500-E612 VanDerWaalsContact CB-OE1 3.27Å; T500-E612 WeakPolarHBondContact CB-OE1 3.42Å; T500-E612 WeakPolarHBondContact CG2-OE1 3.24Å; T500-E612 PolarHBondContact N-OE1 3.43Å; T500-E612 WeakPolarHBondContact OG1-CG 3.21Å; T500-E612 PolarHBondContact OG1-OE1 2.94Å
501	P	86.7	Confident	75	Confident	76 Å²	76	49 Å²	49	49%	0.494	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-61.6	129.4	174.2	-21	33	0	0	0	111.8	Y465	Y465-P501 HydrophobicContact CD1-CB 4.21Å; Y465-P501 HydrophobicContact CD1-CG 4.13Å; Y465-P501 HydrophobicContact CE1-CB 3.7Å; Y465-P501 HydrophobicContact CE1-CG 3.69Å
502	H	90.5	Very high	75.5	Confident	5 Å²	5	41.3 Å²	41.3	2%	0.023	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-67.3	139.6	-177.4	-167.2	-75.7	0	0	0	111.2	W209 Y219 H456 I459 D460 F498 T500 F608	W209-H502 AromaticContact CE3-CE1 3.82Å; W209-H502 AromaticContact CZ3-CE1 3.35Å; W209-H502 WeakPolarHBondContact CZ3-CE1 3.12Å; W209-H502 AromaticContact CZ3-ND1 3.7Å; Y219-H502 AromaticContact CE1-CE1 3.62Å; Y219-H502 AromaticContact CE1-NE2 3.53Å; Y219-H502 AromaticContact CZ-CE1 3.9Å; Y219-H502 AromaticContact CZ-NE2 3.57Å; Y219-H502 PolarHBondContact OH-CE1 3.31Å; Y219-H502 PolarHBondContact OH-NE2 3.33Å; H456-H502 HydrophobicContact CB-CB 4.3Å; H456-H502 PolarHBondContact CD2-O 3Å; H456-H502 VanDerWaalsContact CD2-O 3.26Å; I459-H502 HydrophobicContact CG2-CB 4.3Å; D460-H502 PolarHBondContact OD1-N 3.11Å; F498-H502 AromaticContact CD2-CD2 3.93Å; F498-H502 AromaticContact CE2-CD2 3.73Å; T500-H502 PolarHBondContact O-N 3.13Å; H502-F608 HydrophobicContact CB-CE2 4.34Å; H502-F608 AromaticContact CD2-CE2 3.95Å; H502-F608 AromaticContact CD2-CZ 3.67Å
503	P	89	Confident	75.7	Confident	5 Å²	5	43.2 Å²	43.2	3%	0.032	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-61.9	148.5	177.6	24.4	-34.9	0	0	0	112.5	T206 W209 V210 H456 L605 F608	T206-P503 HydrophobicContact CG2-CG 3.87Å; W209-P503 WeakPolarHBondContact CZ3-O 3.4Å; V210-P503 HydrophobicContact CG2-CB 4.13Å; V210-P503 HydrophobicContact CG2-CG 4.13Å; H456-P503 VanDerWaalsContact CB-O 3.24Å; H456-P503 WeakPolarHBondContact CB-O 3.24Å; P503-L605 HydrophobicContact CB-CB 4.38Å; P503-L605 HydrophobicContact CB-CD1 4.14Å; P503-L605 HydrophobicContact CG-CD1 3.97Å; P503-F608 VanDerWaalsContact CD-CG 3.41Å; P503-F608 HydrophobicContact CG-CB 4.46Å; P503-F608 HydrophobicContact CG-CD1 4.03Å; P503-F608 HydrophobicContact CG-CE1 4.43Å; P503-F608 HydrophobicContact CG-CG 4.17Å
504	Q	87	Confident	75.4	Confident	76 Å²	76	44.9 Å²	44.9	36%	0.355	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-81.3	135	176.6	-177.8	174.7	51.7	0	0	111.1	S453 I506	S453-Q504 WeakPolarHBondContact O-CG 3.24Å; S453-Q504 PolarHBondContact O-NE2 3.26Å; Q504-I506 PolarHBondContact O-N 3.08Å
505	R	86.1	Confident	74.5	Confident	7 Å²	7	48 Å²	48	3%	0.026	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-69.3	126	171.1	-170.3	172.3	-165.8	-141.4	15.1	110.1	W209 V214 N216 E447 S452 C507	W209-R505 HydrophobicContact CD2-CB 4.48Å; W209-R505 HydrophobicContact CE3-CB 4.45Å; W209-R505 HydrophobicContact CH2-CB 3.77Å; W209-R505 HydrophobicContact CZ2-CB 3.79Å; W209-R505 HydrophobicContact CZ2-CG 4.45Å; W209-R505 HydrophobicContact CZ3-CB 4.09Å; W209-R505 WeakPolarHBondContact O-CG 3.47Å; W209-R505 PolarHBondContact O-NE 3.13Å; V214-R505 PolarHBondContact O-NH2 2.78Å; N216-R505 PolarHBondContact ND2-NH1 3.5Å; N216-R505 WeakPolarHBondContact OD1-CD 3.31Å; N216-R505 VanDerWaalsContact OD1-CZ 3.27Å; N216-R505 PolarHBondContact OD1-NE 2.93Å; N216-R505 PolarHBondContact OD1-NH1 2.83Å; E447-R505 IonicContact OE2-NH1 3.42Å; E447-R505 PolarHBondContact OE2-NH1 3.29Å; E447-R505 IonicContact OE2-NH2 2.68Å; S452-R505 PolarHBondContact OG-NH1 2.89Å; R505-C507 PolarHBondContact O-N 3.07Å
506	I	78.9	Confident	73.4	Confident	26 Å²	26	46.9 Å²	46.9	13%	0.133	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-65.2	127.7	-175.7	-56.8	171.6	0	0	0	108.9	V210 L211 H212 Q504 S508 L511 M601	V210-I506 HydrophobicContact CG1-CD1 4.13Å; V210-I506 HydrophobicContact CG1-CG1 3.94Å; V210-I506 PolarHBondContact O-N 3.2Å; L211-I506 HydrophobicContact CD2-CD1 4.3Å; H212-I506 PolarHBondContact CD2-O 3.43Å; H212-I506 PolarHBondContact NE2-O 3.12Å; Q504-I506 PolarHBondContact O-N 3.08Å; I506-S508 PolarHBondContact O-N 3.01Å; I506-L511 HydrophobicContact CB-CD1 4.29Å; I506-L511 HydrophobicContact CG2-CB 4.01Å; I506-L511 HydrophobicContact CG2-CD1 4.11Å; I506-L511 HydrophobicContact CG2-CG 4.1Å; I506-M601 HydrophobicContact CG1-SD 4.31Å
507	C	71.5	Confident	71.7	Confident	26 Å²	26	50 Å²	50	18%	0.176	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-62.7	133.5	177.9	173.5	0	0	0	0	111.3	D449 R505 K509 K510 L511	D449-C507 VanDerWaalsContact CG-SG 3.59Å; D449-C507 PolarHBondContact OD1-SG 2.69Å; R505-C507 PolarHBondContact O-N 3.07Å; C507-K509 PolarHBondContact O-N 2.93Å; C507-K510 HydrophobicContact CB-CB 4.27Å; C507-K510 HydrophobicContact CB-CD 4.47Å; C507-K510 HydrophobicContact CB-CG 4.14Å; C507-K510 WeakPolarHBondContact O-CA 3.33Å; C507-K510 WeakPolarHBondContact O-CB 3.29Å; C507-K510 PolarHBondContact O-N 2.93Å; C507-L511 PolarHBondContact O-N 3.21Å
508	S	66.2	Low	69.8	Low	60 Å²	60	53.6 Å²	53.6	42%	0.42	31%	0.314	S	S	.	.	H	α-helix	trans	-60.7	-34.8	-176	-170.3	0	0	0	0	112.2	D449 I506 L511 S512	D449-S508 WeakPolarHBondContact OD1-CB 3.16Å; D449-S508 PolarHBondContact OD1-N 2.65Å; I506-S508 PolarHBondContact O-N 3.01Å; S508-L511 PolarHBondContact O-N 2.81Å; S508-S512 WeakPolarHBondContact O-CB 2.87Å; S508-S512 PolarHBondContact O-N 3.44Å; S508-S512 PolarHBondContact O-OG 3.34Å
509	K	65.6	Low	67.7	Low	125 Å²	125	57.2 Å²	57.2	54%	0.543	33%	0.333	S	S	.	.	H	α-helix	trans	-66.9	-32.2	173	-61.6	160.5	-173.8	149.9	0	113.1	D449 E450 C507 S512 K513	D449-K509 WeakPolarHBondContact OD2-CD 3.37Å; D449-K509 WeakPolarHBondContact OD2-CE 3.45Å; D449-K509 WeakPolarHBondContact OD2-CG 3.38Å; D449-K509 IonicContact OD2-NZ 3.98Å; D449-K509 PolarHBondContact OD2-NZ 3.01Å; E450-K509 IonicContact OE1-NZ 3.06Å; C507-K509 PolarHBondContact O-N 2.93Å; K509-S512 PolarHBondContact O-OG 2.79Å; K509-K513 WeakPolarHBondContact O-CB 3.4Å; K509-K513 PolarHBondContact O-N 3.38Å
510	K	64.1	Low	65.8	Low	68 Å²	68	56.7 Å²	56.7	30%	0.296	33%	0.328	S	S	.	.	H	α-helix	trans	-74	-49	171.5	-72.9	-168.2	178.1	-168.9	0	110.3	C507 S512 K513 Y514 E597	C507-K510 HydrophobicContact CB-CB 4.27Å; C507-K510 HydrophobicContact CB-CD 4.47Å; C507-K510 HydrophobicContact CB-CG 4.14Å; C507-K510 WeakPolarHBondContact O-CA 3.33Å; C507-K510 WeakPolarHBondContact O-CB 3.29Å; C507-K510 PolarHBondContact O-N 2.93Å; K510-S512 VanDerWaalsContact C-N 3.3Å; K510-S512 PolarHBondContact O-N 3.21Å; K510-K513 WeakPolarHBondContact O-CA 3.48Å; K510-K513 VanDerWaalsContact O-CB 3.3Å; K510-K513 WeakPolarHBondContact O-CB 3.43Å; K510-K513 PolarHBondContact O-N 3.42Å; K510-Y514 HydrophobicContact CB-CD2 4.47Å; K510-Y514 HydrophobicContact CB-CE2 4.15Å; K510-Y514 WeakPolarHBondContact O-CD2 3.47Å; K510-Y514 PolarHBondContact O-N 3.11Å; K510-Y514 VanDerWaalsContact O-N 3.14Å; K510-E597 IonicContact NZ-OE1 3.4Å; K510-E597 PolarHBondContact NZ-OE1 2.83Å; K510-E597 IonicContact NZ-OE2 3.53Å; K510-E597 PolarHBondContact NZ-OE2 3.45Å
511	L	60.4	Low	63.8	Low	13 Å²	13	60.6 Å²	60.6	7%	0.068	35%	0.347	C	S	.	.	H	α-helix	trans	-55.5	-47	-177.1	-148.9	164.3	0	0	0	110.9	I506 C507 S508 K513 Y514 F515 L519	I506-L511 HydrophobicContact CB-CD1 4.29Å; I506-L511 HydrophobicContact CG2-CB 4.01Å; I506-L511 HydrophobicContact CG2-CD1 4.11Å; I506-L511 HydrophobicContact CG2-CG 4.1Å; C507-L511 PolarHBondContact O-N 3.21Å; S508-L511 PolarHBondContact O-N 2.81Å; L511-K513 PolarHBondContact O-N 3.32Å; L511-Y514 PolarHBondContact O-N 3.41Å; L511-F515 HydrophobicContact CD2-CB 4.32Å; L511-F515 HydrophobicContact CD2-CD2 3.94Å; L511-F515 HydrophobicContact CG-CD2 4.39Å; L511-F515 PolarHBondContact O-N 3.07Å; L511-L519 HydrophobicContact CD2-CD1 3.61Å; L511-L519 HydrophobicContact CD2-CD2 3.93Å; L511-L519 HydrophobicContact CD2-CG 3.61Å
512	S	59.1	Low	61.7	Low	60 Å²	60	61.8 Å²	61.8	42%	0.42	35%	0.349	S	S	.	.	H	α-helix	trans	-69.4	-24.6	174.8	53.9	0	0	0	0	115	S508 K509 K510 G516	S508-S512 WeakPolarHBondContact O-CB 2.87Å; S508-S512 PolarHBondContact O-N 3.44Å; S508-S512 PolarHBondContact O-OG 3.34Å; K509-S512 PolarHBondContact O-OG 2.79Å; K510-S512 VanDerWaalsContact C-N 3.3Å; K510-S512 PolarHBondContact O-N 3.21Å; S512-G516 WeakPolarHBondContact CA-O 3.28Å; S512-G516 WeakPolarHBondContact O-CA 3.45Å; S512-G516 PolarHBondContact O-N 3.47Å; S512-G516 VanDerWaalsContact O-N 3.15Å
513	K	57.3	Low	59.1	Low	91 Å²	91	66.5 Å²	66.5	40%	0.396	37%	0.369	S	S	.	.	H	α-helix	trans	-68.3	-32.6	170.8	-169.8	-171.6	-178.8	-169	0	112.3	K509 K510 L511 P590 D592	K509-K513 WeakPolarHBondContact O-CB 3.4Å; K509-K513 PolarHBondContact O-N 3.38Å; K510-K513 WeakPolarHBondContact O-CA 3.48Å; K510-K513 VanDerWaalsContact O-CB 3.3Å; K510-K513 WeakPolarHBondContact O-CB 3.43Å; K510-K513 PolarHBondContact O-N 3.42Å; L511-K513 PolarHBondContact O-N 3.32Å; K513-P590 HydrophobicContact CG-CG 4.2Å; K513-D592 IonicContact NZ-OD2 3.79Å; K513-D592 PolarHBondContact NZ-OD2 3.37Å
514	Y	54.9	Low	56.6	Low	46 Å²	46	72.2 Å²	72.2	18%	0.18	40%	0.396	C	S	.	.	H	α-helix	trans	-96.7	-36.1	-177.6	-62.2	-68.5	0	0	0	114.1	K510 L511 Y593 L598	K510-Y514 HydrophobicContact CB-CD2 4.47Å; K510-Y514 HydrophobicContact CB-CE2 4.15Å; K510-Y514 WeakPolarHBondContact O-CD2 3.47Å; K510-Y514 PolarHBondContact O-N 3.11Å; K510-Y514 VanDerWaalsContact O-N 3.14Å; L511-Y514 PolarHBondContact O-N 3.41Å; Y514-Y593 AromaticContact CD1-CD2 3.82Å; Y514-Y593 HydrophobicContact CD1-CD2 3.82Å; Y514-Y593 AromaticContact CD1-CE2 3.85Å; Y514-Y593 HydrophobicContact CD1-CE2 3.85Å; Y514-Y593 AromaticContact CE1-CD2 3.78Å; Y514-Y593 HydrophobicContact CE1-CD2 3.78Å; Y514-Y593 HydrophobicContact CE1-CE2 4.08Å; Y514-L598 HydrophobicContact CD1-CD1 3.79Å; Y514-L598 HydrophobicContact CD1-CG 4.49Å; Y514-L598 HydrophobicContact CD2-CD1 4.39Å; Y514-L598 HydrophobicContact CD2-CD2 3.92Å; Y514-L598 HydrophobicContact CD2-CG 4.41Å; Y514-L598 HydrophobicContact CE1-CD1 4.13Å; Y514-L598 HydrophobicContact CE2-CD2 4.23Å; Y514-L598 HydrophobicContact CE2-CG 4.47Å; Y514-L598 HydrophobicContact CG-CD1 3.94Å; Y514-L598 HydrophobicContact CG-CD2 4.23Å; Y514-L598 HydrophobicContact CG-CG 4.45Å
515	F	54.2	Low	54	Low	78 Å²	78	75.6 Å²	75.6	34%	0.342	41%	0.413	S	S	.	.	H	α-helix	trans	-116.7	-6	-170.9	-60.1	-74.4	0	0	0	114.5	L511 P520 I522 L598	L511-F515 HydrophobicContact CD2-CB 4.32Å; L511-F515 HydrophobicContact CD2-CD2 3.94Å; L511-F515 HydrophobicContact CG-CD2 4.39Å; L511-F515 PolarHBondContact O-N 3.07Å; F515-P520 HydrophobicContact CD1-CG 4.09Å; F515-I522 HydrophobicContact CE1-CD1 4.05Å; F515-L598 HydrophobicContact CE2-CD2 4.32Å
516	G	52.8	Low	51.3	Low	38 Å²	38	80.9 Å²	80.9	39%	0.392	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	-160.8	-177.9	0	0	0	0	0	113.9	S512 T518	S512-G516 WeakPolarHBondContact CA-O 3.28Å; S512-G516 WeakPolarHBondContact O-CA 3.45Å; S512-G516 PolarHBondContact O-N 3.47Å; S512-G516 VanDerWaalsContact O-N 3.15Å; G516-T518 VanDerWaalsContact C-N 3.28Å; G516-T518 PolarHBondContact O-N 3.11Å
517	A	48.3	Very low	49	Very low	107 Å²	107	85.5 Å²	85.5	88%	0.884	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-5.8	-174.3	0	0	0	0	0	114.6
518	T	43.6	Very low	47	Very low	116 Å²	116	90.5 Å²	90.5	71%	0.712	50%	0.496	S	S	*	.	S	Bend	trans	-141.4	119.3	178.2	46.3	0	0	0	0	107.3	G516	G516-T518 VanDerWaalsContact C-N 3.28Å; G516-T518 PolarHBondContact O-N 3.11Å
519	L	40.1	Very low	45.3	Very low	77 Å²	77	92.2 Å²	92.2	40%	0.403	51%	0.506	S	S	.	.			trans	-58.9	146.6	171.6	-74.8	80.9	0	0	0	109.6	L511	L511-L519 HydrophobicContact CD2-CD1 3.61Å; L511-L519 HydrophobicContact CD2-CD2 3.93Å; L511-L519 HydrophobicContact CD2-CG 3.61Å
520	P	40.2	Very low	43.6	Very low	70 Å²	70	92.8 Å²	92.8	46%	0.455	52%	0.522	S	S	.	.			trans	-66.7	138.9	153	1.3	14.2	0	0	0	108.4	F515 I522	F515-P520 HydrophobicContact CD1-CG 4.09Å; P520-I522 HydrophobicContact CB-CG1 4.15Å; P520-I522 HydrophobicContact CG-CD1 4.36Å; P520-I522 HydrophobicContact CG-CG1 4.46Å; P520-I522 PolarHBondContact O-N 2.93Å
521	D	43.1	Very low	42	Very low	102 Å²	102	95.9 Å²	95.9	55%	0.545	55%	0.547	S	S	.	.			trans	-75.1	76	173.9	-82.8	-63.8	0	0	0	111	K213 F523 Q524	K213-D521 IonicContact NZ-OD1 2.8Å; D521-F523 PolarHBondContact O-N 3.38Å; D521-Q524 HydrophobicContact CB-CB 4.11Å
522	I	42.3	Very low	40.5	Very low	102 Å²	102	100 Å²	100	52%	0.523	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.6	-17.7	179.8	-66.1	168	0	0	0	111.9	F515 P520	F515-I522 HydrophobicContact CE1-CD1 4.05Å; P520-I522 HydrophobicContact CB-CG1 4.15Å; P520-I522 HydrophobicContact CG-CD1 4.36Å; P520-I522 HydrophobicContact CG-CG1 4.46Å; P520-I522 PolarHBondContact O-N 2.93Å
523	F	36.5	Very low	39.1	Very low	104 Å²	104	106.4 Å²	106.4	46%	0.456	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-132.9	53.6	176.7	-63.5	-65.5	0	0	0	112.3	D521 L618	D521-F523 PolarHBondContact O-N 3.38Å; F523-L618 HydrophobicContact CD1-CD2 4.37Å; F523-L618 HydrophobicContact CE1-CD2 3.39Å; F523-L618 HydrophobicContact CZ-CD2 3.56Å
524	Q	35.9	Very low	38	Very low	125 Å²	125	110.2 Å²	110.2	58%	0.584	62%	0.616	S	S	*	*			trans	-87.6	93.8	158.3	-178.6	170.7	-17.7	0	0	109	D521 D526	D521-Q524 HydrophobicContact CB-CB 4.11Å; Q524-D526 PolarHBondContact NE2-OD1 3.13Å
525	M	33.4	Very low	36.6	Very low	146 Å²	146	114.7 Å²	114.7	72%	0.719	64%	0.643	S	S	*	*			trans	-69.3	130.7	151.6	-71.6	174.1	65.3	0	0	107.1	V527	M525-V527 HydrophobicContact CB-CG2 4.35Å; M525-V527 PolarHBondContact O-N 2.92Å
526	D	29.3	Very low	35.2	Very low	119 Å²	119	116.2 Å²	116.2	64%	0.636	66%	0.664	S	S	*	*			trans	-76	66.1	-178.4	-82	-37.4	0	0	0	112.5	Q524 N528	Q524-D526 PolarHBondContact NE2-OD1 3.13Å; D526-N528 PolarHBondContact O-N 3.29Å
527	V	31.2	Very low	34	Very low	122 Å²	122	120.4 Å²	120.4	74%	0.739	68%	0.681	S	S	*	*			trans	-76	79.6	168.1	-173.6	0	0	0	0	108.6	M525	M525-V527 HydrophobicContact CB-CG2 4.35Å; M525-V527 PolarHBondContact O-N 2.92Å
528	N	28.2	Very low	32.9	Very low	132 Å²	132	120.2 Å²	120.2	71%	0.706	67%	0.673	S	S	*	*			trans	-63.4	127.1	171.5	-76.8	-71.9	0	0	0	109.7	D526	D526-N528 PolarHBondContact O-N 3.29Å
529	P	30.2	Very low	32.2	Very low	95 Å²	95	122.5 Å²	122.5	62%	0.617	68%	0.678	S	S	*	*			trans	-73.8	133.7	-177.8	28.7	-34	0	0	0	111.2	T531	P529-T531 PolarHBondContact O-N 2.9Å
530	P	30	Very low	31.4	Very low	137 Å²	137	127.7 Å²	127.7	89%	0.89	70%	0.7	S	S	*	*			trans	-69.7	103.1	-178.3	27.3	-34.2	0	0	0	111.1	S532	P530-S532 PolarHBondContact O-N 3.34Å
531	T	31.9	Very low	30.8	Very low	133 Å²	133	132.6 Å²	132.6	82%	0.816	72%	0.719	S	S	*	*			trans	-91	99.3	177.8	45.9	0	0	0	0	111.1	P529 K533	P529-T531 PolarHBondContact O-N 2.9Å; T531-K533 PolarHBondContact O-N 3.48Å
532	S	27.8	Very low	30.2	Very low	100 Å²	100	137.4 Å²	137.4	70%	0.699	74%	0.738	S	S	*	*			trans	-59.1	124.1	178	66.7	0	0	0	0	112.7	P530	P530-S532 PolarHBondContact O-N 3.34Å
533	K	30.7	Very low	29.6	Very low	194 Å²	194	136.3 Å²	136.3	84%	0.843	74%	0.744	S	S	*	*				171.9	142	116.6	-91.8	156.1	-171.9	172.4	0	114.8	T531	T531-K533 PolarHBondContact O-N 3.48Å
534	H	32.7	Very low	29.2	Very low	172 Å²	172	138.7 Å²	138.7	80%	0.796	76%	0.762	S	S	*	*			trans	-41.8	133	176.4	-64.6	-66.3	0	0	0	117.8
535	N	27.4	Very low	28.9	Very low	139 Å²	139	139.6 Å²	139.6	74%	0.743	77%	0.77	S	S	*	*				44	107.6	122.6	-58.8	-9.6	0	0	0	119.1
536	S	24.3	Very low	28.6	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	77%	0.772	S	S	*	*				146.7	162.8	82.1	56.8	0	0	0	0	116.3
537	V	26.9	Very low	28.7	Very low	126 Å²	126	136.9 Å²	136.9	76%	0.764	77%	0.773	S	S	*	*			trans	84.3	91.9	160.2	-169.3	0	0	0	0	119.3
538	S	26.1	Very low	28.6	Very low	102 Å²	102	137.8 Å²	137.8	71%	0.713	77%	0.774	S	S	*	*			trans	69.4	110.6	134	78.8	0	0	0	0	123.4
539	M	28.5	Very low	28.3	Very low	165 Å²	165	140 Å²	140	81%	0.813	78%	0.78	S	S	*	*				72.6	124.2	114.1	-141.8	83.5	171.1	0	0	120.9
540	E	23.1	Very low	28.3	Very low	185 Å²	185	141.5 Å²	141.5	86%	0.864	79%	0.787	S	S	*	*			trans	-66.4	133.7	154.9	-52.2	175	117.6	0	0	110.6
541	M	28.4	Very low	28	Very low	174 Å²	174	139.9 Å²	139.9	86%	0.857	78%	0.779	S	S	*	*			trans	-161.6	116.2	144.2	-81.8	-144.4	175.5	0	0	110.8
542	H	30.3	Very low	27.9	Very low	202 Å²	202	141.5 Å²	141.5	94%	0.935	78%	0.781	S	S	*	*			trans	-90	145.7	163.9	-69.2	-56.6	0	0	0	110.1
543	A	28.1	Very low	27.7	Very low	79 Å²	79	147 Å²	147	65%	0.653	79%	0.787	S	S	*	*			cis	-168.9	158	-18.4	0	0	0	0	0	108
544	N	29	Very low	27.5	Very low	155 Å²	155	145.4 Å²	145.4	83%	0.829	78%	0.78	S	S	*	*			trans	-171	109.3	148.7	-102.2	-27.8	0	0	0	113.5
545	N	28.8	Very low	27.1	Very low	143 Å²	143	143.6 Å²	143.6	77%	0.765	78%	0.776	S	S	*	*			trans	141.6	85.4	142.3	-70.8	-12.5	0	0	0	114.1
546	S	26.9	Very low	27.1	Very low	107 Å²	107	145.8 Å²	145.8	75%	0.748	78%	0.781	S	S	*	*				22.5	156.9	127.9	42.9	0	0	0	0	122.7
547	P	32.3	Very low	27.6	Very low	102 Å²	102	145.5 Å²	145.5	66%	0.662	78%	0.777	S	S	*	*			cis	-141.3	-167.3	-19.3	38.3	-17.8	0	0	0	115
548	N	28.6	Very low	27.6	Very low	141 Å²	141	145.6 Å²	145.6	75%	0.754	78%	0.778	S	S	*	*			trans	77.6	122.6	167.3	-54.4	-9.6	0	0	0	115.4
549	E	22.8	Very low	27.6	Very low	178 Å²	178	148.3 Å²	148.3	83%	0.832	78%	0.784	S	S	*	*			cis	95.1	157.7	46	-79.6	-151	135.9	0	0	114.2
550	V	29.9	Very low	27.7	Very low	126 Å²	126	145.7 Å²	145.7	76%	0.764	78%	0.777	S	S	*	*			trans	71.3	94.8	-178.6	-170.3	0	0	0	0	113.9
551	S	23.7	Very low	28	Very low	104 Å²	104	145.6 Å²	145.6	73%	0.727	77%	0.774	S	S	*	*				62.4	112.1	63.2	-61.7	0	0	0	0	116.6
552	L	30.2	Very low	27.8	Very low	166 Å²	166	141.9 Å²	141.9	87%	0.869	77%	0.765	S	S	*	*			trans	-179.2	102.7	139.9	-98.3	156.4	0	0	0	108.5
553	R	23.4	Very low	27.8	Very low	215 Å²	215	139.4 Å²	139.4	81%	0.811	76%	0.757	S	S	*	*				65.7	116.8	64.6	-91.8	-175.3	169	-177.3	-0.2	116.8
554	K	26.2	Very low	27.5	Very low	161 Å²	161	139.9 Å²	139.9	70%	0.7	76%	0.756	S	S	*	*			trans	96	104.1	139.5	-70.4	179	174.1	-172.1	0	121.2
555	N	24.1	Very low	27.3	Very low	134 Å²	134	138.3 Å²	138.3	72%	0.717	76%	0.757	S	S	*	*				49.4	124.4	114.1	-51.3	10	0	0	0	119.9
556	H	27.1	Very low	27.3	Very low	185 Å²	185	136.9 Å²	136.9	86%	0.856	76%	0.758	S	S	*	*				-162	147.7	97	-109.2	-82.7	0	0	0	112
557	P	35.3	Very low	27.3	Very low	105 Å²	105	141 Å²	141	68%	0.682	76%	0.762	S	S	*	*			trans	-110.9	156	-180	39.3	-32.1	0	0	0	114.1
558	T	26.2	Very low	27.2	Very low	128 Å²	128	143.1 Å²	143.1	79%	0.785	77%	0.773	S	S	*	*			trans	-164.8	125.2	161.2	22.9	0	0	0	0	113.4
559	L	25.8	Very low	27.1	Very low	160 Å²	160	142.5 Å²	142.5	84%	0.838	77%	0.77	S	S	*	*			trans	63.2	149.1	160.5	-75.3	79.2	0	0	0	117.3
560	T	31.4	Very low	27.5	Very low	109 Å²	109	143.3 Å²	143.3	67%	0.669	77%	0.773	S	S	*	*			cis	-135.9	136.5	15.2	47.9	0	0	0	0	115.7
561	K	29.8	Very low	27.5	Very low	183 Å²	183	142.7 Å²	142.7	80%	0.796	77%	0.77	S	S	*	*			trans	63.2	134.6	139.3	-61.7	176	-179.4	179.3	0	120.7
562	S	24.6	Very low	27.8	Very low	96 Å²	96	143.9 Å²	143.9	67%	0.671	78%	0.775	S	S	*	*			cis	80.2	135.7	21.1	89.8	0	0	0	0	115.3
563	I	29.1	Very low	27.7	Very low	150 Å²	150	144.6 Å²	144.6	77%	0.769	77%	0.771	S	S	*	*			cis	-161.8	167.4	13.8	-107.3	145.9	0	0	0	107.2
564	S	22.7	Very low	27.9	Very low	89 Å²	89	141.3 Å²	141.3	62%	0.622	77%	0.769	S	S	*	*			cis	148.6	119	-42.8	66.4	0	0	0	0	113.8
565	S	25.2	Very low	28.2	Very low	123 Å²	123	139.1 Å²	139.1	86%	0.86	77%	0.771	S	S	*	*			trans	77.4	128.7	162.1	80.5	0	0	0	0	122.7
566	S	28.6	Very low	28.8	Very low	112 Å²	112	139.4 Å²	139.4	78%	0.783	78%	0.778	S	S	*	*			trans	-179.5	106	140	57.2	0	0	0	0	110.2
567	K	25.9	Very low	28.9	Very low	194 Å²	194	134.1 Å²	134.1	84%	0.843	77%	0.773	S	S	*	*				66	105.3	83.8	-78.5	-171.5	174	179.6	0	117.2
568	V	30.8	Very low	28.7	Very low	146 Å²	146	135.8 Å²	135.8	89%	0.885	78%	0.776	S	S	*	*				-142.3	153.5	129.2	-179.9	0	0	0	0	107.2
569	N	25.6	Very low	28.9	Very low	128 Å²	128	140 Å²	140	68%	0.684	78%	0.778	S	S	*	*			trans	-102.3	163.6	-172.9	-37.6	-69.6	0	0	0	112.6
570	H	32.2	Very low	29.2	Very low	196 Å²	196	140.1 Å²	140.1	91%	0.907	78%	0.78	S	S	*	*				-161.3	141.7	118.5	-102.2	-71.4	0	0	0	111.4
571	T	29.5	Very low	29.2	Very low	112 Å²	112	140.8 Å²	140.8	69%	0.687	79%	0.789	S	S	*	*			trans	-133.5	144.9	-175.9	55.5	0	0	0	0	111.6
572	P	30.2	Very low	29.3	Very low	129 Å²	129	137.7 Å²	137.7	84%	0.838	79%	0.789	S	S	*	*			trans	-103.1	-174.4	152.3	35.8	-29.5	0	0	0	112.8
573	K	27.5	Very low	29.6	Very low	182 Å²	182	139.7 Å²	139.7	79%	0.791	79%	0.791	S	S	*	*			trans	-147.6	159.7	-161.7	-79.6	-177.7	-179.4	179.8	0	108.9
574	L	27.3	Very low	29.9	Very low	146 Å²	146	142.4 Å²	142.4	76%	0.764	80%	0.798	S	S	*	*			cis	-159.6	-166.6	0.6	-108.6	164.8	0	0	0	104.7
575	P	34.1	Very low	30.5	Very low	114 Å²	114	145.4 Å²	145.4	74%	0.74	81%	0.807	S	S	*	*			cis	-130.6	-176.2	-3.5	41.3	-23.6	0	0	0	115.1
576	T	35.3	Very low	30.9	Very low	140 Å²	140	147.3 Å²	147.3	86%	0.859	80%	0.799	S	S	*	*			trans	-88.5	140.5	161.1	49.6	0	0	0	0	111.5
577	G	29.7	Very low	31.8	Very low	74 Å²	74	149.1 Å²	149.1	76%	0.763	80%	0.799	S	S	*	*			trans	-162	149.9	173.8	0	0	0	0	0	112.3
578	D	31.6	Very low	32.7	Very low	140 Å²	140	151.3 Å²	151.3	75%	0.749	80%	0.802	S	S	*	*			trans	-67	150.4	-165.6	-81	-83.6	0	0	0	117.4
579	R	30.4	Very low	33.6	Very low	217 Å²	217	148.7 Å²	148.7	82%	0.819	78%	0.782	S	S	*	*			trans	28.9	114.7	140.5	-52.5	174.2	-169	-152.7	-3.1	118.4
580	D	32.6	Very low	35.1	Very low	163 Å²	163	144.7 Å²	144.7	87%	0.872	76%	0.764	S	S	*	*				-162.7	157	103.7	-107.7	-19.3	0	0	0	113	C582	D580-C582 PolarHBondContact O-N 3.39Å
581	S	31.5	Very low	36.3	Very low	123 Å²	123	143.7 Å²	143.7	86%	0.86	77%	0.765	S	S	*	*			trans	-102.1	64.6	-163	63.5	0	0	0	0	114.9
582	C	30.3	Very low	37.8	Very low	118 Å²	118	144 Å²	144	80%	0.797	76%	0.762	S	S	*	*			trans	-160.6	92.2	161	-165.3	0	0	0	0	113.1	D580	D580-C582 PolarHBondContact O-N 3.39Å
583	L	31.7	Very low	39.3	Very low	138 Å²	138	141.9 Å²	141.9	72%	0.723	74%	0.738	S	S	*	*			trans	-176	87.4	162.8	-107.1	160.7	0	0	0	110	K586	L583-K586 HydrophobicContact CD2-CB 4.17Å; L583-K586 HydrophobicContact CD2-CD 3.73Å; L583-K586 HydrophobicContact CD2-CG 3.68Å
584	K	34.6	Very low	41.2	Very low	207 Å²	207	136.8 Å²	136.8	90%	0.9	72%	0.719	S	S	*	*			trans	-106.9	-11.6	174.7	-118.4	-172.3	178.3	-169.6	0	115.1
585	N	36.1	Very low	43	Very low	152 Å²	152	132.1 Å²	132.1	81%	0.813	70%	0.698	S	S	*	*			trans	-120.2	71.3	-178.5	-65.5	21.6	0	0	0	111
586	K	33.5	Very low	44.7	Very low	163 Å²	163	131.7 Å²	131.7	71%	0.709	69%	0.689	S	S	*	*			trans	-141.8	109.2	161.5	-84.7	-162.1	176.6	-173.1	0	110.2	L583	L583-K586 HydrophobicContact CD2-CB 4.17Å; L583-K586 HydrophobicContact CD2-CD 3.73Å; L583-K586 HydrophobicContact CD2-CG 3.68Å
587	I	46.9	Very low	46.3	Very low	150 Å²	150	128.2 Å²	128.2	77%	0.769	66%	0.663	S	S	*	*			trans	-71.4	130.2	167.6	-59.8	170.1	0	0	0	107.4	L589	I587-L589 HydrophobicContact CG2-CD2 3.75Å; I587-L589 HydrophobicContact CG2-CG 4.24Å
588	W	45.1	Very low	48	Very low	239 Å²	239	126.3 Å²	126.3	91%	0.905	64%	0.635	S	S	*	*			trans	-90.6	105.5	168.9	-89.3	73.8	0	0	0	108.7
589	L	50	Low	49.8	Very low	91 Å²	91	123.6 Å²	123.6	48%	0.476	62%	0.62	S	S	.	*			trans	-85.2	135.8	170.1	-57.9	175.1	0	0	0	108.4	I587 Y593	I587-L589 HydrophobicContact CG2-CD2 3.75Å; I587-L589 HydrophobicContact CG2-CG 4.24Å; L589-Y593 HydrophobicContact CB-CD1 4.37Å; L589-Y593 HydrophobicContact CB-CG 4.04Å; L589-Y593 HydrophobicContact CD1-CD1 3.81Å; L589-Y593 HydrophobicContact CD1-CE1 4.02Å; L589-Y593 HydrophobicContact CD1-CG 4.3Å; L589-Y593 HydrophobicContact CD2-CD1 4.11Å; L589-Y593 HydrophobicContact CD2-CD2 3.84Å; L589-Y593 HydrophobicContact CD2-CE1 4.1Å; L589-Y593 HydrophobicContact CD2-CE2 3.84Å; L589-Y593 HydrophobicContact CD2-CG 3.98Å; L589-Y593 HydrophobicContact CG-CD1 4.32Å; L589-Y593 HydrophobicContact CG-CG 4.32Å
590	P	56.7	Low	51.7	Low	45 Å²	45	117.1 Å²	117.1	29%	0.292	60%	0.601	S	S	.	*			trans	-59.9	155.2	169	-23.2	34.1	0	0	0	111.9	K513 D592 Y593	K513-P590 HydrophobicContact CG-CG 4.2Å; P590-D592 PolarHBondContact O-N 2.93Å; P590-Y593 WeakPolarHBondContact O-CB 3.43Å; P590-Y593 PolarHBondContact O-N 3.01Å
591	D	58.9	Low	53.5	Low	175 Å²	175	110.9 Å²	110.9	94%	0.936	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-29.1	-180	-60.4	-53.7	0	0	0	112.9
592	D	59	Low	55.4	Low	118 Å²	118	108.6 Å²	108.6	63%	0.631	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	46	169.5	23.1	-101.1	0	0	0	113	K513 P590 D594	K513-D592 IonicContact NZ-OD2 3.79Å; K513-D592 PolarHBondContact NZ-OD2 3.37Å; P590-D592 PolarHBondContact O-N 2.93Å; D592-D594 PolarHBondContact O-N 2.75Å
593	Y	62.6	Low	57.5	Low	85 Å²	85	107.8 Å²	107.8	33%	0.333	53%	0.527	S	S	.	.			trans	-79.9	96.3	167.9	178.8	-99.5	0	0	0	110.9	Y514 L589 P590 P595 L598	Y514-Y593 AromaticContact CD1-CD2 3.82Å; Y514-Y593 HydrophobicContact CD1-CD2 3.82Å; Y514-Y593 AromaticContact CD1-CE2 3.85Å; Y514-Y593 HydrophobicContact CD1-CE2 3.85Å; Y514-Y593 AromaticContact CE1-CD2 3.78Å; Y514-Y593 HydrophobicContact CE1-CD2 3.78Å; Y514-Y593 HydrophobicContact CE1-CE2 4.08Å; L589-Y593 HydrophobicContact CB-CD1 4.37Å; L589-Y593 HydrophobicContact CB-CG 4.04Å; L589-Y593 HydrophobicContact CD1-CD1 3.81Å; L589-Y593 HydrophobicContact CD1-CE1 4.02Å; L589-Y593 HydrophobicContact CD1-CG 4.3Å; L589-Y593 HydrophobicContact CD2-CD1 4.11Å; L589-Y593 HydrophobicContact CD2-CD2 3.84Å; L589-Y593 HydrophobicContact CD2-CE1 4.1Å; L589-Y593 HydrophobicContact CD2-CE2 3.84Å; L589-Y593 HydrophobicContact CD2-CG 3.98Å; L589-Y593 HydrophobicContact CG-CD1 4.32Å; L589-Y593 HydrophobicContact CG-CG 4.32Å; P590-Y593 WeakPolarHBondContact O-CB 3.43Å; P590-Y593 PolarHBondContact O-N 3.01Å; Y593-P595 HydrophobicContact CE1-CB 3.83Å; Y593-P595 HydrophobicContact CE1-CG 4.19Å; Y593-P595 WeakPolarHBondContact O-CD 3.47Å; Y593-L598 HydrophobicContact CE2-CD1 4.11Å
594	D	67.2	Low	59.5	Low	74 Å²	74	105.9 Å²	105.9	40%	0.396	52%	0.518	S	S	.	.			trans	-90.9	111.2	165.7	-179.1	16.7	0	0	0	110.8	D592 L596 E597	D592-D594 PolarHBondContact O-N 2.75Å; D594-L596 VanDerWaalsContact C-N 3.29Å; D594-L596 WeakPolarHBondContact OD1-CB 3.43Å; D594-L596 VanDerWaalsContact OD1-CD1 3.3Å; D594-L596 WeakPolarHBondContact OD1-CD1 3.34Å; D594-L596 PolarHBondContact OD1-N 3.02Å; D594-E597 PolarHBondContact OD2-N 3.26Å
595	P	64.6	Low	61.6	Low	49 Å²	49	96.8 Å²	96.8	32%	0.318	48%	0.479	S	S	.	.	H	α-helix	trans	-71.8	-21.3	173.4	29	-32.4	0	0	0	113	Y593 E597 L598 I599	Y593-P595 HydrophobicContact CE1-CB 3.83Å; Y593-P595 HydrophobicContact CE1-CG 4.19Å; Y593-P595 WeakPolarHBondContact O-CD 3.47Å; P595-E597 VanDerWaalsContact C-N 3.33Å; P595-E597 PolarHBondContact O-N 3.29Å; P595-L598 PolarHBondContact O-N 3.45Å; P595-I599 HydrophobicContact CB-CD1 4.42Å; P595-I599 WeakPolarHBondContact O-CB 3.49Å; P595-I599 WeakPolarHBondContact O-CD1 3.47Å; P595-I599 VanDerWaalsContact O-CG1 3.27Å; P595-I599 WeakPolarHBondContact O-CG1 3.49Å; P595-I599 PolarHBondContact O-N 2.97Å
596	L	70.1	Confident	63.4	Low	104 Å²	104	90 Å²	90	55%	0.545	44%	0.443	S	S	.	.	H	α-helix	trans	-67.4	-33.9	-179.8	-72	86.3	0	0	0	111.5	D594 L598 I599 N600	D594-L596 VanDerWaalsContact C-N 3.29Å; D594-L596 WeakPolarHBondContact OD1-CB 3.43Å; D594-L596 VanDerWaalsContact OD1-CD1 3.3Å; D594-L596 WeakPolarHBondContact OD1-CD1 3.34Å; D594-L596 PolarHBondContact OD1-N 3.02Å; L596-L598 PolarHBondContact O-N 2.93Å; L596-I599 PolarHBondContact O-N 3.4Å; L596-N600 WeakPolarHBondContact O-CB 3.45Å; L596-N600 PolarHBondContact O-N 3.32Å; L596-N600 PolarHBondContact O-ND2 2.97Å
597	E	68.6	Low	65.4	Low	67 Å²	67	88.5 Å²	88.5	31%	0.313	44%	0.437	S	S	.	.	H	α-helix	trans	-62.6	-43.7	176	-166.5	177.6	-131.7	0	0	111.9	K510 D594 P595 M601	K510-E597 IonicContact NZ-OE1 3.4Å; K510-E597 PolarHBondContact NZ-OE1 2.83Å; K510-E597 IonicContact NZ-OE2 3.53Å; K510-E597 PolarHBondContact NZ-OE2 3.45Å; D594-E597 PolarHBondContact OD2-N 3.26Å; P595-E597 VanDerWaalsContact C-N 3.33Å; P595-E597 PolarHBondContact O-N 3.29Å; E597-M601 HydrophobicContact CG-CE 4.28Å; E597-M601 WeakPolarHBondContact O-CG 3.42Å; E597-M601 PolarHBondContact O-N 3.46Å
598	L	66.2	Low	67.2	Low	34 Å²	34	81.5 Å²	81.5	18%	0.178	40%	0.401	C	S	.	.	H	α-helix	trans	-65.8	-44.6	175.5	-72.9	171.8	0	0	0	111.9	Y514 F515 Y593 P595 L596 M601 H602	Y514-L598 HydrophobicContact CD1-CD1 3.79Å; Y514-L598 HydrophobicContact CD1-CG 4.49Å; Y514-L598 HydrophobicContact CD2-CD1 4.39Å; Y514-L598 HydrophobicContact CD2-CD2 3.92Å; Y514-L598 HydrophobicContact CD2-CG 4.41Å; Y514-L598 HydrophobicContact CE1-CD1 4.13Å; Y514-L598 HydrophobicContact CE2-CD2 4.23Å; Y514-L598 HydrophobicContact CE2-CG 4.47Å; Y514-L598 HydrophobicContact CG-CD1 3.94Å; Y514-L598 HydrophobicContact CG-CD2 4.23Å; Y514-L598 HydrophobicContact CG-CG 4.45Å; F515-L598 HydrophobicContact CE2-CD2 4.32Å; Y593-L598 HydrophobicContact CE2-CD1 4.11Å; P595-L598 PolarHBondContact O-N 3.45Å; L596-L598 PolarHBondContact O-N 2.93Å; L598-M601 HydrophobicContact CD2-CE 3.88Å; L598-M601 PolarHBondContact O-N 2.93Å; L598-H602 WeakPolarHBondContact O-CB 3.46Å; L598-H602 PolarHBondContact O-N 2.98Å
599	I	69	Low	68.7	Low	84 Å²	84	70.2 Å²	70.2	43%	0.431	36%	0.358	S	S	.	.	H	α-helix	trans	-62.7	-44	178.2	-69.5	165.2	0	0	0	110.6	P595 L596 H602 Q603	P595-I599 HydrophobicContact CB-CD1 4.42Å; P595-I599 WeakPolarHBondContact O-CB 3.49Å; P595-I599 WeakPolarHBondContact O-CD1 3.47Å; P595-I599 VanDerWaalsContact O-CG1 3.27Å; P595-I599 WeakPolarHBondContact O-CG1 3.49Å; P595-I599 PolarHBondContact O-N 2.97Å; L596-I599 PolarHBondContact O-N 3.4Å; I599-H602 PolarHBondContact O-N 3.32Å; I599-Q603 HydrophobicContact CG2-CG 4.21Å; I599-Q603 WeakPolarHBondContact O-CB 3.43Å; I599-Q603 VanDerWaalsContact O-CG 3.3Å; I599-Q603 WeakPolarHBondContact O-CG 3.34Å; I599-Q603 PolarHBondContact O-N 2.92Å
600	N	71.1	Confident	69.8	Low	80 Å²	80	70 Å²	70	43%	0.428	35%	0.354	S	S	.	.	H	α-helix	trans	-64.4	-41.6	177.9	-73	-25.1	0	0	0	111.9	L596 Q603 N604	L596-N600 WeakPolarHBondContact O-CB 3.45Å; L596-N600 PolarHBondContact O-N 3.32Å; L596-N600 PolarHBondContact O-ND2 2.97Å; N600-Q603 PolarHBondContact O-N 3.17Å; N600-N604 WeakPolarHBondContact O-CB 3.26Å; N600-N604 PolarHBondContact O-N 3.24Å; N600-N604 PolarHBondContact O-ND2 2.59Å
601	M	70.5	Confident	70.4	Confident	32 Å²	32	70.7 Å²	70.7	16%	0.158	36%	0.355	C	S	.	.	H	α-helix	trans	-62.4	-42.6	174.1	-74.1	-173.4	-63.9	0	0	111.7	I506 E597 L598 N604 L605	I506-M601 HydrophobicContact CG1-SD 4.31Å; E597-M601 HydrophobicContact CG-CE 4.28Å; E597-M601 WeakPolarHBondContact O-CG 3.42Å; E597-M601 PolarHBondContact O-N 3.46Å; L598-M601 HydrophobicContact CD2-CE 3.88Å; L598-M601 PolarHBondContact O-N 2.93Å; M601-N604 PolarHBondContact O-N 3.11Å; M601-L605 PolarHBondContact O-N 3.46Å
602	H	71.7	Confident	71	Confident	75 Å²	75	64.2 Å²	64.2	35%	0.347	32%	0.319	S	S	.	.	H	α-helix	trans	-67.1	-41.7	177.9	-161.8	-0.1	0	0	0	112.1	L598 I599 C606 N619	L598-H602 WeakPolarHBondContact O-CB 3.46Å; L598-H602 PolarHBondContact O-N 2.98Å; I599-H602 PolarHBondContact O-N 3.32Å; H602-C606 PolarHBondContact ND1-SG 3.42Å; H602-C606 VanDerWaalsContact ND1-SG 3.35Å; H602-C606 WeakPolarHBondContact O-CB 3.46Å; H602-C606 PolarHBondContact O-N 3.38Å; H602-C606 PolarHBondContact O-SG 2.92Å; H602-N619 PolarHBondContact CE1-OD1 3.4Å; H602-N619 PolarHBondContact ND1-OD1 2.9Å; H602-N619 PolarHBondContact NE2-OD1 3.31Å; H602-N619 PolarHBondContact O-ND2 2.98Å; H602-N619 VanDerWaalsContact O-ND2 3.1Å
603	Q	74	Confident	71.2	Confident	102 Å²	102	58.8 Å²	58.8	48%	0.477	29%	0.29	S	S	.	.	H	α-helix	trans	-65.1	-39.8	175.1	-75.3	178.9	-4.6	0	0	112.2	I599 N600 K607 N619	I599-Q603 HydrophobicContact CG2-CG 4.21Å; I599-Q603 WeakPolarHBondContact O-CB 3.43Å; I599-Q603 VanDerWaalsContact O-CG 3.3Å; I599-Q603 WeakPolarHBondContact O-CG 3.34Å; I599-Q603 PolarHBondContact O-N 2.92Å; N600-Q603 PolarHBondContact O-N 3.17Å; Q603-K607 WeakPolarHBondContact O-CB 3.44Å; Q603-K607 PolarHBondContact O-N 3.44Å; Q603-N619 WeakPolarHBondContact CA-ND2 3.21Å
604	N	72.9	Confident	70.7	Confident	97 Å²	97	60.4 Å²	60.4	52%	0.519	30%	0.301	S	S	.	.	H	α-helix	trans	-67.1	-44.3	176.8	-73.3	-25.6	0	0	0	112.2	N600 M601 F608	N600-N604 WeakPolarHBondContact O-CB 3.26Å; N600-N604 PolarHBondContact O-N 3.24Å; N600-N604 PolarHBondContact O-ND2 2.59Å; M601-N604 PolarHBondContact O-N 3.11Å; N604-F608 WeakPolarHBondContact O-CB 3.2Å; N604-F608 PolarHBondContact O-N 2.98Å
605	L	79.5	Confident	69.7	Low	17 Å²	17	58.7 Å²	58.7	9%	0.089	29%	0.291	C	S	.	.	H	α-helix	trans	-57	-51	173.6	173.4	60.1	0	0	0	111.1	T206 V210 P503 M601 F608 L609	T206-L605 HydrophobicContact CG2-CD1 4.38Å; V210-L605 HydrophobicContact CG1-CD2 4.36Å; V210-L605 HydrophobicContact CG2-CD1 4.25Å; P503-L605 HydrophobicContact CB-CB 4.38Å; P503-L605 HydrophobicContact CB-CD1 4.14Å; P503-L605 HydrophobicContact CG-CD1 3.97Å; M601-L605 PolarHBondContact O-N 3.46Å; L605-F608 WeakPolarHBondContact O-CB 3.38Å; L605-F608 PolarHBondContact O-N 3.04Å; L605-L609 HydrophobicContact CD1-CD1 3.94Å; L605-L609 HydrophobicContact CD1-CG 4.14Å; L605-L609 HydrophobicContact CG-CD1 4.05Å; L605-L609 WeakPolarHBondContact O-CG 3.45Å; L605-L609 PolarHBondContact O-N 2.76Å
606	C	73.2	Confident	68.6	Low	8 Å²	8	58.2 Å²	58.2	5%	0.054	29%	0.285	C	S	.	.	H	α-helix	trans	-76.6	-29.2	-172.9	-56.4	0	0	0	0	112.5	H602 L609 H610 L618 N619	H602-C606 PolarHBondContact ND1-SG 3.42Å; H602-C606 VanDerWaalsContact ND1-SG 3.35Å; H602-C606 WeakPolarHBondContact O-CB 3.46Å; H602-C606 PolarHBondContact O-N 3.38Å; H602-C606 PolarHBondContact O-SG 2.92Å; C606-L609 PolarHBondContact O-N 3.44Å; C606-H610 WeakPolarHBondContact O-CB 3.35Å; C606-H610 PolarHBondContact O-N 3.36Å; C606-L618 HydrophobicContact CB-CB 3.87Å; C606-L618 WeakPolarHBondContact CB-O 3.4Å; C606-L618 VanDerWaalsContact SG-CB 3.57Å; C606-N619 WeakPolarHBondContact CB-ND2 3.49Å; C606-N619 PolarHBondContact SG-OD1 2.93Å
607	K	76.1	Confident	67.1	Low	133 Å²	133	54.1 Å²	54.1	58%	0.578	26%	0.263	S	S	*	.	H	α-helix	trans	-62.1	-42.4	168.2	-179	176.6	178.7	-178.6	0	111.8	Q603 I611	Q603-K607 WeakPolarHBondContact O-CB 3.44Å; Q603-K607 PolarHBondContact O-N 3.44Å; K607-I611 HydrophobicContact CG-CD1 3.87Å; K607-I611 WeakPolarHBondContact O-CB 3.28Å; K607-I611 VanDerWaalsContact O-CG1 3.32Å; K607-I611 WeakPolarHBondContact O-CG1 3.35Å; K607-I611 PolarHBondContact O-N 3.41Å; K607-I611 VanDerWaalsContact O-N 3.11Å
608	F	83.5	Confident	65.5	Low	3 Å²	3	53.1 Å²	53.1	1%	0.013	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-48.6	174.2	176.6	-90.3	0	0	0	111.3	T206 F498 T500 H502 P503 N604 L605 H610 I611 E612	T206-F608 HydrophobicContact CG2-CD1 4.28Å; T206-F608 HydrophobicContact CG2-CE1 3.9Å; F498-F608 HydrophobicContact CB-CE2 3.94Å; F498-F608 HydrophobicContact CB-CZ 4.38Å; F498-F608 HydrophobicContact CD1-CE1 4.49Å; F498-F608 AromaticContact CD1-CE2 3.91Å; F498-F608 HydrophobicContact CD1-CE2 3.91Å; F498-F608 AromaticContact CD1-CZ 3.49Å; F498-F608 HydrophobicContact CD1-CZ 3.49Å; F498-F608 VanDerWaalsContact CD1-CZ 3.49Å; F498-F608 HydrophobicContact CD2-CE2 4.25Å; F498-F608 HydrophobicContact CD2-CZ 4.09Å; F498-F608 HydrophobicContact CE1-CE1 4.44Å; F498-F608 AromaticContact CE1-CZ 3.69Å; F498-F608 HydrophobicContact CE1-CZ 3.69Å; F498-F608 HydrophobicContact CE2-CZ 4.24Å; F498-F608 AromaticContact CG-CE2 3.76Å; F498-F608 HydrophobicContact CG-CE2 3.76Å; F498-F608 AromaticContact CG-CZ 3.71Å; F498-F608 HydrophobicContact CG-CZ 3.71Å; F498-F608 HydrophobicContact CZ-CZ 4.05Å; T500-F608 WeakPolarHBondContact OG1-CD2 3.34Å; H502-F608 HydrophobicContact CB-CE2 4.34Å; H502-F608 AromaticContact CD2-CE2 3.95Å; H502-F608 AromaticContact CD2-CZ 3.67Å; P503-F608 VanDerWaalsContact CD-CG 3.41Å; P503-F608 HydrophobicContact CG-CB 4.46Å; P503-F608 HydrophobicContact CG-CD1 4.03Å; P503-F608 HydrophobicContact CG-CE1 4.43Å; P503-F608 HydrophobicContact CG-CG 4.17Å; N604-F608 WeakPolarHBondContact O-CB 3.2Å; N604-F608 PolarHBondContact O-N 2.98Å; L605-F608 WeakPolarHBondContact O-CB 3.38Å; L605-F608 PolarHBondContact O-N 3.04Å; F608-H610 PolarHBondContact O-N 3.46Å; F608-I611 PolarHBondContact O-N 2.89Å; F608-E612 HydrophobicContact CD2-CG 3.85Å; F608-E612 HydrophobicContact CE1-CG 4.46Å; F608-E612 HydrophobicContact CE2-CG 3.79Å; F608-E612 HydrophobicContact CG-CG 4.24Å; F608-E612 HydrophobicContact CZ-CG 4.11Å; F608-E612 WeakPolarHBondContact O-CB 3.35Å; F608-E612 WeakPolarHBondContact O-CG 3.42Å; F608-E612 PolarHBondContact O-N 2.85Å
609	L	77.7	Confident	64	Low	1 Å²	1	54.4 Å²	54.4	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-62.6	-42.5	178.2	-66.1	174.9	0	0	0	112.7	L605 C606 I611 T613 H614 I615 L618	L605-L609 HydrophobicContact CD1-CD1 3.94Å; L605-L609 HydrophobicContact CD1-CG 4.14Å; L605-L609 HydrophobicContact CG-CD1 4.05Å; L605-L609 WeakPolarHBondContact O-CG 3.45Å; L605-L609 PolarHBondContact O-N 2.76Å; C606-L609 PolarHBondContact O-N 3.44Å; L609-I611 VanDerWaalsContact C-N 3.31Å; L609-I611 PolarHBondContact O-N 3.1Å; L609-T613 HydrophobicContact CD2-CG2 3.98Å; L609-T613 PolarHBondContact O-N 3.05Å; L609-T613 VanDerWaalsContact O-N 3.11Å; L609-T613 PolarHBondContact O-OG1 3.12Å; L609-H614 PolarHBondContact O-N 3.24Å; L609-I615 PolarHBondContact O-N 3.25Å; L609-L618 HydrophobicContact CD1-CD1 4.04Å
610	H	71.7	Confident	62.2	Low	87 Å²	87	53.9 Å²	53.9	40%	0.403	27%	0.265	S	S	.	.	H	α-helix	trans	-58.7	-41.6	176.6	-176.2	119.4	0	0	0	111.8	C606 F608 H614 I615 Q616	C606-H610 WeakPolarHBondContact O-CB 3.35Å; C606-H610 PolarHBondContact O-N 3.36Å; F608-H610 PolarHBondContact O-N 3.46Å; H610-H614 WeakPolarHBondContact O-CA 3.49Å; H610-I615 VanDerWaalsContact CA-O 3.31Å; H610-I615 WeakPolarHBondContact CA-O 3.4Å; H610-Q616 PolarHBondContact CE1-O 3.03Å; H610-Q616 VanDerWaalsContact ND1-CA 3.28Å; H610-Q616 WeakPolarHBondContact ND1-CA 3.03Å; H610-Q616 PolarHBondContact ND1-O 2.96Å; H610-Q616 VanDerWaalsContact ND1-O 3.11Å
611	I	70.8	Confident	60.1	Low	59 Å²	59	56.8 Å²	56.8	30%	0.303	29%	0.288	S	S	.	.	H	α-helix	trans	-82.8	-56.3	-177.4	-64.5	168.4	0	0	0	111	T500 K607 F608 L609 H614	T500-I611 HydrophobicContact CG2-CB 4.22Å; T500-I611 HydrophobicContact CG2-CD1 3.77Å; T500-I611 HydrophobicContact CG2-CG2 3.81Å; K607-I611 HydrophobicContact CG-CD1 3.87Å; K607-I611 WeakPolarHBondContact O-CB 3.28Å; K607-I611 VanDerWaalsContact O-CG1 3.32Å; K607-I611 WeakPolarHBondContact O-CG1 3.35Å; K607-I611 PolarHBondContact O-N 3.41Å; K607-I611 VanDerWaalsContact O-N 3.11Å; F608-I611 PolarHBondContact O-N 2.89Å; L609-I611 VanDerWaalsContact C-N 3.31Å; L609-I611 PolarHBondContact O-N 3.1Å; I611-H614 PolarHBondContact O-CE1 3.45Å; I611-H614 PolarHBondContact O-ND1 2.96Å
612	E	71.3	Confident	57.9	Low	39 Å²	39	63.1 Å²	63.1	18%	0.182	32%	0.317	C	S	.	.	H	α-helix	trans	-81.8	-38.6	-168.7	-52.5	-56.1	150.3	0	0	114.1	F498 S499 T500 F608 H614	F498-E612 WeakPolarHBondContact CA-OE2 3.02Å; F498-E612 HydrophobicContact CB-CG 4.3Å; F498-E612 HydrophobicContact CD1-CB 4.18Å; F498-E612 HydrophobicContact CD1-CG 4.08Å; S499-E612 WeakPolarHBondContact CA-OE1 3.14Å; S499-E612 VanDerWaalsContact N-CD 3.26Å; S499-E612 PolarHBondContact N-OE1 3.42Å; S499-E612 PolarHBondContact N-OE2 3.25Å; S499-E612 PolarHBondContact OG-OE1 2.76Å; T500-E612 VanDerWaalsContact CB-OE1 3.27Å; T500-E612 WeakPolarHBondContact CB-OE1 3.42Å; T500-E612 WeakPolarHBondContact CG2-OE1 3.24Å; T500-E612 PolarHBondContact N-OE1 3.43Å; T500-E612 WeakPolarHBondContact OG1-CG 3.21Å; T500-E612 PolarHBondContact OG1-OE1 2.94Å; F608-E612 HydrophobicContact CD2-CG 3.85Å; F608-E612 HydrophobicContact CE1-CG 4.46Å; F608-E612 HydrophobicContact CE2-CG 3.79Å; F608-E612 HydrophobicContact CG-CG 4.24Å; F608-E612 HydrophobicContact CZ-CG 4.11Å; F608-E612 WeakPolarHBondContact O-CB 3.35Å; F608-E612 WeakPolarHBondContact O-CG 3.42Å; F608-E612 PolarHBondContact O-N 2.85Å; E612-H614 VanDerWaalsContact C-N 3.32Å
613	T	62.6	Low	55.7	Low	5 Å²	5	61.7 Å²	61.7	3%	0.031	32%	0.316	C	S	.	.	S	Bend	trans	-89.5	-5.9	177.2	72.8	0	0	0	0	112.4	L202 L609 I615	L202-T613 HydrophobicContact CB-CG2 4.33Å; L202-T613 HydrophobicContact CD2-CG2 3.88Å; L202-T613 HydrophobicContact CG-CG2 3.79Å; L609-T613 HydrophobicContact CD2-CG2 3.98Å; L609-T613 PolarHBondContact O-N 3.05Å; L609-T613 VanDerWaalsContact O-N 3.11Å; L609-T613 PolarHBondContact O-OG1 3.12Å; T613-I615 VanDerWaalsContact C-N 3.26Å; T613-I615 PolarHBondContact O-N 2.9Å; T613-I615 WeakPolarHBondContact OG1-CG1 3.49Å
614	H	51.6	Low	53.4	Low	119 Å²	119	62.3 Å²	62.3	55%	0.551	32%	0.321	S	S	*	.			trans	46.4	48.2	-167.7	-63.2	-29.5	0	0	0	112	L609 H610 I611 E612 K628	L609-H614 PolarHBondContact O-N 3.24Å; H610-H614 WeakPolarHBondContact O-CA 3.49Å; I611-H614 PolarHBondContact O-CE1 3.45Å; I611-H614 PolarHBondContact O-ND1 2.96Å; E612-H614 VanDerWaalsContact C-N 3.32Å; H614-K628 VanDerWaalsContact CB-NZ 3.3Å; H614-K628 WeakPolarHBondContact O-CE 3.42Å; H614-K628 WeakPolarHBondContact O-CG 3.34Å; H614-K628 PolarHBondContact O-NZ 2.97Å
615	I	47.9	Very low	51	Low	38 Å²	38	60.1 Å²	60.1	20%	0.195	31%	0.308	C	S	.	.			trans	-108.6	92.4	170.4	-63.8	179.5	0	0	0	105.6	L609 H610 T613 D617	L609-I615 PolarHBondContact O-N 3.25Å; H610-I615 VanDerWaalsContact CA-O 3.31Å; H610-I615 WeakPolarHBondContact CA-O 3.4Å; T613-I615 VanDerWaalsContact C-N 3.26Å; T613-I615 PolarHBondContact O-N 2.9Å; T613-I615 WeakPolarHBondContact OG1-CG1 3.49Å; I615-D617 PolarHBondContact O-N 3.06Å
616	Q	41.1	Very low	48.5	Very low	39 Å²	39	64.6 Å²	64.6	18%	0.182	33%	0.331	C	S	.	.			trans	-68.5	9.7	-166.6	-59.1	152.5	-82.8	0	0	114.4	H610 K628 L629 N630	H610-Q616 PolarHBondContact CE1-O 3.03Å; H610-Q616 VanDerWaalsContact ND1-CA 3.28Å; H610-Q616 WeakPolarHBondContact ND1-CA 3.03Å; H610-Q616 PolarHBondContact ND1-O 2.96Å; H610-Q616 VanDerWaalsContact ND1-O 3.11Å; Q616-K628 HydrophobicContact CG-CG 4.36Å; Q616-K628 VanDerWaalsContact OE1-CD 3.3Å; Q616-L629 HydrophobicContact CB-CB 3.99Å; Q616-N630 PolarHBondContact NE2-OD1 3.33Å; Q616-N630 VanDerWaalsContact NE2-OD1 3.11Å; Q616-N630 PolarHBondContact OE1-OD1 3.45Å
617	D	37.3	Very low	46.2	Very low	17 Å²	17	67.7 Å²	67.7	9%	0.091	35%	0.353	C	S	.	.			trans	-132	105.5	-158.7	-108.9	43.6	0	0	0	110.1	I615 Q625 L626 S627 L629	I615-D617 PolarHBondContact O-N 3.06Å; D617-Q625 HydrophobicContact CB-CB 3.64Å; D617-Q625 HydrophobicContact CB-CG 4.21Å; D617-Q625 PolarHBondContact OD1-NE2 3.26Å; D617-Q625 WeakPolarHBondContact OD2-CA 3.3Å; D617-Q625 WeakPolarHBondContact OD2-CB 3.19Å; D617-Q625 VanDerWaalsContact OD2-CG 3.31Å; D617-Q625 WeakPolarHBondContact OD2-CG 3.5Å; D617-L626 PolarHBondContact OD2-N 3.28Å; D617-S627 WeakPolarHBondContact CB-O 3.19Å; D617-L629 WeakPolarHBondContact OD1-CB 3.45Å; D617-L629 WeakPolarHBondContact OD1-CD1 3.27Å; D617-L629 VanDerWaalsContact OD1-CG 3.26Å; D617-L629 WeakPolarHBondContact OD1-CG 3.37Å
618	L	37	Very low	44	Very low	47 Å²	47	66 Å²	66	25%	0.246	35%	0.346	C	S	.	.			trans	172.3	112.9	161.5	-94.8	154.2	0	0	0	107.8	F523 C606 L609	F523-L618 HydrophobicContact CD1-CD2 4.37Å; F523-L618 HydrophobicContact CE1-CD2 3.39Å; F523-L618 HydrophobicContact CZ-CD2 3.56Å; C606-L618 HydrophobicContact CB-CB 3.87Å; C606-L618 WeakPolarHBondContact CB-O 3.4Å; C606-L618 VanDerWaalsContact SG-CB 3.57Å; L609-L618 HydrophobicContact CD1-CD1 4.04Å
619	N	34.4	Very low	41.1	Very low	60 Å²	60	71.2 Å²	71.2	32%	0.321	37%	0.373	S	S	.	.			trans	130.5	62.4	164.9	-66.9	-5.1	0	0	0	115.8	H602 Q603 C606	H602-N619 PolarHBondContact CE1-OD1 3.4Å; H602-N619 PolarHBondContact ND1-OD1 2.9Å; H602-N619 PolarHBondContact NE2-OD1 3.31Å; H602-N619 PolarHBondContact O-ND2 2.98Å; H602-N619 VanDerWaalsContact O-ND2 3.1Å; Q603-N619 WeakPolarHBondContact CA-ND2 3.21Å; C606-N619 WeakPolarHBondContact CB-ND2 3.49Å; C606-N619 PolarHBondContact SG-OD1 2.93Å
620	D	29.5	Very low	38.6	Very low	74 Å²	74	76.2 Å²	76.2	40%	0.396	40%	0.4	S	S	.	.			trans	-122.7	122.8	149.8	-156.8	18.7	0	0	0	106	R61 E622 S623	R61-D620 IonicContact NH1-OD2 3.85Å; R61-D620 PolarHBondContact NH1-OD2 3.36Å; D620-E622 PolarHBondContact O-N 3.48Å; D620-S623 WeakPolarHBondContact CB-OG 3.41Å; D620-S623 PolarHBondContact O-N 3.05Å; D620-S623 VanDerWaalsContact O-N 3.09Å
621	P	28.8	Very low	36.6	Very low	140 Å²	140	75.8 Å²	75.8	91%	0.909	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	14.7	-178.1	30.8	-35.8	0	0	0	113.5
622	E	24.4	Very low	34.6	Very low	166 Å²	166	82.5 Å²	82.5	78%	0.776	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.9	30.7	171	-145.2	-179.6	-117.5	0	0	112.3	R61 D620	R61-E622 PolarHBondContact NH2-O 3.24Å; D620-E622 PolarHBondContact O-N 3.48Å
623	S	23.9	Very low	32.6	Very low	45 Å²	45	85 Å²	85	32%	0.315	44%	0.441	S	S	.	.			trans	-143.1	141	160.3	76.4	0	0	0	0	114.4	D620 Q625	D620-S623 WeakPolarHBondContact CB-OG 3.41Å; D620-S623 PolarHBondContact O-N 3.05Å; D620-S623 VanDerWaalsContact O-N 3.09Å; S623-Q625 PolarHBondContact O-N 3.09Å
624	I	26.3	Very low	31.4	Very low	115 Å²	115	88.3 Å²	88.3	59%	0.59	46%	0.459	S	S	*	.			trans	-53.6	123.5	150.5	-66.9	160	0	0	0	106.1	L626	I624-L626 HydrophobicContact CG2-CB 3.9Å; I624-L626 HydrophobicContact CG2-CD1 4.27Å
625	Q	23.3	Very low	31.3	Very low	50 Å²	50	86 Å²	86	23%	0.234	45%	0.45	C	S	.	.			trans	-114.5	116.2	166.6	-89.3	-156.9	-68.1	0	0	107.6	D617 S623	D617-Q625 HydrophobicContact CB-CB 3.64Å; D617-Q625 HydrophobicContact CB-CG 4.21Å; D617-Q625 PolarHBondContact OD1-NE2 3.26Å; D617-Q625 WeakPolarHBondContact OD2-CA 3.3Å; D617-Q625 WeakPolarHBondContact OD2-CB 3.19Å; D617-Q625 VanDerWaalsContact OD2-CG 3.31Å; D617-Q625 WeakPolarHBondContact OD2-CG 3.5Å; S623-Q625 PolarHBondContact O-N 3.09Å
626	L	25.7	Very low	31.4	Very low	112 Å²	112	86.1 Å²	86.1	59%	0.586	45%	0.449	S	S	*	.			trans	-132.5	82.2	-162.3	-171.5	162.1	0	0	0	107.2	D617 I624	D617-L626 PolarHBondContact OD2-N 3.28Å; I624-L626 HydrophobicContact CG2-CB 3.9Å; I624-L626 HydrophobicContact CG2-CD1 4.27Å
627	S	25.9	Very low	32.2	Very low	72 Å²	72	88 Å²	88	50%	0.503	46%	0.46	S	S	.	.	S	Bend	trans	63.8	154.5	-178.7	85.4	0	0	0	0	116.2	D617 L629	D617-S627 WeakPolarHBondContact CB-O 3.19Å; S627-L629 PolarHBondContact O-N 2.97Å
628	K	29	Very low	33.5	Very low	98 Å²	98	91.5 Å²	91.5	43%	0.426	48%	0.479	S	S	.	.			trans	6.6	94.2	162.3	-82.6	-144.3	170.4	67.4	0	117.4	H614 Q616 N630	H614-K628 VanDerWaalsContact CB-NZ 3.3Å; H614-K628 WeakPolarHBondContact O-CE 3.42Å; H614-K628 WeakPolarHBondContact O-CG 3.34Å; H614-K628 PolarHBondContact O-NZ 2.97Å; Q616-K628 HydrophobicContact CG-CG 4.36Å; Q616-K628 VanDerWaalsContact OE1-CD 3.3Å; K628-N630 PolarHBondContact O-N 2.91Å
629	L	22	Very low	34.8	Very low	113 Å²	113	91.9 Å²	91.9	59%	0.592	48%	0.481	S	S	*	.			trans	-56.4	37.7	153.2	-111.2	173.3	0	0	0	115.1	Q616 D617 S627 T631	Q616-L629 HydrophobicContact CB-CB 3.99Å; D617-L629 WeakPolarHBondContact OD1-CB 3.45Å; D617-L629 WeakPolarHBondContact OD1-CD1 3.27Å; D617-L629 VanDerWaalsContact OD1-CG 3.26Å; D617-L629 WeakPolarHBondContact OD1-CG 3.37Å; S627-L629 PolarHBondContact O-N 2.97Å; L629-T631 VanDerWaalsContact C-N 3.28Å; L629-T631 PolarHBondContact O-N 3.15Å
630	N	26.2	Very low	36.5	Very low	106 Å²	106	90.4 Å²	90.4	57%	0.567	47%	0.472	S	S	*	.			trans	-75	90.9	156.7	-103.1	27.7	0	0	0	108.6	Q616 K628	Q616-N630 PolarHBondContact NE2-OD1 3.33Å; Q616-N630 VanDerWaalsContact NE2-OD1 3.11Å; Q616-N630 PolarHBondContact OE1-OD1 3.45Å; K628-N630 PolarHBondContact O-N 2.91Å
631	T	30.2	Very low	38.6	Very low	78 Å²	78	90.2 Å²	90.2	48%	0.479	47%	0.468	S	S	.	.				58.4	94.4	127.2	58	0	0	0	0	117.4	L629	L629-T631 VanDerWaalsContact C-N 3.28Å; L629-T631 PolarHBondContact O-N 3.15Å
632	Y	28.9	Very low	40.9	Very low	200 Å²	200	85.6 Å²	85.6	78%	0.784	44%	0.435	S	S	*	.			trans	67	157.3	144.2	-44.5	-58	0	0	0	116.3
633	D	29.1	Very low	43.5	Very low	90 Å²	90	77.7 Å²	77.7	48%	0.481	40%	0.398	S	S	.	.			cis	-164.5	161.4	-27.4	-99	-22.8	0	0	0	105.1
634	N	37.9	Very low	46.2	Very low	76 Å²	76	75.8 Å²	75.8	41%	0.406	38%	0.384	S	S	.	.			trans	63.3	137.5	158.5	-43.7	-56.5	0	0	0	120.9	F636 D637	N634-F636 HydrophobicContact CB-CB 3.7Å; N634-F636 HydrophobicContact CB-CD2 4.06Å; N634-F636 HydrophobicContact CB-CG 4.33Å; N634-F636 PolarHBondContact O-N 3.04Å; N634-D637 PolarHBondContact O-N 3.2Å
635	D	48.2	Very low	48.9	Very low	71 Å²	71	72.1 Å²	72.1	38%	0.38	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-15.1	153.3	-65.5	-83.8	0	0	0	114.4	I58 D637 N638	I58-D635 WeakPolarHBondContact CD1-OD1 3.47Å; I58-D635 WeakPolarHBondContact CG1-OD1 3.47Å; D635-D637 VanDerWaalsContact C-N 3.28Å; D635-D637 PolarHBondContact O-N 3.06Å; D635-N638 PolarHBondContact O-N 2.98Å
636	F	51	Low	51.8	Low	40 Å²	40	70 Å²	70	18%	0.175	36%	0.355	C	S	.	.	H	α-helix	trans	-66.4	-25.8	-179.3	-80.5	-97.8	0	0	0	113.5	I71 P147 N634 N638 L639 F640	I71-F636 HydrophobicContact CB-CZ 4.44Å; I71-F636 HydrophobicContact CD1-CD2 4.49Å; I71-F636 HydrophobicContact CD1-CE1 3.9Å; I71-F636 HydrophobicContact CD1-CE2 3.78Å; I71-F636 HydrophobicContact CD1-CZ 3.46Å; I71-F636 VanDerWaalsContact CD1-CZ 3.46Å; I71-F636 HydrophobicContact CG1-CZ 4.49Å; I71-F636 HydrophobicContact CG2-CE1 3.8Å; I71-F636 HydrophobicContact CG2-CZ 3.91Å; P147-F636 HydrophobicContact CG-CD1 3.84Å; P147-F636 HydrophobicContact CG-CE1 4.16Å; N634-F636 HydrophobicContact CB-CB 3.7Å; N634-F636 HydrophobicContact CB-CD2 4.06Å; N634-F636 HydrophobicContact CB-CG 4.33Å; N634-F636 PolarHBondContact O-N 3.04Å; F636-N638 PolarHBondContact O-N 3.31Å; F636-L639 HydrophobicContact CD1-CD1 3.98Å; F636-L639 HydrophobicContact CE1-CD1 4.09Å; F636-L639 HydrophobicContact CG-CD1 4.42Å; F636-L639 WeakPolarHBondContact O-CA 3.05Å; F636-L639 WeakPolarHBondContact O-CB 3.23Å; F636-L639 PolarHBondContact O-N 3.04Å; F636-F640 HydrophobicContact CB-CD2 4.47Å; F636-F640 HydrophobicContact CB-CE2 3.97Å; F636-F640 WeakPolarHBondContact O-CD2 3.42Å; F636-F640 PolarHBondContact O-N 3.39Å
637	D	58	Low	54.7	Low	77 Å²	77	64.7 Å²	64.7	41%	0.412	33%	0.328	S	S	.	.	H	α-helix	trans	-66.3	-29.1	179.9	-82.4	30	0	0	0	112.2	N634 D635 F640 K641	N634-D637 PolarHBondContact O-N 3.2Å; D635-D637 VanDerWaalsContact C-N 3.28Å; D635-D637 PolarHBondContact O-N 3.06Å; D637-F640 PolarHBondContact O-N 3.48Å; D637-K641 VanDerWaalsContact O-CG 3.27Å; D637-K641 WeakPolarHBondContact O-CG 3.36Å; D637-K641 PolarHBondContact O-N 2.71Å
638	N	63	Low	57.5	Low	92 Å²	92	61.3 Å²	61.3	49%	0.492	30%	0.304	S	S	.	.	H	α-helix	trans	-72.9	-28	170.4	-66.4	-29.4	0	0	0	112.5	D635 F636 K641 I642	D635-N638 PolarHBondContact O-N 2.98Å; F636-N638 PolarHBondContact O-N 3.31Å; N638-K641 PolarHBondContact OD1-NZ 2.93Å; N638-K641 VanDerWaalsContact OD1-NZ 3.14Å; N638-I642 WeakPolarHBondContact O-CG1 3.34Å; N638-I642 PolarHBondContact O-N 2.8Å
639	L	64.7	Low	60.3	Low	55 Å²	55	56.6 Å²	56.6	29%	0.288	28%	0.283	S	S	.	.	H	α-helix	trans	-72.8	-34.8	172.6	-60.5	177.5	0	0	0	112.2	P147 S149 F636 I642	P147-L639 HydrophobicContact CB-CB 3.65Å; P147-L639 HydrophobicContact CG-CB 3.66Å; P147-L639 HydrophobicContact CG-CD1 3.96Å; P147-L639 HydrophobicContact CG-CG 4.48Å; S149-L639 PolarHBondContact OG-O 3.44Å; F636-L639 HydrophobicContact CD1-CD1 3.98Å; F636-L639 HydrophobicContact CE1-CD1 4.09Å; F636-L639 HydrophobicContact CG-CD1 4.42Å; F636-L639 WeakPolarHBondContact O-CA 3.05Å; F636-L639 WeakPolarHBondContact O-CB 3.23Å; F636-L639 PolarHBondContact O-N 3.04Å; L639-I642 HydrophobicContact CD2-CD1 4.47Å; L639-I642 PolarHBondContact O-N 3.19Å
640	F	70.6	Confident	63.3	Low	29 Å²	29	51.3 Å²	51.3	13%	0.127	26%	0.256	C	S	.	.	H	α-helix	trans	-69	-37.6	172	-63.8	-55.1	0	0	0	112	H142 N145 P147 F636 D637 I642 D643 L644	H142-F640 HydrophobicContact CB-CD1 4.49Å; H142-F640 AromaticContact CD2-CD1 3.54Å; H142-F640 AromaticContact CD2-CE1 3.9Å; H142-F640 AromaticContact CE1-CD1 3.64Å; H142-F640 AromaticContact CG-CD1 3.73Å; H142-F640 AromaticContact ND1-CD1 3.8Å; H142-F640 AromaticContact NE2-CD1 3.49Å; H142-F640 WeakPolarHBondContact NE2-CD1 3.44Å; N145-F640 HydrophobicContact CB-CZ 4.36Å; P147-F640 HydrophobicContact CB-CD1 3.69Å; P147-F640 HydrophobicContact CB-CE1 3.78Å; P147-F640 HydrophobicContact CB-CG 4.45Å; P147-F640 HydrophobicContact CG-CE1 4.23Å; P147-F640 VanDerWaalsContact N-CE1 3.34Å; F636-F640 HydrophobicContact CB-CD2 4.47Å; F636-F640 HydrophobicContact CB-CE2 3.97Å; F636-F640 WeakPolarHBondContact O-CD2 3.42Å; F636-F640 PolarHBondContact O-N 3.39Å; D637-F640 PolarHBondContact O-N 3.48Å; F640-I642 VanDerWaalsContact C-N 3.34Å; F640-I642 PolarHBondContact O-N 3.01Å; F640-D643 WeakPolarHBondContact O-CB 3.23Å; F640-D643 PolarHBondContact O-N 3.37Å; F640-L644 PolarHBondContact O-N 3.29Å
641	K	74.1	Confident	66.2	Low	69 Å²	69	46.4 Å²	46.4	30%	0.3	23%	0.229	S	C	.	.	H	α-helix	trans	-59.6	-39.1	171.8	-74.2	171.4	-165.6	169	0	113.1	D637 N638 D643 L644 E645 L717	D637-K641 VanDerWaalsContact O-CG 3.27Å; D637-K641 WeakPolarHBondContact O-CG 3.36Å; D637-K641 PolarHBondContact O-N 2.71Å; N638-K641 PolarHBondContact OD1-NZ 2.93Å; N638-K641 VanDerWaalsContact OD1-NZ 3.14Å; K641-D643 VanDerWaalsContact C-N 3.27Å; K641-D643 PolarHBondContact O-N 3.43Å; K641-L644 WeakPolarHBondContact O-CB 3.22Å; K641-L644 PolarHBondContact O-N 2.82Å; K641-L644 VanDerWaalsContact O-N 3.16Å; K641-E645 PolarHBondContact O-N 3.23Å; K641-E645 VanDerWaalsContact O-N 3.12Å; K641-L717 HydrophobicContact CB-CD1 4.01Å; K641-L717 HydrophobicContact CD-CD1 3.9Å; K641-L717 HydrophobicContact CG-CB 4.25Å; K641-L717 HydrophobicContact CG-CD1 3.81Å
642	I	76.6	Confident	68.9	Low	43 Å²	43	42.7 Å²	42.7	22%	0.221	21%	0.207	C	C	.	.	H	α-helix	trans	-62.7	-31.8	176.9	-72.4	165.2	0	0	0	112.2	N638 L639 F640 S646	N638-I642 WeakPolarHBondContact O-CG1 3.34Å; N638-I642 PolarHBondContact O-N 2.8Å; L639-I642 HydrophobicContact CD2-CD1 4.47Å; L639-I642 PolarHBondContact O-N 3.19Å; F640-I642 VanDerWaalsContact C-N 3.34Å; F640-I642 PolarHBondContact O-N 3.01Å; I642-S646 VanDerWaalsContact O-CB 3.29Å; I642-S646 WeakPolarHBondContact O-CB 3.15Å; I642-S646 PolarHBondContact O-N 3.21Å; I642-S646 PolarHBondContact O-OG 3.49Å
643	D	79	Confident	71.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-68.2	-38.3	174.7	-74.6	-22.8	0	0	0	112.2	I138 H142 H148 S149 F640 K641 S646 L647	I138-D643 HydrophobicContact CD1-CB 4.17Å; I138-D643 HydrophobicContact CG2-CB 4.23Å; H142-D643 IonicContact CD2-OD2 2.61Å; H142-D643 IonicContact CE1-OD2 2.82Å; H142-D643 IonicContact NE2-OD2 2.71Å; H142-D643 PolarHBondContact NE2-OD2 2.84Å; H148-D643 WeakPolarHBondContact CB-OD1 3.35Å; H148-D643 PolarHBondContact N-OD2 3.15Å; S149-D643 WeakPolarHBondContact CA-OD1 3.38Å; S149-D643 PolarHBondContact N-OD1 3.31Å; F640-D643 WeakPolarHBondContact O-CB 3.23Å; F640-D643 PolarHBondContact O-N 3.37Å; K641-D643 VanDerWaalsContact C-N 3.27Å; K641-D643 PolarHBondContact O-N 3.43Å; D643-S646 WeakPolarHBondContact O-CB 3.45Å; D643-S646 PolarHBondContact O-N 2.71Å; D643-L647 WeakPolarHBondContact O-CG 2.94Å; D643-L647 PolarHBondContact O-N 2.85Å
644	L	80.9	Confident	74.3	Confident	5 Å²	5	29.1 Å²	29.1	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-65.4	-47.5	177	-77.8	150.2	0	0	0	112.4	F640 K641 S646 L647 A648 P718 V720 F723	F640-L644 PolarHBondContact O-N 3.29Å; K641-L644 WeakPolarHBondContact O-CB 3.22Å; K641-L644 PolarHBondContact O-N 2.82Å; K641-L644 VanDerWaalsContact O-N 3.16Å; L644-S646 VanDerWaalsContact C-N 3.26Å; L644-S646 PolarHBondContact O-N 3.43Å; L644-L647 WeakPolarHBondContact O-CB 3.42Å; L644-L647 PolarHBondContact O-N 3.41Å; L644-A648 PolarHBondContact O-N 2.68Å; L644-P718 WeakPolarHBondContact CD1-O 3.15Å; L644-P718 WeakPolarHBondContact CD2-O 3.4Å; L644-V720 HydrophobicContact CD1-CG2 4.2Å; L644-V720 HydrophobicContact CD2-CB 4.34Å; L644-V720 HydrophobicContact CD2-CG2 3.6Å; L644-V720 HydrophobicContact CG-CG2 3.63Å; L644-F723 HydrophobicContact CD2-CB 3.56Å; L644-F723 HydrophobicContact CD2-CD1 4.34Å; L644-F723 HydrophobicContact CD2-CD2 4.27Å; L644-F723 HydrophobicContact CD2-CG 3.82Å
645	E	83	Confident	76.4	Confident	39 Å²	39	25.9 Å²	25.9	18%	0.182	13%	0.131	C	C	.	.	H	α-helix	trans	-60.7	-38	172.8	-68.5	-171.8	133.7	0	0	111.7	K641 A648 C649 H670 V674 V699 L717	K641-E645 PolarHBondContact O-N 3.23Å; K641-E645 VanDerWaalsContact O-N 3.12Å; E645-A648 PolarHBondContact O-N 3.24Å; E645-C649 PolarHBondContact O-N 3.32Å; E645-C649 PolarHBondContact O-SG 3.28Å; E645-H670 IonicContact OE2-CD2 2.71Å; E645-H670 IonicContact OE2-CE1 3.75Å; E645-H670 IonicContact OE2-NE2 3.39Å; E645-H670 PolarHBondContact OE2-NE2 3.46Å; E645-V674 HydrophobicContact CB-CG2 3.99Å; E645-V699 HydrophobicContact CB-CG1 4.43Å; E645-V699 HydrophobicContact CG-CG1 4.04Å; E645-L717 HydrophobicContact CG-CD2 4.19Å
646	S	84	Confident	78.1	Confident	4 Å²	4	22.5 Å²	22.5	3%	0.028	11%	0.112	C	C	.	.	H	α-helix	trans	-67.2	-36.3	176.5	-62.1	0	0	0	0	113.1	I642 D643 L644 L650 H670	I642-S646 VanDerWaalsContact O-CB 3.29Å; I642-S646 WeakPolarHBondContact O-CB 3.15Å; I642-S646 PolarHBondContact O-N 3.21Å; I642-S646 PolarHBondContact O-OG 3.49Å; D643-S646 WeakPolarHBondContact O-CB 3.45Å; D643-S646 PolarHBondContact O-N 2.71Å; L644-S646 VanDerWaalsContact C-N 3.26Å; L644-S646 PolarHBondContact O-N 3.43Å; S646-L650 WeakPolarHBondContact O-CB 3.45Å; S646-L650 PolarHBondContact O-N 3.15Å; S646-H670 PolarHBondContact OG-CE1 3Å
647	L	86.5	Confident	79.6	Confident	2 Å²	2	22 Å²	22	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-65.5	-46.2	172.7	-81.7	167.5	0	0	0	111.3	A134 I135 I138 M151 D643 L644 C649 L650 I651 V720 F723	A134-L647 HydrophobicContact CB-CD2 4.38Å; I135-L647 HydrophobicContact CG1-CD1 4.39Å; I135-L647 HydrophobicContact CG1-CD2 3.93Å; I138-L647 HydrophobicContact CD1-CD1 4.37Å; I138-L647 HydrophobicContact CD1-CG 4.34Å; M151-L647 HydrophobicContact CE-CD2 3.73Å; M151-L647 HydrophobicContact CE-CG 4.49Å; M151-L647 HydrophobicContact SD-CD2 3.57Å; M151-L647 VanDerWaalsContact SD-CD2 3.57Å; M151-L647 HydrophobicContact SD-CG 3.82Å; D643-L647 WeakPolarHBondContact O-CG 2.94Å; D643-L647 PolarHBondContact O-N 2.85Å; L644-L647 WeakPolarHBondContact O-CB 3.42Å; L644-L647 PolarHBondContact O-N 3.41Å; L647-C649 VanDerWaalsContact C-N 3.35Å; L647-C649 PolarHBondContact O-N 2.97Å; L647-L650 WeakPolarHBondContact O-CB 3.46Å; L647-L650 PolarHBondContact O-N 3.26Å; L647-L650 VanDerWaalsContact O-N 3.16Å; L647-I651 WeakPolarHBondContact O-CG1 3.5Å; L647-I651 PolarHBondContact O-N 2.87Å; L647-V720 HydrophobicContact CD1-CG1 4.11Å; L647-V720 HydrophobicContact CD1-CG2 4.37Å; L647-F723 HydrophobicContact CB-CD1 4.48Å; L647-F723 HydrophobicContact CB-CE1 3.77Å; L647-F723 HydrophobicContact CB-CZ 4.27Å; L647-F723 HydrophobicContact CD1-CD1 4.32Å; L647-F723 HydrophobicContact CD1-CE1 4.37Å
648	A	84.9	Confident	80.4	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62	-41.5	176.3	0	0	0	0	0	112	L644 E645 L650 I651 V652 V699 L700 F723	L644-A648 PolarHBondContact O-N 2.68Å; E645-A648 PolarHBondContact O-N 3.24Å; A648-L650 PolarHBondContact O-N 3.45Å; A648-I651 PolarHBondContact O-N 2.87Å; A648-V652 PolarHBondContact O-N 3.44Å; A648-V699 HydrophobicContact CB-CB 3.82Å; A648-V699 HydrophobicContact CB-CG1 3.58Å; A648-V699 HydrophobicContact CB-CG2 4.49Å; A648-L700 HydrophobicContact CB-CD1 4.44Å; A648-L700 HydrophobicContact CB-CD2 4.14Å; A648-L700 HydrophobicContact CB-CG 4.06Å; A648-F723 HydrophobicContact CB-CE2 4.35Å; A648-F723 HydrophobicContact CB-CZ 4.16Å
649	C	86.9	Confident	81.1	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60	-44.3	171.9	-66.5	0	0	0	0	112	E645 L647 I651 V652 E653 R673 A677	E645-C649 PolarHBondContact O-N 3.32Å; E645-C649 PolarHBondContact O-SG 3.28Å; L647-C649 VanDerWaalsContact C-N 3.35Å; L647-C649 PolarHBondContact O-N 2.97Å; C649-I651 VanDerWaalsContact C-N 3.28Å; C649-I651 PolarHBondContact O-N 3.12Å; C649-V652 PolarHBondContact O-N 2.9Å; C649-E653 WeakPolarHBondContact O-CB 3.14Å; C649-E653 VanDerWaalsContact O-CG 3.23Å; C649-E653 WeakPolarHBondContact O-CG 3.26Å; C649-E653 PolarHBondContact O-N 2.7Å; C649-R673 HydrophobicContact CB-CG 4.23Å; C649-A677 HydrophobicContact CB-CB 4.35Å
650	L	86.3	Confident	81.5	Confident	2 Å²	2	20.1 Å²	20.1	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-59.4	-38.4	178.7	-168.6	80.4	0	0	0	112.1	L110 A134 L153 I156 S646 L647 A648 E653 L654	L110-L650 HydrophobicContact CD1-CD1 4.4Å; A134-L650 HydrophobicContact CB-CD2 4.19Å; L153-L650 HydrophobicContact CD2-CD1 3.71Å; I156-L650 HydrophobicContact CD1-CD1 3.69Å; I156-L650 HydrophobicContact CD1-CD2 3.63Å; I156-L650 HydrophobicContact CD1-CG 4.33Å; S646-L650 WeakPolarHBondContact O-CB 3.45Å; S646-L650 PolarHBondContact O-N 3.15Å; L647-L650 WeakPolarHBondContact O-CB 3.46Å; L647-L650 PolarHBondContact O-N 3.26Å; L647-L650 VanDerWaalsContact O-N 3.16Å; A648-L650 PolarHBondContact O-N 3.45Å; L650-E653 PolarHBondContact O-N 2.84Å; L650-L654 HydrophobicContact CD2-CD1 4.19Å; L650-L654 HydrophobicContact CG-CD1 3.94Å; L650-L654 HydrophobicContact CG-CG 4.42Å; L650-L654 VanDerWaalsContact O-CB 3.3Å; L650-L654 WeakPolarHBondContact O-CB 3.18Å; L650-L654 VanDerWaalsContact O-CG 3.25Å; L650-L654 WeakPolarHBondContact O-CG 3.25Å; L650-L654 PolarHBondContact O-N 3.11Å
651	I	85.9	Confident	81.6	Confident	2 Å²	2	24.6 Å²	24.6	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-67.8	-43.8	179.1	-65.3	162.1	0	0	0	111.2	T131 L647 A648 C649 L654 S655 L692 I696 F723 I727	T131-I651 HydrophobicContact CG2-CG1 3.79Å; L647-I651 WeakPolarHBondContact O-CG1 3.5Å; L647-I651 PolarHBondContact O-N 2.87Å; A648-I651 PolarHBondContact O-N 2.87Å; C649-I651 VanDerWaalsContact C-N 3.28Å; C649-I651 PolarHBondContact O-N 3.12Å; I651-L654 PolarHBondContact O-N 3.41Å; I651-S655 WeakPolarHBondContact O-CB 3.31Å; I651-S655 PolarHBondContact O-N 3.23Å; I651-S655 PolarHBondContact O-OG 3.45Å; I651-L692 HydrophobicContact CG2-CB 4.15Å; I651-L692 HydrophobicContact CG2-CD1 3.4Å; I651-L692 VanDerWaalsContact CG2-CD1 3.4Å; I651-L692 HydrophobicContact CG2-CG 4.32Å; I651-I696 HydrophobicContact CB-CD1 4.29Å; I651-I696 HydrophobicContact CB-CG1 4.45Å; I651-I696 HydrophobicContact CG2-CD1 3.52Å; I651-I696 HydrophobicContact CG2-CG1 4.06Å; I651-F723 HydrophobicContact CD1-CE1 3.93Å; I651-F723 HydrophobicContact CD1-CZ 3.74Å; I651-I727 HydrophobicContact CD1-CD1 3.44Å; I651-I727 VanDerWaalsContact CD1-CD1 3.44Å
652	V	86.8	Confident	81.4	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.006	12%	0.12	C	C	.	.	H	α-helix	trans	-64	-43.5	175.7	178.6	0	0	0	0	110.4	A648 C649 S655 L656 A677 Q680 A681 I688 I696 L700	A648-V652 PolarHBondContact O-N 3.44Å; C649-V652 PolarHBondContact O-N 2.9Å; V652-S655 PolarHBondContact O-N 3.01Å; V652-L656 HydrophobicContact CG1-CD1 3.72Å; V652-L656 HydrophobicContact CG1-CG 4.31Å; V652-L656 WeakPolarHBondContact O-CB 3.34Å; V652-L656 WeakPolarHBondContact O-CG 3.48Å; V652-L656 PolarHBondContact O-N 3.07Å; V652-A677 HydrophobicContact CB-CB 4.37Å; V652-A677 HydrophobicContact CG1-CB 4.42Å; V652-Q680 HydrophobicContact CG1-CB 4.44Å; V652-A681 HydrophobicContact CG1-CB 4.38Å; V652-A681 HydrophobicContact CG2-CB 4.18Å; V652-I688 HydrophobicContact CG2-CD1 4.29Å; V652-I696 HydrophobicContact CG2-CD1 4.12Å; V652-I696 HydrophobicContact CG2-CG2 4.02Å; V652-L700 HydrophobicContact CG2-CD1 3.94Å
653	E	87	Confident	80.9	Confident	4 Å²	4	22.2 Å²	22.2	2%	0.019	13%	0.125	C	C	.	.	H	α-helix	trans	-57.8	-47.7	174.7	-75.6	164.3	-177.1	0	0	112.5	L153 C649 L650 S655 F657 Y662 R673	L153-E653 HydrophobicContact CD1-CB 4.35Å; L153-E653 HydrophobicContact CD1-CG 4.46Å; L153-E653 HydrophobicContact CD2-CB 4.37Å; C649-E653 WeakPolarHBondContact O-CB 3.14Å; C649-E653 VanDerWaalsContact O-CG 3.23Å; C649-E653 WeakPolarHBondContact O-CG 3.26Å; C649-E653 PolarHBondContact O-N 2.7Å; L650-E653 PolarHBondContact O-N 2.84Å; E653-S655 VanDerWaalsContact C-N 3.35Å; E653-F657 PolarHBondContact O-N 3.08Å; E653-Y662 HydrophobicContact CB-CD1 4.43Å; E653-Y662 HydrophobicContact CB-CE1 4.4Å; E653-Y662 HydrophobicContact CB-CE2 4.49Å; E653-Y662 HydrophobicContact CG-CD1 3.64Å; E653-Y662 HydrophobicContact CG-CE1 3.64Å; E653-Y662 HydrophobicContact CG-CG 4.14Å; E653-R673 VanDerWaalsContact CD-NH2 3.31Å; E653-R673 IonicContact OE1-CZ 2.71Å; E653-R673 IonicContact OE1-NE 2.77Å; E653-R673 PolarHBondContact OE1-NE 3Å; E653-R673 IonicContact OE1-NH2 3.72Å; E653-R673 PolarHBondContact OE1-NH2 2.99Å; E653-R673 VanDerWaalsContact OE1-NH2 3.14Å; E653-R673 IonicContact OE2-CZ 3.84Å; E653-R673 IonicContact OE2-NE 3.37Å; E653-R673 IonicContact OE2-NH2 3.96Å; E653-R673 PolarHBondContact OE2-NH2 3.41Å
654	L	84.1	Confident	80.3	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-70.1	-28.3	179.3	-75.3	170.7	0	0	0	113.2	L110 I114 L121 L127 T131 L650 I651 F657	L110-L654 HydrophobicContact CD1-CD1 4.45Å; L110-L654 HydrophobicContact CD1-CD2 4.31Å; L110-L654 HydrophobicContact CD2-CD2 4.14Å; I114-L654 HydrophobicContact CD1-CD2 4.36Å; L121-L654 HydrophobicContact CD1-CD2 4.02Å; L127-L654 HydrophobicContact CD1-CB 4.42Å; L127-L654 WeakPolarHBondContact CD1-O 3.5Å; L127-L654 HydrophobicContact CG-CB 4.3Å; T131-L654 HydrophobicContact CG2-CD1 3.85Å; L650-L654 HydrophobicContact CD2-CD1 4.19Å; L650-L654 HydrophobicContact CG-CD1 3.94Å; L650-L654 HydrophobicContact CG-CG 4.42Å; L650-L654 VanDerWaalsContact O-CB 3.3Å; L650-L654 WeakPolarHBondContact O-CB 3.18Å; L650-L654 VanDerWaalsContact O-CG 3.25Å; L650-L654 WeakPolarHBondContact O-CG 3.25Å; L650-L654 PolarHBondContact O-N 3.11Å; I651-L654 PolarHBondContact O-N 3.41Å; L654-F657 WeakPolarHBondContact O-CD1 3.46Å
655	S	83.3	Confident	79.5	Confident	7 Å²	7	28.5 Å²	28.5	5%	0.049	16%	0.155	C	C	.	.	H	α-helix	trans	-81.2	-42.5	178.9	-55.7	0	0	0	0	112.2	I651 V652 E653	I651-S655 WeakPolarHBondContact O-CB 3.31Å; I651-S655 PolarHBondContact O-N 3.23Å; I651-S655 PolarHBondContact O-OG 3.45Å; V652-S655 PolarHBondContact O-N 3.01Å; E653-S655 VanDerWaalsContact C-N 3.35Å
656	L	84	Confident	78.6	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-95.1	6.7	-173.6	-56.4	-176.7	0	0	0	114	V652 S658 I659 V660 Y662 Q680 H684 K687 I688	V652-L656 HydrophobicContact CG1-CD1 3.72Å; V652-L656 HydrophobicContact CG1-CG 4.31Å; V652-L656 WeakPolarHBondContact O-CB 3.34Å; V652-L656 WeakPolarHBondContact O-CG 3.48Å; V652-L656 PolarHBondContact O-N 3.07Å; L656-S658 PolarHBondContact O-N 3.48Å; L656-I659 PolarHBondContact O-N 3.35Å; L656-V660 HydrophobicContact CB-CG2 4.27Å; L656-V660 PolarHBondContact O-N 3.32Å; L656-Y662 HydrophobicContact CB-CE2 4.14Å; L656-Q680 HydrophobicContact CD1-CB 3.69Å; L656-Q680 WeakPolarHBondContact CD1-O 3.41Å; L656-H684 HydrophobicContact CD1-CB 4Å; L656-H684 HydrophobicContact CD2-CB 3.6Å; L656-H684 HydrophobicContact CG-CB 4.47Å; L656-K687 HydrophobicContact CD2-CB 3.59Å; L656-I688 HydrophobicContact CD2-CG1 4.35Å
657	F	82.6	Confident	77.9	Confident	29 Å²	29	35.6 Å²	35.6	13%	0.127	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-22.5	179.3	81	-75.4	0	0	0	115.6	I114 P118 L121 Q122 E653 L654	I114-F657 HydrophobicContact CD1-CB 4.3Å; I114-F657 HydrophobicContact CG1-CB 4.16Å; I114-F657 HydrophobicContact CG2-CB 4.09Å; P118-F657 HydrophobicContact CB-CD2 3.91Å; P118-F657 HydrophobicContact CB-CE2 3.66Å; P118-F657 VanDerWaalsContact O-CE2 3.25Å; P118-F657 WeakPolarHBondContact O-CE2 3.45Å; L121-F657 HydrophobicContact CB-CD2 4.49Å; L121-F657 HydrophobicContact CB-CE1 4.05Å; L121-F657 HydrophobicContact CB-CE2 3.97Å; L121-F657 HydrophobicContact CB-CZ 3.7Å; Q122-F657 HydrophobicContact CG-CZ 4.47Å; E653-F657 PolarHBondContact O-N 3.08Å; L654-F657 WeakPolarHBondContact O-CD1 3.46Å
658	S	75.2	Confident	77.2	Confident	90 Å²	90	39.1 Å²	39.1	63%	0.629	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-8.2	-179.9	59.1	0	0	0	0	114.1	L656	L656-S658 PolarHBondContact O-N 3.48Å
659	I	77	Confident	76.6	Confident	78 Å²	78	42.1 Å²	42.1	40%	0.4	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122	-42.3	-174.7	-57.7	173.5	0	0	0	110.6	L656 K687	L656-I659 PolarHBondContact O-N 3.35Å; I659-K687 HydrophobicContact CD1-CB 4.17Å; I659-K687 HydrophobicContact CD1-CD 4.17Å; I659-K687 HydrophobicContact CD1-CG 3.67Å
660	V	72.2	Confident	76.2	Confident	17 Å²	17	44.6 Å²	44.6	10%	0.103	24%	0.239	C	C	.	.	S	Bend	trans	-110.2	127	-172.6	-178	0	0	0	0	110.1	L656 Y662 F676 Q680	L656-V660 HydrophobicContact CB-CG2 4.27Å; L656-V660 PolarHBondContact O-N 3.32Å; V660-Y662 HydrophobicContact CB-CD2 4.26Å; V660-Y662 HydrophobicContact CB-CE2 3.62Å; V660-Y662 HydrophobicContact CG1-CD1 4.39Å; V660-Y662 HydrophobicContact CG1-CD2 4.32Å; V660-Y662 HydrophobicContact CG1-CE1 3.97Å; V660-Y662 HydrophobicContact CG1-CE2 3.88Å; V660-Y662 WeakPolarHBondContact O-CD2 3.48Å; V660-Y662 PolarHBondContact O-N 2.96Å; V660-Y662 VanDerWaalsContact O-N 3.15Å; V660-F676 HydrophobicContact CG1-CE1 3.67Å; V660-F676 HydrophobicContact CG1-CZ 3.71Å; V660-Q680 HydrophobicContact CG1-CG 4.28Å; V660-Q680 HydrophobicContact CG2-CG 4.18Å
661	N	72.5	Confident	75.5	Confident	124 Å²	124	46.3 Å²	46.3	66%	0.663	26%	0.257	S	S	*	.			trans	-83.5	89	-178.6	-177.9	18	0	0	0	111.5	V663	N661-V663 PolarHBondContact O-N 2.75Å; N661-V663 WeakPolarHBondContact OD1-CB 3.45Å; N661-V663 WeakPolarHBondContact OD1-CG2 3.28Å; N661-V663 PolarHBondContact OD1-N 3.24Å
662	Y	71.5	Confident	75.2	Confident	8 Å²	8	51.4 Å²	51.4	3%	0.031	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-70.1	11.9	-177.5	-68.4	-77.8	0	0	0	115.8	E653 L656 V660 E664 V665 F676	E653-Y662 HydrophobicContact CB-CD1 4.43Å; E653-Y662 HydrophobicContact CB-CE1 4.4Å; E653-Y662 HydrophobicContact CB-CE2 4.49Å; E653-Y662 HydrophobicContact CG-CD1 3.64Å; E653-Y662 HydrophobicContact CG-CE1 3.64Å; E653-Y662 HydrophobicContact CG-CG 4.14Å; L656-Y662 HydrophobicContact CB-CE2 4.14Å; V660-Y662 HydrophobicContact CB-CD2 4.26Å; V660-Y662 HydrophobicContact CB-CE2 3.62Å; V660-Y662 HydrophobicContact CG1-CD1 4.39Å; V660-Y662 HydrophobicContact CG1-CD2 4.32Å; V660-Y662 HydrophobicContact CG1-CE1 3.97Å; V660-Y662 HydrophobicContact CG1-CE2 3.88Å; V660-Y662 WeakPolarHBondContact O-CD2 3.48Å; V660-Y662 PolarHBondContact O-N 2.96Å; V660-Y662 VanDerWaalsContact O-N 3.15Å; Y662-E664 PolarHBondContact O-N 3.06Å; Y662-V665 HydrophobicContact CD1-CG2 3.7Å; Y662-V665 HydrophobicContact CG-CG2 4.47Å; Y662-V665 PolarHBondContact O-N 3.29Å; Y662-F676 HydrophobicContact CD1-CE1 4.35Å; Y662-F676 HydrophobicContact CE1-CD1 4.2Å; Y662-F676 AromaticContact CE1-CE1 3.79Å; Y662-F676 HydrophobicContact CE1-CE1 3.79Å
663	V	65.2	Low	75	Confident	54 Å²	54	51.8 Å²	51.8	33%	0.327	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-60.7	-27.6	-177	160.1	0	0	0	0	114.1	Y111 N661	Y111-V663 HydrophobicContact CE2-CG2 4.44Å; N661-V663 PolarHBondContact O-N 2.75Å; N661-V663 WeakPolarHBondContact OD1-CB 3.45Å; N661-V663 WeakPolarHBondContact OD1-CG2 3.28Å; N661-V663 PolarHBondContact OD1-N 3.24Å
664	E	66.5	Low	74.8	Confident	127 Å²	127	51.7 Å²	51.7	59%	0.593	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-89.7	-16.5	-177.2	-62.3	-174.4	173.1	0	0	114.1	Y662 N666 N667 W668	Y662-E664 PolarHBondContact O-N 3.06Å; E664-N666 PolarHBondContact O-N 3.47Å; E664-N666 VanDerWaalsContact O-N 3.13Å; E664-N667 WeakPolarHBondContact O-CB 3.31Å; E664-N667 PolarHBondContact O-N 2.92Å; E664-W668 HydrophobicContact CB-CZ2 4.45Å
665	V	64.7	Low	74.6	Confident	9 Å²	9	56.1 Å²	56.1	6%	0.055	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-65.4	-23.1	-169.2	-179.5	0	0	0	0	113.8	Y662 N667 W668 R673	Y662-V665 HydrophobicContact CD1-CG2 3.7Å; Y662-V665 HydrophobicContact CG-CG2 4.47Å; Y662-V665 PolarHBondContact O-N 3.29Å; V665-N667 PolarHBondContact O-N 2.79Å; V665-N667 VanDerWaalsContact O-N 3.13Å; V665-W668 HydrophobicContact CB-CD2 4.42Å; V665-W668 HydrophobicContact CB-CE3 4Å; V665-W668 HydrophobicContact CB-CZ3 4.15Å; V665-W668 HydrophobicContact CG1-CE3 3.81Å; V665-W668 HydrophobicContact CG1-CZ3 4.17Å; V665-W668 HydrophobicContact CG2-CD2 4.28Å; V665-W668 HydrophobicContact CG2-CE3 3.68Å; V665-W668 HydrophobicContact CG2-CH2 3.64Å; V665-W668 HydrophobicContact CG2-CZ2 4.23Å; V665-W668 HydrophobicContact CG2-CZ3 3.31Å; V665-W668 PolarHBondContact O-N 3.18Å; V665-R673 HydrophobicContact CG1-CB 4.34Å; V665-R673 HydrophobicContact CG1-CG 3.74Å
666	N	64.1	Low	74.6	Confident	46 Å²	46	58.3 Å²	58.3	25%	0.246	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-61.8	-17.4	173.5	-79.7	-32.6	0	0	0	113.9	D154 E664	D154-N666 PolarHBondContact OD1-ND2 3.01Å; E664-N666 PolarHBondContact O-N 3.47Å; E664-N666 VanDerWaalsContact O-N 3.13Å
667	N	68.3	Low	74.5	Confident	146 Å²	146	58.4 Å²	58.4	78%	0.781	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-95.1	-9.9	178.7	-64.6	-20.5	0	0	0	113.9	E664 V665	E664-N667 WeakPolarHBondContact O-CB 3.31Å; E664-N667 PolarHBondContact O-N 2.92Å; V665-N667 PolarHBondContact O-N 2.79Å; V665-N667 VanDerWaalsContact O-N 3.13Å
668	W	71.3	Confident	74.5	Confident	77 Å²	77	59.2 Å²	59.2	29%	0.292	32%	0.318	S	S	.	.	S	Bend	trans	-85.3	152	-174.2	-61.8	-14.9	0	0	0	112.2	E664 V665 E672 F676	E664-W668 HydrophobicContact CB-CZ2 4.45Å; V665-W668 HydrophobicContact CB-CD2 4.42Å; V665-W668 HydrophobicContact CB-CE3 4Å; V665-W668 HydrophobicContact CB-CZ3 4.15Å; V665-W668 HydrophobicContact CG1-CE3 3.81Å; V665-W668 HydrophobicContact CG1-CZ3 4.17Å; V665-W668 HydrophobicContact CG2-CD2 4.28Å; V665-W668 HydrophobicContact CG2-CE3 3.68Å; V665-W668 HydrophobicContact CG2-CH2 3.64Å; V665-W668 HydrophobicContact CG2-CZ2 4.23Å; V665-W668 HydrophobicContact CG2-CZ3 3.31Å; V665-W668 PolarHBondContact O-N 3.18Å; W668-E672 HydrophobicContact CB-CB 4.01Å; W668-E672 HydrophobicContact CG-CB 4.49Å; W668-F676 HydrophobicContact CE3-CB 4.23Å; W668-F676 HydrophobicContact CE3-CG 4.46Å; W668-F676 HydrophobicContact CH2-CB 4.15Å; W668-F676 AromaticContact CH2-CD1 3.68Å; W668-F676 HydrophobicContact CH2-CD1 3.68Å; W668-F676 AromaticContact CH2-CD2 3.61Å; W668-F676 HydrophobicContact CH2-CD2 3.61Å; W668-F676 AromaticContact CH2-CE1 3.81Å; W668-F676 HydrophobicContact CH2-CE1 3.81Å; W668-F676 AromaticContact CH2-CE2 3.77Å; W668-F676 HydrophobicContact CH2-CE2 3.77Å; W668-F676 AromaticContact CH2-CG 3.55Å; W668-F676 HydrophobicContact CH2-CG 3.55Å; W668-F676 AromaticContact CH2-CZ 3.86Å; W668-F676 HydrophobicContact CH2-CZ 3.86Å; W668-F676 HydrophobicContact CZ3-CB 3.5Å; W668-F676 AromaticContact CZ3-CD1 3.41Å; W668-F676 HydrophobicContact CZ3-CD1 3.41Å; W668-F676 VanDerWaalsContact CZ3-CD1 3.41Å; W668-F676 AromaticContact CZ3-CD2 3.88Å; W668-F676 HydrophobicContact CZ3-CD2 3.88Å; W668-F676 AromaticContact CZ3-CE1 3.98Å; W668-F676 HydrophobicContact CZ3-CE1 3.98Å; W668-F676 HydrophobicContact CZ3-CE2 4.41Å; W668-F676 AromaticContact CZ3-CG 3.32Å; W668-F676 HydrophobicContact CZ3-CG 3.32Å; W668-F676 HydrophobicContact CZ3-CZ 4.45Å
669	S	74.1	Confident	74.8	Confident	62 Å²	62	59.3 Å²	59.3	43%	0.434	31%	0.311	S	S	.	.			trans	-65.7	160	166.1	68.2	0	0	0	0	111.1	G671 E672 R673	S669-G671 VanDerWaalsContact C-N 3.31Å; S669-G671 PolarHBondContact O-N 3.37Å; S669-E672 VanDerWaalsContact CB-OE2 3.22Å; S669-E672 WeakPolarHBondContact CB-OE2 3.46Å; S669-E672 PolarHBondContact N-OE2 2.94Å; S669-E672 PolarHBondContact O-N 3.14Å; S669-E672 VanDerWaalsContact OG-CD 3.28Å; S669-E672 VanDerWaalsContact OG-CG 3.29Å; S669-E672 WeakPolarHBondContact OG-CG 3.37Å; S669-E672 PolarHBondContact OG-N 3.38Å; S669-E672 PolarHBondContact OG-OE2 3.49Å; S669-R673 PolarHBondContact O-N 3.23Å
670	H	76.8	Confident	75.1	Confident	52 Å²	52	56.7 Å²	56.7	24%	0.241	30%	0.297	C	S	.	.	H	α-helix	trans	-57.6	-42.9	179.7	-177.7	69.1	0	0	0	112.1	E645 S646 R673 V674	E645-H670 IonicContact OE2-CD2 2.71Å; E645-H670 IonicContact OE2-CE1 3.75Å; E645-H670 IonicContact OE2-NE2 3.39Å; E645-H670 PolarHBondContact OE2-NE2 3.46Å; S646-H670 PolarHBondContact OG-CE1 3Å; H670-R673 PolarHBondContact O-N 3.44Å; H670-V674 WeakPolarHBondContact O-CG2 3.32Å; H670-V674 PolarHBondContact O-N 2.86Å
671	G	73.3	Confident	75.6	Confident	38 Å²	38	55.9 Å²	55.9	39%	0.392	29%	0.292	S	S	.	.	H	α-helix	trans	-65	-39.3	176.8	0	0	0	0	0	113.9	S669 V674 N675	S669-G671 VanDerWaalsContact C-N 3.31Å; S669-G671 PolarHBondContact O-N 3.37Å; G671-V674 PolarHBondContact O-N 3.01Å; G671-N675 WeakPolarHBondContact O-CB 3.48Å; G671-N675 VanDerWaalsContact O-CG 3.3Å; G671-N675 PolarHBondContact O-N 3.38Å; G671-N675 PolarHBondContact O-ND2 3.06Å
672	E	78.8	Confident	75.8	Confident	109 Å²	109	55 Å²	55	51%	0.509	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-42.3	173.6	-73.7	165.1	128.4	0	0	111.5	W668 S669 N675 F676	W668-E672 HydrophobicContact CB-CB 4.01Å; W668-E672 HydrophobicContact CG-CB 4.49Å; S669-E672 VanDerWaalsContact CB-OE2 3.22Å; S669-E672 WeakPolarHBondContact CB-OE2 3.46Å; S669-E672 PolarHBondContact N-OE2 2.94Å; S669-E672 PolarHBondContact O-N 3.14Å; S669-E672 VanDerWaalsContact OG-CD 3.28Å; S669-E672 VanDerWaalsContact OG-CG 3.29Å; S669-E672 WeakPolarHBondContact OG-CG 3.37Å; S669-E672 PolarHBondContact OG-N 3.38Å; S669-E672 PolarHBondContact OG-OE2 3.49Å; E672-N675 PolarHBondContact O-N 3.36Å; E672-F676 WeakPolarHBondContact O-CB 3.25Å; E672-F676 PolarHBondContact O-N 3.16Å
673	R	83.3	Confident	76.2	Confident	9 Å²	9	59.7 Å²	59.7	3%	0.034	30%	0.304	C	S	.	.	H	α-helix	trans	-62.1	-46.5	176.1	-179.3	176.4	177.6	-128.7	2.9	112.1	M151 C649 E653 V665 S669 H670 F676 A677	M151-R673 PolarHBondContact O-NH1 3.05Å; C649-R673 HydrophobicContact CB-CG 4.23Å; E653-R673 VanDerWaalsContact CD-NH2 3.31Å; E653-R673 IonicContact OE1-CZ 2.71Å; E653-R673 IonicContact OE1-NE 2.77Å; E653-R673 PolarHBondContact OE1-NE 3Å; E653-R673 IonicContact OE1-NH2 3.72Å; E653-R673 PolarHBondContact OE1-NH2 2.99Å; E653-R673 VanDerWaalsContact OE1-NH2 3.14Å; E653-R673 IonicContact OE2-CZ 3.84Å; E653-R673 IonicContact OE2-NE 3.37Å; E653-R673 IonicContact OE2-NH2 3.96Å; E653-R673 PolarHBondContact OE2-NH2 3.41Å; V665-R673 HydrophobicContact CG1-CB 4.34Å; V665-R673 HydrophobicContact CG1-CG 3.74Å; S669-R673 PolarHBondContact O-N 3.23Å; H670-R673 PolarHBondContact O-N 3.44Å; R673-F676 PolarHBondContact O-N 3.26Å; R673-A677 WeakPolarHBondContact O-CB 3.39Å; R673-A677 PolarHBondContact O-N 3.07Å
674	V	81.7	Confident	77.1	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-61.2	-45	175.8	172.1	0	0	0	0	111.1	E645 H670 G671 A677 R678 L700	E645-V674 HydrophobicContact CB-CG2 3.99Å; H670-V674 WeakPolarHBondContact O-CG2 3.32Å; H670-V674 PolarHBondContact O-N 2.86Å; G671-V674 PolarHBondContact O-N 3.01Å; V674-A677 PolarHBondContact O-N 2.94Å; V674-R678 VanDerWaalsContact CG1-CZ 3.48Å; V674-R678 WeakPolarHBondContact O-CG 3.34Å; V674-R678 PolarHBondContact O-N 2.76Å; V674-L700 HydrophobicContact CG1-CD2 4.02Å
675	N	79.5	Confident	77.9	Confident	95 Å²	95	56.6 Å²	56.6	51%	0.508	28%	0.284	S	S	.	.	H	α-helix	trans	-70.6	-32	-179.9	-72.2	-24.5	0	0	0	113.1	G671 E672 R678 L679	G671-N675 WeakPolarHBondContact O-CB 3.48Å; G671-N675 VanDerWaalsContact O-CG 3.3Å; G671-N675 PolarHBondContact O-N 3.38Å; G671-N675 PolarHBondContact O-ND2 3.06Å; E672-N675 PolarHBondContact O-N 3.36Å; N675-R678 WeakPolarHBondContact O-CB 3.3Å; N675-R678 PolarHBondContact OD1-NH1 3.2Å; N675-L679 PolarHBondContact O-N 3.48Å
676	F	83.5	Confident	78.6	Confident	52 Å²	52	63.1 Å²	63.1	23%	0.228	32%	0.318	C	S	.	.	H	α-helix	trans	-71	-40.6	170.7	-173.7	-96.3	0	0	0	112	V660 Y662 W668 E672 R673 R678 L679 Q680	V660-F676 HydrophobicContact CG1-CE1 3.67Å; V660-F676 HydrophobicContact CG1-CZ 3.71Å; Y662-F676 HydrophobicContact CD1-CE1 4.35Å; Y662-F676 HydrophobicContact CE1-CD1 4.2Å; Y662-F676 AromaticContact CE1-CE1 3.79Å; Y662-F676 HydrophobicContact CE1-CE1 3.79Å; W668-F676 HydrophobicContact CE3-CB 4.23Å; W668-F676 HydrophobicContact CE3-CG 4.46Å; W668-F676 HydrophobicContact CH2-CB 4.15Å; W668-F676 AromaticContact CH2-CD1 3.68Å; W668-F676 HydrophobicContact CH2-CD1 3.68Å; W668-F676 AromaticContact CH2-CD2 3.61Å; W668-F676 HydrophobicContact CH2-CD2 3.61Å; W668-F676 AromaticContact CH2-CE1 3.81Å; W668-F676 HydrophobicContact CH2-CE1 3.81Å; W668-F676 AromaticContact CH2-CE2 3.77Å; W668-F676 HydrophobicContact CH2-CE2 3.77Å; W668-F676 AromaticContact CH2-CG 3.55Å; W668-F676 HydrophobicContact CH2-CG 3.55Å; W668-F676 AromaticContact CH2-CZ 3.86Å; W668-F676 HydrophobicContact CH2-CZ 3.86Å; W668-F676 HydrophobicContact CZ3-CB 3.5Å; W668-F676 AromaticContact CZ3-CD1 3.41Å; W668-F676 HydrophobicContact CZ3-CD1 3.41Å; W668-F676 VanDerWaalsContact CZ3-CD1 3.41Å; W668-F676 AromaticContact CZ3-CD2 3.88Å; W668-F676 HydrophobicContact CZ3-CD2 3.88Å; W668-F676 AromaticContact CZ3-CE1 3.98Å; W668-F676 HydrophobicContact CZ3-CE1 3.98Å; W668-F676 HydrophobicContact CZ3-CE2 4.41Å; W668-F676 AromaticContact CZ3-CG 3.32Å; W668-F676 HydrophobicContact CZ3-CG 3.32Å; W668-F676 HydrophobicContact CZ3-CZ 4.45Å; E672-F676 WeakPolarHBondContact O-CB 3.25Å; E672-F676 PolarHBondContact O-N 3.16Å; R673-F676 PolarHBondContact O-N 3.26Å; F676-R678 VanDerWaalsContact C-N 3.31Å; F676-R678 PolarHBondContact O-N 2.72Å; F676-L679 PolarHBondContact O-N 2.75Å; F676-L679 VanDerWaalsContact O-N 3.15Å; F676-Q680 HydrophobicContact CD1-CG 3.76Å; F676-Q680 HydrophobicContact CE1-CG 3.42Å; F676-Q680 VanDerWaalsContact CE1-CG 3.42Å; F676-Q680 HydrophobicContact CE2-CG 4.2Å; F676-Q680 VanDerWaalsContact CE2-NE2 3.28Å; F676-Q680 HydrophobicContact CG-CG 4.32Å; F676-Q680 HydrophobicContact CZ-CG 3.67Å; F676-Q680 WeakPolarHBondContact O-CG 3.35Å; F676-Q680 PolarHBondContact O-N 3.23Å
677	A	82.8	Confident	79.4	Confident	3 Å²	3	67 Å²	67	3%	0.025	33%	0.333	C	S	.	.	H	α-helix	trans	-59.1	-42.9	173.3	0	0	0	0	0	111.2	C649 V652 R673 V674 L679 Q680 A681 L700	C649-A677 HydrophobicContact CB-CB 4.35Å; V652-A677 HydrophobicContact CB-CB 4.37Å; V652-A677 HydrophobicContact CG1-CB 4.42Å; R673-A677 WeakPolarHBondContact O-CB 3.39Å; R673-A677 PolarHBondContact O-N 3.07Å; V674-A677 PolarHBondContact O-N 2.94Å; A677-L679 PolarHBondContact O-N 3Å; A677-Q680 PolarHBondContact O-N 3.32Å; A677-A681 WeakPolarHBondContact O-CB 3.36Å; A677-A681 PolarHBondContact O-N 2.87Å; A677-L700 HydrophobicContact CB-CD1 3.96Å
678	R	82.8	Confident	79.9	Confident	45 Å²	45	60.2 Å²	60.2	17%	0.17	30%	0.297	C	S	.	.	H	α-helix	trans	-55.2	-49.1	170.5	-75.8	173.6	175.2	137.7	10	112.3	V674 N675 F676 R682 L700 F703	V674-R678 VanDerWaalsContact CG1-CZ 3.48Å; V674-R678 WeakPolarHBondContact O-CG 3.34Å; V674-R678 PolarHBondContact O-N 2.76Å; N675-R678 WeakPolarHBondContact O-CB 3.3Å; N675-R678 PolarHBondContact OD1-NH1 3.2Å; F676-R678 VanDerWaalsContact C-N 3.31Å; F676-R678 PolarHBondContact O-N 2.72Å; R678-R682 PolarHBondContact O-N 3.37Å; R678-L700 WeakPolarHBondContact CD-O 3.37Å; R678-L700 HydrophobicContact CG-CB 3.87Å; R678-L700 HydrophobicContact CG-CD2 4.29Å; R678-L700 HydrophobicContact CG-CG 4.47Å; R678-L700 WeakPolarHBondContact CG-O 3.49Å; R678-L700 PolarHBondContact NE-O 3.5Å; R678-F703 WeakPolarHBondContact O-CE1 3.4Å
679	L	81.3	Confident	80.2	Confident	92 Å²	92	57.2 Å²	57.2	48%	0.482	29%	0.287	S	S	.	.	H	α-helix	trans	-62.6	-47.3	-179.9	-170.8	77.4	0	0	0	112.3	N675 F676 A677 R682 L683	N675-L679 PolarHBondContact O-N 3.48Å; F676-L679 PolarHBondContact O-N 2.75Å; F676-L679 VanDerWaalsContact O-N 3.15Å; A677-L679 PolarHBondContact O-N 3Å; L679-R682 PolarHBondContact O-N 3.2Å; L679-L683 HydrophobicContact CG-CD1 4.17Å; L679-L683 WeakPolarHBondContact O-CG 3.35Å; L679-L683 PolarHBondContact O-N 3.12Å; L679-L683 VanDerWaalsContact O-N 3.08Å
680	Q	82.5	Confident	80.2	Confident	23 Å²	23	59.8 Å²	59.8	11%	0.107	30%	0.296	C	S	.	.	H	α-helix	trans	-71.3	-37.2	-177.3	-62	-55.7	-26.9	0	0	112.3	V652 L656 V660 F676 A677 R682 L683 H684	V652-Q680 HydrophobicContact CG1-CB 4.44Å; L656-Q680 HydrophobicContact CD1-CB 3.69Å; L656-Q680 WeakPolarHBondContact CD1-O 3.41Å; V660-Q680 HydrophobicContact CG1-CG 4.28Å; V660-Q680 HydrophobicContact CG2-CG 4.18Å; F676-Q680 HydrophobicContact CD1-CG 3.76Å; F676-Q680 HydrophobicContact CE1-CG 3.42Å; F676-Q680 VanDerWaalsContact CE1-CG 3.42Å; F676-Q680 HydrophobicContact CE2-CG 4.2Å; F676-Q680 VanDerWaalsContact CE2-NE2 3.28Å; F676-Q680 HydrophobicContact CG-CG 4.32Å; F676-Q680 HydrophobicContact CZ-CG 3.67Å; F676-Q680 WeakPolarHBondContact O-CG 3.35Å; F676-Q680 PolarHBondContact O-N 3.23Å; A677-Q680 PolarHBondContact O-N 3.32Å; Q680-R682 VanDerWaalsContact C-N 3.34Å; Q680-R682 PolarHBondContact O-N 2.9Å; Q680-L683 PolarHBondContact O-N 3.08Å; Q680-H684 PolarHBondContact O-N 3.2Å
681	A	82.1	Confident	79.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.8	-45.2	170.9	0	0	0	0	0	111.2	V652 A677 L683 H684 W685 I688 F703	V652-A681 HydrophobicContact CG1-CB 4.38Å; V652-A681 HydrophobicContact CG2-CB 4.18Å; A677-A681 WeakPolarHBondContact O-CB 3.36Å; A677-A681 PolarHBondContact O-N 2.87Å; A681-L683 VanDerWaalsContact C-N 3.33Å; A681-L683 PolarHBondContact O-N 2.7Å; A681-H684 CarbonylContact O-C 3.55Å; A681-H684 PolarHBondContact O-N 3.45Å; A681-W685 HydrophobicContact CB-CE3 4.06Å; A681-W685 HydrophobicContact CB-CZ3 4.02Å; A681-W685 WeakPolarHBondContact O-CA 3.21Å; A681-W685 WeakPolarHBondContact O-CB 3.45Å; A681-W685 PolarHBondContact O-N 3.41Å; A681-I688 HydrophobicContact CB-CD1 4.03Å; A681-F703 HydrophobicContact CB-CE1 4.19Å; A681-F703 HydrophobicContact CB-CZ 4.1Å
682	R	78.3	Confident	80	Confident	107 Å²	107	56.5 Å²	56.5	40%	0.404	27%	0.272	S	S	.	.	H	α-helix	trans	-61.5	-37.7	176.2	-167.2	-175.9	-171.6	-163.9	5.5	113.3	R678 L679 Q680 F703 D704	R678-R682 PolarHBondContact O-N 3.37Å; L679-R682 PolarHBondContact O-N 3.2Å; Q680-R682 VanDerWaalsContact C-N 3.34Å; Q680-R682 PolarHBondContact O-N 2.9Å; R682-F703 HydrophobicContact CB-CB 4.48Å; R682-F703 HydrophobicContact CB-CD1 3.78Å; R682-F703 HydrophobicContact CB-CE1 4.26Å; R682-F703 HydrophobicContact CB-CG 4.19Å; R682-F703 HydrophobicContact CG-CB 3.97Å; R682-F703 HydrophobicContact CG-CD1 4.21Å; R682-F703 HydrophobicContact CG-CG 4.15Å; R682-F703 PolarHBondContact NE-O 3.42Å; R682-F703 VanDerWaalsContact NE-O 3.1Å; R682-F703 PolarHBondContact NH1-O 2.95Å; R682-F703 PolarHBondContact NH2-O 3.49Å; R682-D704 IonicContact NH2-OD1 3.75Å
683	L	79.2	Confident	80	Confident	106 Å²	106	52.3 Å²	52.3	56%	0.555	25%	0.253	S	S	*	.	H	α-helix	trans	-79.8	-26.9	-177.8	-70.7	172.1	0	0	0	113.7	L679 Q680 A681	L679-L683 HydrophobicContact CG-CD1 4.17Å; L679-L683 WeakPolarHBondContact O-CG 3.35Å; L679-L683 PolarHBondContact O-N 3.12Å; L679-L683 VanDerWaalsContact O-N 3.08Å; Q680-L683 PolarHBondContact O-N 3.08Å; A681-L683 VanDerWaalsContact C-N 3.33Å; A681-L683 PolarHBondContact O-N 2.7Å
684	H	83.4	Confident	79.5	Confident	57 Å²	57	56.5 Å²	56.5	26%	0.264	28%	0.276	S	S	.	.			trans	-134.9	37.2	-170.8	-61.3	-38.9	0	0	0	112.5	L656 Q680 A681 D686 K687	L656-H684 HydrophobicContact CD1-CB 4Å; L656-H684 HydrophobicContact CD2-CB 3.6Å; L656-H684 HydrophobicContact CG-CB 4.47Å; Q680-H684 PolarHBondContact O-N 3.2Å; A681-H684 CarbonylContact O-C 3.55Å; A681-H684 PolarHBondContact O-N 3.45Å; H684-D686 VanDerWaalsContact C-N 3.28Å; H684-D686 PolarHBondContact O-N 3.36Å; H684-K687 HydrophobicContact CB-CB 4.35Å; H684-K687 HydrophobicContact CB-CG 4.37Å; H684-K687 WeakPolarHBondContact O-CB 3.41Å; H684-K687 PolarHBondContact O-N 3.26Å
685	W	84.7	Confident	79.1	Confident	59 Å²	59	56.4 Å²	56.4	22%	0.223	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-54	-45.1	179.1	-160.1	-115.3	0	0	0	111.3	A681 K687 I688 H693 I696 N697 F703	A681-W685 HydrophobicContact CB-CE3 4.06Å; A681-W685 HydrophobicContact CB-CZ3 4.02Å; A681-W685 WeakPolarHBondContact O-CA 3.21Å; A681-W685 WeakPolarHBondContact O-CB 3.45Å; A681-W685 PolarHBondContact O-N 3.41Å; W685-K687 PolarHBondContact O-N 3.22Å; W685-I688 HydrophobicContact CE3-CD1 3.98Å; W685-I688 HydrophobicContact CZ3-CD1 4.18Å; W685-I688 PolarHBondContact O-N 2.95Å; W685-H693 AromaticContact CD1-CE1 3.75Å; W685-H693 AromaticContact CD1-ND1 3.96Å; W685-H693 AromaticContact CE2-CD2 3.8Å; W685-H693 AromaticContact CE2-CG 3.63Å; W685-H693 AromaticContact CE2-ND1 3.79Å; W685-H693 HydrophobicContact CH2-CB 4.22Å; W685-H693 WeakPolarHBondContact CH2-O 3.26Å; W685-H693 HydrophobicContact CZ2-CB 3.52Å; W685-H693 AromaticContact CZ2-CD2 3.89Å; W685-H693 AromaticContact CZ2-CG 3.6Å; W685-H693 AromaticContact NE1-CE1 3.6Å; W685-H693 AromaticContact NE1-CG 3.7Å; W685-H693 AromaticContact NE1-ND1 3.36Å; W685-H693 PolarHBondContact NE1-ND1 3.32Å; W685-H693 PolarHBondContact O-NE2 3.24Å; W685-I696 HydrophobicContact CH2-CB 4.31Å; W685-I696 HydrophobicContact CH2-CG2 4.19Å; W685-I696 HydrophobicContact CZ3-CB 4.46Å; W685-I696 HydrophobicContact CZ3-CG2 3.92Å; W685-N697 VanDerWaalsContact CH2-OD1 3.26Å; W685-N697 WeakPolarHBondContact CH2-OD1 3.46Å; W685-N697 WeakPolarHBondContact CZ2-OD1 3.34Å; W685-F703 HydrophobicContact CE3-CE2 4.26Å; W685-F703 HydrophobicContact CE3-CZ 4.25Å; W685-F703 HydrophobicContact CH2-CE2 4.06Å; W685-F703 HydrophobicContact CH2-CZ 4.27Å; W685-F703 AromaticContact CZ3-CE2 3.86Å; W685-F703 HydrophobicContact CZ3-CE2 3.86Å; W685-F703 AromaticContact CZ3-CZ 3.73Å; W685-F703 HydrophobicContact CZ3-CZ 3.73Å
686	D	79.7	Confident	79.1	Confident	146 Å²	146	51.9 Å²	51.9	78%	0.781	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-57.5	-3	175.1	-29.9	-24.9	0	0	0	115.9	H684	H684-D686 VanDerWaalsContact C-N 3.28Å; H684-D686 PolarHBondContact O-N 3.36Å
687	K	79.3	Confident	78.8	Confident	126 Å²	126	51.4 Å²	51.4	55%	0.548	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-115.7	-7.4	-178.6	-60.5	-65	-178.5	-164.8	0	113.4	L656 I659 H684 W685	L656-K687 HydrophobicContact CD2-CB 3.59Å; I659-K687 HydrophobicContact CD1-CB 4.17Å; I659-K687 HydrophobicContact CD1-CD 4.17Å; I659-K687 HydrophobicContact CD1-CG 3.67Å; H684-K687 HydrophobicContact CB-CB 4.35Å; H684-K687 HydrophobicContact CB-CG 4.37Å; H684-K687 WeakPolarHBondContact O-CB 3.41Å; H684-K687 PolarHBondContact O-N 3.26Å; W685-K687 PolarHBondContact O-N 3.22Å
688	I	79.8	Confident	78.3	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.026	27%	0.266	C	S	.	.	S	Bend	trans	-83.5	143.5	166.5	-60.3	175.1	0	0	0	107.1	V652 L656 A681 W685 N690 L692 H693 I696	V652-I688 HydrophobicContact CG2-CD1 4.29Å; L656-I688 HydrophobicContact CD2-CG1 4.35Å; A681-I688 HydrophobicContact CB-CD1 4.03Å; W685-I688 HydrophobicContact CE3-CD1 3.98Å; W685-I688 HydrophobicContact CZ3-CD1 4.18Å; W685-I688 PolarHBondContact O-N 2.95Å; I688-N690 PolarHBondContact O-N 2.94Å; I688-L692 HydrophobicContact CG2-CB 4.13Å; I688-H693 PolarHBondContact O-NE2 2.98Å; I688-I696 HydrophobicContact CD1-CD1 3.98Å; I688-I696 HydrophobicContact CG2-CD1 3.54Å
689	P	76.8	Confident	77.9	Confident	13 Å²	13	51.6 Å²	51.6	8%	0.084	26%	0.259	C	S	.	.			trans	-61.5	127.3	170.5	-22	33.3	0	0	0	110.4	L127 L128 C691 L692	L127-P689 HydrophobicContact CD2-CG 4.34Å; L128-P689 HydrophobicContact CD2-CB 4.17Å; L128-P689 HydrophobicContact CD2-CG 4.32Å; P689-C691 PolarHBondContact O-N 3.35Å; P689-L692 HydrophobicContact CB-CD1 4.25Å; P689-L692 HydrophobicContact CB-CG 4.28Å; P689-L692 HydrophobicContact CG-CD1 4.02Å; P689-L692 WeakPolarHBondContact O-CB 3.31Å; P689-L692 PolarHBondContact O-N 3.04Å
690	N	73.9	Confident	77.6	Confident	117 Å²	117	47.2 Å²	47.2	63%	0.626	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-49.3	-37.6	-176.5	-69.1	-1.2	0	0	0	113.7	I688 L692 H693	I688-N690 PolarHBondContact O-N 2.94Å; N690-L692 PolarHBondContact O-N 3.16Å; N690-H693 VanDerWaalsContact O-CB 3.23Å; N690-H693 WeakPolarHBondContact O-CB 3.16Å; N690-H693 PolarHBondContact O-N 3.29Å; N690-H693 PolarHBondContact OD1-CE1 2.91Å; N690-H693 VanDerWaalsContact OD1-CE1 3.26Å
691	C	69.3	Low	76.7	Confident	20 Å²	20	51.1 Å²	51.1	14%	0.135	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-63.3	-4.8	177.5	51.2	0	0	0	0	115.8	P689 E729	P689-C691 PolarHBondContact O-N 3.35Å; C691-E729 HydrophobicContact CB-CB 3.33Å; C691-E729 WeakPolarHBondContact CB-O 3.38Å
692	L	76.8	Confident	75.4	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-110.6	-6.5	174.3	-52.1	-179.7	0	0	0	112.3	L127 L128 I651 I688 P689 N690 D694 A695 I696 I727	L127-L692 HydrophobicContact CD2-CD1 4.22Å; L128-L692 HydrophobicContact CD2-CD1 3.68Å; L128-L692 HydrophobicContact CD2-CD2 3.7Å; L128-L692 HydrophobicContact CD2-CG 3.75Å; I651-L692 HydrophobicContact CG2-CB 4.15Å; I651-L692 HydrophobicContact CG2-CD1 3.4Å; I651-L692 VanDerWaalsContact CG2-CD1 3.4Å; I651-L692 HydrophobicContact CG2-CG 4.32Å; I688-L692 HydrophobicContact CG2-CB 4.13Å; P689-L692 HydrophobicContact CB-CD1 4.25Å; P689-L692 HydrophobicContact CB-CG 4.28Å; P689-L692 HydrophobicContact CG-CD1 4.02Å; P689-L692 WeakPolarHBondContact O-CB 3.31Å; P689-L692 PolarHBondContact O-N 3.04Å; N690-L692 PolarHBondContact O-N 3.16Å; L692-D694 PolarHBondContact O-N 2.71Å; L692-A695 PolarHBondContact O-N 2.87Å; L692-I696 HydrophobicContact CB-CD1 4.09Å; L692-I696 WeakPolarHBondContact O-CB 3.44Å; L692-I696 VanDerWaalsContact O-CG1 3.22Å; L692-I696 WeakPolarHBondContact O-CG1 3.48Å; L692-I696 PolarHBondContact O-N 2.71Å; L692-I727 HydrophobicContact CD2-CB 4.2Å; L692-I727 HydrophobicContact CD2-CD1 4.47Å; L692-I727 HydrophobicContact CD2-CG1 4Å; L692-I727 HydrophobicContact CD2-CG2 3.67Å
693	H	80.1	Confident	74.2	Confident	21 Å²	21	49.2 Å²	49.2	10%	0.097	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-43.5	-175.2	-74.9	177.9	0	0	0	112.3	W685 I688 N690 I696 N697	W685-H693 AromaticContact CD1-CE1 3.75Å; W685-H693 AromaticContact CD1-ND1 3.96Å; W685-H693 AromaticContact CE2-CD2 3.8Å; W685-H693 AromaticContact CE2-CG 3.63Å; W685-H693 AromaticContact CE2-ND1 3.79Å; W685-H693 HydrophobicContact CH2-CB 4.22Å; W685-H693 WeakPolarHBondContact CH2-O 3.26Å; W685-H693 HydrophobicContact CZ2-CB 3.52Å; W685-H693 AromaticContact CZ2-CD2 3.89Å; W685-H693 AromaticContact CZ2-CG 3.6Å; W685-H693 AromaticContact NE1-CE1 3.6Å; W685-H693 AromaticContact NE1-CG 3.7Å; W685-H693 AromaticContact NE1-ND1 3.36Å; W685-H693 PolarHBondContact NE1-ND1 3.32Å; W685-H693 PolarHBondContact O-NE2 3.24Å; I688-H693 PolarHBondContact O-NE2 2.98Å; N690-H693 VanDerWaalsContact O-CB 3.23Å; N690-H693 WeakPolarHBondContact O-CB 3.16Å; N690-H693 PolarHBondContact O-N 3.29Å; N690-H693 PolarHBondContact OD1-CE1 2.91Å; N690-H693 VanDerWaalsContact OD1-CE1 3.26Å; H693-I696 PolarHBondContact O-N 3.24Å; H693-N697 VanDerWaalsContact O-CB 3.25Å; H693-N697 WeakPolarHBondContact O-CB 3.43Å; H693-N697 VanDerWaalsContact O-CG 3.23Å; H693-N697 PolarHBondContact O-N 2.9Å; H693-N697 PolarHBondContact O-ND2 3.41Å
694	D	70.8	Confident	72.5	Confident	97 Å²	97	49.1 Å²	49.1	52%	0.519	25%	0.248	S	C	.	.	H	α-helix	trans	-74.1	-34.5	-176.9	-70	-14.9	0	0	0	112.6	L692 N697 S698	L692-D694 PolarHBondContact O-N 2.71Å; D694-N697 PolarHBondContact O-N 3.43Å; D694-S698 WeakPolarHBondContact O-CB 3.43Å; D694-S698 PolarHBondContact O-N 3.01Å
695	A	75	Confident	70.5	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64	-47.8	170.1	0	0	0	0	0	112.6	L692 N697 S698 V699 F723 L726 I727	L692-A695 PolarHBondContact O-N 2.87Å; A695-N697 VanDerWaalsContact C-N 3.31Å; A695-N697 PolarHBondContact O-N 3.21Å; A695-S698 PolarHBondContact O-N 2.95Å; A695-S698 PolarHBondContact O-OG 3.44Å; A695-V699 PolarHBondContact O-N 2.92Å; A695-F723 HydrophobicContact CB-CD2 4.4Å; A695-F723 HydrophobicContact CB-CE2 4.03Å; A695-F723 HydrophobicContact CB-CZ 4.41Å; A695-F723 WeakPolarHBondContact O-CE2 3.4Å; A695-L726 HydrophobicContact CB-CB 3.7Å; A695-I727 HydrophobicContact CB-CD1 3.79Å; A695-I727 HydrophobicContact CB-CG1 3.24Å
696	I	78.6	Confident	68.2	Low	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.8	-37.9	178.1	-64.8	170	0	0	0	110	I651 V652 W685 I688 L692 H693 V699 L700	I651-I696 HydrophobicContact CB-CD1 4.29Å; I651-I696 HydrophobicContact CB-CG1 4.45Å; I651-I696 HydrophobicContact CG2-CD1 3.52Å; I651-I696 HydrophobicContact CG2-CG1 4.06Å; V652-I696 HydrophobicContact CG2-CD1 4.12Å; V652-I696 HydrophobicContact CG2-CG2 4.02Å; W685-I696 HydrophobicContact CH2-CB 4.31Å; W685-I696 HydrophobicContact CH2-CG2 4.19Å; W685-I696 HydrophobicContact CZ3-CB 4.46Å; W685-I696 HydrophobicContact CZ3-CG2 3.92Å; I688-I696 HydrophobicContact CD1-CD1 3.98Å; I688-I696 HydrophobicContact CG2-CD1 3.54Å; L692-I696 HydrophobicContact CB-CD1 4.09Å; L692-I696 WeakPolarHBondContact O-CB 3.44Å; L692-I696 VanDerWaalsContact O-CG1 3.22Å; L692-I696 WeakPolarHBondContact O-CG1 3.48Å; L692-I696 PolarHBondContact O-N 2.71Å; H693-I696 PolarHBondContact O-N 3.24Å; I696-V699 PolarHBondContact O-N 3.34Å; I696-L700 HydrophobicContact CG2-CB 4.25Å; I696-L700 HydrophobicContact CG2-CD1 3.79Å; I696-L700 HydrophobicContact CG2-CG 4.14Å; I696-L700 WeakPolarHBondContact O-CA 3.45Å; I696-L700 VanDerWaalsContact O-CB 3.26Å; I696-L700 WeakPolarHBondContact O-CB 3.49Å; I696-L700 PolarHBondContact O-N 3.14Å
697	N	77.1	Confident	66.3	Low	42 Å²	42	56.9 Å²	56.9	23%	0.225	29%	0.29	C	S	.	.	H	α-helix	trans	-58.8	-48.7	171.6	-82.6	-31.1	0	0	0	111.3	W685 H693 D694 A695 V699 L700 Y701	W685-N697 VanDerWaalsContact CH2-OD1 3.26Å; W685-N697 WeakPolarHBondContact CH2-OD1 3.46Å; W685-N697 WeakPolarHBondContact CZ2-OD1 3.34Å; H693-N697 VanDerWaalsContact O-CB 3.25Å; H693-N697 WeakPolarHBondContact O-CB 3.43Å; H693-N697 VanDerWaalsContact O-CG 3.23Å; H693-N697 PolarHBondContact O-N 2.9Å; H693-N697 PolarHBondContact O-ND2 3.41Å; D694-N697 PolarHBondContact O-N 3.43Å; A695-N697 VanDerWaalsContact C-N 3.31Å; A695-N697 PolarHBondContact O-N 3.21Å; N697-V699 PolarHBondContact O-N 3.4Å; N697-L700 PolarHBondContact O-N 3.43Å; N697-Y701 WeakPolarHBondContact O-CB 3.3Å; N697-Y701 PolarHBondContact O-N 3.41Å
698	S	72.4	Confident	64.1	Low	48 Å²	48	58.1 Å²	58.1	34%	0.336	30%	0.302	S	S	.	.	H	α-helix	trans	-57.9	-21.4	-176.8	76	0	0	0	0	114.9	D694 A695 L726	D694-S698 WeakPolarHBondContact O-CB 3.43Å; D694-S698 PolarHBondContact O-N 3.01Å; A695-S698 PolarHBondContact O-N 2.95Å; A695-S698 PolarHBondContact O-OG 3.44Å; S698-L726 VanDerWaalsContact OG-CD1 3.31Å; S698-L726 WeakPolarHBondContact OG-CD1 3.39Å
699	V	74.5	Confident	62.1	Low	5 Å²	5	59.8 Å²	59.8	3%	0.03	32%	0.32	C	S	.	.	H	α-helix	trans	-113.6	-31.9	-178.7	179.6	0	0	0	0	113	E645 A648 A695 I696 N697 L717 P718 F723	E645-V699 HydrophobicContact CB-CG1 4.43Å; E645-V699 HydrophobicContact CG-CG1 4.04Å; A648-V699 HydrophobicContact CB-CB 3.82Å; A648-V699 HydrophobicContact CB-CG1 3.58Å; A648-V699 HydrophobicContact CB-CG2 4.49Å; A695-V699 PolarHBondContact O-N 2.92Å; I696-V699 PolarHBondContact O-N 3.34Å; N697-V699 PolarHBondContact O-N 3.4Å; V699-L717 HydrophobicContact CB-CD2 4.41Å; V699-L717 HydrophobicContact CG1-CD2 3.9Å; V699-L717 HydrophobicContact CG2-CD2 4.23Å; V699-P718 HydrophobicContact CG2-CG 4.16Å; V699-F723 HydrophobicContact CB-CE2 4.36Å; V699-F723 HydrophobicContact CG2-CD2 3.65Å; V699-F723 HydrophobicContact CG2-CE2 3.51Å
700	L	75	Confident	60.2	Low	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-107.9	-22.5	-173.9	-59	-167.3	0	0	0	115.3	A648 V652 V674 A677 R678 I696 N697	A648-L700 HydrophobicContact CB-CD1 4.44Å; A648-L700 HydrophobicContact CB-CD2 4.14Å; A648-L700 HydrophobicContact CB-CG 4.06Å; V652-L700 HydrophobicContact CG2-CD1 3.94Å; V674-L700 HydrophobicContact CG1-CD2 4.02Å; A677-L700 HydrophobicContact CB-CD1 3.96Å; R678-L700 WeakPolarHBondContact CD-O 3.37Å; R678-L700 HydrophobicContact CG-CB 3.87Å; R678-L700 HydrophobicContact CG-CD2 4.29Å; R678-L700 HydrophobicContact CG-CG 4.47Å; R678-L700 WeakPolarHBondContact CG-O 3.49Å; R678-L700 PolarHBondContact NE-O 3.5Å; I696-L700 HydrophobicContact CG2-CB 4.25Å; I696-L700 HydrophobicContact CG2-CD1 3.79Å; I696-L700 HydrophobicContact CG2-CG 4.14Å; I696-L700 WeakPolarHBondContact O-CA 3.45Å; I696-L700 VanDerWaalsContact O-CB 3.26Å; I696-L700 WeakPolarHBondContact O-CB 3.49Å; I696-L700 PolarHBondContact O-N 3.14Å; N697-L700 PolarHBondContact O-N 3.43Å
701	Y	63.9	Low	58.7	Low	105 Å²	105	60.2 Å²	60.2	41%	0.412	32%	0.317	S	S	.	.			trans	-62.6	153.5	178.2	-162.9	-102.3	0	0	0	111.3	N697 F703 R715	N697-Y701 WeakPolarHBondContact O-CB 3.3Å; N697-Y701 PolarHBondContact O-N 3.41Å; Y701-F703 AromaticContact CD2-CD2 3.66Å; Y701-F703 HydrophobicContact CD2-CD2 3.66Å; Y701-F703 AromaticContact CD2-CE2 3.93Å; Y701-F703 HydrophobicContact CD2-CE2 3.93Å; Y701-F703 HydrophobicContact CD2-CG 4.44Å; Y701-F703 AromaticContact CE2-CD2 3.96Å; Y701-F703 HydrophobicContact CE2-CD2 3.96Å; Y701-R715 VanDerWaalsContact O-CZ 3.31Å; Y701-R715 PolarHBondContact O-NH1 3.48Å; Y701-R715 PolarHBondContact O-NH2 3.37Å
702	P	54.2	Low	57.4	Low	31 Å²	31	63.5 Å²	63.5	20%	0.201	33%	0.329	C	S	.	.			cis	-89.5	154.5	6.2	37.8	-32.3	0	0	0	113.4	L707	P702-L707 HydrophobicContact CG-CD1 4.42Å
703	F	52.9	Low	55.8	Low	35 Å²	35	71.5 Å²	71.5	15%	0.154	37%	0.366	C	S	.	.			trans	-91.6	3.1	176.3	-64.7	-58.1	0	0	0	113.6	R678 A681 R682 W685 Y701	R678-F703 WeakPolarHBondContact O-CE1 3.4Å; A681-F703 HydrophobicContact CB-CE1 4.19Å; A681-F703 HydrophobicContact CB-CZ 4.1Å; R682-F703 HydrophobicContact CB-CB 4.48Å; R682-F703 HydrophobicContact CB-CD1 3.78Å; R682-F703 HydrophobicContact CB-CE1 4.26Å; R682-F703 HydrophobicContact CB-CG 4.19Å; R682-F703 HydrophobicContact CG-CB 3.97Å; R682-F703 HydrophobicContact CG-CD1 4.21Å; R682-F703 HydrophobicContact CG-CG 4.15Å; R682-F703 PolarHBondContact NE-O 3.42Å; R682-F703 VanDerWaalsContact NE-O 3.1Å; R682-F703 PolarHBondContact NH1-O 2.95Å; R682-F703 PolarHBondContact NH2-O 3.49Å; W685-F703 HydrophobicContact CE3-CE2 4.26Å; W685-F703 HydrophobicContact CE3-CZ 4.25Å; W685-F703 HydrophobicContact CH2-CE2 4.06Å; W685-F703 HydrophobicContact CH2-CZ 4.27Å; W685-F703 AromaticContact CZ3-CE2 3.86Å; W685-F703 HydrophobicContact CZ3-CE2 3.86Å; W685-F703 AromaticContact CZ3-CZ 3.73Å; W685-F703 HydrophobicContact CZ3-CZ 3.73Å; Y701-F703 AromaticContact CD2-CD2 3.66Å; Y701-F703 HydrophobicContact CD2-CD2 3.66Å; Y701-F703 AromaticContact CD2-CE2 3.93Å; Y701-F703 HydrophobicContact CD2-CE2 3.93Å; Y701-F703 HydrophobicContact CD2-CG 4.44Å; Y701-F703 AromaticContact CE2-CD2 3.96Å; Y701-F703 HydrophobicContact CE2-CD2 3.96Å
704	D	43.8	Very low	54.1	Low	104 Å²	104	77.8 Å²	77.8	56%	0.556	40%	0.396	S	S	*	.			trans	-95.5	137.9	-175.7	-69	-46	0	0	0	113.4	R682 N706	R682-D704 IonicContact NH2-OD1 3.75Å; D704-N706 VanDerWaalsContact C-N 3.33Å; D704-N706 PolarHBondContact O-N 2.82Å
705	Q	41.7	Very low	53	Low	159 Å²	159	78 Å²	78	74%	0.743	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	15	-159.4	-69.7	169.6	-94.2	0	0	115.3
706	N	37.5	Very low	51.8	Low	151 Å²	151	86.2 Å²	86.2	81%	0.807	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	3.8	-164.5	-71.2	-2.5	0	0	0	115.5	D704	D704-N706 VanDerWaalsContact C-N 3.33Å; D704-N706 PolarHBondContact O-N 2.82Å
707	L	38.4	Very low	50.9	Low	115 Å²	115	87.9 Å²	87.9	60%	0.602	43%	0.434	S	S	*	.			trans	-98.1	106.3	174.4	-79.1	160.9	0	0	0	110.5	P702	P702-L707 HydrophobicContact CG-CD1 4.42Å
708	I	34.4	Very low	50.2	Low	153 Å²	153	86.3 Å²	86.3	79%	0.785	43%	0.426	S	S	*	.			trans	-78.8	150.1	168.3	-62.1	175.2	0	0	0	108
709	G	36.9	Very low	49.8	Very low	39 Å²	39	87.4 Å²	87.4	40%	0.402	43%	0.431	S	S	.	.	S	Bend	trans	-80.3	135.5	-155	0	0	0	0	0	117.1	N188	N188-G709 PolarHBondContact N-O 2.61Å
710	E	37.8	Very low	49.5	Very low	74 Å²	74	87.2 Å²	87.2	35%	0.346	43%	0.429	S	S	.	.	S	Bend	trans	-170	-42	136.5	-112.3	175.1	-163.1	0	0	109.1	E187 N188 T189 F712 H713	E187-E710 WeakPolarHBondContact CA-OE1 3.4Å; E187-E710 PolarHBondContact N-OE1 2.96Å; E187-E710 VanDerWaalsContact N-OE1 3.12Å; N188-E710 VanDerWaalsContact C-OE2 3.24Å; N188-E710 WeakPolarHBondContact CA-OE1 3.39Å; N188-E710 WeakPolarHBondContact CA-OE2 3.35Å; N188-E710 VanDerWaalsContact N-CD 3.3Å; N188-E710 PolarHBondContact N-OE1 2.97Å; T189-E710 HydrophobicContact CG2-CB 4.05Å; T189-E710 PolarHBondContact N-OE2 2.76Å; T189-E710 WeakPolarHBondContact OG1-CB 3.4Å; E710-F712 PolarHBondContact O-N 3.11Å; E710-H713 PolarHBondContact O-N 3.05Å; E710-H713 VanDerWaalsContact O-N 3.17Å
711	Q	41.1	Very low	48.9	Very low	66 Å²	66	89 Å²	89	31%	0.308	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	0	179.4	-103.5	169.6	20.9	0	0	117.2	T189 H713	T189-Q711 HydrophobicContact CG2-CB 4.26Å; T189-Q711 WeakPolarHBondContact OG1-CG 3.48Å; T189-Q711 PolarHBondContact OG1-N 3.47Å; Q711-H713 VanDerWaalsContact C-N 3.33Å
712	F	42.7	Very low	48.9	Very low	88 Å²	88	85.9 Å²	85.9	39%	0.386	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-21.9	170.3	-90	-96.2	0	0	0	113.1	E710	E710-F712 PolarHBondContact O-N 3.11Å
713	H	44	Very low	49.7	Very low	169 Å²	169	84.4 Å²	84.4	78%	0.782	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-26	-173.9	-79.5	-80.8	0	0	0	115.1	E710 Q711 R715	E710-H713 PolarHBondContact O-N 3.05Å; E710-H713 VanDerWaalsContact O-N 3.17Å; Q711-H713 VanDerWaalsContact C-N 3.33Å; H713-R715 VanDerWaalsContact C-N 3.32Å; H713-R715 PolarHBondContact O-N 2.69Å
714	E	44.1	Very low	50.3	Low	153 Å²	153	83.4 Å²	83.4	72%	0.715	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	4.4	-180	-63.8	-163.5	129.1	0	0	114.3	F716	E714-F716 PolarHBondContact O-N 3.24Å
715	R	47.5	Very low	51.2	Low	101 Å²	101	80.6 Å²	80.6	38%	0.381	40%	0.399	S	S	.	.			trans	-69.4	119.9	-175.4	-87.4	174.7	154.2	-162.4	-14.7	112.7	Y701 H713 L717	Y701-R715 VanDerWaalsContact O-CZ 3.31Å; Y701-R715 PolarHBondContact O-NH1 3.48Å; Y701-R715 PolarHBondContact O-NH2 3.37Å; H713-R715 VanDerWaalsContact C-N 3.32Å; H713-R715 PolarHBondContact O-N 2.69Å; R715-L717 PolarHBondContact O-N 2.79Å
716	F	49.5	Very low	52	Low	172 Å²	172	76 Å²	76	75%	0.754	38%	0.38	S	S	*	.			trans	-66.4	81.3	164.1	-163.9	-87.3	0	0	0	109.7	E714 I722	E714-F716 PolarHBondContact O-N 3.24Å; F716-I722 HydrophobicContact CE1-CD1 4.2Å
717	L	58.7	Low	53.2	Low	35 Å²	35	69 Å²	69	18%	0.183	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-57.4	127.6	165.1	-82.7	137	0	0	0	108	K641 E645 V699 R715 T719	K641-L717 HydrophobicContact CB-CD1 4.01Å; K641-L717 HydrophobicContact CD-CD1 3.9Å; K641-L717 HydrophobicContact CG-CB 4.25Å; K641-L717 HydrophobicContact CG-CD1 3.81Å; E645-L717 HydrophobicContact CG-CD2 4.19Å; V699-L717 HydrophobicContact CB-CD2 4.41Å; V699-L717 HydrophobicContact CG1-CD2 3.9Å; V699-L717 HydrophobicContact CG2-CD2 4.23Å; R715-L717 PolarHBondContact O-N 2.79Å; L717-T719 PolarHBondContact O-N 3.36Å
718	P	62.4	Low	53.9	Low	9 Å²	9	64.5 Å²	64.5	6%	0.058	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-59.6	136.2	-179.9	25.2	-34.2	0	0	0	109.5	L644 V699 I722 F723 L726	L644-P718 WeakPolarHBondContact CD1-O 3.15Å; L644-P718 WeakPolarHBondContact CD2-O 3.4Å; V699-P718 HydrophobicContact CG2-CG 4.16Å; P718-I722 HydrophobicContact CB-CB 3.69Å; P718-I722 HydrophobicContact CB-CG2 3.46Å; P718-I722 VanDerWaalsContact CB-CG2 3.46Å; P718-F723 HydrophobicContact CG-CB 4.32Å; P718-F723 HydrophobicContact CG-CD2 4.27Å; P718-L726 HydrophobicContact CG-CD1 4.42Å
719	T	65.3	Low	54.6	Low	71 Å²	71	63.6 Å²	63.6	44%	0.436	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-57.8	159.8	171.8	58.8	0	0	0	0	110.5	L717 D721 I722 F723	L717-T719 PolarHBondContact O-N 3.36Å; T719-D721 CarbonylContact O-C 3.56Å; T719-D721 PolarHBondContact O-N 3.04Å; T719-D721 VanDerWaalsContact O-N 3.1Å; T719-I722 CarbonylContact O-C 3.6Å; T719-I722 WeakPolarHBondContact O-CA 3.39Å; T719-I722 PolarHBondContact O-N 3.07Å; T719-I722 WeakPolarHBondContact OG1-CG1 3.5Å; T719-F723 PolarHBondContact O-N 2.83Å
720	V	68.6	Low	55.2	Low	1 Å²	1	63.2 Å²	63.2	1%	0.006	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-25.9	-176.3	-178.9	0	0	0	0	112.6	I135 I138 H142 L644 L647 L724	I135-V720 HydrophobicContact CG2-CG1 3.72Å; I138-V720 HydrophobicContact CB-CG1 4.34Å; I138-V720 HydrophobicContact CG2-CB 4.47Å; I138-V720 HydrophobicContact CG2-CG1 4.04Å; I138-V720 HydrophobicContact CG2-CG2 3.91Å; H142-V720 WeakPolarHBondContact CE1-CG2 3.46Å; H142-V720 VanDerWaalsContact ND1-CG2 3.3Å; H142-V720 WeakPolarHBondContact ND1-CG2 3.27Å; L644-V720 HydrophobicContact CD1-CG2 4.2Å; L644-V720 HydrophobicContact CD2-CB 4.34Å; L644-V720 HydrophobicContact CD2-CG2 3.6Å; L644-V720 HydrophobicContact CG-CG2 3.63Å; L647-V720 HydrophobicContact CD1-CG1 4.11Å; L647-V720 HydrophobicContact CD1-CG2 4.37Å; V720-L724 WeakPolarHBondContact O-CB 3.47Å; V720-L724 PolarHBondContact O-N 3.32Å; V720-L724 VanDerWaalsContact O-N 3.08Å
721	D	62	Low	55.7	Low	37 Å²	37	62.2 Å²	62.2	20%	0.198	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-55.7	164.6	-67.9	-85.2	0	0	0	111.6	T139 K143 T719 F723 L724 H725	T139-D721 VanDerWaalsContact CG2-OD1 3.26Å; T139-D721 WeakPolarHBondContact CG2-OD1 3.44Å; K143-D721 VanDerWaalsContact CE-OD1 3.31Å; K143-D721 WeakPolarHBondContact CE-OD1 3.48Å; K143-D721 WeakPolarHBondContact CE-OD2 3.44Å; K143-D721 IonicContact NZ-OD1 3.99Å; K143-D721 PolarHBondContact NZ-OD1 3.48Å; K143-D721 IonicContact NZ-OD2 2.74Å; T719-D721 CarbonylContact O-C 3.56Å; T719-D721 PolarHBondContact O-N 3.04Å; T719-D721 VanDerWaalsContact O-N 3.1Å; D721-F723 VanDerWaalsContact C-N 3.3Å; D721-F723 PolarHBondContact O-N 3.2Å; D721-L724 VanDerWaalsContact O-CB 3.26Å; D721-L724 WeakPolarHBondContact O-CB 3.5Å; D721-L724 PolarHBondContact O-N 3.49Å; D721-H725 PolarHBondContact O-CD2 2.79Å; D721-H725 PolarHBondContact O-N 2.67Å; D721-H725 PolarHBondContact O-NE2 2.95Å
722	I	63.3	Low	56.2	Low	41 Å²	41	61.7 Å²	61.7	21%	0.21	30%	0.302	C	S	.	.	H	α-helix	trans	-59.7	-38.9	178.9	-60.5	168.3	0	0	0	111.9	F716 P718 T719 L724 H725 L726 Y762	F716-I722 HydrophobicContact CE1-CD1 4.2Å; P718-I722 HydrophobicContact CB-CB 3.69Å; P718-I722 HydrophobicContact CB-CG2 3.46Å; P718-I722 VanDerWaalsContact CB-CG2 3.46Å; T719-I722 CarbonylContact O-C 3.6Å; T719-I722 WeakPolarHBondContact O-CA 3.39Å; T719-I722 PolarHBondContact O-N 3.07Å; T719-I722 WeakPolarHBondContact OG1-CG1 3.5Å; I722-L724 VanDerWaalsContact C-N 3.32Å; I722-L724 PolarHBondContact O-N 3.43Å; I722-H725 PolarHBondContact O-N 3.14Å; I722-H725 VanDerWaalsContact O-N 3.09Å; I722-L726 PolarHBondContact O-N 2.95Å; I722-Y762 HydrophobicContact CG1-CE2 4.11Å
723	F	70.2	Confident	56.8	Low	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.5	-34	176.2	-173.4	-101.4	0	0	0	112.6	I135 L644 L647 A648 I651 A695 V699 P718 T719 D721 H725 I727	I135-F723 HydrophobicContact CD1-CE1 4.46Å; I135-F723 HydrophobicContact CG1-CD1 4.36Å; I135-F723 HydrophobicContact CG1-CE1 4.31Å; I135-F723 HydrophobicContact CG2-CD1 4.45Å; L644-F723 HydrophobicContact CD2-CB 3.56Å; L644-F723 HydrophobicContact CD2-CD1 4.34Å; L644-F723 HydrophobicContact CD2-CD2 4.27Å; L644-F723 HydrophobicContact CD2-CG 3.82Å; L647-F723 HydrophobicContact CB-CD1 4.48Å; L647-F723 HydrophobicContact CB-CE1 3.77Å; L647-F723 HydrophobicContact CB-CZ 4.27Å; L647-F723 HydrophobicContact CD1-CD1 4.32Å; L647-F723 HydrophobicContact CD1-CE1 4.37Å; A648-F723 HydrophobicContact CB-CE2 4.35Å; A648-F723 HydrophobicContact CB-CZ 4.16Å; I651-F723 HydrophobicContact CD1-CE1 3.93Å; I651-F723 HydrophobicContact CD1-CZ 3.74Å; A695-F723 HydrophobicContact CB-CD2 4.4Å; A695-F723 HydrophobicContact CB-CE2 4.03Å; A695-F723 HydrophobicContact CB-CZ 4.41Å; A695-F723 WeakPolarHBondContact O-CE2 3.4Å; V699-F723 HydrophobicContact CB-CE2 4.36Å; V699-F723 HydrophobicContact CG2-CD2 3.65Å; V699-F723 HydrophobicContact CG2-CE2 3.51Å; P718-F723 HydrophobicContact CG-CB 4.32Å; P718-F723 HydrophobicContact CG-CD2 4.27Å; T719-F723 PolarHBondContact O-N 2.83Å; D721-F723 VanDerWaalsContact C-N 3.3Å; D721-F723 PolarHBondContact O-N 3.2Å; F723-H725 VanDerWaalsContact C-N 3.3Å; F723-H725 PolarHBondContact O-N 2.95Å; F723-I727 HydrophobicContact CD1-CD1 3.93Å; F723-I727 HydrophobicContact CE1-CD1 3.46Å; F723-I727 VanDerWaalsContact CE1-CD1 3.46Å; F723-I727 HydrophobicContact CZ-CD1 3.84Å; F723-I727 WeakPolarHBondContact O-CG1 3.29Å
724	L	67.2	Low	57.3	Low	14 Å²	14	55.9 Å²	55.9	7%	0.073	28%	0.275	C	S	.	.	H	α-helix	trans	-61.3	-40.1	170.8	-175	65.7	0	0	0	111.2	F132 I135 V720 D721 I722 I727 C728	F132-L724 HydrophobicContact CD2-CD1 3.75Å; F132-L724 HydrophobicContact CE2-CD1 3.82Å; I135-L724 HydrophobicContact CB-CD1 4.01Å; I135-L724 HydrophobicContact CD1-CD1 4.22Å; I135-L724 HydrophobicContact CG2-CB 3.83Å; I135-L724 HydrophobicContact CG2-CD1 3.69Å; I135-L724 HydrophobicContact CG2-CG 4.31Å; V720-L724 WeakPolarHBondContact O-CB 3.47Å; V720-L724 PolarHBondContact O-N 3.32Å; V720-L724 VanDerWaalsContact O-N 3.08Å; D721-L724 VanDerWaalsContact O-CB 3.26Å; D721-L724 WeakPolarHBondContact O-CB 3.5Å; D721-L724 PolarHBondContact O-N 3.49Å; I722-L724 VanDerWaalsContact C-N 3.32Å; I722-L724 PolarHBondContact O-N 3.43Å; L724-I727 WeakPolarHBondContact O-CB 3.39Å; L724-I727 PolarHBondContact O-N 2.94Å; L724-I727 VanDerWaalsContact O-N 3.12Å; L724-C728 PolarHBondContact O-N 2.88Å; L724-C728 PolarHBondContact O-SG 3.24Å
725	H	62.1	Low	57.7	Low	44 Å²	44	50.4 Å²	50.4	20%	0.204	25%	0.249	C	C	.	.	H	α-helix	trans	-70.6	-33.3	-178.1	-64.7	-58.2	0	0	0	113.8	D721 I722 F723 I727 C728 Y762	D721-H725 PolarHBondContact O-CD2 2.79Å; D721-H725 PolarHBondContact O-N 2.67Å; D721-H725 PolarHBondContact O-NE2 2.95Å; I722-H725 PolarHBondContact O-N 3.14Å; I722-H725 VanDerWaalsContact O-N 3.09Å; F723-H725 VanDerWaalsContact C-N 3.3Å; F723-H725 PolarHBondContact O-N 2.95Å; H725-I727 PolarHBondContact O-N 3.41Å; H725-C728 PolarHBondContact O-N 3.26Å; H725-Y762 WeakPolarHBondContact CD2-CB 3.46Å; H725-Y762 AromaticContact CD2-CG 3.97Å; H725-Y762 VanDerWaalsContact CE1-C 3.48Å; H725-Y762 PolarHBondContact CE1-O 3.24Å; H725-Y762 VanDerWaalsContact NE2-CB 3.3Å; H725-Y762 WeakPolarHBondContact NE2-CB 3.23Å; H725-Y762 PolarHBondContact NE2-O 2.89Å
726	L	59.3	Low	58.2	Low	64 Å²	64	45.6 Å²	45.6	34%	0.335	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-8.1	171.9	-62.3	171.9	0	0	0	113.5	A695 S698 P718 I722	A695-L726 HydrophobicContact CB-CB 3.7Å; S698-L726 VanDerWaalsContact OG-CD1 3.31Å; S698-L726 WeakPolarHBondContact OG-CD1 3.39Å; P718-L726 HydrophobicContact CG-CD1 4.42Å; I722-L726 PolarHBondContact O-N 2.95Å
727	I	61.7	Low	58.9	Low	2 Å²	2	39.2 Å²	39.2	1%	0.01	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-7.5	177.6	-72.1	-179	0	0	0	111.8	I135 I651 L692 A695 F723 L724 H725 E729	I135-I727 HydrophobicContact CD1-CB 4.35Å; I135-I727 HydrophobicContact CD1-CD1 3.4Å; I135-I727 HydrophobicContact CD1-CG1 4.4Å; I135-I727 HydrophobicContact CD1-CG2 3.92Å; I135-I727 HydrophobicContact CG1-CD1 4.44Å; I651-I727 HydrophobicContact CD1-CD1 3.44Å; I651-I727 VanDerWaalsContact CD1-CD1 3.44Å; L692-I727 HydrophobicContact CD2-CB 4.2Å; L692-I727 HydrophobicContact CD2-CD1 4.47Å; L692-I727 HydrophobicContact CD2-CG1 4Å; L692-I727 HydrophobicContact CD2-CG2 3.67Å; A695-I727 HydrophobicContact CB-CD1 3.79Å; A695-I727 HydrophobicContact CB-CG1 3.24Å; F723-I727 HydrophobicContact CD1-CD1 3.93Å; F723-I727 HydrophobicContact CE1-CD1 3.46Å; F723-I727 VanDerWaalsContact CE1-CD1 3.46Å; F723-I727 HydrophobicContact CZ-CD1 3.84Å; F723-I727 WeakPolarHBondContact O-CG1 3.29Å; L724-I727 WeakPolarHBondContact O-CB 3.39Å; L724-I727 PolarHBondContact O-N 2.94Å; L724-I727 VanDerWaalsContact O-N 3.12Å; H725-I727 PolarHBondContact O-N 3.41Å; I727-E729 VanDerWaalsContact C-N 3.25Å; I727-E729 PolarHBondContact O-N 3.21Å; I727-E729 VanDerWaalsContact O-N 3.15Å
728	C	52.7	Low	58.8	Low	22 Å²	22	41.6 Å²	41.6	15%	0.149	22%	0.217	C	C	.	.			trans	-79.6	14.4	-173.1	-78.5	0	0	0	0	115.7	L724 H725 F730 P764	L724-C728 PolarHBondContact O-N 2.88Å; L724-C728 PolarHBondContact O-SG 3.24Å; H725-C728 PolarHBondContact O-N 3.26Å; C728-F730 PolarHBondContact O-N 2.98Å; C728-P764 HydrophobicContact CB-CB 3.88Å; C728-P764 HydrophobicContact CB-CG 4.08Å
729	E	48.8	Very low	58.6	Low	133 Å²	133	43.7 Å²	43.7	62%	0.621	22%	0.224	S	C	*	.			trans	-72.4	37.6	166.2	-78.3	-152.8	144	0	0	113.1	C691 I727	C691-E729 HydrophobicContact CB-CB 3.33Å; C691-E729 WeakPolarHBondContact CB-O 3.38Å; I727-E729 VanDerWaalsContact C-N 3.25Å; I727-E729 PolarHBondContact O-N 3.21Å; I727-E729 VanDerWaalsContact O-N 3.15Å
730	F	50.6	Low	58.6	Low	32 Å²	32	40.4 Å²	40.4	14%	0.14	20%	0.204	C	C	.	.	S	Bend	trans	-70.5	161.8	162.9	-102.8	-99	0	0	0	110.6	L128 F132 C728 P732	L128-F730 VanDerWaalsContact C-CZ 3.45Å; L128-F730 HydrophobicContact CB-CE1 4.05Å; L128-F730 HydrophobicContact CB-CE2 3.68Å; L128-F730 HydrophobicContact CB-CZ 3.39Å; F132-F730 HydrophobicContact CB-CE2 4.44Å; C728-F730 PolarHBondContact O-N 2.98Å; F730-P732 VanDerWaalsContact O-CD 3.27Å; F730-P732 WeakPolarHBondContact O-CD 3.36Å
731	P	48.9	Very low	58.4	Low	52 Å²	52	45.3 Å²	45.3	34%	0.338	22%	0.222	S	C	.	.			trans	-48.6	114.4	157.4	-27.8	36.1	0	0	0	110.7	Y733 I734	P731-Y733 VanDerWaalsContact C-N 3.27Å; P731-Y733 HydrophobicContact CB-CD1 4.26Å; P731-Y733 HydrophobicContact CB-CE1 3.61Å; P731-Y733 PolarHBondContact O-N 3.12Å; P731-I734 PolarHBondContact O-N 3.22Å
732	P	51	Low	58.3	Low	55 Å²	55	47 Å²	47	36%	0.357	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45	-44.5	-164.5	-39.8	39.7	0	0	0	116.2	F730 I734 D736 T766	F730-P732 VanDerWaalsContact O-CD 3.27Å; F730-P732 WeakPolarHBondContact O-CD 3.36Å; P732-I734 VanDerWaalsContact C-N 3.31Å; P732-I734 PolarHBondContact O-N 3.22Å; P732-D736 VanDerWaalsContact O-CG 3.27Å; P732-D736 PolarHBondContact O-N 2.83Å; P732-T766 HydrophobicContact CB-CG2 3.58Å; P732-T766 HydrophobicContact CG-CG2 4.34Å
733	Y	55.5	Low	58.3	Low	70 Å²	70	46.8 Å²	46.8	28%	0.275	23%	0.228	S	C	.	.	H	α-helix	trans	-67.3	-20.7	-167.4	58.7	-92.2	0	0	0	115.2	P731 L737	P731-Y733 VanDerWaalsContact C-N 3.27Å; P731-Y733 HydrophobicContact CB-CD1 4.26Å; P731-Y733 HydrophobicContact CB-CE1 3.61Å; P731-Y733 PolarHBondContact O-N 3.12Å; Y733-L737 HydrophobicContact CD2-CD1 4.44Å; Y733-L737 WeakPolarHBondContact O-CB 3.33Å; Y733-L737 VanDerWaalsContact O-CD1 3.25Å; Y733-L737 WeakPolarHBondContact O-CD1 3.46Å; Y733-L737 WeakPolarHBondContact O-CG 3.3Å; Y733-L737 PolarHBondContact O-N 3.01Å; Y733-L737 VanDerWaalsContact O-N 3.09Å
734	I	53.4	Low	58	Low	66 Å²	66	47 Å²	47	34%	0.338	23%	0.229	S	C	.	.	H	α-helix	trans	-74.8	-42.6	-175.7	-58.3	-177.3	0	0	0	111.2	P731 P732	P731-I734 PolarHBondContact O-N 3.22Å; P732-I734 VanDerWaalsContact C-N 3.31Å; P732-I734 PolarHBondContact O-N 3.22Å
735	F	54	Low	57.9	Low	38 Å²	38	49.9 Å²	49.9	17%	0.167	24%	0.244	C	C	.	.	H	α-helix	trans	-65.1	-46.2	172.9	179.2	-91.1	0	0	0	110.3	F132 L737 L738 Y739 I763 P764	F132-F735 AromaticContact CE2-CD2 3.67Å; F132-F735 HydrophobicContact CE2-CD2 3.67Å; F132-F735 AromaticContact CE2-CE2 3.8Å; F132-F735 HydrophobicContact CE2-CE2 3.8Å; F132-F735 AromaticContact CZ-CD2 3.82Å; F132-F735 HydrophobicContact CZ-CD2 3.82Å; F132-F735 AromaticContact CZ-CE2 3.88Å; F132-F735 HydrophobicContact CZ-CE2 3.88Å; F735-L737 VanDerWaalsContact C-N 3.27Å; F735-L737 PolarHBondContact O-N 3.12Å; F735-L738 PolarHBondContact O-N 3.35Å; F735-Y739 AromaticContact CE1-CD2 3.91Å; F735-Y739 HydrophobicContact CE1-CD2 3.91Å; F735-Y739 AromaticContact CZ-CD2 3.81Å; F735-Y739 HydrophobicContact CZ-CD2 3.81Å; F735-Y739 HydrophobicContact CZ-CE2 4.29Å; F735-Y739 PolarHBondContact O-N 3.39Å; F735-I763 HydrophobicContact CE1-CG2 4.29Å; F735-P764 HydrophobicContact CD1-CG 3.72Å; F735-P764 HydrophobicContact CE1-CG 3.84Å; F735-P764 HydrophobicContact CG-CG 4.32Å
736	D	58.1	Low	57.9	Low	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-52	-45.4	178.5	-66.2	-2.1	0	0	0	112	P732 Y739 I740 T766 L768 F769	P732-D736 VanDerWaalsContact O-CG 3.27Å; P732-D736 PolarHBondContact O-N 2.83Å; D736-Y739 PolarHBondContact O-N 3.02Å; D736-I740 HydrophobicContact CB-CD1 4.06Å; D736-I740 VanDerWaalsContact O-CB 3.26Å; D736-I740 WeakPolarHBondContact O-CB 3.44Å; D736-I740 WeakPolarHBondContact O-CD1 3.29Å; D736-I740 WeakPolarHBondContact O-CG1 3.41Å; D736-I740 PolarHBondContact O-N 3.41Å; D736-T766 WeakPolarHBondContact OD1-CB 3.3Å; D736-T766 WeakPolarHBondContact OD1-CG2 3.23Å; D736-T766 PolarHBondContact OD1-OG1 3.06Å; D736-T766 VanDerWaalsContact OD2-CB 3.24Å; D736-T766 WeakPolarHBondContact OD2-CB 3.48Å; D736-T766 PolarHBondContact OD2-OG1 3.05Å; D736-L768 HydrophobicContact CB-CB 4.31Å; D736-L768 WeakPolarHBondContact OD2-CB 3.43Å; D736-L768 PolarHBondContact OD2-N 2.89Å; D736-F769 HydrophobicContact CB-CB 4.31Å; D736-F769 HydrophobicContact CB-CD2 4.12Å; D736-F769 PolarHBondContact OD2-N 3.34Å
737	L	62.7	Low	58	Low	37 Å²	37	51.1 Å²	51.1	19%	0.194	25%	0.251	C	S	.	.	H	α-helix	trans	-68	-41.2	-172	-78.1	163.4	0	0	0	114.1	Y733 F735 R741 I796 L800	Y733-L737 HydrophobicContact CD2-CD1 4.44Å; Y733-L737 WeakPolarHBondContact O-CB 3.33Å; Y733-L737 VanDerWaalsContact O-CD1 3.25Å; Y733-L737 WeakPolarHBondContact O-CD1 3.46Å; Y733-L737 WeakPolarHBondContact O-CG 3.3Å; Y733-L737 PolarHBondContact O-N 3.01Å; Y733-L737 VanDerWaalsContact O-N 3.09Å; F735-L737 VanDerWaalsContact C-N 3.27Å; F735-L737 PolarHBondContact O-N 3.12Å; L737-R741 VanDerWaalsContact O-CB 3.29Å; L737-R741 WeakPolarHBondContact O-CB 3.47Å; L737-R741 PolarHBondContact O-N 3.33Å; L737-R741 VanDerWaalsContact O-N 3.1Å; L737-I796 HydrophobicContact CD1-CD1 3.99Å; L737-I796 HydrophobicContact CD1-CG1 4.37Å; L737-I796 HydrophobicContact CD1-CG2 3.5Å; L737-I796 HydrophobicContact CD2-CG2 3.29Å; L737-I796 HydrophobicContact CG-CG2 3.98Å; L737-L800 HydrophobicContact CD2-CD1 3.72Å; L737-L800 HydrophobicContact CD2-CD2 4.21Å; L737-L800 HydrophobicContact CD2-CG 3.98Å
738	L	57.1	Low	57.7	Low	85 Å²	85	55.5 Å²	55.5	45%	0.445	28%	0.275	S	S	.	.	H	α-helix	trans	-66.2	-43.6	176.3	-67.8	171.5	0	0	0	110.3	F735 D742	F735-L738 PolarHBondContact O-N 3.35Å; L738-D742 PolarHBondContact O-N 3.47Å; L738-D742 VanDerWaalsContact O-N 3.12Å
739	Y	59	Low	57.5	Low	54 Å²	54	57 Å²	57	21%	0.212	29%	0.286	C	S	.	.	H	α-helix	trans	-71.4	-43.3	-178.5	-159.6	-63.1	0	0	0	112	F735 D736 R741 D742 R743 F759 I763 F769	F735-Y739 AromaticContact CE1-CD2 3.91Å; F735-Y739 HydrophobicContact CE1-CD2 3.91Å; F735-Y739 AromaticContact CZ-CD2 3.81Å; F735-Y739 HydrophobicContact CZ-CD2 3.81Å; F735-Y739 HydrophobicContact CZ-CE2 4.29Å; F735-Y739 PolarHBondContact O-N 3.39Å; D736-Y739 PolarHBondContact O-N 3.02Å; Y739-R741 VanDerWaalsContact C-N 3.34Å; Y739-R741 PolarHBondContact O-N 2.96Å; Y739-D742 PolarHBondContact O-N 3.1Å; Y739-R743 HydrophobicContact CD1-CG 3.49Å; Y739-R743 VanDerWaalsContact CD1-CG 3.49Å; Y739-R743 HydrophobicContact CE1-CG 3.56Å; Y739-R743 WeakPolarHBondContact O-CB 3.33Å; Y739-R743 WeakPolarHBondContact O-CG 3.44Å; Y739-R743 PolarHBondContact O-N 3.03Å; Y739-F759 WeakPolarHBondContact OH-CD1 3.45Å; Y739-F759 WeakPolarHBondContact OH-CE1 3.39Å; Y739-I763 WeakPolarHBondContact OH-CD1 3.48Å; Y739-F769 AromaticContact CD1-CE2 3.45Å; Y739-F769 HydrophobicContact CD1-CE2 3.45Å; Y739-F769 VanDerWaalsContact CD1-CE2 3.45Å; Y739-F769 AromaticContact CD1-CZ 3.28Å; Y739-F769 HydrophobicContact CD1-CZ 3.28Å; Y739-F769 HydrophobicContact CE1-CE1 4.46Å; Y739-F769 HydrophobicContact CE1-CE2 4.17Å; Y739-F769 AromaticContact CE1-CZ 3.52Å; Y739-F769 HydrophobicContact CE1-CZ 3.52Å; Y739-F769 AromaticContact CG-CE2 3.9Å; Y739-F769 HydrophobicContact CG-CE2 3.9Å; Y739-F769 HydrophobicContact CG-CZ 4.07Å
740	I	64.5	Low	57.3	Low	2 Å²	2	58.7 Å²	58.7	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-57.3	-48.5	173.9	-71.3	162	0	0	0	109.7	D736 D742 R743 L744 L768 F769 F772 L800	D736-I740 HydrophobicContact CB-CD1 4.06Å; D736-I740 VanDerWaalsContact O-CB 3.26Å; D736-I740 WeakPolarHBondContact O-CB 3.44Å; D736-I740 WeakPolarHBondContact O-CD1 3.29Å; D736-I740 WeakPolarHBondContact O-CG1 3.41Å; D736-I740 PolarHBondContact O-N 3.41Å; I740-D742 PolarHBondContact O-N 3.11Å; I740-R743 PolarHBondContact O-N 3.13Å; I740-L744 HydrophobicContact CG2-CD1 3.64Å; I740-L744 HydrophobicContact CG2-CG 4.17Å; I740-L744 WeakPolarHBondContact O-CG 3.31Å; I740-L744 PolarHBondContact O-N 2.89Å; I740-L768 HydrophobicContact CD1-CD2 4.22Å; I740-F769 HydrophobicContact CD1-CD2 4.1Å; I740-F769 HydrophobicContact CG1-CD2 3.6Å; I740-F769 HydrophobicContact CG1-CE2 3.72Å; I740-F772 HydrophobicContact CD1-CD2 3.75Å; I740-F772 HydrophobicContact CD1-CE2 4.16Å; I740-F772 HydrophobicContact CG1-CD2 4.36Å; I740-F772 HydrophobicContact CG2-CD2 4.49Å; I740-L800 HydrophobicContact CG2-CD1 4.14Å; I740-L800 HydrophobicContact CG2-CD2 3.92Å
741	R	64.4	Low	56.8	Low	104 Å²	104	63.8 Å²	63.8	39%	0.392	32%	0.323	S	S	.	.	H	α-helix	trans	-57.9	-50.8	-179.3	-171.5	-159.5	69.9	-178.6	-1	111.2	L737 Y739 R743 L744 I745	L737-R741 VanDerWaalsContact O-CB 3.29Å; L737-R741 WeakPolarHBondContact O-CB 3.47Å; L737-R741 PolarHBondContact O-N 3.33Å; L737-R741 VanDerWaalsContact O-N 3.1Å; Y739-R741 VanDerWaalsContact C-N 3.34Å; Y739-R741 PolarHBondContact O-N 2.96Å; R741-R743 VanDerWaalsContact C-N 3.3Å; R741-R743 PolarHBondContact O-N 2.99Å; R741-L744 PolarHBondContact O-N 3.12Å; R741-I745 HydrophobicContact CG-CD1 3.99Å; R741-I745 VanDerWaalsContact O-CG1 3.29Å; R741-I745 WeakPolarHBondContact O-CG1 3.07Å; R741-I745 PolarHBondContact O-N 2.99Å
742	D	60.6	Low	56.2	Low	71 Å²	71	65.1 Å²	65.1	38%	0.38	33%	0.334	S	S	.	.	H	α-helix	trans	-70.8	-27.4	-176.4	-68.3	3.3	0	0	0	111.9	L738 Y739 I740 N746	L738-D742 PolarHBondContact O-N 3.47Å; L738-D742 VanDerWaalsContact O-N 3.12Å; Y739-D742 PolarHBondContact O-N 3.1Å; I740-D742 PolarHBondContact O-N 3.11Å; D742-N746 VanDerWaalsContact O-CG 3.25Å; D742-N746 PolarHBondContact O-N 3.38Å; D742-N746 VanDerWaalsContact O-N 3.14Å; D742-N746 PolarHBondContact O-ND2 3.48Å
743	R	63	Low	55.7	Low	38 Å²	38	69.5 Å²	69.5	14%	0.143	35%	0.348	C	S	.	.	H	α-helix	trans	-70.6	-44.6	170.3	-67.1	-71.3	-88.5	164.3	-17.4	112.8	Y739 I740 R741 I745 N746 I747 F759 F773	Y739-R743 HydrophobicContact CD1-CG 3.49Å; Y739-R743 VanDerWaalsContact CD1-CG 3.49Å; Y739-R743 HydrophobicContact CE1-CG 3.56Å; Y739-R743 WeakPolarHBondContact O-CB 3.33Å; Y739-R743 WeakPolarHBondContact O-CG 3.44Å; Y739-R743 PolarHBondContact O-N 3.03Å; I740-R743 PolarHBondContact O-N 3.13Å; R741-R743 VanDerWaalsContact C-N 3.3Å; R741-R743 PolarHBondContact O-N 2.99Å; R743-I745 VanDerWaalsContact C-N 3.3Å; R743-I745 PolarHBondContact O-N 3.02Å; R743-N746 PolarHBondContact O-N 3.44Å; R743-I747 WeakPolarHBondContact O-CG1 3.5Å; R743-I747 PolarHBondContact O-N 2.93Å; R743-F759 VanDerWaalsContact CZ-CZ 3.41Å; R743-F773 HydrophobicContact CB-CZ 4.47Å; R743-F773 HydrophobicContact CG-CZ 4.45Å
744	L	64.4	Low	54.8	Low	4 Å²	4	73.3 Å²	73.3	2%	0.021	37%	0.368	C	S	.	.	H	α-helix	trans	-63.3	-37	176.3	-69.8	170.8	0	0	0	111.7	I740 R741 N748 H803 I804 A807 W814	I740-L744 HydrophobicContact CG2-CD1 3.64Å; I740-L744 HydrophobicContact CG2-CG 4.17Å; I740-L744 WeakPolarHBondContact O-CG 3.31Å; I740-L744 PolarHBondContact O-N 2.89Å; R741-L744 PolarHBondContact O-N 3.12Å; L744-N748 PolarHBondContact O-N 3.3Å; L744-H803 HydrophobicContact CB-CB 3.94Å; L744-H803 HydrophobicContact CD1-CB 3.79Å; L744-I804 HydrophobicContact CD1-CG1 3.9Å; L744-A807 HydrophobicContact CD2-CB 3.7Å; L744-W814 HydrophobicContact CD2-CH2 3.68Å; L744-W814 HydrophobicContact CD2-CZ2 3.9Å
745	I	64.2	Low	54	Low	75 Å²	75	76.3 Å²	76.3	39%	0.385	38%	0.381	S	S	.	.	H	α-helix	trans	-62	-45.9	172.8	-70.5	165.8	0	0	0	111	R741 R743 N748	R741-I745 HydrophobicContact CG-CD1 3.99Å; R741-I745 VanDerWaalsContact O-CG1 3.29Å; R741-I745 WeakPolarHBondContact O-CG1 3.07Å; R741-I745 PolarHBondContact O-N 2.99Å; R743-I745 VanDerWaalsContact C-N 3.3Å; R743-I745 PolarHBondContact O-N 3.02Å; I745-N748 WeakPolarHBondContact O-CB 3.42Å; I745-N748 PolarHBondContact O-N 2.94Å
746	N	61	Low	53.3	Low	97 Å²	97	77.7 Å²	77.7	52%	0.519	39%	0.389	S	S	.	.	H	α-helix	trans	-68.7	-33.1	-179.2	-71.5	-23.3	0	0	0	113.4	D742 R743 N748 S749	D742-N746 VanDerWaalsContact O-CG 3.25Å; D742-N746 PolarHBondContact O-N 3.38Å; D742-N746 VanDerWaalsContact O-N 3.14Å; D742-N746 PolarHBondContact O-ND2 3.48Å; R743-N746 PolarHBondContact O-N 3.44Å; N746-N748 PolarHBondContact O-N 2.82Å; N746-S749 PolarHBondContact O-N 3.01Å; N746-S749 VanDerWaalsContact O-N 3.07Å; N746-S749 PolarHBondContact O-OG 3.24Å
747	I	62.1	Low	52.2	Low	36 Å²	36	85.6 Å²	85.6	19%	0.185	43%	0.426	C	S	.	.	H	α-helix	trans	-60.6	-28.1	173.2	-70.9	165.4	0	0	0	112	R743 S749 A807	R743-I747 WeakPolarHBondContact O-CG1 3.5Å; R743-I747 PolarHBondContact O-N 2.93Å; I747-S749 PolarHBondContact O-N 3.21Å; I747-A807 HydrophobicContact CG2-CB 4.13Å
748	N	55.1	Low	50.8	Low	94 Å²	94	88.5 Å²	88.5	50%	0.503	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	4.5	177.2	-158.3	21.2	0	0	0	113.6	L744 I745 N746	L744-N748 PolarHBondContact O-N 3.3Å; I745-N748 WeakPolarHBondContact O-CB 3.42Å; I745-N748 PolarHBondContact O-N 2.94Å; N746-N748 PolarHBondContact O-N 2.82Å
749	S	49.2	Very low	49.6	Very low	54 Å²	54	88.5 Å²	88.5	38%	0.378	45%	0.446	S	S	.	.	S	Bend	trans	-111.9	126.5	172.7	70.7	0	0	0	0	110.1	N746 I747 Q751	N746-S749 PolarHBondContact O-N 3.01Å; N746-S749 VanDerWaalsContact O-N 3.07Å; N746-S749 PolarHBondContact O-OG 3.24Å; I747-S749 PolarHBondContact O-N 3.21Å; S749-Q751 PolarHBondContact O-N 3.3Å
750	N	45.1	Very low	48.5	Very low	168 Å²	168	88.1 Å²	88.1	90%	0.898	45%	0.452	S	S	*	.			trans	-73.3	38.3	-172.3	-73.5	-13.3	0	0	0	114.5
751	Q	39.7	Very low	47.2	Very low	140 Å²	140	93.3 Å²	93.3	65%	0.654	49%	0.485	S	S	*	.			trans	-83.9	128.9	169.9	-70.9	-171.7	-28.8	0	0	109.7	S749	S749-Q751 PolarHBondContact O-N 3.3Å
752	S	36.2	Very low	46	Very low	80 Å²	80	94.1 Å²	94.1	56%	0.559	49%	0.489	S	S	*	.			trans	-56.4	150.3	-168.3	52	0	0	0	0	114	Q754 Q755	S752-Q754 PolarHBondContact O-N 3.38Å; S752-Q755 PolarHBondContact O-N 2.93Å
753	F	40	Very low	45.3	Very low	146 Å²	146	93.6 Å²	93.6	64%	0.64	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-48.6	-14.2	-177.6	-107.3	-91.4	0	0	0	116.6	L756	F753-L756 HydrophobicContact CD1-CD1 3.92Å; F753-L756 HydrophobicContact CE1-CD1 4.13Å; F753-L756 HydrophobicContact CG-CD1 4.27Å; F753-L756 WeakPolarHBondContact O-CB 3.46Å; F753-L756 PolarHBondContact O-N 3.33Å
754	Q	37.9	Very low	44.3	Very low	150 Å²	150	93 Å²	93	70%	0.701	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-68.8	-31.5	179.4	-70.7	175.1	-33.4	0	0	113.2	S752 L756 Q757	S752-Q754 PolarHBondContact O-N 3.38Å; Q754-L756 PolarHBondContact O-N 3.43Å; Q754-Q757 PolarHBondContact O-N 2.99Å
755	Q	35.6	Very low	43.4	Very low	130 Å²	130	98.6 Å²	98.6	61%	0.607	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-79.4	-2	175.8	-72.2	-171.9	-17.8	0	0	113.9	S752 Q757	S752-Q755 PolarHBondContact O-N 2.93Å; Q755-Q757 VanDerWaalsContact C-N 3.29Å
756	L	38.4	Very low	42.7	Very low	66 Å²	66	95.6 Å²	95.6	35%	0.346	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-79	-8.7	171	-87.2	156.6	0	0	0	113.6	F753 Q754 F759	F753-L756 HydrophobicContact CD1-CD1 3.92Å; F753-L756 HydrophobicContact CE1-CD1 4.13Å; F753-L756 HydrophobicContact CG-CD1 4.27Å; F753-L756 WeakPolarHBondContact O-CB 3.46Å; F753-L756 PolarHBondContact O-N 3.33Å; Q754-L756 PolarHBondContact O-N 3.43Å; L756-F759 WeakPolarHBondContact O-CD2 3.4Å
757	Q	35.3	Very low	42.2	Very low	166 Å²	166	91.9 Å²	91.9	78%	0.776	48%	0.477	S	S	*	.	S	Bend	trans	-92.1	-18.6	-173.5	-65.6	-175.2	-49.4	0	0	115	Q754 Q755 F759	Q754-Q757 PolarHBondContact O-N 2.99Å; Q755-Q757 VanDerWaalsContact C-N 3.29Å; Q757-F759 PolarHBondContact O-N 3.15Å; Q757-F759 VanDerWaalsContact O-N 3.15Å
758	S	33.5	Very low	42	Very low	99 Å²	99	90.6 Å²	90.6	69%	0.692	47%	0.471	S	S	*	.			trans	-89.6	69.1	-179.4	61.1	0	0	0	0	112.2
759	F	33.3	Very low	42.2	Very low	85 Å²	85	87.1 Å²	87.1	37%	0.373	45%	0.451	S	S	.	.			trans	-116.3	142.2	172.9	-81	-87.4	0	0	0	111.2	Y739 R743 L756 Q757	Y739-F759 WeakPolarHBondContact OH-CD1 3.45Å; Y739-F759 WeakPolarHBondContact OH-CE1 3.39Å; R743-F759 VanDerWaalsContact CZ-CZ 3.41Å; L756-F759 WeakPolarHBondContact O-CD2 3.4Å; Q757-F759 PolarHBondContact O-N 3.15Å; Q757-F759 VanDerWaalsContact O-N 3.15Å
760	S	34.5	Very low	42.7	Very low	46 Å²	46	85.6 Å²	85.6	32%	0.322	44%	0.441	S	S	.	.			trans	-54.6	135.8	171.6	180	0	0	0	0	109.4	Y762	S760-Y762 PolarHBondContact O-N 2.88Å; S760-Y762 VanDerWaalsContact O-N 3.12Å; S760-Y762 PolarHBondContact OG-N 2.91Å
761	P	38.5	Very low	43.4	Very low	110 Å²	110	77.6 Å²	77.6	71%	0.714	40%	0.398	S	S	*	.	S	Bend	trans	-68.2	-8.1	177.6	29.8	-35.4	0	0	0	112.6
762	Y	38.4	Very low	44.7	Very low	122 Å²	122	71.1 Å²	71.1	48%	0.478	37%	0.368	S	S	.	.			trans	-101.8	115.6	-179.8	-51.4	-73.3	0	0	0	110.6	I722 H725 S760	I722-Y762 HydrophobicContact CG1-CE2 4.11Å; H725-Y762 WeakPolarHBondContact CD2-CB 3.46Å; H725-Y762 AromaticContact CD2-CG 3.97Å; H725-Y762 VanDerWaalsContact CE1-C 3.48Å; H725-Y762 PolarHBondContact CE1-O 3.24Å; H725-Y762 VanDerWaalsContact NE2-CB 3.3Å; H725-Y762 WeakPolarHBondContact NE2-CB 3.23Å; H725-Y762 PolarHBondContact NE2-O 2.89Å; S760-Y762 PolarHBondContact O-N 2.88Å; S760-Y762 VanDerWaalsContact O-N 3.12Å; S760-Y762 PolarHBondContact OG-N 2.91Å
763	I	46.2	Very low	45.9	Very low	60 Å²	60	69.6 Å²	69.6	31%	0.308	35%	0.351	S	S	.	.			trans	-141.9	135.6	169.8	-61.4	-178.4	0	0	0	105.6	F735 Y739 F769	F735-I763 HydrophobicContact CE1-CG2 4.29Å; Y739-I763 WeakPolarHBondContact OH-CD1 3.48Å; I763-F769 HydrophobicContact CG2-CD1 4.49Å; I763-F769 HydrophobicContact CG2-CE1 4.45Å
764	P	41	Very low	46.5	Very low	24 Å²	24	64.9 Å²	64.9	16%	0.156	34%	0.335	C	S	.	.			trans	-59.6	144.8	-179.7	25.5	-35	0	0	0	111.6	C728 F735 T766	C728-P764 HydrophobicContact CB-CB 3.88Å; C728-P764 HydrophobicContact CB-CG 4.08Å; F735-P764 HydrophobicContact CD1-CG 3.72Å; F735-P764 HydrophobicContact CE1-CG 3.84Å; F735-P764 HydrophobicContact CG-CG 4.32Å; P764-T766 HydrophobicContact CB-CG2 3.91Å; P764-T766 HydrophobicContact CG-CG2 4.05Å; P764-T766 PolarHBondContact O-N 3.38Å; P764-T766 PolarHBondContact O-OG1 2.96Å
765	K	45.5	Very low	47.2	Very low	123 Å²	123	59.7 Å²	59.7	54%	0.535	32%	0.315	S	S	.	.			trans	-79.9	82.7	-174.7	-60.9	-168.5	175.7	-169.7	0	110.2	E780 L781 L784	K765-E780 PolarHBondContact NZ-O 3.43Å; K765-L781 HydrophobicContact CB-CD2 4.24Å; K765-L781 HydrophobicContact CD-CD2 3.69Å; K765-L781 HydrophobicContact CG-CD2 3.67Å; K765-L784 HydrophobicContact CB-CD1 4.35Å; K765-L784 WeakPolarHBondContact O-CD1 3.25Å
766	T	49.5	Very low	47.7	Very low	12 Å²	12	58.9 Å²	58.9	7%	0.074	32%	0.315	C	S	.	.			trans	-113.6	133.7	-168	54.3	0	0	0	0	112.8	P732 D736 P764 L768 F769 S770	P732-T766 HydrophobicContact CB-CG2 3.58Å; P732-T766 HydrophobicContact CG-CG2 4.34Å; D736-T766 WeakPolarHBondContact OD1-CB 3.3Å; D736-T766 WeakPolarHBondContact OD1-CG2 3.23Å; D736-T766 PolarHBondContact OD1-OG1 3.06Å; D736-T766 VanDerWaalsContact OD2-CB 3.24Å; D736-T766 WeakPolarHBondContact OD2-CB 3.48Å; D736-T766 PolarHBondContact OD2-OG1 3.05Å; P764-T766 HydrophobicContact CB-CG2 3.91Å; P764-T766 HydrophobicContact CG-CG2 4.05Å; P764-T766 PolarHBondContact O-N 3.38Å; P764-T766 PolarHBondContact O-OG1 2.96Å; T766-L768 PolarHBondContact O-N 3.28Å; T766-F769 VanDerWaalsContact OG1-CB 3.29Å; T766-F769 WeakPolarHBondContact OG1-CB 3.35Å; T766-S770 PolarHBondContact O-N 2.89Å
767	C	51.6	Low	47.9	Very low	19 Å²	19	64.4 Å²	64.4	13%	0.128	34%	0.339	C	S	.	.	H	α-helix	trans	-64.3	-40.7	-171.3	-58.5	0	0	0	0	113.2	S770	C767-S770 PolarHBondContact O-N 3.15Å; C767-S770 PolarHBondContact O-OG 3Å
768	L	58.6	Low	48	Very low	9 Å²	9	58.8 Å²	58.8	5%	0.047	31%	0.313	C	S	.	.	H	α-helix	trans	-70.2	-42.6	-173.2	-140	173.6	0	0	0	110.4	D736 I740 T766 S770 A771 F772 I792 L827	D736-L768 HydrophobicContact CB-CB 4.31Å; D736-L768 WeakPolarHBondContact OD2-CB 3.43Å; D736-L768 PolarHBondContact OD2-N 2.89Å; I740-L768 HydrophobicContact CD1-CD2 4.22Å; T766-L768 PolarHBondContact O-N 3.28Å; L768-S770 VanDerWaalsContact C-N 3.3Å; L768-S770 PolarHBondContact O-N 3.49Å; L768-A771 PolarHBondContact O-N 3.42Å; L768-F772 HydrophobicContact CD2-CE2 3.86Å; L768-F772 WeakPolarHBondContact O-CD2 3.31Å; L768-I792 HydrophobicContact CD1-CD1 3.71Å; L768-I792 HydrophobicContact CD1-CG1 4.17Å; L768-I792 HydrophobicContact CD1-CG2 4.21Å; L768-I792 HydrophobicContact CG-CD1 3.91Å; L768-L827 HydrophobicContact CD2-CD1 3.94Å; L768-L827 HydrophobicContact CD2-CD2 4.11Å; L768-L827 HydrophobicContact CG-CD1 3.99Å
769	F	58.9	Low	48.1	Very low	20 Å²	20	57.8 Å²	57.8	9%	0.088	31%	0.306	C	S	.	.	H	α-helix	trans	-55.8	-44.6	171.7	-149.1	-104.3	0	0	0	112.4	D736 Y739 I740 I763 T766 A771 F772 F773	D736-F769 HydrophobicContact CB-CB 4.31Å; D736-F769 HydrophobicContact CB-CD2 4.12Å; D736-F769 PolarHBondContact OD2-N 3.34Å; Y739-F769 AromaticContact CD1-CE2 3.45Å; Y739-F769 HydrophobicContact CD1-CE2 3.45Å; Y739-F769 VanDerWaalsContact CD1-CE2 3.45Å; Y739-F769 AromaticContact CD1-CZ 3.28Å; Y739-F769 HydrophobicContact CD1-CZ 3.28Å; Y739-F769 HydrophobicContact CE1-CE1 4.46Å; Y739-F769 HydrophobicContact CE1-CE2 4.17Å; Y739-F769 AromaticContact CE1-CZ 3.52Å; Y739-F769 HydrophobicContact CE1-CZ 3.52Å; Y739-F769 AromaticContact CG-CE2 3.9Å; Y739-F769 HydrophobicContact CG-CE2 3.9Å; Y739-F769 HydrophobicContact CG-CZ 4.07Å; I740-F769 HydrophobicContact CD1-CD2 4.1Å; I740-F769 HydrophobicContact CG1-CD2 3.6Å; I740-F769 HydrophobicContact CG1-CE2 3.72Å; I763-F769 HydrophobicContact CG2-CD1 4.49Å; I763-F769 HydrophobicContact CG2-CE1 4.45Å; T766-F769 VanDerWaalsContact OG1-CB 3.29Å; T766-F769 WeakPolarHBondContact OG1-CB 3.35Å; F769-A771 PolarHBondContact O-N 2.91Å; F769-F772 PolarHBondContact O-N 3.24Å; F769-F772 VanDerWaalsContact O-N 3.09Å; F769-F773 AromaticContact CD1-CD2 3.79Å; F769-F773 HydrophobicContact CD1-CD2 3.79Å; F769-F773 AromaticContact CD1-CE2 3.63Å; F769-F773 HydrophobicContact CD1-CE2 3.63Å; F769-F773 HydrophobicContact CD2-CE2 4.16Å; F769-F773 AromaticContact CE1-CD2 3.62Å; F769-F773 HydrophobicContact CE1-CD2 3.62Å; F769-F773 AromaticContact CE1-CE2 3.17Å; F769-F773 HydrophobicContact CE1-CE2 3.17Å; F769-F773 AromaticContact CE1-CZ 3.76Å; F769-F773 HydrophobicContact CE1-CZ 3.76Å; F769-F773 AromaticContact CE2-CE2 3.75Å; F769-F773 HydrophobicContact CE2-CE2 3.75Å; F769-F773 HydrophobicContact CE2-CZ 4.18Å; F769-F773 HydrophobicContact CG-CD2 4.46Å; F769-F773 HydrophobicContact CG-CE2 4.08Å; F769-F773 HydrophobicContact CZ-CD2 4.14Å; F769-F773 AromaticContact CZ-CE2 3.22Å; F769-F773 HydrophobicContact CZ-CE2 3.22Å; F769-F773 AromaticContact CZ-CZ 3.49Å; F769-F773 HydrophobicContact CZ-CZ 3.49Å; F769-F773 VanDerWaalsContact CZ-CZ 3.49Å; F769-F773 WeakPolarHBondContact O-CD2 3.44Å
770	S	58.5	Low	48.3	Very low	23 Å²	23	58.4 Å²	58.4	16%	0.161	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-17.1	-175.1	84.5	0	0	0	0	114.8	T766 C767 L768 K823	T766-S770 PolarHBondContact O-N 2.89Å; C767-S770 PolarHBondContact O-N 3.15Å; C767-S770 PolarHBondContact O-OG 3Å; L768-S770 VanDerWaalsContact C-N 3.3Å; L768-S770 PolarHBondContact O-N 3.49Å; S770-K823 VanDerWaalsContact O-CD 3.24Å; S770-K823 WeakPolarHBondContact O-CD 3.38Å
771	A	61.3	Low	48.4	Very low	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-6.9	178.7	0	0	0	0	0	114.9	L768 F769 I818 K823 L827	L768-A771 PolarHBondContact O-N 3.42Å; F769-A771 PolarHBondContact O-N 2.91Å; A771-I818 WeakPolarHBondContact O-CG2 3.46Å; A771-K823 HydrophobicContact CB-CB 3.91Å; A771-L827 HydrophobicContact CB-CB 4.29Å; A771-L827 HydrophobicContact CB-CD2 4.14Å
772	F	65.9	Low	48	Very low	4 Å²	4	61.3 Å²	61.3	2%	0.018	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	13.2	-174.7	-67.6	-74.6	0	0	0	114.8	I740 L768 F769 L800 I804 W814 I818 M824 L827	I740-F772 HydrophobicContact CD1-CD2 3.75Å; I740-F772 HydrophobicContact CD1-CE2 4.16Å; I740-F772 HydrophobicContact CG1-CD2 4.36Å; I740-F772 HydrophobicContact CG2-CD2 4.49Å; L768-F772 HydrophobicContact CD2-CE2 3.86Å; L768-F772 WeakPolarHBondContact O-CD2 3.31Å; F769-F772 PolarHBondContact O-N 3.24Å; F769-F772 VanDerWaalsContact O-N 3.09Å; F772-L800 HydrophobicContact CE2-CD1 4.41Å; F772-L800 HydrophobicContact CZ-CD1 4.43Å; F772-I804 HydrophobicContact CE1-CD1 3.61Å; F772-I804 HydrophobicContact CE1-CG1 4.1Å; F772-I804 HydrophobicContact CZ-CD1 3.95Å; F772-W814 PolarHBondContact O-NE1 2.99Å; F772-I818 VanDerWaalsContact O-CD1 3.29Å; F772-I818 WeakPolarHBondContact O-CD1 3.46Å; F772-M824 HydrophobicContact CD1-CE 4Å; F772-M824 HydrophobicContact CE1-CE 4.04Å; F772-M824 HydrophobicContact CE1-CG 4.39Å; F772-L827 HydrophobicContact CE2-CD2 3.52Å; F772-L827 HydrophobicContact CZ-CD2 3.53Å
773	F	61.1	Low	47.7	Very low	48 Å²	48	62 Å²	62	21%	0.211	32%	0.318	C	S	.	.	S	Bend	trans	-134.2	142.2	179.7	-64.5	-83.1	0	0	0	112.8	R743 F769	R743-F773 HydrophobicContact CB-CZ 4.47Å; R743-F773 HydrophobicContact CG-CZ 4.45Å; F769-F773 AromaticContact CD1-CD2 3.79Å; F769-F773 HydrophobicContact CD1-CD2 3.79Å; F769-F773 AromaticContact CD1-CE2 3.63Å; F769-F773 HydrophobicContact CD1-CE2 3.63Å; F769-F773 HydrophobicContact CD2-CE2 4.16Å; F769-F773 AromaticContact CE1-CD2 3.62Å; F769-F773 HydrophobicContact CE1-CD2 3.62Å; F769-F773 AromaticContact CE1-CE2 3.17Å; F769-F773 HydrophobicContact CE1-CE2 3.17Å; F769-F773 AromaticContact CE1-CZ 3.76Å; F769-F773 HydrophobicContact CE1-CZ 3.76Å; F769-F773 AromaticContact CE2-CE2 3.75Å; F769-F773 HydrophobicContact CE2-CE2 3.75Å; F769-F773 HydrophobicContact CE2-CZ 4.18Å; F769-F773 HydrophobicContact CG-CD2 4.46Å; F769-F773 HydrophobicContact CG-CE2 4.08Å; F769-F773 HydrophobicContact CZ-CD2 4.14Å; F769-F773 AromaticContact CZ-CE2 3.22Å; F769-F773 HydrophobicContact CZ-CE2 3.22Å; F769-F773 AromaticContact CZ-CZ 3.49Å; F769-F773 HydrophobicContact CZ-CZ 3.49Å; F769-F773 VanDerWaalsContact CZ-CZ 3.49Å; F769-F773 WeakPolarHBondContact O-CD2 3.44Å
774	P	53.4	Low	47.2	Very low	46 Å²	46	63.7 Å²	63.7	30%	0.299	33%	0.327	S	S	.	.			trans	-56.6	143	176	-28.6	37	0	0	0	114.2	N776 N817	P774-N776 VanDerWaalsContact C-N 3.28Å; P774-N776 PolarHBondContact O-N 2.79Å; P774-N817 HydrophobicContact CB-CB 4.03Å; P774-N817 HydrophobicContact CG-CB 3.92Å
775	S	52.2	Low	46.9	Very low	42 Å²	42	68.7 Å²	68.7	29%	0.294	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-73.3	-9.7	-176.7	49.6	0	0	0	0	115.5	H777 Q778	S775-H777 PolarHBondContact O-N 3.19Å; S775-Q778 WeakPolarHBondContact O-CB 3.41Å; S775-Q778 PolarHBondContact O-N 3.13Å
776	N	45.7	Very low	46.9	Very low	113 Å²	113	67.4 Å²	67.4	60%	0.604	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-69.7	1.9	-165.3	-65.6	-6.3	0	0	0	116.1	P774	P774-N776 VanDerWaalsContact C-N 3.28Å; P774-N776 PolarHBondContact O-N 2.79Å
777	H	42.4	Very low	46.8	Very low	182 Å²	182	67.8 Å²	67.8	84%	0.843	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-127.3	18.5	172.7	-66.6	-69.3	0	0	0	113.1	S775 S779	S775-H777 PolarHBondContact O-N 3.19Å; H777-S779 PolarHBondContact O-N 3.44Å
778	Q	37.9	Very low	46.5	Very low	48 Å²	48	70.9 Å²	70.9	22%	0.224	38%	0.379	C	S	.	.			trans	-94.7	58.3	-175.3	-61.1	-161.7	-27.4	0	0	113.6	S775 L781	S775-Q778 WeakPolarHBondContact O-CB 3.41Å; S775-Q778 PolarHBondContact O-N 3.13Å; Q778-L781 HydrophobicContact CB-CB 4.26Å; Q778-L781 HydrophobicContact CG-CB 4.48Å; Q778-L781 HydrophobicContact CG-CD1 4.03Å
779	S	36.4	Very low	45.9	Very low	78 Å²	78	75.8 Å²	75.8	55%	0.545	41%	0.409	S	S	.	.	S	Bend	trans	-76.6	-25.2	166.6	50	0	0	0	0	113.2	H777	H777-S779 PolarHBondContact O-N 3.44Å
780	E	37.9	Very low	45.4	Very low	97 Å²	97	77.1 Å²	77.1	45%	0.453	42%	0.419	S	S	.	.	S	Bend	trans	-101.4	0.4	-174.6	-63.9	-174	174.8	0	0	115	K765 H1045	K765-E780 PolarHBondContact NZ-O 3.43Å; E780-H1045 WeakPolarHBondContact CG-NE2 3.27Å; E780-H1045 IonicContact OE1-CD2 3.66Å; E780-H1045 PolarHBondContact OE1-CD2 2.98Å; E780-H1045 IonicContact OE1-CG 3.2Å; E780-H1045 IonicContact OE1-NE2 3.74Å
781	L	36	Very low	45.1	Very low	77 Å²	77	84.6 Å²	84.6	40%	0.403	45%	0.451	S	S	.	.			trans	-112.9	39.3	-171.5	-70	174	0	0	0	113.3	K765 Q778	K765-L781 HydrophobicContact CB-CD2 4.24Å; K765-L781 HydrophobicContact CD-CD2 3.69Å; K765-L781 HydrophobicContact CG-CD2 3.67Å; Q778-L781 HydrophobicContact CB-CB 4.26Å; Q778-L781 HydrophobicContact CG-CB 4.48Å; Q778-L781 HydrophobicContact CG-CD1 4.03Å
782	Y	30.6	Very low	45	Very low	141 Å²	141	85.6 Å²	85.6	55%	0.553	46%	0.456	S	S	*	.			trans	-70.2	150.4	165.8	-79.9	-86.1	0	0	0	111.7
783	N	32.2	Very low	44.8	Very low	137 Å²	137	88.6 Å²	88.6	73%	0.733	48%	0.476	S	S	*	.			trans	69.8	54.7	172.4	-59.9	-6.4	0	0	0	118.2
784	L	34.5	Very low	44.9	Very low	94 Å²	94	89 Å²	89	49%	0.492	48%	0.48	S	S	.	.			trans	-125.3	53.8	152.6	-80.2	174.5	0	0	0	111.9	K765 N786	K765-L784 HydrophobicContact CB-CD1 4.35Å; K765-L784 WeakPolarHBondContact O-CD1 3.25Å; L784-N786 PolarHBondContact O-N 2.98Å; L784-N786 VanDerWaalsContact O-N 3.12Å
785	V	35.6	Very low	45.5	Very low	130 Å²	130	91 Å²	91	79%	0.788	49%	0.488	S	S	*	.			trans	-81.4	84.2	173	-177.1	0	0	0	0	109.5
786	N	44.6	Very low	46.2	Very low	96 Å²	96	90.2 Å²	90.2	51%	0.513	48%	0.48	S	S	.	.			trans	167.1	104.5	147.6	-96.1	-61.9	0	0	0	110.5	L784 S788 T789	L784-N786 PolarHBondContact O-N 2.98Å; L784-N786 VanDerWaalsContact O-N 3.12Å; N786-S788 WeakPolarHBondContact CB-OG 3.44Å; N786-S788 VanDerWaalsContact CG-OG 3.31Å; N786-S788 PolarHBondContact O-N 3.47Å; N786-S788 PolarHBondContact OD1-OG 3.24Å; N786-T789 HydrophobicContact CB-CG2 4.44Å; N786-T789 PolarHBondContact O-OG1 3.05Å
787	L	46.9	Very low	47.3	Very low	20 Å²	20	85.2 Å²	85.2	11%	0.105	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-69.7	-21.3	164	-93.4	75.3	0	0	0	112.3	T789 V790 E826 L827 T830	L787-T789 PolarHBondContact O-N 3.48Å; L787-V790 PolarHBondContact O-N 2.6Å; L787-E826 HydrophobicContact CD2-CB 4.27Å; L787-L827 HydrophobicContact CD2-CB 3.97Å; L787-L827 HydrophobicContact CD2-CD1 4.01Å; L787-T830 HydrophobicContact CB-CG2 4.48Å
788	S	46	Very low	48.5	Very low	83 Å²	83	83 Å²	83	58%	0.58	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-59.9	-12.4	-173.8	58.3	0	0	0	0	115.8	N786	N786-S788 WeakPolarHBondContact CB-OG 3.44Å; N786-S788 VanDerWaalsContact CG-OG 3.31Å; N786-S788 PolarHBondContact O-N 3.47Å; N786-S788 PolarHBondContact OD1-OG 3.24Å
789	T	45.3	Very low	50	Low	113 Å²	113	87 Å²	87	69%	0.693	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-100.3	-9.2	-176.6	55.8	0	0	0	0	114.2	N786 L787	N786-T789 HydrophobicContact CB-CG2 4.44Å; N786-T789 PolarHBondContact O-OG1 3.05Å; L787-T789 PolarHBondContact O-N 3.48Å
790	V	49.3	Very low	51.7	Low	47 Å²	47	83.8 Å²	83.8	29%	0.285	44%	0.436	S	S	.	.			trans	-103.9	107.3	-174.5	-168.3	0	0	0	0	110.8	L787 I792	L787-V790 PolarHBondContact O-N 2.6Å; V790-I792 HydrophobicContact CB-CD1 4.48Å; V790-I792 HydrophobicContact CB-CG1 4.47Å; V790-I792 HydrophobicContact CG1-CD1 4.24Å; V790-I792 HydrophobicContact CG1-CG1 3.92Å; V790-I792 PolarHBondContact O-N 2.79Å
791	H	51.4	Low	53.6	Low	180 Å²	180	81.3 Å²	81.3	83%	0.833	42%	0.423	S	S	*	.			trans	-76.4	91.2	-178.2	-162.2	-28.3	0	0	0	111.5	P793	H791-P793 WeakPolarHBondContact O-CD 3.28Å
792	I	59.4	Low	55.5	Low	22 Å²	22	81.3 Å²	81.3	11%	0.113	43%	0.428	C	S	.	.			trans	-94.6	121	-177.7	-62.1	161.4	0	0	0	110.3	L768 V790 I796 L827 I831	L768-I792 HydrophobicContact CD1-CD1 3.71Å; L768-I792 HydrophobicContact CD1-CG1 4.17Å; L768-I792 HydrophobicContact CD1-CG2 4.21Å; L768-I792 HydrophobicContact CG-CD1 3.91Å; V790-I792 HydrophobicContact CB-CD1 4.48Å; V790-I792 HydrophobicContact CB-CG1 4.47Å; V790-I792 HydrophobicContact CG1-CD1 4.24Å; V790-I792 HydrophobicContact CG1-CG1 3.92Å; V790-I792 PolarHBondContact O-N 2.79Å; I792-I796 HydrophobicContact CG2-CB 4.32Å; I792-I796 HydrophobicContact CG2-CD1 4.18Å; I792-I796 HydrophobicContact CG2-CG2 4.41Å; I792-L827 HydrophobicContact CD1-CD1 4.24Å; I792-I831 HydrophobicContact CB-CD1 3.75Å; I792-I831 HydrophobicContact CB-CG1 4.08Å; I792-I831 HydrophobicContact CD1-CD1 3.84Å; I792-I831 HydrophobicContact CG1-CD1 4.4Å; I792-I831 HydrophobicContact CG2-CD1 3.64Å; I792-I831 HydrophobicContact CG2-CG1 4.37Å
793	P	61.3	Low	57.5	Low	67 Å²	67	77.3 Å²	77.3	44%	0.435	41%	0.414	S	S	.	.			trans	-59.7	134.5	174.7	-27.5	34	0	0	0	114.1	H791 D795 I796	H791-P793 WeakPolarHBondContact O-CD 3.28Å; P793-D795 PolarHBondContact O-N 2.7Å; P793-D795 VanDerWaalsContact O-N 3.15Å; P793-I796 HydrophobicContact CB-CD1 4.13Å; P793-I796 HydrophobicContact CB-CG1 4.28Å; P793-I796 HydrophobicContact CG-CD1 4.11Å; P793-I796 VanDerWaalsContact O-CB 3.23Å; P793-I796 WeakPolarHBondContact O-CB 3.38Å; P793-I796 WeakPolarHBondContact O-CG1 3.43Å; P793-I796 PolarHBondContact O-N 3.44Å
794	I	64.3	Low	59.7	Low	57 Å²	57	71 Å²	71	29%	0.292	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-26.5	-172.7	-159	162.7	0	0	0	114.4	I796 I797 I831 F836	I794-I796 PolarHBondContact O-N 3.49Å; I794-I797 PolarHBondContact O-N 3.49Å; I794-I831 HydrophobicContact CB-CG2 4.38Å; I794-I831 HydrophobicContact CG1-CG2 4.12Å; I794-F836 HydrophobicContact CD1-CE2 3.77Å; I794-F836 HydrophobicContact CD1-CZ 3.91Å; I794-F836 HydrophobicContact CG1-CE2 4.43Å; I794-F836 HydrophobicContact CG1-CZ 4.06Å
795	D	65.3	Low	61.8	Low	88 Å²	88	69.3 Å²	69.3	47%	0.471	37%	0.37	S	S	.	.	H	α-helix	trans	-68.4	-15.8	177.9	-59.4	-52.2	0	0	0	113.4	P793 R798 L799	P793-D795 PolarHBondContact O-N 2.7Å; P793-D795 VanDerWaalsContact O-N 3.15Å; D795-R798 WeakPolarHBondContact O-CB 3.45Å; D795-R798 PolarHBondContact O-N 3.39Å; D795-R798 IonicContact OD1-CZ 3.82Å; D795-R798 IonicContact OD1-NH1 3.42Å; D795-R798 PolarHBondContact OD1-NH1 2.96Å; D795-L799 PolarHBondContact O-N 3.03Å
796	I	66.4	Low	63.7	Low	25 Å²	25	64.8 Å²	64.8	13%	0.128	34%	0.344	C	S	.	.	H	α-helix	trans	-70.1	-40.2	176.5	-65.8	-179.8	0	0	0	111.2	L737 I792 P793 I794 R798 L799 L800	L737-I796 HydrophobicContact CD1-CD1 3.99Å; L737-I796 HydrophobicContact CD1-CG1 4.37Å; L737-I796 HydrophobicContact CD1-CG2 3.5Å; L737-I796 HydrophobicContact CD2-CG2 3.29Å; L737-I796 HydrophobicContact CG-CG2 3.98Å; I792-I796 HydrophobicContact CG2-CB 4.32Å; I792-I796 HydrophobicContact CG2-CD1 4.18Å; I792-I796 HydrophobicContact CG2-CG2 4.41Å; P793-I796 HydrophobicContact CB-CD1 4.13Å; P793-I796 HydrophobicContact CB-CG1 4.28Å; P793-I796 HydrophobicContact CG-CD1 4.11Å; P793-I796 VanDerWaalsContact O-CB 3.23Å; P793-I796 WeakPolarHBondContact O-CB 3.38Å; P793-I796 WeakPolarHBondContact O-CG1 3.43Å; P793-I796 PolarHBondContact O-N 3.44Å; I794-I796 PolarHBondContact O-N 3.49Å; I796-R798 VanDerWaalsContact C-N 3.32Å; I796-L799 PolarHBondContact O-N 2.8Å; I796-L800 PolarHBondContact O-N 3.29Å
797	I	68.9	Low	65.2	Low	7 Å²	7	60.2 Å²	60.2	4%	0.036	32%	0.319	C	S	.	.	H	α-helix	trans	-65.2	-39.5	172.4	-67.5	-173.7	0	0	0	110.2	I794 L799 L800 Y801 F828 I831	I794-I797 PolarHBondContact O-N 3.49Å; I797-L799 VanDerWaalsContact C-N 3.26Å; I797-L799 PolarHBondContact O-N 3.32Å; I797-L800 PolarHBondContact O-N 3.25Å; I797-Y801 WeakPolarHBondContact O-CB 3.41Å; I797-Y801 PolarHBondContact O-N 2.68Å; I797-F828 HydrophobicContact CD1-CD1 4.42Å; I797-F828 HydrophobicContact CD1-CD2 4.43Å; I797-F828 HydrophobicContact CD1-CG 4.4Å; I797-F828 HydrophobicContact CG2-CD1 4.47Å; I797-F828 HydrophobicContact CG2-CE1 3.72Å; I797-F828 HydrophobicContact CG2-CZ 3.81Å; I797-I831 HydrophobicContact CD1-CB 3.83Å; I797-I831 HydrophobicContact CD1-CD1 3.82Å; I797-I831 HydrophobicContact CD1-CG1 4.43Å; I797-I831 HydrophobicContact CD1-CG2 3.63Å; I797-I831 HydrophobicContact CG1-CD1 4.27Å; I797-I831 HydrophobicContact CG1-CG2 4.2Å
798	R	68.4	Low	66.6	Low	137 Å²	137	59.2 Å²	59.2	52%	0.517	31%	0.314	S	S	.	.	H	α-helix	trans	-60.7	-34.5	177.7	-64.1	177.7	172.2	146.3	-4.3	112.5	D795 I796	D795-R798 WeakPolarHBondContact O-CB 3.45Å; D795-R798 PolarHBondContact O-N 3.39Å; D795-R798 IonicContact OD1-CZ 3.82Å; D795-R798 IonicContact OD1-NH1 3.42Å; D795-R798 PolarHBondContact OD1-NH1 2.96Å; I796-R798 VanDerWaalsContact C-N 3.32Å
799	L	69.9	Low	68.2	Low	132 Å²	132	60.6 Å²	60.6	69%	0.691	31%	0.308	S	S	*	.	H	α-helix	trans	-70.5	-31.4	173.3	-87.5	159.6	0	0	0	113.7	D795 I796 I797	D795-L799 PolarHBondContact O-N 3.03Å; I796-L799 PolarHBondContact O-N 2.8Å; I797-L799 VanDerWaalsContact C-N 3.26Å; I797-L799 PolarHBondContact O-N 3.32Å
800	L	71.4	Confident	69.5	Low	9 Å²	9	57.3 Å²	57.3	5%	0.047	29%	0.292	C	S	.	.	H	α-helix	trans	-88.5	-30.4	179.3	-71.1	-178.2	0	0	0	114.2	L737 I740 F772 I796 I797 H803 I804	L737-L800 HydrophobicContact CD2-CD1 3.72Å; L737-L800 HydrophobicContact CD2-CD2 4.21Å; L737-L800 HydrophobicContact CD2-CG 3.98Å; I740-L800 HydrophobicContact CG2-CD1 4.14Å; I740-L800 HydrophobicContact CG2-CD2 3.92Å; F772-L800 HydrophobicContact CE2-CD1 4.41Å; F772-L800 HydrophobicContact CZ-CD1 4.43Å; I796-L800 PolarHBondContact O-N 3.29Å; I797-L800 PolarHBondContact O-N 3.25Å; L800-H803 WeakPolarHBondContact O-CA 3.45Å; L800-H803 WeakPolarHBondContact O-CB 3.33Å; L800-H803 PolarHBondContact O-N 3.06Å; L800-I804 HydrophobicContact CB-CD1 3.91Å; L800-I804 HydrophobicContact CB-CG1 4.44Å; L800-I804 PolarHBondContact O-N 3.22Å
801	Y	77.3	Confident	70.7	Confident	45 Å²	45	56.6 Å²	56.6	18%	0.176	29%	0.286	C	S	.	.	H	α-helix	trans	-53.8	-43.2	-169.3	179.9	-100.8	0	0	0	115	I797 H803 I804 Q805 H840 L844	I797-Y801 WeakPolarHBondContact O-CB 3.41Å; I797-Y801 PolarHBondContact O-N 2.68Å; Y801-H803 VanDerWaalsContact C-N 3.29Å; Y801-H803 PolarHBondContact O-N 2.88Å; Y801-I804 PolarHBondContact O-N 3.19Å; Y801-Q805 PolarHBondContact O-N 3.34Å; Y801-H840 HydrophobicContact CD2-CB 4.18Å; Y801-H840 AromaticContact CD2-CD2 3.82Å; Y801-H840 HydrophobicContact CE2-CB 3.72Å; Y801-H840 AromaticContact CE2-CD2 3.88Å; Y801-H840 WeakPolarHBondContact CE2-O 3.48Å; Y801-H840 AromaticContact CG-CD2 3.97Å; Y801-L844 HydrophobicContact CE2-CD1 4.31Å
802	P	75.8	Confident	71.7	Confident	78 Å²	78	48.8 Å²	48.8	51%	0.506	25%	0.252	S	S	.	.	H	α-helix	trans	-61.1	-37.2	176.5	-23.1	34.6	0	0	0	113	S806	P802-S806 PolarHBondContact O-N 3.21Å; P802-S806 VanDerWaalsContact O-N 3.08Å; P802-S806 PolarHBondContact O-OG 3.44Å
803	H	74	Confident	72.2	Confident	57 Å²	57	49.5 Å²	49.5	26%	0.264	26%	0.256	S	S	.	.	H	α-helix	trans	-69.6	-42.4	176.3	-64	-67.3	0	0	0	111.3	L744 L800 Y801 S806 A807	L744-H803 HydrophobicContact CB-CB 3.94Å; L744-H803 HydrophobicContact CD1-CB 3.79Å; L800-H803 WeakPolarHBondContact O-CA 3.45Å; L800-H803 WeakPolarHBondContact O-CB 3.33Å; L800-H803 PolarHBondContact O-N 3.06Å; Y801-H803 VanDerWaalsContact C-N 3.29Å; Y801-H803 PolarHBondContact O-N 2.88Å; H803-S806 PolarHBondContact O-N 3.07Å; H803-S806 PolarHBondContact O-OG 2.81Å; H803-A807 PolarHBondContact O-N 3.44Å
804	I	77.3	Confident	72.8	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.015	24%	0.239	C	C	.	.	H	α-helix	trans	-59.4	-49.9	174.8	-63.3	164.2	0	0	0	110.3	L744 F772 L800 Y801 S806 A807 V808 F828	L744-I804 HydrophobicContact CD1-CG1 3.9Å; F772-I804 HydrophobicContact CE1-CD1 3.61Å; F772-I804 HydrophobicContact CE1-CG1 4.1Å; F772-I804 HydrophobicContact CZ-CD1 3.95Å; L800-I804 HydrophobicContact CB-CD1 3.91Å; L800-I804 HydrophobicContact CB-CG1 4.44Å; L800-I804 PolarHBondContact O-N 3.22Å; Y801-I804 PolarHBondContact O-N 3.19Å; I804-S806 VanDerWaalsContact C-N 3.33Å; I804-S806 PolarHBondContact O-N 3.41Å; I804-A807 PolarHBondContact O-N 3.43Å; I804-A807 VanDerWaalsContact O-N 3.12Å; I804-V808 HydrophobicContact CG2-CG2 4.38Å; I804-V808 WeakPolarHBondContact O-CG2 3.39Å; I804-V808 PolarHBondContact O-N 3.26Å; I804-F828 HydrophobicContact CD1-CZ 4.48Å
805	Q	79.9	Confident	73.5	Confident	60 Å²	60	44.7 Å²	44.7	28%	0.28	23%	0.225	S	C	.	.	H	α-helix	trans	-58.7	-43.6	179.1	-175.3	173.2	13.1	0	0	111.7	Y801 A807 V808 Y809 L844	Y801-Q805 PolarHBondContact O-N 3.34Å; Q805-A807 PolarHBondContact O-N 3.3Å; Q805-V808 PolarHBondContact O-N 3.46Å; Q805-Y809 HydrophobicContact CG-CD2 4.06Å; Q805-Y809 HydrophobicContact CG-CE2 3.47Å; Q805-Y809 VanDerWaalsContact CG-CE2 3.47Å; Q805-Y809 PolarHBondContact NE2-OH 3.39Å; Q805-Y809 WeakPolarHBondContact O-CD2 3.27Å; Q805-Y809 PolarHBondContact O-N 3.05Å; Q805-L844 HydrophobicContact CG-CD2 4.32Å
806	S	74.7	Confident	74	Confident	34 Å²	34	40.6 Å²	40.6	24%	0.238	20%	0.203	C	C	.	.	H	α-helix	trans	-62.4	-38.8	175.4	68.2	0	0	0	0	113.2	P802 H803 I804 A810	P802-S806 PolarHBondContact O-N 3.21Å; P802-S806 VanDerWaalsContact O-N 3.08Å; P802-S806 PolarHBondContact O-OG 3.44Å; H803-S806 PolarHBondContact O-N 3.07Å; H803-S806 PolarHBondContact O-OG 2.81Å; I804-S806 VanDerWaalsContact C-N 3.33Å; I804-S806 PolarHBondContact O-N 3.41Å; S806-A810 WeakPolarHBondContact O-CB 3.49Å; S806-A810 PolarHBondContact O-N 3.46Å; S806-A810 VanDerWaalsContact O-N 3.08Å
807	A	75.6	Confident	74.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-70.6	-36	178.7	0	0	0	0	0	113	L744 I747 H803 I804 Q805 A810 N811 W814	L744-A807 HydrophobicContact CD2-CB 3.7Å; I747-A807 HydrophobicContact CG2-CB 4.13Å; H803-A807 PolarHBondContact O-N 3.44Å; I804-A807 PolarHBondContact O-N 3.43Å; I804-A807 VanDerWaalsContact O-N 3.12Å; Q805-A807 PolarHBondContact O-N 3.3Å; A807-A810 PolarHBondContact O-N 2.91Å; A807-N811 PolarHBondContact O-N 3.27Å; A807-W814 HydrophobicContact CB-CE3 4.42Å; A807-W814 HydrophobicContact CB-CH2 4.38Å; A807-W814 HydrophobicContact CB-CZ3 3.98Å
808	V	76.3	Confident	74.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-42.5	175.9	176.1	0	0	0	0	111.3	I804 Q805 A810 N811 W814 F815 L844 Y847	I804-V808 HydrophobicContact CG2-CG2 4.38Å; I804-V808 WeakPolarHBondContact O-CG2 3.39Å; I804-V808 PolarHBondContact O-N 3.26Å; Q805-V808 PolarHBondContact O-N 3.46Å; V808-A810 VanDerWaalsContact C-N 3.33Å; V808-N811 CarbonylContact O-C 3.56Å; V808-N811 PolarHBondContact O-N 3.45Å; V808-W814 HydrophobicContact CG2-CZ3 4.05Å; V808-F815 HydrophobicContact CG1-CB 4.27Å; V808-F815 HydrophobicContact CG1-CD1 3.76Å; V808-F815 HydrophobicContact CG1-CE1 4.29Å; V808-F815 HydrophobicContact CG1-CG 4.06Å; V808-F815 HydrophobicContact CG2-CB 4.03Å; V808-F815 HydrophobicContact CG2-CD1 4.09Å; V808-F815 HydrophobicContact CG2-CD2 3.67Å; V808-F815 HydrophobicContact CG2-CE1 4.49Å; V808-F815 HydrophobicContact CG2-CE2 4.1Å; V808-F815 HydrophobicContact CG2-CG 3.67Å; V808-L844 HydrophobicContact CB-CD2 4.5Å; V808-L844 HydrophobicContact CG1-CD2 4.32Å; V808-Y847 HydrophobicContact CG1-CD1 4.4Å
809	Y	79.6	Confident	74.5	Confident	112 Å²	112	34.8 Å²	34.8	44%	0.439	18%	0.183	S	C	.	.	H	α-helix	trans	-70.5	-26.7	176.2	-62.9	-32	0	0	0	113.3	Q805 L844 Y847	Q805-Y809 HydrophobicContact CG-CD2 4.06Å; Q805-Y809 HydrophobicContact CG-CE2 3.47Å; Q805-Y809 VanDerWaalsContact CG-CE2 3.47Å; Q805-Y809 PolarHBondContact NE2-OH 3.39Å; Q805-Y809 WeakPolarHBondContact O-CD2 3.27Å; Q805-Y809 PolarHBondContact O-N 3.05Å; Y809-L844 HydrophobicContact CE1-CD2 4.42Å; Y809-Y847 HydrophobicContact CD1-CD1 4.03Å; Y809-Y847 AromaticContact CD1-CE1 3.57Å; Y809-Y847 HydrophobicContact CD1-CE1 3.57Å; Y809-Y847 HydrophobicContact CD1-CE2 4.21Å; Y809-Y847 AromaticContact CD1-CZ 3.66Å; Y809-Y847 HydrophobicContact CE1-CD1 4.09Å; Y809-Y847 HydrophobicContact CE1-CD2 4.25Å; Y809-Y847 HydrophobicContact CE1-CE1 4.05Å; Y809-Y847 HydrophobicContact CE1-CE2 4.21Å; Y809-Y847 HydrophobicContact CE1-CG 4.19Å
810	A	73.8	Confident	74.5	Confident	44 Å²	44	30.6 Å²	30.6	36%	0.364	16%	0.161	S	C	.	.	H	α-helix	trans	-77.9	-36	173.2	0	0	0	0	0	113	S806 A807 V808	S806-A810 WeakPolarHBondContact O-CB 3.49Å; S806-A810 PolarHBondContact O-N 3.46Å; S806-A810 VanDerWaalsContact O-N 3.08Å; A807-A810 PolarHBondContact O-N 2.91Å; V808-A810 VanDerWaalsContact C-N 3.33Å
811	N	73.1	Confident	74.3	Confident	31 Å²	31	31 Å²	31	17%	0.166	16%	0.164	C	C	.	.			trans	-149.5	91.9	-175.6	-172.3	-22.8	0	0	0	112.6	A807 V808 N813 W814	A807-N811 PolarHBondContact O-N 3.27Å; V808-N811 CarbonylContact O-C 3.56Å; V808-N811 PolarHBondContact O-N 3.45Å; N811-N813 VanDerWaalsContact C-N 3.32Å; N811-N813 PolarHBondContact O-N 2.9Å; N811-N813 WeakPolarHBondContact OD1-CB 3.23Å; N811-N813 PolarHBondContact OD1-N 3.2Å; N811-W814 HydrophobicContact CB-CB 4.37Å; N811-W814 PolarHBondContact O-N 3.15Å; N811-W814 PolarHBondContact OD1-N 3.14Å
812	P	72.6	Confident	73.9	Confident	16 Å²	16	29.7 Å²	29.7	10%	0.104	16%	0.161	C	C	.	.	H	α-helix	trans	-68.9	-27.7	179.3	26.5	-34.2	0	0	0	113.2	W814 F815 V816 L848 M857	P812-W814 VanDerWaalsContact C-N 3.3Å; P812-W814 PolarHBondContact O-N 2.93Å; P812-F815 PolarHBondContact O-N 3.38Å; P812-F815 VanDerWaalsContact O-N 3.12Å; P812-V816 PolarHBondContact O-N 3.5Å; P812-V816 VanDerWaalsContact O-N 3.16Å; P812-L848 HydrophobicContact CB-CD2 3.79Å; P812-M857 HydrophobicContact CB-CG 4.48Å; P812-M857 HydrophobicContact CB-SD 4.14Å; P812-M857 HydrophobicContact CG-CG 4.06Å; P812-M857 HydrophobicContact CG-SD 4.36Å
813	N	70.3	Confident	73.6	Confident	37 Å²	37	28.3 Å²	28.3	20%	0.198	15%	0.147	C	C	.	.	H	α-helix	trans	-63.2	-34	178.3	-79.4	-40.4	0	0	0	112.3	N811 N817 M857	N811-N813 VanDerWaalsContact C-N 3.32Å; N811-N813 PolarHBondContact O-N 2.9Å; N811-N813 WeakPolarHBondContact OD1-CB 3.23Å; N811-N813 PolarHBondContact OD1-N 3.2Å; N813-N817 PolarHBondContact O-N 3.48Å; N813-N817 PolarHBondContact O-ND2 3.31Å; N813-M857 WeakPolarHBondContact OD1-CE 3.16Å
814	W	74.4	Confident	73.7	Confident	24 Å²	24	25.6 Å²	25.6	9%	0.091	14%	0.135	C	C	.	.	H	α-helix	trans	-62.2	-44.2	171.9	168.5	81.3	0	0	0	111.8	L744 F772 A807 V808 N811 P812 N817 I818	L744-W814 HydrophobicContact CD2-CH2 3.68Å; L744-W814 HydrophobicContact CD2-CZ2 3.9Å; F772-W814 PolarHBondContact O-NE1 2.99Å; A807-W814 HydrophobicContact CB-CE3 4.42Å; A807-W814 HydrophobicContact CB-CH2 4.38Å; A807-W814 HydrophobicContact CB-CZ3 3.98Å; V808-W814 HydrophobicContact CG2-CZ3 4.05Å; N811-W814 HydrophobicContact CB-CB 4.37Å; N811-W814 PolarHBondContact O-N 3.15Å; N811-W814 PolarHBondContact OD1-N 3.14Å; P812-W814 VanDerWaalsContact C-N 3.3Å; P812-W814 PolarHBondContact O-N 2.93Å; W814-N817 PolarHBondContact O-N 3.47Å; W814-I818 HydrophobicContact CD2-CD1 3.76Å; W814-I818 HydrophobicContact CE3-CD1 4.36Å; W814-I818 HydrophobicContact CG-CD1 4.2Å; W814-I818 HydrophobicContact CH2-CD1 4.08Å; W814-I818 HydrophobicContact CZ2-CD1 3.43Å; W814-I818 VanDerWaalsContact CZ2-CD1 3.43Å; W814-I818 PolarHBondContact O-N 2.98Å
815	F	79.3	Confident	73.6	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.5	-44.7	-176	-171.4	-130.1	0	0	0	112.8	V808 P812 N817 I818 L819 M824 L841 L844 L848	V808-F815 HydrophobicContact CG1-CB 4.27Å; V808-F815 HydrophobicContact CG1-CD1 3.76Å; V808-F815 HydrophobicContact CG1-CE1 4.29Å; V808-F815 HydrophobicContact CG1-CG 4.06Å; V808-F815 HydrophobicContact CG2-CB 4.03Å; V808-F815 HydrophobicContact CG2-CD1 4.09Å; V808-F815 HydrophobicContact CG2-CD2 3.67Å; V808-F815 HydrophobicContact CG2-CE1 4.49Å; V808-F815 HydrophobicContact CG2-CE2 4.1Å; V808-F815 HydrophobicContact CG2-CG 3.67Å; P812-F815 PolarHBondContact O-N 3.38Å; P812-F815 VanDerWaalsContact O-N 3.12Å; F815-N817 VanDerWaalsContact C-N 3.31Å; F815-N817 PolarHBondContact O-N 3.17Å; F815-I818 PolarHBondContact O-N 3.2Å; F815-L819 HydrophobicContact CD1-CD1 4.08Å; F815-L819 HydrophobicContact CD2-CG 4.48Å; F815-L819 HydrophobicContact CE1-CD1 3.77Å; F815-L819 HydrophobicContact CE1-CG 4.39Å; F815-L819 HydrophobicContact CE2-CD1 4.5Å; F815-L819 HydrophobicContact CE2-CD2 4.08Å; F815-L819 HydrophobicContact CE2-CG 4.26Å; F815-L819 HydrophobicContact CZ-CD1 4Å; F815-L819 HydrophobicContact CZ-CD2 4Å; F815-L819 HydrophobicContact CZ-CG 4.21Å; F815-L819 PolarHBondContact O-N 3.21Å; F815-M824 HydrophobicContact CD2-CE 4.02Å; F815-M824 HydrophobicContact CE2-CE 3.84Å; F815-M824 HydrophobicContact CE2-SD 3.85Å; F815-L841 HydrophobicContact CZ-CD2 4.31Å; F815-L844 HydrophobicContact CE1-CB 3.68Å; F815-L844 HydrophobicContact CZ-CB 3.75Å; F815-L844 HydrophobicContact CZ-CD1 4.38Å; F815-L848 HydrophobicContact CD1-CD1 3.77Å; F815-L848 HydrophobicContact CD1-CD2 4.25Å; F815-L848 HydrophobicContact CD1-CG 4.18Å; F815-L848 HydrophobicContact CE1-CD1 4.05Å
816	V	74	Confident	73.2	Confident	2 Å²	2	25.3 Å²	25.3	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-59.2	-41.9	177.7	177.5	0	0	0	0	112.1	P812 I818 L819 N820 L848 M857 P866 L870	P812-V816 PolarHBondContact O-N 3.5Å; P812-V816 VanDerWaalsContact O-N 3.16Å; V816-I818 PolarHBondContact O-N 3.12Å; V816-L819 PolarHBondContact O-N 3.32Å; V816-N820 PolarHBondContact O-N 3.25Å; V816-L848 HydrophobicContact CG2-CD1 3.72Å; V816-L848 HydrophobicContact CG2-CD2 3.67Å; V816-L848 HydrophobicContact CG2-CG 4.27Å; V816-M857 HydrophobicContact CB-CE 4.33Å; V816-M857 HydrophobicContact CG2-CE 3.67Å; V816-P866 HydrophobicContact CG1-CB 4.27Å; V816-L870 HydrophobicContact CG1-CD2 3.94Å; V816-L870 HydrophobicContact CG1-CG 4.26Å; V816-L870 HydrophobicContact CG2-CD2 4.06Å
817	N	69.3	Low	73.2	Confident	44 Å²	44	23.8 Å²	23.8	24%	0.235	12%	0.123	C	C	.	.	H	α-helix	trans	-64.3	-27.5	177.6	-81.2	-69.2	0	0	0	113.1	P774 N813 W814 F815	P774-N817 HydrophobicContact CB-CB 4.03Å; P774-N817 HydrophobicContact CG-CB 3.92Å; N813-N817 PolarHBondContact O-N 3.48Å; N813-N817 PolarHBondContact O-ND2 3.31Å; W814-N817 PolarHBondContact O-N 3.47Å; F815-N817 VanDerWaalsContact C-N 3.31Å; F815-N817 PolarHBondContact O-N 3.17Å
818	I	72.7	Confident	73.1	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-82.3	-40.8	176.3	-66.6	163	0	0	0	111.6	A771 F772 W814 F815 V816 N820 S821 M824	A771-I818 WeakPolarHBondContact O-CG2 3.46Å; F772-I818 VanDerWaalsContact O-CD1 3.29Å; F772-I818 WeakPolarHBondContact O-CD1 3.46Å; W814-I818 HydrophobicContact CD2-CD1 3.76Å; W814-I818 HydrophobicContact CE3-CD1 4.36Å; W814-I818 HydrophobicContact CG-CD1 4.2Å; W814-I818 HydrophobicContact CH2-CD1 4.08Å; W814-I818 HydrophobicContact CZ2-CD1 3.43Å; W814-I818 VanDerWaalsContact CZ2-CD1 3.43Å; W814-I818 PolarHBondContact O-N 2.98Å; F815-I818 PolarHBondContact O-N 3.2Å; V816-I818 PolarHBondContact O-N 3.12Å; I818-N820 PolarHBondContact O-N 3.41Å; I818-S821 WeakPolarHBondContact O-CB 3.34Å; I818-S821 PolarHBondContact O-N 2.92Å; I818-S821 PolarHBondContact O-OG 3.08Å; I818-M824 HydrophobicContact CB-CE 4.35Å; I818-M824 HydrophobicContact CD1-CE 4.49Å; I818-M824 HydrophobicContact CG2-CB 3.89Å; I818-M824 HydrophobicContact CG2-CE 3.6Å
819	L	73.1	Confident	72.9	Confident	3 Å²	3	25.3 Å²	25.3	2%	0.016	13%	0.133	C	C	.	.	H	α-helix	trans	-59.6	-32.6	176.8	-65.3	176.4	0	0	0	111.8	F815 V816 S821 T822 L841 I845 L848 F875	F815-L819 HydrophobicContact CD1-CD1 4.08Å; F815-L819 HydrophobicContact CD2-CG 4.48Å; F815-L819 HydrophobicContact CE1-CD1 3.77Å; F815-L819 HydrophobicContact CE1-CG 4.39Å; F815-L819 HydrophobicContact CE2-CD1 4.5Å; F815-L819 HydrophobicContact CE2-CD2 4.08Å; F815-L819 HydrophobicContact CE2-CG 4.26Å; F815-L819 HydrophobicContact CZ-CD1 4Å; F815-L819 HydrophobicContact CZ-CD2 4Å; F815-L819 HydrophobicContact CZ-CG 4.21Å; F815-L819 PolarHBondContact O-N 3.21Å; V816-L819 PolarHBondContact O-N 3.32Å; L819-S821 PolarHBondContact O-N 3.42Å; L819-T822 PolarHBondContact O-N 2.99Å; L819-L841 HydrophobicContact CD2-CD2 3.95Å; L819-I845 HydrophobicContact CD1-CG1 4.06Å; L819-L848 HydrophobicContact CD1-CD1 3.92Å; L819-F875 HydrophobicContact CB-CE2 3.76Å; L819-F875 HydrophobicContact CB-CZ 4.37Å; L819-F875 HydrophobicContact CD1-CE2 4.49Å; L819-F875 HydrophobicContact CD1-CZ 4.3Å
820	N	69.9	Low	72.4	Confident	44 Å²	44	23.6 Å²	23.6	24%	0.235	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-18.9	172.2	-170.9	38.1	0	0	0	114.4	V816 I818 L869 R878	V816-N820 PolarHBondContact O-N 3.25Å; I818-N820 PolarHBondContact O-N 3.41Å; N820-L869 HydrophobicContact CB-CD1 4.34Å; N820-L869 HydrophobicContact CB-CD2 3.84Å; N820-R878 PolarHBondContact O-NH1 3.36Å
821	S	67.7	Low	72.2	Confident	16 Å²	16	22.9 Å²	22.9	11%	0.112	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-5.3	-178.8	76.1	0	0	0	0	114.8	I818 L819 K823	I818-S821 WeakPolarHBondContact O-CB 3.34Å; I818-S821 PolarHBondContact O-N 2.92Å; I818-S821 PolarHBondContact O-OG 3.08Å; L819-S821 PolarHBondContact O-N 3.42Å; S821-K823 WeakPolarHBondContact O-CG 3.32Å; S821-K823 PolarHBondContact O-N 3.4Å
822	T	67.8	Low	71.9	Confident	18 Å²	18	22.6 Å²	22.6	11%	0.11	13%	0.128	C	C	.	.	S	Bend	trans	54.7	-25.9	-167.9	58.7	0	0	0	0	117.3	L819 M824 L825 E826 R878	L819-T822 PolarHBondContact O-N 2.99Å; T822-M824 VanDerWaalsContact C-N 3.26Å; T822-M824 PolarHBondContact O-N 2.78Å; T822-L825 WeakPolarHBondContact O-CA 3.48Å; T822-L825 WeakPolarHBondContact O-CB 3.41Å; T822-L825 PolarHBondContact O-N 3.47Å; T822-E826 WeakPolarHBondContact CB-OE1 3.33Å; T822-E826 PolarHBondContact O-N 2.77Å; T822-E826 PolarHBondContact OG1-OE1 3.39Å; T822-R878 HydrophobicContact CG2-CB 4.13Å; T822-R878 VanDerWaalsContact CG2-CD 3.43Å; T822-R878 HydrophobicContact CG2-CG 3.75Å
823	K	69.6	Low	71.8	Confident	49 Å²	49	23.3 Å²	23.3	21%	0.213	14%	0.138	C	C	.	.	H	α-helix	trans	-49.2	-36.1	-176.7	-65.3	171.2	-175	-175.1	0	115	S770 A771 S821 L827	S770-K823 VanDerWaalsContact O-CD 3.24Å; S770-K823 WeakPolarHBondContact O-CD 3.38Å; A771-K823 HydrophobicContact CB-CB 3.91Å; S821-K823 WeakPolarHBondContact O-CG 3.32Å; S821-K823 PolarHBondContact O-N 3.4Å; K823-L827 VanDerWaalsContact O-CB 3.28Å; K823-L827 WeakPolarHBondContact O-CB 3.39Å; K823-L827 PolarHBondContact O-N 2.67Å
824	M	76.6	Confident	71.7	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-73.3	-36.8	175.3	-161.5	-162.4	-68.9	0	0	112.9	F772 F815 I818 T822 L827 F828 L841	F772-M824 HydrophobicContact CD1-CE 4Å; F772-M824 HydrophobicContact CE1-CE 4.04Å; F772-M824 HydrophobicContact CE1-CG 4.39Å; F815-M824 HydrophobicContact CD2-CE 4.02Å; F815-M824 HydrophobicContact CE2-CE 3.84Å; F815-M824 HydrophobicContact CE2-SD 3.85Å; I818-M824 HydrophobicContact CB-CE 4.35Å; I818-M824 HydrophobicContact CD1-CE 4.49Å; I818-M824 HydrophobicContact CG2-CB 3.89Å; I818-M824 HydrophobicContact CG2-CE 3.6Å; T822-M824 VanDerWaalsContact C-N 3.26Å; T822-M824 PolarHBondContact O-N 2.78Å; M824-L827 PolarHBondContact O-N 3.27Å; M824-F828 HydrophobicContact CG-CD2 4Å; M824-F828 HydrophobicContact CG-CE2 3.96Å; M824-F828 WeakPolarHBondContact O-CD2 3.42Å; M824-F828 PolarHBondContact O-N 3.38Å; M824-F828 HydrophobicContact SD-CE2 4.28Å; M824-L841 HydrophobicContact CG-CD1 4.45Å; M824-L841 HydrophobicContact SD-CD1 4.15Å
825	L	74.6	Confident	71.6	Confident	4 Å²	4	30.4 Å²	30.4	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-69	-38.1	174.8	-64.1	169.3	0	0	0	110.5	T822 S829 I837 L841 Y882	T822-L825 WeakPolarHBondContact O-CA 3.48Å; T822-L825 WeakPolarHBondContact O-CB 3.41Å; T822-L825 PolarHBondContact O-N 3.47Å; L825-S829 VanDerWaalsContact O-CB 3.29Å; L825-S829 WeakPolarHBondContact O-CB 3.33Å; L825-S829 PolarHBondContact O-N 3.49Å; L825-S829 PolarHBondContact O-OG 3.49Å; L825-I837 HydrophobicContact CD2-CG2 4.38Å; L825-L841 HydrophobicContact CD2-CD1 4.11Å; L825-L841 HydrophobicContact CD2-CD2 3.78Å; L825-Y882 HydrophobicContact CB-CD1 4.42Å; L825-Y882 HydrophobicContact CB-CD2 3.7Å; L825-Y882 HydrophobicContact CB-CE2 3.99Å; L825-Y882 HydrophobicContact CB-CG 3.96Å; L825-Y882 HydrophobicContact CD1-CD2 3.91Å; L825-Y882 HydrophobicContact CD1-CE2 4.49Å; L825-Y882 HydrophobicContact CG-CD2 4.36Å
826	E	71.9	Confident	71.4	Confident	53 Å²	53	31.9 Å²	31.9	25%	0.248	18%	0.18	C	C	.	.	H	α-helix	trans	-61.7	-45.2	170.3	-70.3	165.8	-132.7	0	0	111.8	L787 T822 F828 S829 T830 Y882	L787-E826 HydrophobicContact CD2-CB 4.27Å; T822-E826 WeakPolarHBondContact CB-OE1 3.33Å; T822-E826 PolarHBondContact O-N 2.77Å; T822-E826 PolarHBondContact OG1-OE1 3.39Å; E826-F828 PolarHBondContact O-N 3.39Å; E826-S829 WeakPolarHBondContact CA-OG 3.05Å; E826-S829 PolarHBondContact O-N 3.31Å; E826-S829 PolarHBondContact O-OG 3.35Å; E826-S829 VanDerWaalsContact O-OG 3.06Å; E826-T830 WeakPolarHBondContact O-CB 3.16Å; E826-T830 VanDerWaalsContact O-CG2 3.32Å; E826-T830 WeakPolarHBondContact O-CG2 3.48Å; E826-T830 PolarHBondContact O-N 3.35Å; E826-T830 PolarHBondContact O-OG1 2.98Å; E826-Y882 VanDerWaalsContact CG-OH 3.25Å; E826-Y882 WeakPolarHBondContact CG-OH 3.22Å
827	L	73.9	Confident	71.5	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-60.1	-46.4	177.4	-175.7	78.4	0	0	0	112.1	L768 A771 F772 L787 I792 K823 M824 T830 I831	L768-L827 HydrophobicContact CD2-CD1 3.94Å; L768-L827 HydrophobicContact CD2-CD2 4.11Å; L768-L827 HydrophobicContact CG-CD1 3.99Å; A771-L827 HydrophobicContact CB-CB 4.29Å; A771-L827 HydrophobicContact CB-CD2 4.14Å; F772-L827 HydrophobicContact CE2-CD2 3.52Å; F772-L827 HydrophobicContact CZ-CD2 3.53Å; L787-L827 HydrophobicContact CD2-CB 3.97Å; L787-L827 HydrophobicContact CD2-CD1 4.01Å; I792-L827 HydrophobicContact CD1-CD1 4.24Å; K823-L827 VanDerWaalsContact O-CB 3.28Å; K823-L827 WeakPolarHBondContact O-CB 3.39Å; K823-L827 PolarHBondContact O-N 2.67Å; M824-L827 PolarHBondContact O-N 3.27Å; L827-T830 PolarHBondContact O-OG1 3.44Å; L827-I831 HydrophobicContact CD1-CD1 3.72Å; L827-I831 HydrophobicContact CG-CD1 4.02Å; L827-I831 WeakPolarHBondContact O-CB 3.46Å; L827-I831 WeakPolarHBondContact O-CD1 3.29Å; L827-I831 WeakPolarHBondContact O-CG1 3.41Å; L827-I831 PolarHBondContact O-N 3.24Å
828	F	74.3	Confident	71.8	Confident	4 Å²	4	36 Å²	36	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-74	-36.3	-178.9	-84.4	-111.2	0	0	0	112.4	I797 I804 M824 E826 G832 I837 H840 L841	I797-F828 HydrophobicContact CD1-CD1 4.42Å; I797-F828 HydrophobicContact CD1-CD2 4.43Å; I797-F828 HydrophobicContact CD1-CG 4.4Å; I797-F828 HydrophobicContact CG2-CD1 4.47Å; I797-F828 HydrophobicContact CG2-CE1 3.72Å; I797-F828 HydrophobicContact CG2-CZ 3.81Å; I804-F828 HydrophobicContact CD1-CZ 4.48Å; M824-F828 HydrophobicContact CG-CD2 4Å; M824-F828 HydrophobicContact CG-CE2 3.96Å; M824-F828 WeakPolarHBondContact O-CD2 3.42Å; M824-F828 PolarHBondContact O-N 3.38Å; M824-F828 HydrophobicContact SD-CE2 4.28Å; E826-F828 PolarHBondContact O-N 3.39Å; F828-G832 PolarHBondContact O-N 3.42Å; F828-I837 HydrophobicContact CB-CD1 4.4Å; F828-I837 HydrophobicContact CB-CG1 3.81Å; F828-H840 HydrophobicContact CE1-CB 4.21Å; F828-L841 HydrophobicContact CB-CD1 4.13Å; F828-L841 HydrophobicContact CD1-CD1 4.15Å; F828-L841 HydrophobicContact CD2-CD1 3.95Å; F828-L841 HydrophobicContact CE2-CD1 4.38Å; F828-L841 HydrophobicContact CG-CD1 3.82Å
829	S	73	Confident	72.1	Confident	28 Å²	28	39 Å²	39	20%	0.196	21%	0.214	C	C	.	.	H	α-helix	trans	-68.8	-41	176	53.9	0	0	0	0	112.6	L825 E826 G833 Y882	L825-S829 VanDerWaalsContact O-CB 3.29Å; L825-S829 WeakPolarHBondContact O-CB 3.33Å; L825-S829 PolarHBondContact O-N 3.49Å; L825-S829 PolarHBondContact O-OG 3.49Å; E826-S829 WeakPolarHBondContact CA-OG 3.05Å; E826-S829 PolarHBondContact O-N 3.31Å; E826-S829 PolarHBondContact O-OG 3.35Å; E826-S829 VanDerWaalsContact O-OG 3.06Å; S829-G833 VanDerWaalsContact O-CA 3.3Å; S829-G833 WeakPolarHBondContact O-CA 3.35Å; S829-G833 PolarHBondContact O-N 3.41Å; S829-Y882 WeakPolarHBondContact OG-CE1 3.34Å
830	T	68.4	Low	72.4	Confident	76 Å²	76	41.1 Å²	41.1	47%	0.466	22%	0.223	S	C	.	.	H	α-helix	trans	-69.6	-31.1	179.4	49.5	0	0	0	0	113.2	L787 E826 L827	L787-T830 HydrophobicContact CB-CG2 4.48Å; E826-T830 WeakPolarHBondContact O-CB 3.16Å; E826-T830 VanDerWaalsContact O-CG2 3.32Å; E826-T830 WeakPolarHBondContact O-CG2 3.48Å; E826-T830 PolarHBondContact O-N 3.35Å; E826-T830 PolarHBondContact O-OG1 2.98Å; L827-T830 PolarHBondContact O-OG1 3.44Å
831	I	69.2	Low	72.9	Confident	29 Å²	29	39.1 Å²	39.1	15%	0.149	21%	0.213	C	C	.	.	H	α-helix	trans	-92.6	-32	-177.2	-66.8	167.3	0	0	0	113.4	I792 I794 I797 L827	I792-I831 HydrophobicContact CB-CD1 3.75Å; I792-I831 HydrophobicContact CB-CG1 4.08Å; I792-I831 HydrophobicContact CD1-CD1 3.84Å; I792-I831 HydrophobicContact CG1-CD1 4.4Å; I792-I831 HydrophobicContact CG2-CD1 3.64Å; I792-I831 HydrophobicContact CG2-CG1 4.37Å; I794-I831 HydrophobicContact CB-CG2 4.38Å; I794-I831 HydrophobicContact CG1-CG2 4.12Å; I797-I831 HydrophobicContact CD1-CB 3.83Å; I797-I831 HydrophobicContact CD1-CD1 3.82Å; I797-I831 HydrophobicContact CD1-CG1 4.43Å; I797-I831 HydrophobicContact CD1-CG2 3.63Å; I797-I831 HydrophobicContact CG1-CD1 4.27Å; I797-I831 HydrophobicContact CG1-CG2 4.2Å; L827-I831 HydrophobicContact CD1-CD1 3.72Å; L827-I831 HydrophobicContact CG-CD1 4.02Å; L827-I831 WeakPolarHBondContact O-CB 3.46Å; L827-I831 WeakPolarHBondContact O-CD1 3.29Å; L827-I831 WeakPolarHBondContact O-CG1 3.41Å; L827-I831 PolarHBondContact O-N 3.24Å
832	G	67	Low	73.6	Confident	25 Å²	25	38.9 Å²	38.9	26%	0.258	21%	0.21	S	C	.	.	H	α-helix	trans	-135.9	-1.4	-173.2	0	0	0	0	0	116.4	F828	F828-G832 PolarHBondContact O-N 3.42Å
833	G	69.9	Low	74.4	Confident	30 Å²	30	41.1 Å²	41.1	31%	0.309	23%	0.225	S	C	.	.	H	α-helix	trans	70	-175.7	-176.7	0	0	0	0	0	114.7	S829 E835 F836	S829-G833 VanDerWaalsContact O-CA 3.3Å; S829-G833 WeakPolarHBondContact O-CA 3.35Å; S829-G833 PolarHBondContact O-N 3.41Å; G833-E835 VanDerWaalsContact C-N 3.32Å; G833-E835 PolarHBondContact O-N 3.33Å; G833-F836 PolarHBondContact O-N 3.1Å; G833-F836 VanDerWaalsContact O-N 3.14Å
834	L	69.9	Low	75	Confident	97 Å²	97	39 Å²	39	51%	0.508	22%	0.216	S	C	.	.	H	α-helix	trans	-62.6	-33.3	-172.3	-63.2	171.6	0	0	0	113.5	F836 I837 R838 Y882	L834-F836 VanDerWaalsContact C-N 3.31Å; L834-F836 PolarHBondContact O-N 2.84Å; L834-I837 PolarHBondContact O-N 3.28Å; L834-R838 PolarHBondContact O-N 2.83Å; L834-Y882 WeakPolarHBondContact CD2-O 3.46Å
835	E	71.7	Confident	75.3	Confident	114 Å²	114	39 Å²	39	53%	0.533	22%	0.216	S	C	.	.	H	α-helix	trans	-69	-26.8	177.8	-70.6	-65.1	167.4	0	0	112.8	G833 R838 S839	G833-E835 VanDerWaalsContact C-N 3.32Å; G833-E835 PolarHBondContact O-N 3.33Å; E835-R838 VanDerWaalsContact CD-NH1 3.3Å; E835-R838 IonicContact OE1-NH1 3.22Å; E835-R838 PolarHBondContact OE1-NH1 3.01Å; E835-R838 WeakPolarHBondContact OE2-CD 3.39Å; E835-R838 IonicContact OE2-CZ 3.68Å; E835-R838 IonicContact OE2-NE 3.9Å; E835-R838 IonicContact OE2-NH1 3.77Å; E835-R838 PolarHBondContact OE2-NH1 3.02Å; E835-S839 WeakPolarHBondContact O-CB 3.29Å; E835-S839 PolarHBondContact O-N 3.15Å; E835-S839 PolarHBondContact O-OG 2.91Å
836	F	74	Confident	75.6	Confident	31 Å²	31	40.5 Å²	40.5	14%	0.136	22%	0.224	C	C	.	.	H	α-helix	trans	-68.7	-39.9	171.5	-111.1	-98.8	0	0	0	111.8	I794 G833 L834 S839 H840	I794-F836 HydrophobicContact CD1-CE2 3.77Å; I794-F836 HydrophobicContact CD1-CZ 3.91Å; I794-F836 HydrophobicContact CG1-CE2 4.43Å; I794-F836 HydrophobicContact CG1-CZ 4.06Å; G833-F836 PolarHBondContact O-N 3.1Å; G833-F836 VanDerWaalsContact O-N 3.14Å; L834-F836 VanDerWaalsContact C-N 3.31Å; L834-F836 PolarHBondContact O-N 2.84Å; F836-S839 WeakPolarHBondContact CA-OG 3.47Å; F836-S839 PolarHBondContact O-N 3.11Å; F836-S839 PolarHBondContact O-OG 2.95Å; F836-H840 AromaticContact CD1-CE1 3.83Å; F836-H840 AromaticContact CD1-ND1 3.77Å; F836-H840 AromaticContact CE1-CE1 3.64Å; F836-H840 AromaticContact CE1-NE2 3.96Å; F836-H840 WeakPolarHBondContact O-CB 3.21Å; F836-H840 PolarHBondContact O-N 3.08Å; F836-H840 PolarHBondContact O-ND1 3.15Å
837	I	77.4	Confident	76.1	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.218	C	C	.	.	I	π-helix	trans	-64.2	-46.7	174.7	-63.8	-177.8	0	0	0	110.2	L825 F828 L834 S839 L841 L842 Y882 L883	L825-I837 HydrophobicContact CD2-CG2 4.38Å; F828-I837 HydrophobicContact CB-CD1 4.4Å; F828-I837 HydrophobicContact CB-CG1 3.81Å; L834-I837 PolarHBondContact O-N 3.28Å; I837-S839 VanDerWaalsContact C-N 3.32Å; I837-S839 PolarHBondContact O-N 3.46Å; I837-L841 HydrophobicContact CG2-CB 4.24Å; I837-L841 CarbonylContact O-C 3.57Å; I837-L841 WeakPolarHBondContact O-CA 3.17Å; I837-L841 WeakPolarHBondContact O-CB 3.45Å; I837-L841 PolarHBondContact O-N 3.01Å; I837-L842 PolarHBondContact O-N 2.78Å; I837-Y882 HydrophobicContact CD1-CD1 4.24Å; I837-Y882 HydrophobicContact CD1-CG 4.39Å; I837-L883 HydrophobicContact CG2-CD2 3.98Å
838	R	76.1	Confident	76.4	Confident	130 Å²	130	39.6 Å²	39.6	49%	0.491	22%	0.218	S	C	.	.	I	π-helix	trans	-59.8	-37.9	177	175.9	177.4	157.5	-143.9	1.5	113.2	L834 E835 L842	L834-R838 PolarHBondContact O-N 2.83Å; E835-R838 VanDerWaalsContact CD-NH1 3.3Å; E835-R838 IonicContact OE1-NH1 3.22Å; E835-R838 PolarHBondContact OE1-NH1 3.01Å; E835-R838 WeakPolarHBondContact OE2-CD 3.39Å; E835-R838 IonicContact OE2-CZ 3.68Å; E835-R838 IonicContact OE2-NE 3.9Å; E835-R838 IonicContact OE2-NH1 3.77Å; E835-R838 PolarHBondContact OE2-NH1 3.02Å; R838-L842 HydrophobicContact CG-CD2 4.42Å
839	S	78	Confident	76.4	Confident	65 Å²	65	39.7 Å²	39.7	46%	0.455	22%	0.219	S	C	.	.	I	π-helix	trans	-85.7	-36.8	-175.9	50.2	0	0	0	0	114.4	E835 F836 I837	E835-S839 WeakPolarHBondContact O-CB 3.29Å; E835-S839 PolarHBondContact O-N 3.15Å; E835-S839 PolarHBondContact O-OG 2.91Å; F836-S839 WeakPolarHBondContact CA-OG 3.47Å; F836-S839 PolarHBondContact O-N 3.11Å; F836-S839 PolarHBondContact O-OG 2.95Å; I837-S839 VanDerWaalsContact C-N 3.32Å; I837-S839 PolarHBondContact O-N 3.46Å
840	H	79.2	Confident	76.5	Confident	46 Å²	46	42.1 Å²	42.1	21%	0.213	23%	0.227	C	C	.	.	I	π-helix	trans	-107.5	-29.3	-172.4	-65	70	0	0	0	113.8	Y801 F828 F836	Y801-H840 HydrophobicContact CD2-CB 4.18Å; Y801-H840 AromaticContact CD2-CD2 3.82Å; Y801-H840 HydrophobicContact CE2-CB 3.72Å; Y801-H840 AromaticContact CE2-CD2 3.88Å; Y801-H840 WeakPolarHBondContact CE2-O 3.48Å; Y801-H840 AromaticContact CG-CD2 3.97Å; F828-H840 HydrophobicContact CE1-CB 4.21Å; F836-H840 AromaticContact CD1-CE1 3.83Å; F836-H840 AromaticContact CD1-ND1 3.77Å; F836-H840 AromaticContact CE1-CE1 3.64Å; F836-H840 AromaticContact CE1-NE2 3.96Å; F836-H840 WeakPolarHBondContact O-CB 3.21Å; F836-H840 PolarHBondContact O-N 3.08Å; F836-H840 PolarHBondContact O-ND1 3.15Å
841	L	81.8	Confident	76.3	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	22%	0.22	C	C	.	.	I	π-helix	trans	-111.3	-35.9	-165.4	-150.5	159.1	0	0	0	112	F815 L819 M824 L825 F828 I837 L844 I845	F815-L841 HydrophobicContact CZ-CD2 4.31Å; L819-L841 HydrophobicContact CD2-CD2 3.95Å; M824-L841 HydrophobicContact CG-CD1 4.45Å; M824-L841 HydrophobicContact SD-CD1 4.15Å; L825-L841 HydrophobicContact CD2-CD1 4.11Å; L825-L841 HydrophobicContact CD2-CD2 3.78Å; F828-L841 HydrophobicContact CB-CD1 4.13Å; F828-L841 HydrophobicContact CD1-CD1 4.15Å; F828-L841 HydrophobicContact CD2-CD1 3.95Å; F828-L841 HydrophobicContact CE2-CD1 4.38Å; F828-L841 HydrophobicContact CG-CD1 3.82Å; I837-L841 HydrophobicContact CG2-CB 4.24Å; I837-L841 CarbonylContact O-C 3.57Å; I837-L841 WeakPolarHBondContact O-CA 3.17Å; I837-L841 WeakPolarHBondContact O-CB 3.45Å; I837-L841 PolarHBondContact O-N 3.01Å; L841-L844 PolarHBondContact O-N 3.43Å; L841-I845 HydrophobicContact CD2-CD1 3.43Å; L841-I845 VanDerWaalsContact CD2-CD1 3.43Å; L841-I845 HydrophobicContact CD2-CG1 3.9Å; L841-I845 WeakPolarHBondContact O-CG1 3.48Å; L841-I845 PolarHBondContact O-N 3.27Å
842	L	82.6	Confident	76.2	Confident	11 Å²	11	44.8 Å²	44.8	6%	0.058	24%	0.237	C	C	.	.	H	α-helix	trans	-57	-41.7	173	180	63.8	0	0	0	113.9	I837 R838 L844 I845 I846 L883 T887 I892	I837-L842 PolarHBondContact O-N 2.78Å; R838-L842 HydrophobicContact CG-CD2 4.42Å; L842-L844 VanDerWaalsContact C-N 3.31Å; L842-L844 PolarHBondContact O-N 3.04Å; L842-I845 PolarHBondContact O-N 2.91Å; L842-I846 HydrophobicContact CD1-CD1 4.15Å; L842-I846 HydrophobicContact CD1-CG1 4.28Å; L842-I846 HydrophobicContact CG-CD1 4Å; L842-I846 WeakPolarHBondContact O-CG1 3.46Å; L842-I846 PolarHBondContact O-N 3.24Å; L842-L883 HydrophobicContact CD1-CD1 4.14Å; L842-T887 HydrophobicContact CD2-CG2 3.81Å; L842-I892 HydrophobicContact CD1-CD1 3.99Å
843	P	83.3	Confident	76.2	Confident	66 Å²	66	43.9 Å²	43.9	43%	0.429	23%	0.227	S	C	.	.	H	α-helix	trans	-62.1	-38	175.7	-23.4	35.2	0	0	0	112.9	I845 I846 Y847	P843-I845 VanDerWaalsContact C-N 3.33Å; P843-I846 PolarHBondContact O-N 2.94Å; P843-Y847 PolarHBondContact O-N 3.38Å; P843-Y847 VanDerWaalsContact O-N 3.1Å
844	L	82.4	Confident	76.2	Confident	5 Å²	5	43.8 Å²	43.8	3%	0.026	22%	0.219	C	C	.	.	H	α-helix	trans	-70	-29.9	176.7	-59.8	175.2	0	0	0	112.1	Y801 Q805 V808 Y809 F815 L841 L842	Y801-L844 HydrophobicContact CE2-CD1 4.31Å; Q805-L844 HydrophobicContact CG-CD2 4.32Å; V808-L844 HydrophobicContact CB-CD2 4.5Å; V808-L844 HydrophobicContact CG1-CD2 4.32Å; Y809-L844 HydrophobicContact CE1-CD2 4.42Å; F815-L844 HydrophobicContact CE1-CB 3.68Å; F815-L844 HydrophobicContact CZ-CB 3.75Å; F815-L844 HydrophobicContact CZ-CD1 4.38Å; L841-L844 PolarHBondContact O-N 3.43Å; L842-L844 VanDerWaalsContact C-N 3.31Å; L842-L844 PolarHBondContact O-N 3.04Å
845	I	82.7	Confident	76	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-70.2	-44.8	171.6	-68.7	156.8	0	0	0	111	L819 L841 L842 P843 Y847 L848 Y849 L879 I892	L819-I845 HydrophobicContact CD1-CG1 4.06Å; L841-I845 HydrophobicContact CD2-CD1 3.43Å; L841-I845 VanDerWaalsContact CD2-CD1 3.43Å; L841-I845 HydrophobicContact CD2-CG1 3.9Å; L841-I845 WeakPolarHBondContact O-CG1 3.48Å; L841-I845 PolarHBondContact O-N 3.27Å; L842-I845 PolarHBondContact O-N 2.91Å; P843-I845 VanDerWaalsContact C-N 3.33Å; I845-Y847 VanDerWaalsContact C-N 3.29Å; I845-Y847 PolarHBondContact O-N 3.02Å; I845-L848 WeakPolarHBondContact O-CB 3.43Å; I845-L848 PolarHBondContact O-N 3.03Å; I845-L848 VanDerWaalsContact O-N 3.15Å; I845-Y849 HydrophobicContact CG2-CE2 4.02Å; I845-Y849 WeakPolarHBondContact O-CD2 3.21Å; I845-L879 HydrophobicContact CD1-CD1 3.96Å; I845-L879 HydrophobicContact CG2-CD2 4.43Å; I845-I892 HydrophobicContact CG2-CD1 4.02Å
846	I	82.1	Confident	75.5	Confident	35 Å²	35	44.6 Å²	44.6	18%	0.179	21%	0.213	C	C	.	.	H	α-helix	trans	-62	-39.5	-179.8	-68.8	167.2	0	0	0	110.8	L842 P843 L848 Y849 H891 I892 Y895	L842-I846 HydrophobicContact CD1-CD1 4.15Å; L842-I846 HydrophobicContact CD1-CG1 4.28Å; L842-I846 HydrophobicContact CG-CD1 4Å; L842-I846 WeakPolarHBondContact O-CG1 3.46Å; L842-I846 PolarHBondContact O-N 3.24Å; P843-I846 PolarHBondContact O-N 2.94Å; I846-L848 PolarHBondContact O-N 3.44Å; I846-Y849 PolarHBondContact O-N 3.48Å; I846-H891 HydrophobicContact CD1-CB 4.33Å; I846-I892 HydrophobicContact CG1-CD1 4.4Å; I846-Y895 HydrophobicContact CG2-CE2 4.27Å
847	Y	82.5	Confident	75.1	Confident	34 Å²	34	43.5 Å²	43.5	13%	0.133	21%	0.208	C	C	.	.	H	α-helix	trans	-54.5	-32.8	174.8	179.5	-110.2	0	0	0	113.9	V808 Y809 P843 I845 Y849 E850 Q853	V808-Y847 HydrophobicContact CG1-CD1 4.4Å; Y809-Y847 HydrophobicContact CD1-CD1 4.03Å; Y809-Y847 AromaticContact CD1-CE1 3.57Å; Y809-Y847 HydrophobicContact CD1-CE1 3.57Å; Y809-Y847 HydrophobicContact CD1-CE2 4.21Å; Y809-Y847 AromaticContact CD1-CZ 3.66Å; Y809-Y847 HydrophobicContact CE1-CD1 4.09Å; Y809-Y847 HydrophobicContact CE1-CD2 4.25Å; Y809-Y847 HydrophobicContact CE1-CE1 4.05Å; Y809-Y847 HydrophobicContact CE1-CE2 4.21Å; Y809-Y847 HydrophobicContact CE1-CG 4.19Å; P843-Y847 PolarHBondContact O-N 3.38Å; P843-Y847 VanDerWaalsContact O-N 3.1Å; I845-Y847 VanDerWaalsContact C-N 3.29Å; I845-Y847 PolarHBondContact O-N 3.02Å; Y847-Y849 PolarHBondContact O-N 3.41Å; Y847-E850 WeakPolarHBondContact CD2-OE2 3.5Å; Y847-E850 WeakPolarHBondContact CE2-OE2 3.43Å; Y847-E850 PolarHBondContact O-N 3.28Å; Y847-Q853 HydrophobicContact CD1-CG 4.39Å; Y847-Q853 HydrophobicContact CD2-CG 4.28Å; Y847-Q853 HydrophobicContact CE1-CG 3.92Å; Y847-Q853 HydrophobicContact CE2-CG 3.8Å; Y847-Q853 WeakPolarHBondContact O-CG 3.34Å; Y847-Q853 VanDerWaalsContact OH-CD 3.24Å; Y847-Q853 PolarHBondContact OH-NE2 3.01Å; Y847-Q853 PolarHBondContact OH-OE1 3.24Å
848	L	78.4	Confident	74.4	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-20.3	177	-65.8	169.6	0	0	0	113.7	P812 F815 V816 L819 I845 I846 L854 M857 L870	P812-L848 HydrophobicContact CB-CD2 3.79Å; F815-L848 HydrophobicContact CD1-CD1 3.77Å; F815-L848 HydrophobicContact CD1-CD2 4.25Å; F815-L848 HydrophobicContact CD1-CG 4.18Å; F815-L848 HydrophobicContact CE1-CD1 4.05Å; V816-L848 HydrophobicContact CG2-CD1 3.72Å; V816-L848 HydrophobicContact CG2-CD2 3.67Å; V816-L848 HydrophobicContact CG2-CG 4.27Å; L819-L848 HydrophobicContact CD1-CD1 3.92Å; I845-L848 WeakPolarHBondContact O-CB 3.43Å; I845-L848 PolarHBondContact O-N 3.03Å; I845-L848 VanDerWaalsContact O-N 3.15Å; I846-L848 PolarHBondContact O-N 3.44Å; L848-L854 VanDerWaalsContact O-CD2 3.29Å; L848-L854 WeakPolarHBondContact O-CD2 3.42Å; L848-M857 HydrophobicContact CD2-SD 4.48Å; L848-L870 HydrophobicContact CD1-CD2 4.27Å
849	Y	75.6	Confident	73.6	Confident	7 Å²	7	42.4 Å²	42.4	3%	0.027	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	2.8	179	-65.6	-78.9	0	0	0	113.4	I845 I846 Y847 L854 L870 Y871 Y895	I845-Y849 HydrophobicContact CG2-CE2 4.02Å; I845-Y849 WeakPolarHBondContact O-CD2 3.21Å; I846-Y849 PolarHBondContact O-N 3.48Å; Y847-Y849 PolarHBondContact O-N 3.41Å; Y849-L854 WeakPolarHBondContact O-CD1 3.3Å; Y849-L870 HydrophobicContact CE1-CB 4.03Å; Y849-L870 PolarHBondContact OH-O 3.02Å; Y849-Y871 AromaticContact CD1-CE1 4Å; Y849-Y871 HydrophobicContact CD1-CE1 4Å; Y849-Y871 HydrophobicContact CE1-CD1 4.25Å; Y849-Y871 AromaticContact CE1-CE1 3.63Å; Y849-Y871 HydrophobicContact CE1-CE1 3.63Å; Y849-Y871 AromaticContact CE1-CZ 3.93Å; Y849-Y895 HydrophobicContact CG-CD1 4.4Å; Y849-Y895 HydrophobicContact CG-CG 4.21Å
850	E	73.6	Confident	72.4	Confident	78 Å²	78	44.4 Å²	44.4	36%	0.364	23%	0.226	S	C	.	.	S	Bend	trans	-67.4	138.5	172.6	-71.1	-177	172.2	0	0	111.4	Y847 E852 Q853 L854	Y847-E850 WeakPolarHBondContact CD2-OE2 3.5Å; Y847-E850 WeakPolarHBondContact CE2-OE2 3.43Å; Y847-E850 PolarHBondContact O-N 3.28Å; E850-E852 PolarHBondContact O-N 3.37Å; E850-Q853 HydrophobicContact CB-CG 4.17Å; E850-Q853 PolarHBondContact O-N 3.33Å; E850-Q853 VanDerWaalsContact O-N 3.09Å; E850-L854 WeakPolarHBondContact O-CG 3.42Å; E850-L854 PolarHBondContact O-N 3.27Å
851	P	64.7	Low	70.6	Confident	49 Å²	49	49.1 Å²	49.1	32%	0.318	25%	0.251	S	S	.	.	H	α-helix	trans	-62.7	-29.2	-174.9	25.1	-34.3	0	0	0	113.2	K855 W915	P851-K855 VanDerWaalsContact O-CB 3.24Å; P851-K855 WeakPolarHBondContact O-CB 3.4Å; P851-K855 PolarHBondContact O-N 2.63Å; P851-W915 HydrophobicContact CB-CG 4.25Å; P851-W915 HydrophobicContact CG-CB 4.3Å; P851-W915 HydrophobicContact CG-CG 4.47Å
852	E	67.4	Low	68.4	Low	112 Å²	112	53.3 Å²	53.3	52%	0.523	28%	0.281	S	S	.	.	H	α-helix	trans	-68.3	-42.7	174.6	-67.9	-172.8	-158	0	0	112.5	E850 K855 R856	E850-E852 PolarHBondContact O-N 3.37Å; E852-K855 PolarHBondContact O-N 2.9Å; E852-R856 WeakPolarHBondContact O-CG 3.47Å; E852-R856 PolarHBondContact O-N 2.93Å
853	Q	67.7	Low	66.5	Low	7 Å²	7	57.7 Å²	57.7	3%	0.033	31%	0.31	C	S	.	.	H	α-helix	trans	-73.6	-40	179.6	-47.7	-39.2	-38.1	0	0	110.9	Y847 E850 K855 R856 M857	Y847-Q853 HydrophobicContact CD1-CG 4.39Å; Y847-Q853 HydrophobicContact CD2-CG 4.28Å; Y847-Q853 HydrophobicContact CE1-CG 3.92Å; Y847-Q853 HydrophobicContact CE2-CG 3.8Å; Y847-Q853 WeakPolarHBondContact O-CG 3.34Å; Y847-Q853 VanDerWaalsContact OH-CD 3.24Å; Y847-Q853 PolarHBondContact OH-NE2 3.01Å; Y847-Q853 PolarHBondContact OH-OE1 3.24Å; E850-Q853 HydrophobicContact CB-CG 4.17Å; E850-Q853 PolarHBondContact O-N 3.33Å; E850-Q853 VanDerWaalsContact O-N 3.09Å; Q853-K855 VanDerWaalsContact C-N 3.27Å; Q853-K855 PolarHBondContact O-N 3.5Å; Q853-R856 PolarHBondContact O-N 2.93Å; Q853-M857 WeakPolarHBondContact O-CB 2.93Å; Q853-M857 VanDerWaalsContact O-CG 3.31Å; Q853-M857 WeakPolarHBondContact O-CG 3.34Å; Q853-M857 PolarHBondContact O-N 3.12Å
854	L	69	Low	64.5	Low	27 Å²	27	65.5 Å²	65.5	14%	0.141	33%	0.331	C	S	.	.	H	α-helix	trans	-57.7	-40.2	171	-67	172	0	0	0	111.4	L848 Y849 E850 S858 L867 L870	L848-L854 VanDerWaalsContact O-CD2 3.29Å; L848-L854 WeakPolarHBondContact O-CD2 3.42Å; Y849-L854 WeakPolarHBondContact O-CD1 3.3Å; E850-L854 WeakPolarHBondContact O-CG 3.42Å; E850-L854 PolarHBondContact O-N 3.27Å; L854-S858 WeakPolarHBondContact O-CB 3.29Å; L854-S858 PolarHBondContact O-N 3.45Å; L854-L867 HydrophobicContact CB-CD2 4.5Å; L854-L867 HydrophobicContact CD2-CD2 3.5Å; L854-L867 VanDerWaalsContact CD2-CD2 3.5Å; L854-L870 HydrophobicContact CD2-CD1 4.44Å
855	K	65	Low	63.1	Low	99 Å²	99	70 Å²	70	43%	0.43	35%	0.354	S	S	.	.	H	α-helix	trans	-66.7	-45	175.8	-172.7	161.7	177.3	165.6	0	112.1	P851 E852 Q853 S858 S859 L908	P851-K855 VanDerWaalsContact O-CB 3.24Å; P851-K855 WeakPolarHBondContact O-CB 3.4Å; P851-K855 PolarHBondContact O-N 2.63Å; E852-K855 PolarHBondContact O-N 2.9Å; Q853-K855 VanDerWaalsContact C-N 3.27Å; Q853-K855 PolarHBondContact O-N 3.5Å; K855-S858 WeakPolarHBondContact CA-OG 3.31Å; K855-S858 CarbonylContact O-C 3.55Å; K855-S858 WeakPolarHBondContact O-CA 3.26Å; K855-S858 PolarHBondContact O-N 2.75Å; K855-S858 VanDerWaalsContact O-N 3.08Å; K855-S858 PolarHBondContact O-OG 2.75Å; K855-S859 PolarHBondContact O-N 3.21Å; K855-S859 PolarHBondContact O-OG 3.45Å; K855-L908 WeakPolarHBondContact CE-O 3.3Å; K855-L908 PolarHBondContact NZ-O 3.45Å
856	R	63.2	Low	61.9	Low	129 Å²	129	71.1 Å²	71.1	49%	0.487	36%	0.362	S	S	.	.	H	α-helix	trans	-58.7	-47.5	173.2	-71.7	170.1	-179.5	177.2	-4.1	112.3	E852 Q853 S858 S859 D860	E852-R856 WeakPolarHBondContact O-CG 3.47Å; E852-R856 PolarHBondContact O-N 2.93Å; Q853-R856 PolarHBondContact O-N 2.93Å; R856-S858 PolarHBondContact O-N 2.71Å; R856-S859 WeakPolarHBondContact CA-OG 3.37Å; R856-S859 PolarHBondContact O-N 2.92Å; R856-S859 VanDerWaalsContact O-N 3.11Å; R856-S859 PolarHBondContact O-OG 2.89Å; R856-D860 PolarHBondContact O-N 3.28Å
857	M	65.2	Low	61.1	Low	9 Å²	9	71.3 Å²	71.3	4%	0.044	36%	0.362	C	S	.	.	H	α-helix	trans	-63.4	-20.4	175.6	-69.3	178.8	73.7	0	0	113.3	P812 N813 V816 L848 Q853 P866 L867	P812-M857 HydrophobicContact CB-CG 4.48Å; P812-M857 HydrophobicContact CB-SD 4.14Å; P812-M857 HydrophobicContact CG-CG 4.06Å; P812-M857 HydrophobicContact CG-SD 4.36Å; N813-M857 WeakPolarHBondContact OD1-CE 3.16Å; V816-M857 HydrophobicContact CB-CE 4.33Å; V816-M857 HydrophobicContact CG2-CE 3.67Å; L848-M857 HydrophobicContact CD2-SD 4.48Å; Q853-M857 WeakPolarHBondContact O-CB 2.93Å; Q853-M857 VanDerWaalsContact O-CG 3.31Å; Q853-M857 WeakPolarHBondContact O-CG 3.34Å; Q853-M857 PolarHBondContact O-N 3.12Å; M857-P866 HydrophobicContact CE-CB 3.95Å; M857-P866 HydrophobicContact CE-CG 4.06Å; M857-L867 HydrophobicContact CB-CD2 4.43Å
858	S	61.9	Low	60.4	Low	30 Å²	30	70.4 Å²	70.4	21%	0.21	36%	0.362	C	S	.	.	H	α-helix	trans	-88.6	-24.6	173.3	78.1	0	0	0	0	114.3	L854 K855 R856 I861	L854-S858 WeakPolarHBondContact O-CB 3.29Å; L854-S858 PolarHBondContact O-N 3.45Å; K855-S858 WeakPolarHBondContact CA-OG 3.31Å; K855-S858 CarbonylContact O-C 3.55Å; K855-S858 WeakPolarHBondContact O-CA 3.26Å; K855-S858 PolarHBondContact O-N 2.75Å; K855-S858 VanDerWaalsContact O-N 3.08Å; K855-S858 PolarHBondContact O-OG 2.75Å; R856-S858 PolarHBondContact O-N 2.71Å; S858-I861 VanDerWaalsContact O-CG1 3.22Å; S858-I861 WeakPolarHBondContact O-CG1 3.29Å
859	S	59.7	Low	60.1	Low	77 Å²	77	72.1 Å²	72.1	54%	0.538	37%	0.371	S	S	.	.	H	α-helix	trans	-82.1	-27.2	178.6	55.4	0	0	0	0	113.4	K855 R856 I861	K855-S859 PolarHBondContact O-N 3.21Å; K855-S859 PolarHBondContact O-OG 3.45Å; R856-S859 WeakPolarHBondContact CA-OG 3.37Å; R856-S859 PolarHBondContact O-N 2.92Å; R856-S859 VanDerWaalsContact O-N 3.11Å; R856-S859 PolarHBondContact O-OG 2.89Å; S859-I861 PolarHBondContact O-N 3.28Å
860	D	51.9	Low	60	Low	108 Å²	108	71.8 Å²	71.8	58%	0.578	37%	0.37	S	S	*	.	S	Bend	trans	-79.1	59.1	-179.3	-66.2	-4.2	0	0	0	111.4	R856 S862	R856-D860 PolarHBondContact O-N 3.28Å; D860-S862 PolarHBondContact O-N 3.48Å
861	I	42.3	Very low	60.1	Low	144 Å²	144	68.8 Å²	68.8	74%	0.738	36%	0.355	S	S	*	.			trans	-72.2	103	-169.2	-58.8	177.5	0	0	0	111.5	S858 S859	S858-I861 VanDerWaalsContact O-CG1 3.22Å; S858-I861 WeakPolarHBondContact O-CG1 3.29Å; S859-I861 PolarHBondContact O-N 3.28Å
862	S	36.1	Very low	60.8	Low	90 Å²	90	67.7 Å²	67.7	63%	0.629	35%	0.349	S	S	*	.			trans	-121.7	143.4	139.3	67.6	0	0	0	0	108.7	D860 R864	D860-S862 PolarHBondContact O-N 3.48Å; S862-R864 VanDerWaalsContact C-N 3.26Å; S862-R864 PolarHBondContact O-N 2.99Å
863	P	42.6	Very low	61.3	Low	103 Å²	103	65.7 Å²	65.7	67%	0.669	34%	0.336	S	S	*	.	S	Bend	trans	-81.5	58	-161	32.6	-37.6	0	0	0	114
864	R	41.5	Very low	61.5	Low	230 Å²	230	70.1 Å²	70.1	87%	0.868	36%	0.36	S	S	*	.	S	Bend	trans	-138.5	63.5	179.2	-67.5	-171.5	176.8	177	-0.9	113.4	S862	S862-R864 VanDerWaalsContact C-N 3.26Å; S862-R864 PolarHBondContact O-N 2.99Å
865	I	52	Low	62	Low	100 Å²	100	69 Å²	69	51%	0.513	35%	0.354	S	S	.	.			trans	32.2	106.9	152.8	-46.1	172.5	0	0	0	117.7	A868	I865-A868 HydrophobicContact CG2-CB 4.47Å
866	P	58	Low	62.9	Low	25 Å²	25	64.5 Å²	64.5	16%	0.162	33%	0.334	C	S	.	.	S	Bend	trans	-120.3	-33.6	151.9	35.2	-28.3	0	0	0	114.4	V816 M857 A868 L869	V816-P866 HydrophobicContact CG1-CB 4.27Å; M857-P866 HydrophobicContact CE-CB 3.95Å; M857-P866 HydrophobicContact CE-CG 4.06Å; P866-A868 PolarHBondContact O-N 2.83Å; P866-L869 VanDerWaalsContact O-CB 3.31Å; P866-L869 WeakPolarHBondContact O-CB 3.47Å; P866-L869 PolarHBondContact O-N 3.39Å; P866-L869 VanDerWaalsContact O-N 3.17Å
867	L	64.7	Low	63.4	Low	38 Å²	38	60.7 Å²	60.7	20%	0.199	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-46.5	-168.1	-75.7	165.2	0	0	0	114.1	L854 M857 L869 L870 Y871 P1094	L854-L867 HydrophobicContact CB-CD2 4.5Å; L854-L867 HydrophobicContact CD2-CD2 3.5Å; L854-L867 VanDerWaalsContact CD2-CD2 3.5Å; M857-L867 HydrophobicContact CB-CD2 4.43Å; L867-L869 PolarHBondContact O-N 3.24Å; L867-L870 PolarHBondContact O-N 3Å; L867-Y871 VanDerWaalsContact O-CD2 3.24Å; L867-Y871 WeakPolarHBondContact O-CD2 3.31Å; L867-P1094 HydrophobicContact CB-CG 4.15Å
868	A	68	Low	63.9	Low	15 Å²	15	63.4 Å²	63.4	12%	0.124	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-19.9	178.7	0	0	0	0	0	113.2	I865 P866 Y871 S872 I1092 P1094	I865-A868 HydrophobicContact CG2-CB 4.47Å; P866-A868 PolarHBondContact O-N 2.83Å; A868-Y871 PolarHBondContact O-N 3.45Å; A868-S872 PolarHBondContact O-N 2.73Å; A868-I1092 VanDerWaalsContact CB-O 3.27Å; A868-I1092 WeakPolarHBondContact CB-O 3.26Å; A868-P1094 HydrophobicContact CB-CG 4.21Å
869	L	71.4	Confident	64.6	Low	38 Å²	38	62.1 Å²	62.1	20%	0.199	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-72.2	-37.8	-178.4	-164	144	0	0	0	111.6	N820 P866 L867 Y871 S872 F875	N820-L869 HydrophobicContact CB-CD1 4.34Å; N820-L869 HydrophobicContact CB-CD2 3.84Å; P866-L869 VanDerWaalsContact O-CB 3.31Å; P866-L869 WeakPolarHBondContact O-CB 3.47Å; P866-L869 PolarHBondContact O-N 3.39Å; P866-L869 VanDerWaalsContact O-N 3.17Å; L867-L869 PolarHBondContact O-N 3.24Å; L869-Y871 PolarHBondContact O-N 2.93Å; L869-Y871 VanDerWaalsContact O-N 3.17Å; L869-S872 WeakPolarHBondContact O-CB 3.34Å; L869-S872 PolarHBondContact O-N 2.88Å; L869-S872 PolarHBondContact O-OG 2.83Å; L869-F875 HydrophobicContact CD2-CB 4.35Å; L869-F875 HydrophobicContact CD2-CD2 3.82Å; L869-F875 HydrophobicContact CD2-CE2 4.49Å; L869-F875 HydrophobicContact CD2-CG 4.32Å; L869-F875 WeakPolarHBondContact O-CB 3.18Å
870	L	74.3	Confident	65.5	Low	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-59.3	-23.5	174.2	-65.8	175.3	0	0	0	113.6	V816 L848 Y849 L854 L867 F875	V816-L870 HydrophobicContact CG1-CD2 3.94Å; V816-L870 HydrophobicContact CG1-CG 4.26Å; V816-L870 HydrophobicContact CG2-CD2 4.06Å; L848-L870 HydrophobicContact CD1-CD2 4.27Å; Y849-L870 HydrophobicContact CE1-CB 4.03Å; Y849-L870 PolarHBondContact OH-O 3.02Å; L854-L870 HydrophobicContact CD2-CD1 4.44Å; L867-L870 PolarHBondContact O-N 3Å; L870-F875 HydrophobicContact CD2-CE1 4.03Å; L870-F875 HydrophobicContact CD2-CE2 4.41Å; L870-F875 HydrophobicContact CD2-CZ 3.82Å; L870-F875 WeakPolarHBondContact O-CD1 3.35Å
871	Y	76.5	Confident	66.7	Low	14 Å²	14	57.5 Å²	57.5	6%	0.055	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-105.6	5	179.3	-56.2	-73.3	0	0	0	113.2	Y849 L867 A868 L869 I896 S899 P1094 A1097 A1098 S1101	Y849-Y871 AromaticContact CD1-CE1 4Å; Y849-Y871 HydrophobicContact CD1-CE1 4Å; Y849-Y871 HydrophobicContact CE1-CD1 4.25Å; Y849-Y871 AromaticContact CE1-CE1 3.63Å; Y849-Y871 HydrophobicContact CE1-CE1 3.63Å; Y849-Y871 AromaticContact CE1-CZ 3.93Å; L867-Y871 VanDerWaalsContact O-CD2 3.24Å; L867-Y871 WeakPolarHBondContact O-CD2 3.31Å; A868-Y871 PolarHBondContact O-N 3.45Å; L869-Y871 PolarHBondContact O-N 2.93Å; L869-Y871 VanDerWaalsContact O-N 3.17Å; Y871-I896 HydrophobicContact CD1-CG1 4.47Å; Y871-S899 WeakPolarHBondContact CE1-OG 3.24Å; Y871-S899 VanDerWaalsContact CZ-CB 3.45Å; Y871-P1094 HydrophobicContact CD2-CB 3.97Å; Y871-P1094 HydrophobicContact CE2-CB 4.28Å; Y871-A1097 CarbonylContact O-C 3.07Å; Y871-A1097 VanDerWaalsContact O-C 3.3Å; Y871-A1098 HydrophobicContact CD1-CB 4.28Å; Y871-A1098 HydrophobicContact CG-CB 4.3Å; Y871-S1101 PolarHBondContact O-OG 3.38Å
872	S	78	Confident	68.2	Low	26 Å²	26	53.1 Å²	53.1	18%	0.182	27%	0.274	C	S	.	.			trans	-78.7	144.3	-175.9	70.7	0	0	0	0	113	A868 L869 L874 F875 L876	A868-S872 PolarHBondContact O-N 2.73Å; L869-S872 WeakPolarHBondContact O-CB 3.34Å; L869-S872 PolarHBondContact O-N 2.88Å; L869-S872 PolarHBondContact O-OG 2.83Å; S872-L874 PolarHBondContact O-N 3.01Å; S872-F875 PolarHBondContact O-N 3.45Å; S872-F875 VanDerWaalsContact O-N 3.13Å; S872-F875 VanDerWaalsContact OG-CB 3.27Å; S872-F875 WeakPolarHBondContact OG-CB 3.39Å; S872-F875 PolarHBondContact OG-N 3.17Å; S872-L876 WeakPolarHBondContact O-CG 3.47Å; S872-L876 PolarHBondContact O-N 2.96Å
873	R	77.4	Confident	70	Confident	70 Å²	70	49.5 Å²	49.5	26%	0.264	25%	0.247	S	C	.	.	H	α-helix	trans	-50.4	-42	174.6	-74.8	176.3	170.7	166.7	-7	111.9	L876 R877 D1100 S1101 W1104	R873-L876 PolarHBondContact O-N 3.15Å; R873-R877 WeakPolarHBondContact O-CB 3.39Å; R873-R877 PolarHBondContact O-N 2.85Å; R873-D1100 WeakPolarHBondContact CD-OD2 3.4Å; R873-D1100 VanDerWaalsContact CZ-O 3.25Å; R873-D1100 IonicContact CZ-OD1 2.75Å; R873-D1100 IonicContact CZ-OD2 3.66Å; R873-D1100 VanDerWaalsContact NE-CG 3.31Å; R873-D1100 PolarHBondContact NE-O 3.21Å; R873-D1100 IonicContact NE-OD1 3.83Å; R873-D1100 IonicContact NE-OD2 2.89Å; R873-D1100 PolarHBondContact NE-OD2 3.48Å; R873-D1100 IonicContact NH1-OD1 2.65Å; R873-D1100 PolarHBondContact NH1-OD1 3.05Å; R873-D1100 VanDerWaalsContact NH1-OD1 3.08Å; R873-D1100 IonicContact NH1-OD2 2.69Å; R873-D1100 PolarHBondContact NH1-OD2 3.48Å; R873-D1100 VanDerWaalsContact NH1-OD2 3.15Å; R873-D1100 PolarHBondContact NH2-O 3.34Å; R873-D1100 IonicContact NH2-OD1 2.71Å; R873-D1100 PolarHBondContact NH2-OD1 3.5Å; R873-D1100 IonicContact NH2-OD2 3.72Å; R873-S1101 PolarHBondContact N-OG 3.23Å; R873-W1104 HydrophobicContact CG-CB 4.22Å; R873-W1104 HydrophobicContact CG-CG 4.38Å
874	L	72.1	Confident	71.6	Confident	100 Å²	100	49.3 Å²	49.3	52%	0.524	24%	0.241	S	C	.	.	H	α-helix	trans	-61	-51	178.1	-73.5	163.7	0	0	0	112.4	S872 R878 F994	S872-L874 PolarHBondContact O-N 3.01Å; L874-R878 WeakPolarHBondContact O-CB 3.38Å; L874-R878 WeakPolarHBondContact O-CD 3.38Å; L874-R878 VanDerWaalsContact O-CG 3.27Å; L874-R878 WeakPolarHBondContact O-CG 3.4Å; L874-R878 PolarHBondContact O-N 3.47Å; L874-R878 VanDerWaalsContact O-N 3.16Å; L874-F994 HydrophobicContact CD2-CE2 3.77Å; L874-F994 HydrophobicContact CD2-CZ 4.26Å
875	F	80.2	Confident	73.3	Confident	5 Å²	5	40.3 Å²	40.3	2%	0.022	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-43.8	178.5	-178	-99.2	0	0	0	111.6	L819 L869 L870 S872 R878 L879	L819-F875 HydrophobicContact CB-CE2 3.76Å; L819-F875 HydrophobicContact CB-CZ 4.37Å; L819-F875 HydrophobicContact CD1-CE2 4.49Å; L819-F875 HydrophobicContact CD1-CZ 4.3Å; L869-F875 HydrophobicContact CD2-CB 4.35Å; L869-F875 HydrophobicContact CD2-CD2 3.82Å; L869-F875 HydrophobicContact CD2-CE2 4.49Å; L869-F875 HydrophobicContact CD2-CG 4.32Å; L869-F875 WeakPolarHBondContact O-CB 3.18Å; L870-F875 HydrophobicContact CD2-CE1 4.03Å; L870-F875 HydrophobicContact CD2-CE2 4.41Å; L870-F875 HydrophobicContact CD2-CZ 3.82Å; L870-F875 WeakPolarHBondContact O-CD1 3.35Å; S872-F875 PolarHBondContact O-N 3.45Å; S872-F875 VanDerWaalsContact O-N 3.13Å; S872-F875 VanDerWaalsContact OG-CB 3.27Å; S872-F875 WeakPolarHBondContact OG-CB 3.39Å; S872-F875 PolarHBondContact OG-N 3.17Å; F875-R878 WeakPolarHBondContact O-CB 3.37Å; F875-R878 PolarHBondContact O-N 3.37Å; F875-L879 HydrophobicContact CE1-CD1 4.08Å; F875-L879 HydrophobicContact CZ-CD1 4.07Å; F875-L879 PolarHBondContact O-N 2.76Å
876	L	83.2	Confident	74.6	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-73.5	-37.5	-176.9	-64.1	172.8	0	0	0	112.9	S872 R873 R878 L879 L880 F888 I892 I896	S872-L876 WeakPolarHBondContact O-CG 3.47Å; S872-L876 PolarHBondContact O-N 2.96Å; R873-L876 PolarHBondContact O-N 3.15Å; L876-R878 VanDerWaalsContact C-N 3.31Å; L876-R878 PolarHBondContact O-N 3.08Å; L876-L879 PolarHBondContact O-N 2.63Å; L876-L880 VanDerWaalsContact O-CB 3.26Å; L876-L880 WeakPolarHBondContact O-CB 3.42Å; L876-L880 PolarHBondContact O-N 2.81Å; L876-F888 HydrophobicContact CB-CE2 4.41Å; L876-F888 HydrophobicContact CB-CZ 4.21Å; L876-F888 HydrophobicContact CD2-CE2 3.98Å; L876-F888 HydrophobicContact CD2-CZ 4.05Å; L876-I892 HydrophobicContact CD2-CG2 4.22Å; L876-I896 HydrophobicContact CD1-CD1 3.61Å; L876-I896 HydrophobicContact CD1-CG1 4.39Å; L876-I896 HydrophobicContact CD2-CD1 3.88Å; L876-I896 HydrophobicContact CG-CD1 4.4Å
877	R	75.4	Confident	75.7	Confident	49 Å²	49	38.9 Å²	38.9	19%	0.185	20%	0.204	C	C	.	.	H	α-helix	trans	-60.5	-40.9	170.8	-177.9	176.3	175.1	-175.2	-5	111.1	R873 L880 A881 L988 D991 W1104	R873-R877 WeakPolarHBondContact O-CB 3.39Å; R873-R877 PolarHBondContact O-N 2.85Å; R877-L880 PolarHBondContact O-N 3.42Å; R877-A881 PolarHBondContact O-N 3.42Å; R877-A881 VanDerWaalsContact O-N 3.12Å; R877-L988 PolarHBondContact NE-O 3.47Å; R877-L988 PolarHBondContact NH2-O 2.91Å; R877-D991 IonicContact CZ-OD2 3.29Å; R877-D991 IonicContact NH1-OD2 2.6Å; R877-D991 IonicContact NH2-OD2 3.98Å; R877-D991 PolarHBondContact NH2-OD2 2.98Å; R877-W1104 HydrophobicContact CB-CH2 3.9Å; R877-W1104 HydrophobicContact CB-CZ2 3.98Å; R877-W1104 HydrophobicContact CG-CH2 4.38Å; R877-W1104 HydrophobicContact CG-CZ2 4.12Å
878	R	74.7	Confident	76.7	Confident	67 Å²	67	37.1 Å²	37.1	25%	0.253	20%	0.195	S	C	.	.	H	α-helix	trans	-64.7	-46.8	173.4	-73.2	163.8	163.3	-166.7	-11.7	111.6	N820 T822 L874 F875 L876 L880 A881 Y882	N820-R878 PolarHBondContact O-NH1 3.36Å; T822-R878 HydrophobicContact CG2-CB 4.13Å; T822-R878 VanDerWaalsContact CG2-CD 3.43Å; T822-R878 HydrophobicContact CG2-CG 3.75Å; L874-R878 WeakPolarHBondContact O-CB 3.38Å; L874-R878 WeakPolarHBondContact O-CD 3.38Å; L874-R878 VanDerWaalsContact O-CG 3.27Å; L874-R878 WeakPolarHBondContact O-CG 3.4Å; L874-R878 PolarHBondContact O-N 3.47Å; L874-R878 VanDerWaalsContact O-N 3.16Å; F875-R878 WeakPolarHBondContact O-CB 3.37Å; F875-R878 PolarHBondContact O-N 3.37Å; L876-R878 VanDerWaalsContact C-N 3.31Å; L876-R878 PolarHBondContact O-N 3.08Å; R878-L880 VanDerWaalsContact C-N 3.28Å; R878-L880 PolarHBondContact O-N 2.97Å; R878-A881 WeakPolarHBondContact O-CB 3.39Å; R878-A881 PolarHBondContact O-N 2.67Å; R878-A881 VanDerWaalsContact O-N 3.14Å; R878-Y882 VanDerWaalsContact O-CD2 3.24Å; R878-Y882 WeakPolarHBondContact O-CD2 3.24Å; R878-Y882 PolarHBondContact O-N 3.11Å
879	L	77.4	Confident	77.4	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-58.4	-41.2	177.2	-144.3	85.3	0	0	0	112	I845 F875 L876 A881 Y882 L883 F888 I892	I845-L879 HydrophobicContact CD1-CD1 3.96Å; I845-L879 HydrophobicContact CG2-CD2 4.43Å; F875-L879 HydrophobicContact CE1-CD1 4.08Å; F875-L879 HydrophobicContact CZ-CD1 4.07Å; F875-L879 PolarHBondContact O-N 2.76Å; L876-L879 PolarHBondContact O-N 2.63Å; L879-A881 VanDerWaalsContact C-N 3.32Å; L879-A881 PolarHBondContact O-N 3.36Å; L879-Y882 CarbonylContact O-C 3.59Å; L879-Y882 PolarHBondContact O-N 2.83Å; L879-L883 HydrophobicContact CD2-CD1 3.91Å; L879-L883 HydrophobicContact CG-CD1 3.89Å; L879-L883 WeakPolarHBondContact O-CB 3.27Å; L879-L883 WeakPolarHBondContact O-CG 3.25Å; L879-L883 PolarHBondContact O-N 3.41Å; L879-L883 VanDerWaalsContact O-N 3.12Å; L879-F888 HydrophobicContact CB-CE2 4.41Å; L879-F888 HydrophobicContact CD2-CD2 4.23Å; L879-F888 HydrophobicContact CD2-CE2 4.17Å; L879-I892 HydrophobicContact CD2-CD1 4.13Å; L879-I892 HydrophobicContact CD2-CG1 3.92Å; L879-I892 HydrophobicContact CD2-CG2 4.2Å
880	L	78.5	Confident	77.9	Confident	20 Å²	20	37.3 Å²	37.3	11%	0.105	20%	0.196	C	C	.	.	H	α-helix	trans	-73.1	-19.5	179.7	-169.1	146.4	0	0	0	113.2	L876 R877 R878 V885 F888 L988 L1105	L876-L880 VanDerWaalsContact O-CB 3.26Å; L876-L880 WeakPolarHBondContact O-CB 3.42Å; L876-L880 PolarHBondContact O-N 2.81Å; R877-L880 PolarHBondContact O-N 3.42Å; R878-L880 VanDerWaalsContact C-N 3.28Å; R878-L880 PolarHBondContact O-N 2.97Å; L880-V885 HydrophobicContact CD2-CG2 4.35Å; L880-F888 HydrophobicContact CB-CD2 4.34Å; L880-F888 HydrophobicContact CD1-CD1 3.87Å; L880-F888 HydrophobicContact CD1-CE1 4.11Å; L880-F888 HydrophobicContact CD1-CG 4.1Å; L880-L988 HydrophobicContact CD2-CD1 4.1Å; L880-L1105 HydrophobicContact CD1-CD1 4.2Å
881	A	76	Confident	78.3	Confident	69 Å²	69	40.1 Å²	40.1	57%	0.57	21%	0.209	S	C	*	.	H	α-helix	trans	-75.6	-23.7	169.6	0	0	0	0	0	113.1	R877 R878 L879	R877-A881 PolarHBondContact O-N 3.42Å; R877-A881 VanDerWaalsContact O-N 3.12Å; R878-A881 WeakPolarHBondContact O-CB 3.39Å; R878-A881 PolarHBondContact O-N 2.67Å; R878-A881 VanDerWaalsContact O-N 3.14Å; L879-A881 VanDerWaalsContact C-N 3.32Å; L879-A881 PolarHBondContact O-N 3.36Å
882	Y	74.3	Confident	78.7	Confident	52 Å²	52	39.5 Å²	39.5	20%	0.204	21%	0.206	C	C	.	.	S	Bend	trans	-110.4	7.6	-179	-63.3	-71.9	0	0	0	114	L825 E826 S829 L834 I837 R878 L879	L825-Y882 HydrophobicContact CB-CD1 4.42Å; L825-Y882 HydrophobicContact CB-CD2 3.7Å; L825-Y882 HydrophobicContact CB-CE2 3.99Å; L825-Y882 HydrophobicContact CB-CG 3.96Å; L825-Y882 HydrophobicContact CD1-CD2 3.91Å; L825-Y882 HydrophobicContact CD1-CE2 4.49Å; L825-Y882 HydrophobicContact CG-CD2 4.36Å; E826-Y882 VanDerWaalsContact CG-OH 3.25Å; E826-Y882 WeakPolarHBondContact CG-OH 3.22Å; S829-Y882 WeakPolarHBondContact OG-CE1 3.34Å; L834-Y882 WeakPolarHBondContact CD2-O 3.46Å; I837-Y882 HydrophobicContact CD1-CD1 4.24Å; I837-Y882 HydrophobicContact CD1-CG 4.39Å; R878-Y882 VanDerWaalsContact O-CD2 3.24Å; R878-Y882 WeakPolarHBondContact O-CD2 3.24Å; R878-Y882 PolarHBondContact O-N 3.11Å; L879-Y882 CarbonylContact O-C 3.59Å; L879-Y882 PolarHBondContact O-N 2.83Å
883	L	73.7	Confident	79	Confident	13 Å²	13	38.2 Å²	38.2	7%	0.068	20%	0.198	C	C	.	.	S	Bend	trans	-136.3	146	176.4	-67.7	174.2	0	0	0	110.1	I837 L842 L879	I837-L883 HydrophobicContact CG2-CD2 3.98Å; L842-L883 HydrophobicContact CD1-CD1 4.14Å; L879-L883 HydrophobicContact CD2-CD1 3.91Å; L879-L883 HydrophobicContact CG-CD1 3.89Å; L879-L883 WeakPolarHBondContact O-CB 3.27Å; L879-L883 WeakPolarHBondContact O-CG 3.25Å; L879-L883 PolarHBondContact O-N 3.41Å; L879-L883 VanDerWaalsContact O-N 3.12Å
884	N	75.8	Confident	79.2	Confident	100 Å²	100	35.4 Å²	35.4	54%	0.535	19%	0.188	S	C	.	.			trans	-64.5	137.5	172.2	-173.3	-25.3	0	0	0	110.1	N886 T887 F888	N884-N886 PolarHBondContact O-N 3.42Å; N884-N886 PolarHBondContact OD1-N 3.05Å; N884-T887 WeakPolarHBondContact O-CA 3.38Å; N884-T887 VanDerWaalsContact O-CB 3.31Å; N884-T887 WeakPolarHBondContact O-CB 3.41Å; N884-T887 PolarHBondContact O-N 3.36Å; N884-F888 PolarHBondContact O-N 2.83Å
885	V	78.7	Confident	79.7	Confident	40 Å²	40	32.4 Å²	32.4	24%	0.242	17%	0.17	C	C	.	.	H	α-helix	trans	-51.2	-41.5	-178.5	-178.9	0	0	0	0	112	L880 T887 F888 L889	L880-V885 HydrophobicContact CD2-CG2 4.35Å; V885-T887 VanDerWaalsContact C-N 3.34Å; V885-T887 PolarHBondContact O-N 2.78Å; V885-F888 PolarHBondContact O-N 3.15Å; V885-L889 HydrophobicContact CG1-CD1 3.86Å; V885-L889 HydrophobicContact CG1-CG 4.24Å; V885-L889 WeakPolarHBondContact O-CB 3.37Å; V885-L889 VanDerWaalsContact O-CG 3.31Å; V885-L889 WeakPolarHBondContact O-CG 3.32Å; V885-L889 PolarHBondContact O-N 3.31Å
886	N	79.5	Confident	79.8	Confident	69 Å²	69	32.3 Å²	32.3	37%	0.369	17%	0.17	S	C	.	.	H	α-helix	trans	-62.6	-39.7	176.4	-76.4	-24.5	0	0	0	112.5	N884 V890	N884-N886 PolarHBondContact O-N 3.42Å; N884-N886 PolarHBondContact OD1-N 3.05Å; N886-V890 WeakPolarHBondContact O-CG2 3.49Å; N886-V890 PolarHBondContact O-N 3.41Å
887	T	79.8	Confident	79.7	Confident	27 Å²	27	32.1 Å²	32.1	17%	0.166	17%	0.169	C	C	.	.	H	α-helix	trans	-66.9	-41.3	176.8	-48.3	0	0	0	0	111.1	L842 N884 V885 H891	L842-T887 HydrophobicContact CD2-CG2 3.81Å; N884-T887 WeakPolarHBondContact O-CA 3.38Å; N884-T887 VanDerWaalsContact O-CB 3.31Å; N884-T887 WeakPolarHBondContact O-CB 3.41Å; N884-T887 PolarHBondContact O-N 3.36Å; V885-T887 VanDerWaalsContact C-N 3.34Å; V885-T887 PolarHBondContact O-N 2.78Å; T887-H891 WeakPolarHBondContact O-CB 3.12Å; T887-H891 PolarHBondContact O-CD2 3.11Å; T887-H891 PolarHBondContact O-N 3.33Å
888	F	85.5	Confident	79.7	Confident	1 Å²	1	31.2 Å²	31.2	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-63	-47.3	175.9	-179.7	-87.7	0	0	0	112.3	L876 L879 L880 N884 V885 V890 I892 L893 I896 L1105	L876-F888 HydrophobicContact CB-CE2 4.41Å; L876-F888 HydrophobicContact CB-CZ 4.21Å; L876-F888 HydrophobicContact CD2-CE2 3.98Å; L876-F888 HydrophobicContact CD2-CZ 4.05Å; L879-F888 HydrophobicContact CB-CE2 4.41Å; L879-F888 HydrophobicContact CD2-CD2 4.23Å; L879-F888 HydrophobicContact CD2-CE2 4.17Å; L880-F888 HydrophobicContact CB-CD2 4.34Å; L880-F888 HydrophobicContact CD1-CD1 3.87Å; L880-F888 HydrophobicContact CD1-CE1 4.11Å; L880-F888 HydrophobicContact CD1-CG 4.1Å; N884-F888 PolarHBondContact O-N 2.83Å; V885-F888 PolarHBondContact O-N 3.15Å; F888-V890 VanDerWaalsContact C-N 3.3Å; F888-V890 PolarHBondContact O-N 2.89Å; F888-I892 HydrophobicContact CD2-CB 4.05Å; F888-I892 HydrophobicContact CD2-CG1 4.22Å; F888-I892 HydrophobicContact CD2-CG2 4.26Å; F888-I892 HydrophobicContact CE2-CB 4.13Å; F888-I892 HydrophobicContact CE2-CG2 3.85Å; F888-I892 HydrophobicContact CG-CB 4.47Å; F888-I892 HydrophobicContact CZ-CG2 4.27Å; F888-I892 PolarHBondContact O-N 3.2Å; F888-L893 PolarHBondContact O-N 3.31Å; F888-L893 VanDerWaalsContact O-N 3.17Å; F888-I896 HydrophobicContact CZ-CD1 4.17Å; F888-L1105 HydrophobicContact CE1-CD1 4.05Å; F888-L1105 HydrophobicContact CE1-CD2 4.04Å
889	L	83.5	Confident	79.5	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-68.1	-24.8	-178.3	-70	175.7	0	0	0	114.2	V885 L893 L1105 I1109 Y1117	V885-L889 HydrophobicContact CG1-CD1 3.86Å; V885-L889 HydrophobicContact CG1-CG 4.24Å; V885-L889 WeakPolarHBondContact O-CB 3.37Å; V885-L889 VanDerWaalsContact O-CG 3.31Å; V885-L889 WeakPolarHBondContact O-CG 3.32Å; V885-L889 PolarHBondContact O-N 3.31Å; L889-L893 HydrophobicContact CD2-CD2 3.83Å; L889-L1105 HydrophobicContact CD2-CD2 4.16Å; L889-I1109 HydrophobicContact CD1-CD1 4.14Å; L889-I1109 HydrophobicContact CD2-CD1 3.72Å; L889-I1109 HydrophobicContact CG-CD1 4.39Å; L889-Y1117 HydrophobicContact CB-CD1 4.29Å; L889-Y1117 HydrophobicContact CB-CG 4.36Å; L889-Y1117 HydrophobicContact CD1-CD2 4.19Å; L889-Y1117 HydrophobicContact CD1-CE2 4.39Å
890	V	81.9	Confident	79.3	Confident	54 Å²	54	28.7 Å²	28.7	33%	0.327	16%	0.159	S	C	.	.	H	α-helix	trans	-89.1	-45.3	176.3	173.4	0	0	0	0	111.8	N886 F888 P894 Y1117	N886-V890 WeakPolarHBondContact O-CG2 3.49Å; N886-V890 PolarHBondContact O-N 3.41Å; F888-V890 VanDerWaalsContact C-N 3.3Å; F888-V890 PolarHBondContact O-N 2.89Å; V890-P894 WeakPolarHBondContact O-CD 3.43Å; V890-P894 WeakPolarHBondContact O-CG 3.37Å; V890-Y1117 HydrophobicContact CG2-CE1 4.23Å
891	H	81.4	Confident	78.8	Confident	59 Å²	59	28.8 Å²	28.8	27%	0.273	16%	0.16	S	C	.	.	H	α-helix	trans	-101.1	-21.8	-168.5	-62.3	-76.2	0	0	0	115.6	I846 T887 Y895	I846-H891 HydrophobicContact CD1-CB 4.33Å; T887-H891 WeakPolarHBondContact O-CB 3.12Å; T887-H891 PolarHBondContact O-CD2 3.11Å; T887-H891 PolarHBondContact O-N 3.33Å; H891-Y895 VanDerWaalsContact O-CD2 3.23Å; H891-Y895 WeakPolarHBondContact O-CD2 3.26Å; H891-Y895 WeakPolarHBondContact O-CE2 3.37Å
892	I	85	Confident	77.8	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.005	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-41.6	-177.1	-56.9	-62.5	0	0	0	111.5	L842 I845 I846 L876 L879 F888 P894 Y895 I896	L842-I892 HydrophobicContact CD1-CD1 3.99Å; I845-I892 HydrophobicContact CG2-CD1 4.02Å; I846-I892 HydrophobicContact CG1-CD1 4.4Å; L876-I892 HydrophobicContact CD2-CG2 4.22Å; L879-I892 HydrophobicContact CD2-CD1 4.13Å; L879-I892 HydrophobicContact CD2-CG1 3.92Å; L879-I892 HydrophobicContact CD2-CG2 4.2Å; F888-I892 HydrophobicContact CD2-CB 4.05Å; F888-I892 HydrophobicContact CD2-CG1 4.22Å; F888-I892 HydrophobicContact CD2-CG2 4.26Å; F888-I892 HydrophobicContact CE2-CB 4.13Å; F888-I892 HydrophobicContact CE2-CG2 3.85Å; F888-I892 HydrophobicContact CG-CB 4.47Å; F888-I892 HydrophobicContact CZ-CG2 4.27Å; F888-I892 PolarHBondContact O-N 3.2Å; I892-P894 VanDerWaalsContact C-CD 3.43Å; I892-Y895 PolarHBondContact O-N 3.17Å; I892-I896 HydrophobicContact CG2-CD1 4.07Å; I892-I896 HydrophobicContact CG2-CG1 4.39Å; I892-I896 PolarHBondContact O-N 2.68Å
893	L	85.5	Confident	76.5	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-53.7	-40.1	-178.6	-177.8	62.8	0	0	0	115.2	F888 L889 Y895 I896 T897 L1102 L1105 I1118 Y1121	F888-L893 PolarHBondContact O-N 3.31Å; F888-L893 VanDerWaalsContact O-N 3.17Å; L889-L893 HydrophobicContact CD2-CD2 3.83Å; L893-Y895 PolarHBondContact O-N 3.19Å; L893-I896 PolarHBondContact O-N 3.12Å; L893-T897 HydrophobicContact CD1-CG2 4.37Å; L893-T897 PolarHBondContact O-N 3.06Å; L893-T897 PolarHBondContact O-OG1 3.27Å; L893-L1102 HydrophobicContact CD1-CD2 3.5Å; L893-L1102 VanDerWaalsContact CD1-CD2 3.5Å; L893-L1105 HydrophobicContact CD1-CD2 3.78Å; L893-I1118 HydrophobicContact CD1-CG1 4.34Å; L893-I1118 HydrophobicContact CD2-CG1 3.82Å; L893-Y1121 HydrophobicContact CD2-CD2 4.15Å; L893-Y1121 HydrophobicContact CD2-CE2 4.38Å; L893-Y1121 HydrophobicContact CG-CD2 4.29Å
894	P	81.7	Confident	75.1	Confident	10 Å²	10	28.1 Å²	28.1	7%	0.065	17%	0.167	C	C	.	.	H	α-helix	trans	-57.9	-46.3	178.3	-25.3	35.3	0	0	0	112.5	V890 I892 I896 T897 F898 Y1121	V890-P894 WeakPolarHBondContact O-CD 3.43Å; V890-P894 WeakPolarHBondContact O-CG 3.37Å; I892-P894 VanDerWaalsContact C-CD 3.43Å; P894-I896 VanDerWaalsContact C-N 3.32Å; P894-I896 PolarHBondContact O-N 3.47Å; P894-T897 PolarHBondContact O-N 3.41Å; P894-T897 VanDerWaalsContact O-N 3.09Å; P894-T897 PolarHBondContact O-OG1 3.05Å; P894-F898 HydrophobicContact CB-CD2 4.38Å; P894-F898 HydrophobicContact CB-CE2 4.1Å; P894-F898 WeakPolarHBondContact O-CD2 3.37Å; P894-F898 WeakPolarHBondContact O-CG 3.29Å; P894-F898 PolarHBondContact O-N 2.96Å; P894-Y1121 HydrophobicContact CB-CD1 4.48Å; P894-Y1121 HydrophobicContact CB-CE1 4.36Å; P894-Y1121 HydrophobicContact CG-CD1 4.46Å; P894-Y1121 HydrophobicContact CG-CE1 3.97Å; P894-Y1121 HydrophobicContact CG-CE2 4.12Å
895	Y	81.6	Confident	73.5	Confident	38 Å²	38	29.8 Å²	29.8	15%	0.149	18%	0.175	C	C	.	.	H	α-helix	trans	-62.9	-36.3	179.1	-61.4	-85.8	0	0	0	112.4	I846 Y849 H891 I892 L893 F898 S899 Y920	I846-Y895 HydrophobicContact CG2-CE2 4.27Å; Y849-Y895 HydrophobicContact CG-CD1 4.4Å; Y849-Y895 HydrophobicContact CG-CG 4.21Å; H891-Y895 VanDerWaalsContact O-CD2 3.23Å; H891-Y895 WeakPolarHBondContact O-CD2 3.26Å; H891-Y895 WeakPolarHBondContact O-CE2 3.37Å; I892-Y895 PolarHBondContact O-N 3.17Å; L893-Y895 PolarHBondContact O-N 3.19Å; Y895-F898 PolarHBondContact O-N 3.3Å; Y895-S899 PolarHBondContact O-N 3.11Å; Y895-Y920 HydrophobicContact CD1-CE1 4.04Å; Y895-Y920 HydrophobicContact CE1-CD1 4.09Å; Y895-Y920 AromaticContact CE1-CE1 3.29Å; Y895-Y920 HydrophobicContact CE1-CE1 3.29Å; Y895-Y920 AromaticContact CE1-CZ 3.69Å; Y895-Y920 HydrophobicContact CE2-CE1 4.37Å; Y895-Y920 AromaticContact CZ-CD1 3.97Å; Y895-Y920 AromaticContact CZ-CE1 3.48Å; Y895-Y920 VanDerWaalsContact CZ-CE1 3.48Å; Y895-Y920 WeakPolarHBondContact OH-CD1 3.38Å
896	I	83.5	Confident	71.5	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-48.7	171.9	-57.1	169.5	0	0	0	109.8	Y871 L876 F888 I892 L893 P894 F898 S899 A1098 L1102	Y871-I896 HydrophobicContact CD1-CG1 4.47Å; L876-I896 HydrophobicContact CD1-CD1 3.61Å; L876-I896 HydrophobicContact CD1-CG1 4.39Å; L876-I896 HydrophobicContact CD2-CD1 3.88Å; L876-I896 HydrophobicContact CG-CD1 4.4Å; F888-I896 HydrophobicContact CZ-CD1 4.17Å; I892-I896 HydrophobicContact CG2-CD1 4.07Å; I892-I896 HydrophobicContact CG2-CG1 4.39Å; I892-I896 PolarHBondContact O-N 2.68Å; L893-I896 PolarHBondContact O-N 3.12Å; P894-I896 VanDerWaalsContact C-N 3.32Å; P894-I896 PolarHBondContact O-N 3.47Å; I896-F898 PolarHBondContact O-N 2.83Å; I896-S899 WeakPolarHBondContact O-CB 3.16Å; I896-S899 PolarHBondContact O-N 3.42Å; I896-S899 PolarHBondContact O-OG 3.46Å; I896-A1098 HydrophobicContact CG2-CB 4.18Å; I896-L1102 HydrophobicContact CG2-CD1 4.2Å; I896-L1102 HydrophobicContact CG2-CD2 4.04Å; I896-L1102 HydrophobicContact CG2-CG 3.89Å
897	T	80.7	Confident	69.6	Low	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.3	-34.6	179.5	56.4	0	0	0	0	113.5	L893 P894 L900 L1102 Y1121 L1122 T1125	L893-T897 HydrophobicContact CD1-CG2 4.37Å; L893-T897 PolarHBondContact O-N 3.06Å; L893-T897 PolarHBondContact O-OG1 3.27Å; P894-T897 PolarHBondContact O-N 3.41Å; P894-T897 VanDerWaalsContact O-N 3.09Å; P894-T897 PolarHBondContact O-OG1 3.05Å; T897-L900 WeakPolarHBondContact O-CB 3.47Å; T897-L900 WeakPolarHBondContact O-CG 3.5Å; T897-L900 PolarHBondContact O-N 2.84Å; T897-L1102 HydrophobicContact CG2-CD1 4.17Å; T897-L1102 HydrophobicContact CG2-CD2 3.96Å; T897-Y1121 WeakPolarHBondContact OG1-CB 3.28Å; T897-L1122 HydrophobicContact CG2-CD2 4.19Å; T897-L1122 HydrophobicContact CG2-CG 4.37Å; T897-T1125 WeakPolarHBondContact O-CG2 3.33Å
898	F	74.5	Confident	67.7	Low	30 Å²	30	32.9 Å²	32.9	13%	0.132	19%	0.193	C	C	.	.	H	α-helix	trans	-70.7	-30.2	175.5	-70.4	-52.2	0	0	0	113.3	P894 Y895 I896 L900 I901 W915 Y920 L1128	P894-F898 HydrophobicContact CB-CD2 4.38Å; P894-F898 HydrophobicContact CB-CE2 4.1Å; P894-F898 WeakPolarHBondContact O-CD2 3.37Å; P894-F898 WeakPolarHBondContact O-CG 3.29Å; P894-F898 PolarHBondContact O-N 2.96Å; Y895-F898 PolarHBondContact O-N 3.3Å; I896-F898 PolarHBondContact O-N 2.83Å; F898-L900 PolarHBondContact O-N 3.05Å; F898-L900 VanDerWaalsContact O-N 3.08Å; F898-I901 PolarHBondContact O-N 3.35Å; F898-W915 HydrophobicContact CB-CH2 4.16Å; F898-W915 HydrophobicContact CB-CZ3 4Å; F898-W915 HydrophobicContact CG-CZ3 4.42Å; F898-Y920 WeakPolarHBondContact CD2-OH 3.11Å; F898-L1128 HydrophobicContact CD1-CD1 4.21Å; F898-L1128 HydrophobicContact CE1-CD1 3.65Å
899	S	72.1	Confident	65.4	Low	15 Å²	15	37 Å²	37	11%	0.105	22%	0.221	C	C	.	.	H	α-helix	trans	-58.3	-23.4	175.6	78.1	0	0	0	0	113.5	Y871 Y895 I896 I901 G902 A1098	Y871-S899 WeakPolarHBondContact CE1-OG 3.24Å; Y871-S899 VanDerWaalsContact CZ-CB 3.45Å; Y895-S899 PolarHBondContact O-N 3.11Å; I896-S899 WeakPolarHBondContact O-CB 3.16Å; I896-S899 PolarHBondContact O-N 3.42Å; I896-S899 PolarHBondContact O-OG 3.46Å; S899-I901 PolarHBondContact O-N 3.12Å; S899-G902 PolarHBondContact O-N 3.16Å; S899-A1098 VanDerWaalsContact OG-CB 3.26Å; S899-A1098 WeakPolarHBondContact OG-CB 3.44Å
900	L	73.2	Confident	63.2	Low	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-23.6	175.7	-59.5	-178.5	0	0	0	113.6	T897 F898 I1095 A1098 M1099 L1102 L1122 S1169 V1170	T897-L900 WeakPolarHBondContact O-CB 3.47Å; T897-L900 WeakPolarHBondContact O-CG 3.5Å; T897-L900 PolarHBondContact O-N 2.84Å; F898-L900 PolarHBondContact O-N 3.05Å; F898-L900 VanDerWaalsContact O-N 3.08Å; L900-I1095 HydrophobicContact CD2-CG1 4.31Å; L900-A1098 HydrophobicContact CD2-CB 3.85Å; L900-M1099 HydrophobicContact CD2-CG 3.59Å; L900-L1102 HydrophobicContact CD1-CD1 3.79Å; L900-L1102 HydrophobicContact CD2-CD1 4.41Å; L900-L1102 HydrophobicContact CG-CD1 4.34Å; L900-L1122 HydrophobicContact CD1-CD2 3.58Å; L900-S1169 PolarHBondContact O-OG 3.03Å; L900-V1170 HydrophobicContact CB-CG2 3.89Å; L900-V1170 HydrophobicContact CD1-CG2 4.2Å
901	I	67	Low	61.1	Low	23 Å²	23	46.9 Å²	46.9	12%	0.118	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-40.3	175.7	-52.8	-178.9	0	0	0	110.7	F898 S899 G903 T1125 L1128	F898-I901 PolarHBondContact O-N 3.35Å; S899-I901 PolarHBondContact O-N 3.12Å; I901-G903 VanDerWaalsContact C-N 3.26Å; I901-G903 PolarHBondContact O-N 3.04Å; I901-T1125 HydrophobicContact CD1-CG2 3.63Å; I901-T1125 HydrophobicContact CG1-CG2 3.51Å; I901-L1128 HydrophobicContact CD1-CB 3.89Å; I901-L1128 HydrophobicContact CD1-CD1 4.37Å
902	G	55	Low	58.9	Low	28 Å²	28	49.4 Å²	49.4	29%	0.289	28%	0.282	S	S	.	.	S	Bend	trans	-82.3	11.3	-172.4	0	0	0	0	0	115.7	S899 S904	S899-G902 PolarHBondContact O-N 3.16Å; G902-S904 VanDerWaalsContact C-N 3.25Å; G902-S904 PolarHBondContact O-N 3.24Å; G902-S904 VanDerWaalsContact O-N 3.09Å
903	G	46.5	Very low	56.7	Low	24 Å²	24	51.6 Å²	51.6	25%	0.247	29%	0.293	C	S	.	.			trans	-75.7	6	-163.8	0	0	0	0	0	118	I901	I901-G903 VanDerWaalsContact C-N 3.26Å; I901-G903 PolarHBondContact O-N 3.04Å
904	S	45.2	Very low	54.3	Low	67 Å²	67	56 Å²	56	47%	0.469	32%	0.32	S	S	.	.	S	Bend	trans	-114.1	127.6	165	-179	0	0	0	0	108.9	G902 N906 A907	G902-S904 VanDerWaalsContact C-N 3.25Å; G902-S904 PolarHBondContact O-N 3.24Å; G902-S904 VanDerWaalsContact O-N 3.09Å; S904-N906 PolarHBondContact O-N 3.1Å; S904-N906 VanDerWaalsContact O-N 3.12Å; S904-A907 VanDerWaalsContact O-CB 3.28Å; S904-A907 WeakPolarHBondContact O-CB 3.43Å; S904-A907 PolarHBondContact O-N 3.07Å
905	I	41.5	Very low	52.4	Low	135 Å²	135	59.9 Å²	59.9	69%	0.692	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-58.1	-29.8	-178.8	-65.3	169.9	0	0	0	110.8	A907 L908	I905-A907 PolarHBondContact O-N 2.85Å; I905-L908 PolarHBondContact O-N 3.44Å
906	N	37.6	Very low	50	Low	127 Å²	127	63.5 Å²	63.5	68%	0.679	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-73.9	-3.7	178	-57.4	-3.1	0	0	0	114	S904 S909	S904-N906 PolarHBondContact O-N 3.1Å; S904-N906 VanDerWaalsContact O-N 3.12Å; N906-S909 PolarHBondContact O-OG 2.69Å
907	A	39.3	Very low	47.7	Very low	25 Å²	25	70.8 Å²	70.8	21%	0.207	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-88.9	-19	175.3	0	0	0	0	0	113	S904 I905 S909 D910 I913	S904-A907 VanDerWaalsContact O-CB 3.28Å; S904-A907 WeakPolarHBondContact O-CB 3.43Å; S904-A907 PolarHBondContact O-N 3.07Å; I905-A907 PolarHBondContact O-N 2.85Å; A907-S909 VanDerWaalsContact C-N 3.27Å; A907-S909 PolarHBondContact O-N 3.47Å; A907-D910 PolarHBondContact O-N 3.35Å; A907-I913 HydrophobicContact CB-CD1 4.04Å
908	L	38.7	Very low	45.5	Very low	50 Å²	50	78.6 Å²	78.6	26%	0.262	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-11.1	177.3	-73.1	166.1	0	0	0	113.4	K855 I905	K855-L908 WeakPolarHBondContact CE-O 3.3Å; K855-L908 PolarHBondContact NZ-O 3.45Å; I905-L908 PolarHBondContact O-N 3.44Å
909	S	38.6	Very low	43.6	Very low	86 Å²	86	81 Å²	81	60%	0.601	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-18.4	172.4	38.6	0	0	0	0	114	N906 A907 E911	N906-S909 PolarHBondContact O-OG 2.69Å; A907-S909 VanDerWaalsContact C-N 3.27Å; A907-S909 PolarHBondContact O-N 3.47Å; S909-E911 PolarHBondContact O-N 2.88Å
910	D	37.2	Very low	41.9	Very low	89 Å²	89	83.4 Å²	83.4	48%	0.476	44%	0.443	S	S	.	.			trans	-85.1	100.5	-179	-124.1	-25.8	0	0	0	110	A907 N912 I913	A907-D910 PolarHBondContact O-N 3.35Å; D910-N912 PolarHBondContact O-N 3.19Å; D910-I913 PolarHBondContact O-N 2.72Å; D910-I913 VanDerWaalsContact O-N 3.09Å
911	E	36.6	Very low	39.9	Very low	176 Å²	176	86.3 Å²	86.3	82%	0.822	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-14.9	179.8	-58.9	-166.7	142.7	0	0	113.5	S909 I913	S909-E911 PolarHBondContact O-N 2.88Å; E911-I913 VanDerWaalsContact C-N 3.33Å; E911-I913 PolarHBondContact O-N 3.28Å
912	N	36.4	Very low	38.2	Very low	111 Å²	111	88.7 Å²	88.7	59%	0.594	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-12.3	178.2	-64	-73.4	0	0	0	114.2	D910 V914	D910-N912 PolarHBondContact O-N 3.19Å; N912-V914 PolarHBondContact O-N 3.13Å; N912-V914 VanDerWaalsContact O-N 3.08Å
913	I	39	Very low	37	Very low	48 Å²	48	93.2 Å²	93.2	25%	0.246	51%	0.514	C	S	.	.	S	Bend	trans	-83.7	76.3	166.8	-54.9	-177.7	0	0	0	108.1	A907 D910 E911 W915	A907-I913 HydrophobicContact CB-CD1 4.04Å; D910-I913 PolarHBondContact O-N 2.72Å; D910-I913 VanDerWaalsContact O-N 3.09Å; E911-I913 VanDerWaalsContact C-N 3.33Å; E911-I913 PolarHBondContact O-N 3.28Å; I913-W915 PolarHBondContact O-N 3.03Å
914	V	34.8	Very low	36	Very low	91 Å²	91	96.2 Å²	96.2	55%	0.552	53%	0.527	S	S	*	.			trans	-69	96.2	176.4	-177.4	0	0	0	0	109	N912 H916	N912-V914 PolarHBondContact O-N 3.13Å; N912-V914 VanDerWaalsContact O-N 3.08Å; V914-H916 PolarHBondContact O-N 3Å
915	W	41.1	Very low	35.1	Very low	92 Å²	92	99.2 Å²	99.2	35%	0.348	54%	0.538	S	S	.	.			trans	-64.4	80.1	164.3	-71.7	92.4	0	0	0	109.2	P851 F898 I913 Q917	P851-W915 HydrophobicContact CB-CG 4.25Å; P851-W915 HydrophobicContact CG-CB 4.3Å; P851-W915 HydrophobicContact CG-CG 4.47Å; F898-W915 HydrophobicContact CB-CH2 4.16Å; F898-W915 HydrophobicContact CB-CZ3 4Å; F898-W915 HydrophobicContact CG-CZ3 4.42Å; I913-W915 PolarHBondContact O-N 3.03Å; W915-Q917 PolarHBondContact O-N 3.4Å
916	H	32.2	Very low	34.4	Very low	114 Å²	114	102.1 Å²	102.1	53%	0.528	55%	0.549	S	S	.	.			trans	-60.8	111.2	-175.5	-97.8	-47.8	0	0	0	110.9	V914 R918 S919	V914-H916 PolarHBondContact O-N 3Å; H916-R918 PolarHBondContact O-N 3.15Å; H916-S919 PolarHBondContact O-N 3.05Å; H916-S919 VanDerWaalsContact O-N 3.13Å
917	Q	33.9	Very low	33.9	Very low	156 Å²	156	104.5 Å²	104.5	73%	0.729	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-52.1	-18.3	174.9	-68	165.8	-35.2	0	0	113.7	W915 S919 Y920	W915-Q917 PolarHBondContact O-N 3.4Å; Q917-S919 PolarHBondContact O-N 3.37Å; Q917-Y920 PolarHBondContact O-N 2.99Å
918	R	35.2	Very low	33.4	Very low	164 Å²	164	111.2 Å²	111.2	62%	0.619	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-58.9	-24.7	175.7	-67.3	-177.8	172.2	-177.5	-5.1	114.3	H916	H916-R918 PolarHBondContact O-N 3.15Å
919	S	35.3	Very low	32.8	Very low	80 Å²	80	115.3 Å²	115.3	56%	0.559	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-78.8	-24.3	-179.4	-54.4	0	0	0	0	114.4	H916 Q917	H916-S919 PolarHBondContact O-N 3.05Å; H916-S919 VanDerWaalsContact O-N 3.13Å; Q917-S919 PolarHBondContact O-N 3.37Å
920	Y	34.9	Very low	32.3	Very low	66 Å²	66	116.2 Å²	116.2	26%	0.259	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.8	-29.2	-174.8	-73.4	-73.1	0	0	0	113.5	Y895 F898 Q917 G922 L923	Y895-Y920 HydrophobicContact CD1-CE1 4.04Å; Y895-Y920 HydrophobicContact CE1-CD1 4.09Å; Y895-Y920 AromaticContact CE1-CE1 3.29Å; Y895-Y920 HydrophobicContact CE1-CE1 3.29Å; Y895-Y920 AromaticContact CE1-CZ 3.69Å; Y895-Y920 HydrophobicContact CE2-CE1 4.37Å; Y895-Y920 AromaticContact CZ-CD1 3.97Å; Y895-Y920 AromaticContact CZ-CE1 3.48Å; Y895-Y920 VanDerWaalsContact CZ-CE1 3.48Å; Y895-Y920 WeakPolarHBondContact OH-CD1 3.38Å; F898-Y920 WeakPolarHBondContact CD2-OH 3.11Å; Q917-Y920 PolarHBondContact O-N 2.99Å; Y920-G922 PolarHBondContact O-N 2.8Å; Y920-L923 PolarHBondContact O-N 3.27Å
921	A	32.3	Very low	31.7	Very low	60 Å²	60	120.1 Å²	120.1	50%	0.496	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.1	-14.6	-174.9	0	0	0	0	0	115.4	N925	A921-N925 PolarHBondContact O-ND2 3.32Å; A921-N925 VanDerWaalsContact O-ND2 3.08Å
922	G	31.4	Very low	31.2	Very low	73 Å²	73	119.3 Å²	119.3	75%	0.753	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-2.5	-177.3	0	0	0	0	0	116.5	Y920	Y920-G922 PolarHBondContact O-N 2.8Å
923	L	28.8	Very low	30.7	Very low	124 Å²	124	118.8 Å²	118.8	65%	0.649	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	-12.3	-175.1	-81.4	165.3	0	0	0	115.3	Y920	Y920-L923 PolarHBondContact O-N 3.27Å
924	T	26.3	Very low	29.9	Very low	87 Å²	87	123.6 Å²	123.6	53%	0.534	66%	0.66	S	S	.	*			trans	-147.2	88.8	177.9	52.1	0	0	0	0	110.9
925	N	25.4	Very low	29.7	Very low	129 Å²	129	126.2 Å²	126.2	69%	0.69	68%	0.677	S	S	*	*			trans	-152.9	76.5	172	-98.4	-45	0	0	0	111.1	A921	A921-N925 PolarHBondContact O-ND2 3.32Å; A921-N925 VanDerWaalsContact O-ND2 3.08Å
926	E	27.1	Very low	28.8	Very low	197 Å²	197	128.9 Å²	128.9	92%	0.921	70%	0.698	S	S	*	*			trans	-102.4	123.9	156.3	-75.4	-165.6	137.1	0	0	108.6
927	Q	27.2	Very low	28.6	Very low	176 Å²	176	131.8 Å²	131.8	82%	0.822	71%	0.711	S	S	*	*			trans	-82.5	120.7	-178.4	-61.8	175	-80.8	0	0	110.6	D929	Q927-D929 PolarHBondContact O-N 2.85Å
928	I	28.9	Very low	28.2	Very low	166 Å²	166	131.4 Å²	131.4	85%	0.851	72%	0.715	S	S	*	*			trans	-89.5	86.6	161.5	-59.6	-178.4	0	0	0	108.2	S930	I928-S930 PolarHBondContact O-N 3.19Å
929	D	25.9	Very low	27.7	Very low	136 Å²	136	129 Å²	129	73%	0.727	72%	0.718	S	S	*	*			trans	-78.4	108.9	177.4	-145.7	25.3	0	0	0	109.6	Q927	Q927-D929 PolarHBondContact O-N 2.85Å
930	S	28.5	Very low	27.2	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	73%	0.732	S	S	*	*			trans	-130.1	133.5	170.9	73.1	0	0	0	0	110.3	I928	I928-S930 PolarHBondContact O-N 3.19Å
931	K	24.9	Very low	26.6	Very low	171 Å²	171	136.4 Å²	136.4	74%	0.743	76%	0.758	S	S	*	*			trans	-93	155.7	-153.1	-64.7	174	178.7	173.8	0	113.9
932	N	25	Very low	26.1	Very low	159 Å²	159	138.8 Å²	138.8	85%	0.85	77%	0.77	S	S	*	*			trans	81.5	139.2	166.8	-48.1	-38.6	0	0	0	114.8
933	S	26.3	Very low	25.7	Very low	101 Å²	101	143.6 Å²	143.6	71%	0.706	78%	0.778	S	S	*	*			cis	-154.3	138.8	4	52.8	0	0	0	0	114.5
934	N	23.1	Very low	25.5	Very low	148 Å²	148	143.1 Å²	143.1	79%	0.791	79%	0.785	S	S	*	*			trans	28.4	113.1	143.8	-56.4	-5.2	0	0	0	120.6
935	T	29.6	Very low	25.4	Very low	146 Å²	146	149.7 Å²	149.7	90%	0.896	80%	0.8	S	S	*	*				-153.2	132	116.2	33.1	0	0	0	0	110.2
936	N	23.2	Very low	25.3	Very low	148 Å²	148	149.9 Å²	149.9	79%	0.791	80%	0.801	S	S	*	*			trans	-86.4	145.6	175.7	-61	-21.9	0	0	0	110.9
937	Q	27	Very low	25.2	Very low	175 Å²	175	146.4 Å²	146.4	82%	0.818	79%	0.788	S	S	*	*				-170.2	110.9	115.5	-102.7	169.1	28.6	0	0	114
938	N	26.9	Very low	25	Very low	149 Å²	149	145.7 Å²	145.7	80%	0.797	79%	0.785	S	S	*	*			trans	61.9	114	140.4	-54.5	-3.1	0	0	0	120.6
939	T	23.3	Very low	24.8	Very low	113 Å²	113	145 Å²	145	69%	0.693	78%	0.783	S	S	*	*			trans	-79.8	-178	161.9	56.7	0	0	0	0	111.3
940	P	26.4	Very low	24.7	Very low	131 Å²	131	145.6 Å²	145.6	85%	0.851	79%	0.786	S	S	*	*				-136.1	125.6	83.8	34.9	-20.7	0	0	0	114.4
941	E	21.5	Very low	24.6	Very low	171 Å²	171	146 Å²	146	80%	0.799	78%	0.78	S	S	*	*			trans	-87.2	152.3	159.6	-61.8	176.1	110.3	0	0	110
942	S	22.1	Very low	24.7	Very low	109 Å²	109	146.8 Å²	146.8	76%	0.762	79%	0.786	S	S	*	*			trans	-159.2	109.5	147.3	56.9	0	0	0	0	111.8
943	L	23.2	Very low	24.7	Very low	175 Å²	175	141.8 Å²	141.8	92%	0.916	76%	0.763	S	S	*	*			trans	160.2	86.4	140	-88.1	165.2	0	0	0	112.9
944	S	24.7	Very low	24.7	Very low	114 Å²	114	141.7 Å²	141.7	80%	0.797	75%	0.754	S	S	*	*			trans	-150	64.9	158.8	53.6	0	0	0	0	112
945	R	23.8	Very low	24.9	Very low	224 Å²	224	141 Å²	141	85%	0.845	75%	0.75	S	S	*	*			trans	-74.6	134.8	160.3	-94.9	-175	174.4	168.4	-1.2	110.1
946	N	22.9	Very low	24.7	Very low	133 Å²	133	139.4 Å²	139.4	71%	0.711	73%	0.728	S	S	*	*			trans	42.5	106.4	143.4	-52.9	26.7	0	0	0	117.4
947	L	24.8	Very low	24.7	Very low	125 Å²	125	136.6 Å²	136.6	65%	0.654	71%	0.713	S	S	*	*			trans	-149.1	88.7	144.2	-124.7	161.4	0	0	0	108.5
948	E	23	Very low	24.6	Very low	160 Å²	160	134 Å²	134	75%	0.748	70%	0.701	S	S	*	*			trans	-65.4	134.3	170.5	-64.7	162.4	129.2	0	0	108.6
949	L	25.2	Very low	24.5	Very low	153 Å²	153	130.9 Å²	130.9	80%	0.801	69%	0.691	S	S	*	*			trans	-123.7	55.8	169.9	-76.9	176.4	0	0	0	109.7	D951	L949-D951 VanDerWaalsContact C-N 3.31Å; L949-D951 PolarHBondContact O-N 3.03Å
950	N	23.5	Very low	24.5	Very low	148 Å²	148	133.3 Å²	133.3	79%	0.791	69%	0.694	S	S	*	*			trans	-72.1	89.5	164	-72	-11.4	0	0	0	108.4
951	D	26.4	Very low	24.5	Very low	114 Å²	114	132.7 Å²	132.7	61%	0.61	68%	0.684	S	S	*	*			trans	-146.4	37.9	171.4	-126.3	-14.7	0	0	0	111.7	L949 S953	L949-D951 VanDerWaalsContact C-N 3.31Å; L949-D951 PolarHBondContact O-N 3.03Å; D951-S953 PolarHBondContact O-N 3.43Å; D951-S953 PolarHBondContact OD1-OG 2.99Å
952	E	27.7	Very low	24.6	Very low	186 Å²	186	130.1 Å²	130.1	87%	0.869	68%	0.675	S	S	*	*			trans	-73.2	54.5	161.5	-68.7	-138.3	118.8	0	0	110.6
953	S	25.3	Very low	24.7	Very low	54 Å²	54	130.1 Å²	130.1	38%	0.378	68%	0.675	S	S	.	*			trans	-120.5	3.9	-169.3	66.3	0	0	0	0	113.2	D951	D951-S953 PolarHBondContact O-N 3.43Å; D951-S953 PolarHBondContact OD1-OG 2.99Å
954	L	25.9	Very low	24.7	Very low	100 Å²	100	125.5 Å²	125.5	52%	0.524	66%	0.662	S	S	.	*	S	Bend	trans	-115	7.4	-167.8	-93.9	172.5	0	0	0	116.9	K1196	L954-K1196 PolarHBondContact O-NZ 3.38Å
955	L	26	Very low	24.7	Very low	132 Å²	132	128.2 Å²	128.2	69%	0.691	66%	0.662	S	S	*	*	S	Bend	trans	-157.4	106.1	155.7	-108.4	170.5	0	0	0	108.6	T2026	L955-T2026 HydrophobicContact CD2-CG2 4.49Å
956	Y	25.4	Very low	24.7	Very low	113 Å²	113	123.3 Å²	123.3	44%	0.443	66%	0.66	S	S	.	*			trans	61.2	104.1	-169.4	-92.3	-111	0	0	0	114.9	F2024 Y2025 T2026	Y956-F2024 HydrophobicContact CD1-CB 4.16Å; Y956-F2024 HydrophobicContact CE1-CB 3.98Å; Y956-F2024 HydrophobicContact CE2-CB 4.45Å; Y956-F2024 VanDerWaalsContact OH-C 3.27Å; Y956-F2024 PolarHBondContact OH-O 2.81Å; Y956-F2024 VanDerWaalsContact OH-O 3.11Å; Y956-Y2025 VanDerWaalsContact OH-CA 3.3Å; Y956-Y2025 WeakPolarHBondContact OH-CA 3.35Å; Y956-Y2025 PolarHBondContact OH-N 3.4Å; Y956-Y2025 VanDerWaalsContact OH-N 3.1Å; Y956-T2026 HydrophobicContact CE2-CG2 4.08Å; Y956-T2026 VanDerWaalsContact CE2-N 3.33Å; Y956-T2026 VanDerWaalsContact CE2-OG1 3.24Å; Y956-T2026 WeakPolarHBondContact CE2-OG1 3.09Å; Y956-T2026 PolarHBondContact OH-N 2.85Å; Y956-T2026 PolarHBondContact OH-O 3.5Å
957	D	23.3	Very low	24.9	Very low	90 Å²	90	124 Å²	124	48%	0.481	66%	0.664	S	S	.	*			trans	-120.3	114.1	149.7	-173.4	1.5	0	0	0	108.1
958	Q	25.3	Very low	24.9	Very low	119 Å²	119	126 Å²	126	56%	0.556	67%	0.674	S	S	*	*			trans	-161.3	103.2	142.3	-118.4	-160.9	13.8	0	0	108.6	E2022 N2023	Q958-E2022 PolarHBondContact NE2-O 3.07Å; Q958-E2022 PolarHBondContact OE1-O 3.01Å; Q958-E2022 VanDerWaalsContact OE1-O 3.07Å; Q958-N2023 VanDerWaalsContact CD-N 3.3Å
959	S	24.6	Very low	24.9	Very low	85 Å²	85	125.4 Å²	125.4	59%	0.594	68%	0.676	S	S	*	*			trans	-85.9	157.3	161.3	58.2	0	0	0	0	109.8
960	E	24.8	Very low	24.9	Very low	163 Å²	163	126.8 Å²	126.8	76%	0.762	68%	0.676	S	S	*	*				-160.6	132.5	116.4	-114.6	-179.8	-169.7	0	0	114.3
961	N	24.7	Very low	25	Very low	119 Å²	119	129.1 Å²	129.1	64%	0.636	68%	0.675	S	S	*	*			trans	-56.7	156.7	170.9	-48.2	-77.3	0	0	0	112.6	I2004	N961-I2004 WeakPolarHBondContact O-CD1 3.48Å
962	I	24.4	Very low	24.9	Very low	116 Å²	116	130.2 Å²	130.2	60%	0.595	67%	0.674	S	S	*	*				-166.6	146.2	98.9	-95.6	157.6	0	0	0	110.2	I2004 L2005	I962-I2004 HydrophobicContact CB-CD1 3.84Å; I962-L2005 WeakPolarHBondContact O-CD1 3.48Å
963	S	23.4	Very low	24.8	Very low	109 Å²	109	129.1 Å²	129.1	76%	0.762	67%	0.669	S	S	*	*			trans	-63	145.7	179.5	55.6	0	0	0	0	114.9
964	A	24.4	Very low	24.9	Very low	79 Å²	79	132.8 Å²	132.8	65%	0.653	68%	0.684	S	S	*	*			trans	-147.3	135.6	138.8	0	0	0	0	0	110.2
965	H	25.1	Very low	25	Very low	171 Å²	171	133.4 Å²	133.4	79%	0.792	69%	0.687	S	S	*	*			trans	49.6	110.6	167.2	-78.3	-85.2	0	0	0	119.8
966	C	22.8	Very low	25.1	Very low	121 Å²	121	134.4 Å²	134.4	82%	0.818	69%	0.69	S	S	*	*			trans	-55.5	139.1	139.7	-41.2	0	0	0	0	109.5
967	D	27.2	Very low	25.3	Very low	146 Å²	146	133.8 Å²	133.8	78%	0.781	69%	0.694	S	S	*	*			trans	-137.1	138.8	146.7	-92.1	-48.6	0	0	0	107.8	L969	D967-L969 PolarHBondContact O-N 2.87Å
968	L	25.2	Very low	25.8	Very low	167 Å²	167	133.2 Å²	133.2	87%	0.874	69%	0.694	S	S	*	*	S	Bend	trans	-69.7	129.4	-164.3	-73.2	125.1	0	0	0	112.7
969	L	23.4	Very low	26	Very low	149 Å²	149	131.9 Å²	131.9	78%	0.78	69%	0.691	S	S	*	*	S	Bend	trans	88.8	144.8	166.7	-51.4	152.9	0	0	0	117.5	D967	D967-L969 PolarHBondContact O-N 2.87Å
970	F	23.4	Very low	26.5	Very low	182 Å²	182	137.1 Å²	137.1	80%	0.798	71%	0.705	S	S	*	*			trans	75.2	134.9	164.8	-76.8	-77.6	0	0	0	120.8
971	Y	25.3	Very low	27.2	Very low	197 Å²	197	134.9 Å²	134.9	77%	0.773	70%	0.698	S	S	*	*			trans	62.5	144.7	176.2	-73.4	-84	0	0	0	116.2
972	K	24.8	Very low	27.6	Very low	136 Å²	136	133.2 Å²	133.2	59%	0.591	71%	0.709	S	S	*	*			cis	-136.7	129.5	3.2	-172.4	156.3	174	-85.6	0	110.1	D974	K972-D974 IonicContact NZ-OD1 2.71Å; K972-D974 PolarHBondContact NZ-OD1 2.77Å; K972-D974 PolarHBondContact O-N 2.86Å
973	Q	26.6	Very low	28.6	Very low	164 Å²	164	131 Å²	131	77%	0.766	70%	0.697	S	S	*	*			trans	-70.2	110.7	157.2	-66.8	166.5	-70.3	0	0	106.6	I975	Q973-I975 HydrophobicContact CB-CD1 4.39Å; Q973-I975 HydrophobicContact CB-CG1 3.86Å; Q973-I975 PolarHBondContact O-N 3.33Å
974	D	26.7	Very low	29.4	Very low	131 Å²	131	130 Å²	130	70%	0.701	68%	0.684	S	S	*	*			trans	-76	77.8	161	-87.9	-7.5	0	0	0	108.6	K972 M976	K972-D974 IonicContact NZ-OD1 2.71Å; K972-D974 PolarHBondContact NZ-OD1 2.77Å; K972-D974 PolarHBondContact O-N 2.86Å; D974-M976 PolarHBondContact O-N 3.13Å
975	I	27.5	Very low	30.3	Very low	113 Å²	113	130.9 Å²	130.9	58%	0.579	68%	0.676	S	S	*	*			trans	-59.8	103.3	163.3	-55.9	166.1	0	0	0	105.9	Q973 N977	Q973-I975 HydrophobicContact CB-CD1 4.39Å; Q973-I975 HydrophobicContact CB-CG1 3.86Å; Q973-I975 PolarHBondContact O-N 3.33Å; I975-N977 VanDerWaalsContact C-N 3.27Å; I975-N977 WeakPolarHBondContact CG2-OD1 3.27Å; I975-N977 PolarHBondContact O-N 3.36Å
976	M	29.4	Very low	31	Very low	153 Å²	153	131 Å²	131	75%	0.754	67%	0.67	S	S	*	*			trans	-63.6	98.6	152.7	-81.4	-165.6	69.7	0	0	106.8	D974 V978	D974-M976 PolarHBondContact O-N 3.13Å; M976-V978 HydrophobicContact CB-CG2 4.48Å; M976-V978 PolarHBondContact O-N 3.08Å
977	N	28.6	Very low	32.2	Very low	100 Å²	100	127.9 Å²	127.9	54%	0.535	65%	0.649	S	S	.	*			trans	-61.3	102.2	163.2	-83.1	13.4	0	0	0	106.8	I975 D979	I975-N977 VanDerWaalsContact C-N 3.27Å; I975-N977 WeakPolarHBondContact CG2-OD1 3.27Å; I975-N977 PolarHBondContact O-N 3.36Å; N977-D979 PolarHBondContact O-N 3.29Å
978	V	35	Very low	33	Very low	78 Å²	78	122.6 Å²	122.6	47%	0.473	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.3	48.5	171.8	-165.2	0	0	0	0	109.2	M976	M976-V978 HydrophobicContact CB-CG2 4.48Å; M976-V978 PolarHBondContact O-N 3.08Å
979	D	29.8	Very low	33.9	Very low	91 Å²	91	121 Å²	121	49%	0.487	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.5	-16.2	174.7	-70.4	-56.2	0	0	0	111.2	N977 Y2064	N977-D979 PolarHBondContact O-N 3.29Å; D979-Y2064 PolarHBondContact OD2-OH 3.42Å
980	E	33.9	Very low	34.7	Very low	194 Å²	194	119.2 Å²	119.2	91%	0.907	60%	0.603	S	S	*	*	S	Bend	trans	-89.5	3.3	176.2	-65.5	-162.4	141	0	0	114.4
981	I	38.7	Very low	35.6	Very low	117 Å²	117	112.5 Å²	112.5	60%	0.6	58%	0.576	S	S	*	*	S	Bend	trans	-127.2	108.1	161.6	-56.1	179.6	0	0	0	106.9	I983	I981-I983 VanDerWaalsContact C-N 3.27Å; I981-I983 HydrophobicContact CG2-CG1 4.22Å; I981-I983 PolarHBondContact O-N 3.32Å
982	G	34.1	Very low	36.2	Very low	84 Å²	84	110.5 Å²	110.5	87%	0.866	57%	0.573	S	S	*	*			trans	-69.1	73.1	-173	0	0	0	0	0	114.5
983	I	44.4	Very low	36.8	Very low	69 Å²	69	110 Å²	110	35%	0.354	57%	0.573	S	S	.	*			trans	-89.4	98.7	167.2	-56.7	176.1	0	0	0	106.7	I981 L985	I981-I983 VanDerWaalsContact C-N 3.27Å; I981-I983 HydrophobicContact CG2-CG1 4.22Å; I981-I983 PolarHBondContact O-N 3.32Å; I983-L985 VanDerWaalsContact C-N 3.34Å; I983-L985 HydrophobicContact CG2-CD2 3.98Å; I983-L985 PolarHBondContact O-N 3.03Å
984	D	41.4	Very low	37.1	Very low	89 Å²	89	105.9 Å²	105.9	48%	0.476	55%	0.553	S	S	.	*			trans	-72.8	91.1	177.8	-168.4	-4.5	0	0	0	110.7	R986 S987	D984-R986 PolarHBondContact O-N 2.67Å; D984-R986 WeakPolarHBondContact OD1-CB 3.21Å; D984-R986 WeakPolarHBondContact OD1-CD 3.3Å; D984-R986 WeakPolarHBondContact OD1-CG 3.38Å; D984-R986 PolarHBondContact OD1-N 3.05Å; D984-S987 WeakPolarHBondContact O-CB 3.34Å; D984-S987 PolarHBondContact O-N 2.82Å; D984-S987 PolarHBondContact O-OG 3.47Å
985	L	42.3	Very low	37.3	Very low	96 Å²	96	105.7 Å²	105.7	50%	0.503	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-59.3	-14.6	178.2	-63.6	174.9	0	0	0	113.1	I983 S987 L988	I983-L985 VanDerWaalsContact C-N 3.34Å; I983-L985 HydrophobicContact CG2-CD2 3.98Å; I983-L985 PolarHBondContact O-N 3.03Å; L985-S987 PolarHBondContact O-N 3.07Å; L985-L988 HydrophobicContact CD2-CD1 3.83Å; L985-L988 WeakPolarHBondContact O-CB 3.48Å; L985-L988 PolarHBondContact O-N 2.75Å; L985-L988 VanDerWaalsContact O-N 3.08Å
986	R	40.6	Very low	37.5	Very low	175 Å²	175	108.8 Å²	108.8	66%	0.66	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-63.5	-27.8	172.9	-59.2	168.3	-177	141.6	1.8	111.5	D984 L988 I989 N990	D984-R986 PolarHBondContact O-N 2.67Å; D984-R986 WeakPolarHBondContact OD1-CB 3.21Å; D984-R986 WeakPolarHBondContact OD1-CD 3.3Å; D984-R986 WeakPolarHBondContact OD1-CG 3.38Å; D984-R986 PolarHBondContact OD1-N 3.05Å; R986-L988 VanDerWaalsContact C-N 3.27Å; R986-L988 PolarHBondContact O-N 3.06Å; R986-I989 PolarHBondContact O-N 2.86Å; R986-I989 VanDerWaalsContact O-N 3.13Å; R986-N990 WeakPolarHBondContact O-CB 3.41Å; R986-N990 PolarHBondContact O-N 2.83Å
987	S	48.2	Very low	37.5	Very low	54 Å²	54	106.9 Å²	106.9	38%	0.378	55%	0.549	S	S	.	.	G	3₁₀ helix	trans	-61.7	-30	172	63.5	0	0	0	0	113.5	D984 L985 I989 R1108	D984-S987 WeakPolarHBondContact O-CB 3.34Å; D984-S987 PolarHBondContact O-N 2.82Å; D984-S987 PolarHBondContact O-OG 3.47Å; L985-S987 PolarHBondContact O-N 3.07Å; S987-I989 PolarHBondContact O-N 3.31Å; S987-R1108 PolarHBondContact O-NH1 3.26Å
988	L	44.5	Very low	37.6	Very low	35 Å²	35	107.4 Å²	107.4	18%	0.183	55%	0.549	C	S	.	.	G	3₁₀ helix	trans	-72.8	-16	176.8	-75.7	161.2	0	0	0	113.1	R877 L880 L985 R986 W1104	R877-L988 PolarHBondContact NE-O 3.47Å; R877-L988 PolarHBondContact NH2-O 2.91Å; L880-L988 HydrophobicContact CD2-CD1 4.1Å; L985-L988 HydrophobicContact CD2-CD1 3.83Å; L985-L988 WeakPolarHBondContact O-CB 3.48Å; L985-L988 PolarHBondContact O-N 2.75Å; L985-L988 VanDerWaalsContact O-N 3.08Å; R986-L988 VanDerWaalsContact C-N 3.27Å; R986-L988 PolarHBondContact O-N 3.06Å; L988-W1104 HydrophobicContact CD2-CZ2 4.01Å
989	I	44.2	Very low	37.3	Very low	135 Å²	135	109.4 Å²	109.4	69%	0.692	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-39.4	-179.6	-57.3	177.4	0	0	0	110.8	R986 S987	R986-I989 PolarHBondContact O-N 2.86Å; R986-I989 VanDerWaalsContact O-N 3.13Å; S987-I989 PolarHBondContact O-N 3.31Å
990	N	40.2	Very low	37.2	Very low	111 Å²	111	108.3 Å²	108.3	59%	0.594	56%	0.556	S	S	*	*			trans	-97.2	13.7	-167.2	-62.5	1.5	0	0	0	115.3	R986 E992	R986-N990 WeakPolarHBondContact O-CB 3.41Å; R986-N990 PolarHBondContact O-N 2.83Å; N990-E992 PolarHBondContact O-N 2.93Å; N990-E992 VanDerWaalsContact O-N 3.12Å
991	D	41.6	Very low	36.9	Very low	41 Å²	41	104.9 Å²	104.9	22%	0.219	54%	0.538	C	S	.	.			trans	-68.2	105.7	168.7	-60.2	-44.7	0	0	0	109.5	R877 E993 R1108	R877-D991 IonicContact CZ-OD2 3.29Å; R877-D991 IonicContact NH1-OD2 2.6Å; R877-D991 IonicContact NH2-OD2 3.98Å; R877-D991 PolarHBondContact NH2-OD2 2.98Å; D991-E993 PolarHBondContact O-N 3.44Å; D991-R1108 IonicContact OD1-NH1 3.69Å; D991-R1108 IonicContact OD1-NH2 3.08Å; D991-R1108 PolarHBondContact OD1-NH2 2.7Å; D991-R1108 IonicContact OD2-CZ 3.87Å; D991-R1108 VanDerWaalsContact OD2-CZ 3.23Å; D991-R1108 IonicContact OD2-NH1 3.45Å; D991-R1108 PolarHBondContact OD2-NH1 2.98Å; D991-R1108 IonicContact OD2-NH2 2.97Å; D991-R1108 PolarHBondContact OD2-NH2 3.01Å
992	E	37.7	Very low	36.3	Very low	155 Å²	155	104 Å²	104	72%	0.724	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-4.2	-173.8	-65.1	-175.2	165.1	0	0	114.6	N990 F994 Q995	N990-E992 PolarHBondContact O-N 2.93Å; N990-E992 VanDerWaalsContact O-N 3.12Å; E992-F994 PolarHBondContact O-N 2.87Å; E992-F994 VanDerWaalsContact O-N 3.08Å; E992-Q995 WeakPolarHBondContact O-CB 3.2Å; E992-Q995 PolarHBondContact O-N 3.05Å
993	E	37.5	Very low	35.9	Very low	126 Å²	126	108.2 Å²	108.2	59%	0.589	54%	0.544	S	S	*	.	H	α-helix	trans	-52.5	-29.6	173.3	-66.9	-167.2	122.8	0	0	113.7	D991 Q995	D991-E993 PolarHBondContact O-N 3.44Å; E993-Q995 VanDerWaalsContact C-N 3.26Å; E993-Q995 PolarHBondContact O-N 3.19Å
994	F	33.2	Very low	34.9	Very low	77 Å²	77	110 Å²	110	34%	0.338	56%	0.563	S	S	.	*	H	α-helix	trans	-68.9	-27.4	177.7	-130.9	-83.7	0	0	0	112.7	L874 E992 L997 E998	L874-F994 HydrophobicContact CD2-CE2 3.77Å; L874-F994 HydrophobicContact CD2-CZ 4.26Å; E992-F994 PolarHBondContact O-N 2.87Å; E992-F994 VanDerWaalsContact O-N 3.08Å; F994-L997 PolarHBondContact O-N 3.04Å; F994-E998 HydrophobicContact CD1-CG 4.35Å; F994-E998 PolarHBondContact O-N 2.7Å
995	Q	30.7	Very low	34	Very low	126 Å²	126	111.1 Å²	111.1	59%	0.589	57%	0.573	S	S	*	*	H	α-helix	trans	-75	-35.8	-178	-151.7	154.8	-7.8	0	0	111	E992 E993 L997 E998 D999	E992-Q995 WeakPolarHBondContact O-CB 3.2Å; E992-Q995 PolarHBondContact O-N 3.05Å; E993-Q995 VanDerWaalsContact C-N 3.26Å; E993-Q995 PolarHBondContact O-N 3.19Å; Q995-L997 PolarHBondContact O-N 3.49Å; Q995-E998 PolarHBondContact O-N 3.06Å; Q995-D999 PolarHBondContact O-N 2.98Å
996	F	32.2	Very low	33.2	Very low	178 Å²	178	113.5 Å²	113.5	78%	0.781	58%	0.58	S	S	*	*	H	α-helix	trans	-66.5	-20	174.9	-145.9	-91.8	0	0	0	113.7	S1000	F996-S1000 WeakPolarHBondContact O-CB 3.4Å; F996-S1000 PolarHBondContact O-OG 3.13Å
997	L	29.6	Very low	32.2	Very low	113 Å²	113	106.6 Å²	106.6	59%	0.592	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-6.1	179.5	-78.3	169.6	0	0	0	114.7	F994 Q995 S1000 K1001	F994-L997 PolarHBondContact O-N 3.04Å; Q995-L997 PolarHBondContact O-N 3.49Å; L997-S1000 WeakPolarHBondContact CA-OG 3.17Å; L997-K1001 WeakPolarHBondContact O-CE 3.49Å
998	E	29.2	Very low	31	Very low	111 Å²	111	109.2 Å²	109.2	52%	0.519	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104	-41.6	173.8	-58.9	-124	100.7	0	0	111.3	F994 Q995 S1000 K1001	F994-E998 HydrophobicContact CD1-CG 4.35Å; F994-E998 PolarHBondContact O-N 2.7Å; Q995-E998 PolarHBondContact O-N 3.06Å; E998-S1000 PolarHBondContact O-N 3.23Å; E998-K1001 PolarHBondContact O-N 2.96Å; E998-K1001 IonicContact OE1-NZ 3.72Å; E998-K1001 PolarHBondContact OE1-NZ 3.45Å
999	D	29.2	Very low	29.9	Very low	121 Å²	121	112 Å²	112	65%	0.647	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-20.1	174.6	-74.6	-27.7	0	0	0	113	Q995 K1001 S1002	Q995-D999 PolarHBondContact O-N 2.98Å; D999-K1001 PolarHBondContact O-N 2.99Å; D999-S1002 PolarHBondContact O-OG 3.25Å
1000	S	27.9	Very low	28.9	Very low	67 Å²	67	115 Å²	115	47%	0.469	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.6	3.8	177.8	53.1	0	0	0	0	115.2	F996 L997 E998 S1002	F996-S1000 WeakPolarHBondContact O-CB 3.4Å; F996-S1000 PolarHBondContact O-OG 3.13Å; L997-S1000 WeakPolarHBondContact CA-OG 3.17Å; E998-S1000 PolarHBondContact O-N 3.23Å; S1000-S1002 PolarHBondContact O-N 3.43Å
1001	K	27.8	Very low	28.1	Very low	123 Å²	123	114.7 Å²	114.7	54%	0.535	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.6	14.8	175.8	-70.8	174.1	-173.8	160.7	0	114.6	L997 E998 D999	L997-K1001 WeakPolarHBondContact O-CE 3.49Å; E998-K1001 PolarHBondContact O-N 2.96Å; E998-K1001 IonicContact OE1-NZ 3.72Å; E998-K1001 PolarHBondContact OE1-NZ 3.45Å; D999-K1001 PolarHBondContact O-N 2.99Å
1002	S	25.5	Very low	27.1	Very low	99 Å²	99	118.1 Å²	118.1	69%	0.692	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	19.5	-173.1	62.9	0	0	0	0	115.9	D999 S1000	D999-S1002 PolarHBondContact O-OG 3.25Å; S1000-S1002 PolarHBondContact O-N 3.43Å
1003	L	25.3	Very low	26.5	Very low	171 Å²	171	117 Å²	117	90%	0.895	63%	0.629	S	S	*	*			trans	-156.6	139.2	157	-137.9	73	0	0	0	112.8
1004	S	24.2	Very low	25.9	Very low	108 Å²	108	115 Å²	115	76%	0.755	62%	0.62	S	S	*	*			trans	-104.3	112.1	-176.6	55.2	0	0	0	0	113.2
1005	T	22	Very low	25.4	Very low	111 Å²	111	117.9 Å²	117.9	68%	0.681	63%	0.634	S	S	*	*			trans	171.1	113.7	141.3	27.7	0	0	0	0	111
1006	F	25.3	Very low	25	Very low	147 Å²	147	117.4 Å²	117.4	65%	0.645	64%	0.643	S	S	*	*			trans	-153.7	176.6	173.3	-78.7	-18.5	0	0	0	107.8	N339 D340 N341	N339-F1006 WeakPolarHBondContact CA-O 3.45Å; N339-F1006 WeakPolarHBondContact CB-O 3.44Å; N339-F1006 PolarHBondContact OD1-O 2.89Å; N339-F1006 VanDerWaalsContact OD1-O 3.11Å; D340-F1006 PolarHBondContact N-O 3.23Å; D340-F1006 CarbonylContact O-C 3.59Å; D340-F1006 WeakPolarHBondContact O-CA 3.28Å; N341-F1006 WeakPolarHBondContact ND2-CD1 3.25Å; N341-F1006 WeakPolarHBondContact ND2-CE1 3.47Å
1007	T	20	Very low	24.6	Very low	29 Å²	29	116 Å²	116	18%	0.178	64%	0.644	C	S	.	*			cis	99.9	53.7	-27.9	-171.5	0	0	0	0	114.7	N339 D340 N341 V1009	N339-T1007 HydrophobicContact CB-CG2 3.51Å; N339-T1007 PolarHBondContact OD1-N 3.48Å; D340-T1007 VanDerWaalsContact OD1-CG2 3.31Å; D340-T1007 WeakPolarHBondContact OD1-CG2 3.22Å; N341-T1007 HydrophobicContact CB-CG2 4.38Å; N341-T1007 PolarHBondContact ND2-O 3.35Å; N341-T1007 PolarHBondContact O-OG1 3.49Å; T1007-V1009 VanDerWaalsContact C-N 3.33Å; T1007-V1009 PolarHBondContact O-N 3.47Å; T1007-V1009 VanDerWaalsContact O-N 3.12Å; T1007-V1009 PolarHBondContact OG1-N 3.29Å; T1007-V1009 VanDerWaalsContact OG1-N 3.07Å
1008	C	22.4	Very low	24.3	Very low	110 Å²	110	117.3 Å²	117.3	74%	0.743	65%	0.651	S	S	*	*			trans	14.6	-71.1	131.5	-177	0	0	0	0	119.7
1009	V	22.5	Very low	24.1	Very low	92 Å²	92	118.2 Å²	118.2	56%	0.558	66%	0.664	S	S	*	*			trans	30.7	83	-168	-170.7	0	0	0	0	115	N341 T1007 S1011	N341-V1009 HydrophobicContact CB-CG2 3.65Å; T1007-V1009 VanDerWaalsContact C-N 3.33Å; T1007-V1009 PolarHBondContact O-N 3.47Å; T1007-V1009 VanDerWaalsContact O-N 3.12Å; T1007-V1009 PolarHBondContact OG1-N 3.29Å; T1007-V1009 VanDerWaalsContact OG1-N 3.07Å; V1009-S1011 PolarHBondContact O-N 2.74Å
1010	K	22.1	Very low	23.9	Very low	198 Å²	198	116.1 Å²	116.1	86%	0.861	66%	0.659	S	S	*	*			trans	-12	115.4	174.9	-69.3	178.9	179.4	175.3	0	116.4
1011	S	23.6	Very low	23.8	Very low	106 Å²	106	124.1 Å²	124.1	74%	0.741	68%	0.679	S	S	*	*			trans	-130.6	138.8	154.1	52.3	0	0	0	0	107.4	V1009	V1009-S1011 PolarHBondContact O-N 2.74Å
1012	S	21.2	Very low	23.6	Very low	112 Å²	112	127.7 Å²	127.7	78%	0.783	70%	0.695	S	S	*	*			cis	62.5	93.8	27.3	85	0	0	0	0	114
1013	E	24.9	Very low	23.6	Very low	131 Å²	131	129 Å²	129	61%	0.612	70%	0.704	S	S	*	*			trans	-41.7	156	160	-61.8	155.6	137.6	0	0	111.3
1014	E	24.9	Very low	23.5	Very low	86 Å²	86	127.5 Å²	127.5	40%	0.402	70%	0.696	S	S	.	*			cis	-156.9	162.4	26.5	-146	156.3	-142.2	0	0	112.9	R1107	E1014-R1107 IonicContact OE1-CZ 3.6Å; E1014-R1107 IonicContact OE1-NH1 2.94Å; E1014-R1107 PolarHBondContact OE1-NH1 3.47Å; E1014-R1107 IonicContact OE1-NH2 3.52Å
1015	E	23.8	Very low	23.6	Very low	137 Å²	137	131 Å²	131	64%	0.64	70%	0.7	S	S	*	*			trans	-9.6	135.9	171.3	-62.9	173.8	161.9	0	0	123.1
1016	C	22.7	Very low	23.6	Very low	115 Å²	115	129.3 Å²	129.3	78%	0.777	69%	0.693	S	S	*	*				64.1	137.8	128.8	-64.6	0	0	0	0	125.2
1017	D	23.1	Very low	23.6	Very low	148 Å²	148	127.9 Å²	127.9	79%	0.791	70%	0.699	S	S	*	*			trans	-49.1	157.5	162.8	-71	-64.3	0	0	0	116.9	V1019	D1017-V1019 HydrophobicContact CB-CG2 4.08Å
1018	D	22.9	Very low	24	Very low	141 Å²	141	131.4 Å²	131.4	75%	0.754	72%	0.723	S	S	*	*			trans	-116.3	87.4	154.8	-170.4	-1.1	0	0	0	110.4	S1020	D1018-S1020 PolarHBondContact O-N 2.91Å
1019	V	25.3	Very low	24.1	Very low	131 Å²	131	130.9 Å²	130.9	79%	0.794	72%	0.72	S	S	*	*			trans	-82.3	96.8	177.2	174.2	0	0	0	0	110.8	D1017	D1017-V1019 HydrophobicContact CB-CG2 4.08Å
1020	S	24.6	Very low	24.3	Very low	77 Å²	77	134.1 Å²	134.1	54%	0.538	74%	0.735	S	S	.	*			trans	-142.8	120.2	175.7	177.8	0	0	0	0	110.6	D1018	D1018-S1020 PolarHBondContact O-N 2.91Å
1021	R	26.7	Very low	24.6	Very low	234 Å²	234	129.2 Å²	129.2	88%	0.883	73%	0.731	S	S	*	*			cis	-150.3	156.9	5.2	-106.8	161.6	-167.5	167.4	5.3	112.1
1022	K	23.8	Very low	24.7	Very low	199 Å²	199	130.5 Å²	130.5	87%	0.865	73%	0.734	S	S	*	*			trans	-58.4	142.6	163.1	-60.6	166.2	-177.8	171.2	0	110.4
1023	S	24.2	Very low	25.1	Very low	126 Å²	126	131.1 Å²	131.1	88%	0.881	74%	0.736	S	S	*	*			trans	-127.9	116.4	138.1	65.9	0	0	0	0	107.2
1024	L	23.9	Very low	25.1	Very low	139 Å²	139	128.6 Å²	128.6	73%	0.728	74%	0.737	S	S	*	*			trans	-149	101.6	-175.7	-161.2	169.8	0	0	0	108.8
1025	H	25.2	Very low	25.8	Very low	183 Å²	183	130.6 Å²	130.6	85%	0.847	76%	0.758	S	S	*	*			trans	-133.7	105.2	155	-89.6	-68.4	0	0	0	104.6
1026	S	23.8	Very low	26.1	Very low	75 Å²	75	128.8 Å²	128.8	52%	0.524	76%	0.758	S	S	.	*				64.9	132.6	75.7	77.8	0	0	0	0	111.6
1027	C	23.9	Very low	26.2	Very low	116 Å²	116	129.7 Å²	129.7	78%	0.784	75%	0.754	S	S	*	*			cis	177.5	-172.2	1	-109.3	0	0	0	0	105.4
1028	P	29.3	Very low	26.5	Very low	104 Å²	104	130.3 Å²	130.3	68%	0.675	75%	0.752	S	S	*	*			cis	-127.9	-158.4	-33.1	33	-11.8	0	0	0	110.5
1029	S	23.1	Very low	26.5	Very low	98 Å²	98	127.7 Å²	127.7	69%	0.685	75%	0.745	S	S	*	*			trans	69.6	145.9	165.1	-17.4	0	0	0	0	116.2
1030	D	26.7	Very low	26.3	Very low	161 Å²	161	126.7 Å²	126.7	86%	0.861	74%	0.743	S	S	*	*			cis	-150.5	177.3	11.1	-115.9	-33.5	0	0	0	112.2
1031	A	29.5	Very low	26.2	Very low	95 Å²	95	127.8 Å²	127.8	79%	0.785	75%	0.751	S	S	*	*			trans	70.7	94.5	163.3	0	0	0	0	0	119.7
1032	T	25	Very low	26.1	Very low	132 Å²	132	121.3 Å²	121.3	81%	0.81	74%	0.742	S	S	*	*			trans	-77.6	159	144.3	55.7	0	0	0	0	109.9
1033	P	30.5	Very low	26.1	Very low	125 Å²	125	118.3 Å²	118.3	81%	0.812	73%	0.734	S	S	*	*				-123.8	132.5	75.4	19.2	-0.5	0	0	0	112.2
1034	A	24	Very low	26	Very low	78 Å²	78	115.8 Å²	115.8	65%	0.645	72%	0.716	S	S	*	*				80.8	118.4	67.1	0	0	0	0	0	113.3
1035	P	40.2	Very low	26.1	Very low	129 Å²	129	113.8 Å²	113.8	84%	0.838	70%	0.703	S	S	*	*			trans	-86	-89.1	176.8	24.7	-14.4	0	0	0	112.7
1036	P	30.3	Very low	26.1	Very low	98 Å²	98	111.2 Å²	111.2	64%	0.636	70%	0.695	S	S	*	*			cis	-124.5	-152.4	-16.9	24.9	2.1	0	0	0	112.1
1037	L	24.3	Very low	26.1	Very low	134 Å²	134	112 Å²	112	70%	0.702	70%	0.699	S	S	*	*			trans	99.9	103.9	149.5	-62.6	169.9	0	0	0	122.3
1038	H	29.3	Very low	26	Very low	162 Å²	162	111.7 Å²	111.7	75%	0.75	69%	0.69	S	S	*	*			trans	112	120.3	137.9	-63.1	-53.5	0	0	0	118.2
1039	S	22.4	Very low	25.8	Very low	85 Å²	85	112.6 Å²	112.6	59%	0.594	69%	0.694	S	S	*	*			cis	115.9	127.4	-1.5	77.8	0	0	0	0	115.7
1040	S	22.2	Very low	25.8	Very low	110 Å²	110	112.3 Å²	112.3	77%	0.769	69%	0.692	S	S	*	*			trans	60.9	151.9	157.2	46	0	0	0	0	119
1041	S	22	Very low	25.6	Very low	101 Å²	101	108.9 Å²	108.9	71%	0.706	67%	0.67	S	S	*	*			cis	-173.1	172.6	-15.1	50.7	0	0	0	0	110.7
1042	S	24	Very low	25.3	Very low	97 Å²	97	105.8 Å²	105.8	68%	0.678	64%	0.643	S	S	*	*			trans	66.3	122.7	162.5	31.5	0	0	0	0	118.4
1043	I	24.4	Very low	25.3	Very low	137 Å²	137	103.9 Å²	103.9	70%	0.703	64%	0.635	S	S	*	*				79	124.1	62	-68.7	164.9	0	0	0	111.4
1044	S	22.9	Very low	25.2	Very low	72 Å²	72	103.7 Å²	103.7	50%	0.503	62%	0.623	S	S	.	*			cis	-167.5	165.8	0.8	45.7	0	0	0	0	113.9
1045	H	25	Very low	25.3	Very low	98 Å²	98	106.5 Å²	106.5	45%	0.454	63%	0.627	S	S	.	*			trans	68.4	137.8	160.7	-75.4	-60.8	0	0	0	119.2	E780	E780-H1045 WeakPolarHBondContact CG-NE2 3.27Å; E780-H1045 IonicContact OE1-CD2 3.66Å; E780-H1045 PolarHBondContact OE1-CD2 2.98Å; E780-H1045 IonicContact OE1-CG 3.2Å; E780-H1045 IonicContact OE1-NE2 3.74Å
1046	N	24.5	Very low	24.5	Very low	129 Å²	129	105.1 Å²	105.1	69%	0.69	62%	0.621	S	S	*	*			cis	-159.1	169.5	-14.1	-145.6	27.5	0	0	0	114.1
1047	C	23.7	Very low	24.3	Very low	90 Å²	90	106.1 Å²	106.1	61%	0.608	62%	0.62	S	S	*	*			trans	73.2	110.1	162.2	-58.7	0	0	0	0	119.2
1048	N	22.9	Very low	24.5	Very low	110 Å²	110	105.6 Å²	105.6	59%	0.588	62%	0.623	S	S	*	*				41.1	133.4	109.8	-53.9	4.1	0	0	0	117.2	E335	E335-N1048 PolarHBondContact OE1-ND2 3.48Å
1049	V	25	Very low	24.3	Very low	124 Å²	124	104.6 Å²	104.6	75%	0.752	62%	0.618	S	S	*	*			cis	-148.3	144.4	18.2	174.2	0	0	0	0	108.1
1050	S	22	Very low	24.4	Very low	92 Å²	92	103.9 Å²	103.9	64%	0.643	61%	0.608	S	S	*	*			cis	-163	-145.8	-24.5	66.6	0	0	0	0	107.8
1051	Q	23.6	Very low	24.6	Very low	88 Å²	88	104.6 Å²	104.6	41%	0.411	60%	0.597	S	S	.	*			trans	60.4	118.3	177.6	-64	-157.4	-3.2	0	0	116.4
1052	S	23.1	Very low	24.6	Very low	31 Å²	31	103.2 Å²	103.2	22%	0.217	59%	0.587	C	S	.	*			cis	168.5	-168.9	3.4	31.8	0	0	0	0	115.7	T487 A488 L489	T487-S1052 CarbonylContact O-C 3.6Å; T487-S1052 WeakPolarHBondContact O-CA 3.36Å; T487-S1052 WeakPolarHBondContact O-CB 3.49Å; A488-S1052 WeakPolarHBondContact O-CB 3.45Å; A488-S1052 PolarHBondContact O-OG 2.91Å; A488-S1052 VanDerWaalsContact O-OG 3.08Å; L489-S1052 WeakPolarHBondContact CA-OG 3.42Å; L489-S1052 VanDerWaalsContact CB-C 3.42Å; L489-S1052 WeakPolarHBondContact CB-O 3.42Å; L489-S1052 VanDerWaalsContact CD1-O 3.29Å; L489-S1052 WeakPolarHBondContact CD1-O 3.33Å; L489-S1052 WeakPolarHBondContact CG-O 3.36Å; L489-S1052 WeakPolarHBondContact CG-OG 3.18Å; L489-S1052 PolarHBondContact N-OG 3.35Å
1053	S	25.1	Very low	24.6	Very low	92 Å²	92	103 Å²	103	64%	0.643	58%	0.581	S	S	*	*			trans	-153.3	149	172.9	60.2	0	0	0	0	117.8	T487 A488	T487-S1053 PolarHBondContact O-N 2.74Å; A488-S1053 WeakPolarHBondContact CA-O 3.34Å
1054	H	27.9	Very low	24.5	Very low	121 Å²	121	102.1 Å²	102.1	56%	0.56	59%	0.586	S	S	*	*			trans	-98.5	154.6	-168.6	-118.8	-68.2	0	0	0	116.9	L489	L489-H1054 PolarHBondContact O-CD2 3.04Å; L489-H1054 PolarHBondContact O-NE2 2.97Å
1055	D	26.4	Very low	24.6	Very low	136 Å²	136	102.1 Å²	102.1	73%	0.727	60%	0.597	S	S	*	*			trans	50.4	143.7	149.7	-66.7	-1.6	0	0	0	122.8
1056	S	24.4	Very low	24.4	Very low	100 Å²	100	102.6 Å²	102.6	70%	0.699	60%	0.599	S	S	*	*			cis	-177.1	175	-12.2	65.8	0	0	0	0	107.6
1057	L	25.6	Very low	24.6	Very low	120 Å²	120	102.7 Å²	102.7	63%	0.628	61%	0.607	S	S	*	*			cis	-164.9	179.8	-7.7	-130	175.3	0	0	0	108.6
1058	T	28.8	Very low	24.6	Very low	122 Å²	122	104.7 Å²	104.7	75%	0.748	61%	0.605	S	S	*	*			trans	66.3	156.1	170.7	67.9	0	0	0	0	117.1
1059	E	24.8	Very low	24.6	Very low	142 Å²	142	108.6 Å²	108.6	66%	0.664	62%	0.617	S	S	*	*			cis	-160.5	153.6	-24.9	-108.2	-140	-93.7	0	0	106.2	K1061	E1059-K1061 IonicContact OE2-NZ 3.15Å; E1059-K1061 PolarHBondContact OE2-NZ 3.5Å
1060	D	24.8	Very low	24.7	Very low	69 Å²	69	108.8 Å²	108.8	37%	0.369	62%	0.618	S	S	.	*			cis	-172.4	-178.9	-27.4	-146.2	31.7	0	0	0	109.2	N345 T346	N345-D1060 WeakPolarHBondContact ND2-CA 3.48Å; T346-D1060 HydrophobicContact CG2-CB 4.32Å; T346-D1060 VanDerWaalsContact CG2-CG 3.46Å; T346-D1060 WeakPolarHBondContact CG2-OD1 3.42Å
1061	K	24.9	Very low	24.7	Very low	125 Å²	125	109.6 Å²	109.6	54%	0.543	62%	0.624	S	S	.	*			trans	64.6	138.5	157.1	-67.7	153.8	-175.1	86.1	0	119.3	T346 E1059	T346-K1061 VanDerWaalsContact CG2-CA 3.43Å; T346-K1061 HydrophobicContact CG2-CG 4.38Å; E1059-K1061 IonicContact OE2-NZ 3.15Å; E1059-K1061 PolarHBondContact OE2-NZ 3.5Å
1062	C	23	Very low	24.8	Very low	73 Å²	73	114.6 Å²	114.6	49%	0.493	65%	0.645	S	S	.	*			cis	-176.1	127.9	-12.5	-117.4	0	0	0	0	115.3	N345 T346	N345-C1062 WeakPolarHBondContact O-CA 3.21Å; T346-C1062 PolarHBondContact OG1-SG 3.34Å; T346-C1062 VanDerWaalsContact OG1-SG 3.39Å
1063	V	23.9	Very low	24.8	Very low	91 Å²	91	117.1 Å²	117.1	55%	0.552	66%	0.662	S	S	*	*				73.8	138.9	124.2	171.6	0	0	0	0	124.9
1064	C	23	Very low	24.7	Very low	120 Å²	120	119.4 Å²	119.4	81%	0.811	67%	0.667	S	S	*	*			trans	79.7	147.6	160.8	-82.5	0	0	0	0	121.3
1065	G	24	Very low	24.5	Very low	71 Å²	71	120.1 Å²	120.1	73%	0.732	68%	0.675	S	S	*	*			cis	159.9	134.3	-13.3	0	0	0	0	0	117.2
1066	E	21.7	Very low	24.6	Very low	109 Å²	109	120 Å²	120	51%	0.509	68%	0.68	S	S	.	*			trans	65.1	147.9	169	-96.9	-169.7	167.8	0	0	120.9	K285 K1068	K285-E1066 WeakPolarHBondContact CE-OE2 3.46Å; K285-E1066 IonicContact NZ-OE1 3.01Å; K285-E1066 PolarHBondContact NZ-OE1 3.05Å; K285-E1066 IonicContact NZ-OE2 3.57Å; K285-E1066 PolarHBondContact NZ-OE2 3.46Å; E1066-K1068 VanDerWaalsContact OE1-CD 3.23Å; E1066-K1068 WeakPolarHBondContact OE1-CD 3.41Å; E1066-K1068 WeakPolarHBondContact OE1-CE 3.37Å; E1066-K1068 IonicContact OE1-NZ 3.77Å; E1066-K1068 PolarHBondContact OE1-NZ 3.18Å
1067	P	27.1	Very low	24.5	Very low	130 Å²	130	120.3 Å²	120.3	84%	0.844	68%	0.682	S	S	*	*				-134.4	176.3	104.7	39.9	-31.8	0	0	0	114.6
1068	K	24	Very low	24.6	Very low	133 Å²	133	119.5 Å²	119.5	58%	0.578	69%	0.686	S	S	*	*			trans	-140.7	135.9	-173.3	-99.9	-177.8	177.7	138.4	0	115.8	E1066	E1066-K1068 VanDerWaalsContact OE1-CD 3.23Å; E1066-K1068 WeakPolarHBondContact OE1-CD 3.41Å; E1066-K1068 WeakPolarHBondContact OE1-CE 3.37Å; E1066-K1068 IonicContact OE1-NZ 3.77Å; E1066-K1068 PolarHBondContact OE1-NZ 3.18Å
1069	K	24	Very low	24.3	Very low	191 Å²	191	120.5 Å²	120.5	83%	0.83	69%	0.687	S	S	*	*			trans	67.8	159.2	152.6	-66.6	-169	174.7	-165.3	0	115.5
1070	V	26.4	Very low	24.4	Very low	129 Å²	129	121.1 Å²	121.1	78%	0.782	70%	0.695	S	S	*	*			cis	-127.8	154.5	24.1	174.4	0	0	0	0	112.8	F1072	V1070-F1072 HydrophobicContact CG1-CD2 4.35Å
1071	S	22.1	Very low	24.4	Very low	109 Å²	109	123.3 Å²	123.3	76%	0.762	71%	0.711	S	S	*	*			trans	-134.7	135.9	166.7	53	0	0	0	0	111.7
1072	F	26.1	Very low	24.5	Very low	193 Å²	193	124.9 Å²	124.9	85%	0.846	73%	0.725	S	S	*	*			trans	-158.4	144.1	160.2	-86	-85.2	0	0	0	106	V1070	V1070-F1072 HydrophobicContact CG1-CD2 4.35Å
1073	S	23.6	Very low	24.5	Very low	83 Å²	83	128.6 Å²	128.6	58%	0.58	74%	0.739	S	S	*	*			cis	-178.3	137.5	-34.7	47.3	0	0	0	0	107
1074	N	23	Very low	24.5	Very low	141 Å²	141	129.4 Å²	129.4	75%	0.754	75%	0.748	S	S	*	*			trans	49.2	139.2	136.5	-56.7	15.6	0	0	0	119.9
1075	N	23.5	Very low	24.6	Very low	136 Å²	136	131 Å²	131	73%	0.727	75%	0.749	S	S	*	*			cis	-157	163.1	-2	-91.7	-16	0	0	0	106
1076	T	27.6	Very low	24.5	Very low	133 Å²	133	132.6 Å²	132.6	82%	0.816	75%	0.747	S	S	*	*				-153.1	150	91.9	40	0	0	0	0	114
1077	S	22.9	Very low	24.8	Very low	106 Å²	106	131.6 Å²	131.6	74%	0.741	75%	0.752	S	S	*	*			trans	-29	157.5	159.7	53.3	0	0	0	0	117.3
1078	S	26.8	Very low	24.8	Very low	104 Å²	104	133.1 Å²	133.1	73%	0.727	75%	0.753	S	S	*	*			cis	-153.3	161.2	33.7	54.8	0	0	0	0	116.2
1079	N	22.5	Very low	25	Very low	143 Å²	143	133 Å²	133	77%	0.765	76%	0.757	S	S	*	*			trans	4.8	136	150.8	-49.4	8.3	0	0	0	117.4
1080	D	27.7	Very low	25.6	Very low	154 Å²	154	131.5 Å²	131.5	82%	0.824	76%	0.758	S	S	*	*				-143.2	-160.7	68.1	-98.3	-27.1	0	0	0	116
1081	T	24.3	Very low	26.7	Very low	116 Å²	116	129.2 Å²	129.2	71%	0.712	75%	0.747	S	S	*	*			trans	-100	173.2	-147.5	53.2	0	0	0	0	117.3
1082	N	26.7	Very low	28.4	Very low	158 Å²	158	129.2 Å²	129.2	85%	0.845	74%	0.738	S	S	*	*			trans	82.5	91.5	165.6	-60.7	-19.8	0	0	0	117.8
1083	I	23.7	Very low	30.3	Very low	151 Å²	151	122.9 Å²	122.9	77%	0.774	72%	0.716	S	S	*	*			trans	-79.6	132.9	164.5	-63.8	162.1	0	0	0	109.6	N1085	I1083-N1085 WeakPolarHBondContact CG2-OD1 3.26Å
1084	S	25.1	Very low	32.4	Very low	107 Å²	107	120.8 Å²	120.8	75%	0.748	70%	0.7	S	S	*	*			trans	-136.1	115.6	150.6	60.7	0	0	0	0	109.6	C1086	S1084-C1086 PolarHBondContact O-N 2.73Å
1085	N	24.1	Very low	34.8	Very low	154 Å²	154	115.7 Å²	115.7	82%	0.824	67%	0.673	S	S	*	*			trans	-75	97.8	-173.8	-70.1	-31.5	0	0	0	110.8	I1083 S1087	I1083-N1085 WeakPolarHBondContact CG2-OD1 3.26Å; N1085-S1087 PolarHBondContact O-N 2.86Å
1086	C	23	Very low	37.4	Very low	104 Å²	104	112.5 Å²	112.5	70%	0.703	66%	0.658	S	S	*	*			trans	-77.9	114.6	159.9	-74.9	0	0	0	0	109	S1084	S1084-C1086 PolarHBondContact O-N 2.73Å
1087	S	27.6	Very low	39.7	Very low	88 Å²	88	106.8 Å²	106.8	62%	0.615	62%	0.624	S	S	*	*			trans	-63.6	143.6	177.4	48.3	0	0	0	0	111.9	N1085 M1089	N1085-S1087 PolarHBondContact O-N 2.86Å; S1087-M1089 PolarHBondContact O-N 3.26Å
1088	N	26.4	Very low	42.5	Very low	162 Å²	162	101.7 Å²	101.7	87%	0.866	59%	0.589	S	S	*	*			trans	-66.3	80.4	173.5	-77.6	-21.1	0	0	0	111
1089	M	28.5	Very low	45.1	Very low	132 Å²	132	97.6 Å²	97.6	65%	0.65	56%	0.559	S	S	*	*			trans	-82.4	118.3	166.9	-76.5	-67.7	174.4	0	0	109	S1087 S1091	S1087-M1089 PolarHBondContact O-N 3.26Å; M1089-S1091 VanDerWaalsContact C-N 3.27Å; M1089-S1091 PolarHBondContact O-N 2.91Å
1090	N	36.5	Very low	48	Very low	159 Å²	159	93.7 Å²	93.7	85%	0.85	54%	0.537	S	S	*	.			trans	-69.7	80.4	178.6	-67.2	-34.9	0	0	0	110.7	I1092	N1090-I1092 PolarHBondContact O-N 3.22Å
1091	S	48.6	Very low	50.7	Low	81 Å²	81	86.5 Å²	86.5	57%	0.566	50%	0.5	S	S	*	.			trans	-66.7	115	169.1	47	0	0	0	0	109.3	M1089 P1093	M1089-S1091 VanDerWaalsContact C-N 3.27Å; M1089-S1091 PolarHBondContact O-N 2.91Å; S1091-P1093 WeakPolarHBondContact O-CD 3.17Å; S1091-P1093 VanDerWaalsContact O-N 3.16Å
1092	I	59.2	Low	53.7	Low	108 Å²	108	81.3 Å²	81.3	55%	0.554	47%	0.467	S	S	*	.			trans	-60.8	118.2	169.4	-59.5	174.5	0	0	0	106.5	A868 N1090 T1096 A1097	A868-I1092 VanDerWaalsContact CB-O 3.27Å; A868-I1092 WeakPolarHBondContact CB-O 3.26Å; N1090-I1092 PolarHBondContact O-N 3.22Å; I1092-T1096 HydrophobicContact CG2-CG2 4.02Å; I1092-A1097 HydrophobicContact CG2-CB 4.49Å
1093	P	64.6	Low	56.5	Low	60 Å²	60	74.3 Å²	74.3	39%	0.39	43%	0.43	S	S	.	.			trans	-67	142.2	-177.6	27.9	-33.6	0	0	0	108.9	S1091 I1095 T1096 A1097	S1091-P1093 WeakPolarHBondContact O-CD 3.17Å; S1091-P1093 VanDerWaalsContact O-N 3.16Å; P1093-I1095 HydrophobicContact CB-CG2 4.15Å; P1093-I1095 HydrophobicContact CG-CG2 4.19Å; P1093-I1095 PolarHBondContact O-N 3.27Å; P1093-T1096 PolarHBondContact O-N 3.48Å; P1093-A1097 PolarHBondContact O-N 3.45Å
1094	P	68.3	Low	59.5	Low	39 Å²	39	68.8 Å²	68.8	25%	0.253	40%	0.399	S	S	.	.	H	α-helix	trans	-53.2	-33	-172	-29.2	35.2	0	0	0	114.1	L867 A868 Y871 T1096 A1097 A1098	L867-P1094 HydrophobicContact CB-CG 4.15Å; A868-P1094 HydrophobicContact CB-CG 4.21Å; Y871-P1094 HydrophobicContact CD2-CB 3.97Å; Y871-P1094 HydrophobicContact CE2-CB 4.28Å; P1094-T1096 VanDerWaalsContact C-N 3.33Å; P1094-T1096 PolarHBondContact O-N 3.41Å; P1094-A1097 PolarHBondContact O-N 2.78Å; P1094-A1098 WeakPolarHBondContact O-CB 3.5Å; P1094-A1098 PolarHBondContact O-N 2.87Å
1095	I	74.4	Confident	62.3	Low	34 Å²	34	64 Å²	64	17%	0.174	37%	0.365	C	S	.	.	H	α-helix	trans	-57.5	-41	175.2	-159.1	175.7	0	0	0	112.8	L900 P1093 A1098 M1099 S1169	L900-I1095 HydrophobicContact CD2-CG1 4.31Å; P1093-I1095 HydrophobicContact CB-CG2 4.15Å; P1093-I1095 HydrophobicContact CG-CG2 4.19Å; P1093-I1095 PolarHBondContact O-N 3.27Å; I1095-A1098 PolarHBondContact O-N 3.44Å; I1095-M1099 HydrophobicContact CG1-SD 4.48Å; I1095-M1099 WeakPolarHBondContact O-CB 3.39Å; I1095-M1099 WeakPolarHBondContact O-CG 3.37Å; I1095-M1099 PolarHBondContact O-N 2.72Å; I1095-S1169 VanDerWaalsContact CD1-CB 3.43Å
1096	T	76.3	Confident	65.3	Low	70 Å²	70	56.7 Å²	56.7	43%	0.429	33%	0.326	S	S	.	.	H	α-helix	trans	-69.5	-42.8	178.4	-62	0	0	0	0	110.7	I1092 P1093 P1094 A1098 M1099 D1100	I1092-T1096 HydrophobicContact CG2-CG2 4.02Å; P1093-T1096 PolarHBondContact O-N 3.48Å; P1094-T1096 VanDerWaalsContact C-N 3.33Å; P1094-T1096 PolarHBondContact O-N 3.41Å; T1096-A1098 PolarHBondContact O-N 2.86Å; T1096-M1099 PolarHBondContact O-N 2.99Å; T1096-D1100 WeakPolarHBondContact O-CB 3.42Å; T1096-D1100 PolarHBondContact O-N 2.9Å
1097	A	76.1	Confident	68.1	Low	12 Å²	12	56.9 Å²	56.9	10%	0.099	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-42.3	175.3	0	0	0	0	0	112	Y871 I1092 P1093 P1094 D1100 S1101	Y871-A1097 CarbonylContact O-C 3.07Å; Y871-A1097 VanDerWaalsContact O-C 3.3Å; I1092-A1097 HydrophobicContact CG2-CB 4.49Å; P1093-A1097 PolarHBondContact O-N 3.45Å; P1094-A1097 PolarHBondContact O-N 2.78Å; A1097-D1100 PolarHBondContact O-N 3.48Å; A1097-S1101 WeakPolarHBondContact O-CB 3.29Å; A1097-S1101 PolarHBondContact O-N 2.85Å; A1097-S1101 PolarHBondContact O-OG 3.44Å
1098	A	81.7	Confident	70.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-43.5	176.7	0	0	0	0	0	112.8	Y871 I896 S899 L900 P1094 I1095 T1096 L1102	Y871-A1098 HydrophobicContact CD1-CB 4.28Å; Y871-A1098 HydrophobicContact CG-CB 4.3Å; I896-A1098 HydrophobicContact CG2-CB 4.18Å; S899-A1098 VanDerWaalsContact OG-CB 3.26Å; S899-A1098 WeakPolarHBondContact OG-CB 3.44Å; L900-A1098 HydrophobicContact CD2-CB 3.85Å; P1094-A1098 WeakPolarHBondContact O-CB 3.5Å; P1094-A1098 PolarHBondContact O-N 2.87Å; I1095-A1098 PolarHBondContact O-N 3.44Å; T1096-A1098 PolarHBondContact O-N 2.86Å; A1098-L1102 WeakPolarHBondContact O-CB 3.44Å; A1098-L1102 VanDerWaalsContact O-CG 3.26Å; A1098-L1102 WeakPolarHBondContact O-CG 3.46Å; A1098-L1102 PolarHBondContact O-N 3.03Å
1099	M	82.7	Confident	73.3	Confident	18 Å²	18	50.1 Å²	50.1	9%	0.089	26%	0.263	C	S	.	.	H	α-helix	trans	-62	-46.5	174.9	-69	174.9	67.1	0	0	111.9	L900 I1095 T1096 S1101 L1102 D1103 R1172	L900-M1099 HydrophobicContact CD2-CG 3.59Å; I1095-M1099 HydrophobicContact CG1-SD 4.48Å; I1095-M1099 WeakPolarHBondContact O-CB 3.39Å; I1095-M1099 WeakPolarHBondContact O-CG 3.37Å; I1095-M1099 PolarHBondContact O-N 2.72Å; T1096-M1099 PolarHBondContact O-N 2.99Å; M1099-S1101 VanDerWaalsContact C-N 3.33Å; M1099-S1101 PolarHBondContact O-N 2.97Å; M1099-L1102 PolarHBondContact O-N 3.35Å; M1099-D1103 PolarHBondContact O-N 3.22Å; M1099-R1172 HydrophobicContact CE-CB 3.73Å; M1099-R1172 HydrophobicContact CE-CG 3.52Å
1100	D	82.3	Confident	75.8	Confident	60 Å²	60	44.7 Å²	44.7	32%	0.321	24%	0.241	S	C	.	.	H	α-helix	trans	-60.7	-42.4	179.8	-165.9	54.3	0	0	0	111.7	R873 T1096 A1097 W1104	R873-D1100 WeakPolarHBondContact CD-OD2 3.4Å; R873-D1100 VanDerWaalsContact CZ-O 3.25Å; R873-D1100 IonicContact CZ-OD1 2.75Å; R873-D1100 IonicContact CZ-OD2 3.66Å; R873-D1100 VanDerWaalsContact NE-CG 3.31Å; R873-D1100 PolarHBondContact NE-O 3.21Å; R873-D1100 IonicContact NE-OD1 3.83Å; R873-D1100 IonicContact NE-OD2 2.89Å; R873-D1100 PolarHBondContact NE-OD2 3.48Å; R873-D1100 IonicContact NH1-OD1 2.65Å; R873-D1100 PolarHBondContact NH1-OD1 3.05Å; R873-D1100 VanDerWaalsContact NH1-OD1 3.08Å; R873-D1100 IonicContact NH1-OD2 2.69Å; R873-D1100 PolarHBondContact NH1-OD2 3.48Å; R873-D1100 VanDerWaalsContact NH1-OD2 3.15Å; R873-D1100 PolarHBondContact NH2-O 3.34Å; R873-D1100 IonicContact NH2-OD1 2.71Å; R873-D1100 PolarHBondContact NH2-OD1 3.5Å; R873-D1100 IonicContact NH2-OD2 3.72Å; T1096-D1100 WeakPolarHBondContact O-CB 3.42Å; T1096-D1100 PolarHBondContact O-N 2.9Å; A1097-D1100 PolarHBondContact O-N 3.48Å; D1100-W1104 PolarHBondContact O-N 3.4Å; D1100-W1104 VanDerWaalsContact O-N 3.15Å
1101	S	84.7	Confident	77.8	Confident	4 Å²	4	40.3 Å²	40.3	3%	0.028	22%	0.221	C	C	.	.	H	α-helix	trans	-67.4	-37.8	174.3	-67.4	0	0	0	0	113.8	Y871 R873 A1097 M1099 L1105	Y871-S1101 PolarHBondContact O-OG 3.38Å; R873-S1101 PolarHBondContact N-OG 3.23Å; A1097-S1101 WeakPolarHBondContact O-CB 3.29Å; A1097-S1101 PolarHBondContact O-N 2.85Å; A1097-S1101 PolarHBondContact O-OG 3.44Å; M1099-S1101 VanDerWaalsContact C-N 3.33Å; M1099-S1101 PolarHBondContact O-N 2.97Å; S1101-L1105 VanDerWaalsContact O-CB 3.27Å; S1101-L1105 WeakPolarHBondContact O-CB 3.44Å; S1101-L1105 PolarHBondContact O-N 3.27Å
1102	L	87.4	Confident	79.4	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-68.3	-37	176.2	-74	168	0	0	0	112.1	L893 I896 T897 L900 A1098 M1099 A1106 I1118 L1122	L893-L1102 HydrophobicContact CD1-CD2 3.5Å; L893-L1102 VanDerWaalsContact CD1-CD2 3.5Å; I896-L1102 HydrophobicContact CG2-CD1 4.2Å; I896-L1102 HydrophobicContact CG2-CD2 4.04Å; I896-L1102 HydrophobicContact CG2-CG 3.89Å; T897-L1102 HydrophobicContact CG2-CD1 4.17Å; T897-L1102 HydrophobicContact CG2-CD2 3.96Å; L900-L1102 HydrophobicContact CD1-CD1 3.79Å; L900-L1102 HydrophobicContact CD2-CD1 4.41Å; L900-L1102 HydrophobicContact CG-CD1 4.34Å; A1098-L1102 WeakPolarHBondContact O-CB 3.44Å; A1098-L1102 VanDerWaalsContact O-CG 3.26Å; A1098-L1102 WeakPolarHBondContact O-CG 3.46Å; A1098-L1102 PolarHBondContact O-N 3.03Å; M1099-L1102 PolarHBondContact O-N 3.35Å; L1102-A1106 VanDerWaalsContact O-CB 3.29Å; L1102-A1106 WeakPolarHBondContact O-CB 3.27Å; L1102-A1106 PolarHBondContact O-N 3.36Å; L1102-I1118 HydrophobicContact CD2-CG2 4.4Å; L1102-L1122 HydrophobicContact CD1-CD2 4.43Å
1103	D	84.8	Confident	80.4	Confident	12 Å²	12	39.2 Å²	39.2	6%	0.064	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-49.7	175	-164.7	91	0	0	0	111.2	M1099 L1105 A1106 R1107 Q1176	M1099-D1103 PolarHBondContact O-N 3.22Å; D1103-L1105 PolarHBondContact O-N 3.13Å; D1103-A1106 PolarHBondContact O-N 2.9Å; D1103-R1107 WeakPolarHBondContact O-CG 3.41Å; D1103-R1107 PolarHBondContact O-N 3.24Å; D1103-R1107 IonicContact OD2-CZ 2.68Å; D1103-R1107 VanDerWaalsContact OD2-CZ 3.23Å; D1103-R1107 IonicContact OD2-NE 2.53Å; D1103-R1107 PolarHBondContact OD2-NE 2.77Å; D1103-R1107 IonicContact OD2-NH2 2.92Å; D1103-R1107 PolarHBondContact OD2-NH2 3.4Å; D1103-Q1176 WeakPolarHBondContact OD1-CB 3.23Å; D1103-Q1176 PolarHBondContact OD1-NE2 3.38Å
1104	W	87.5	Confident	81.4	Confident	34 Å²	34	36.3 Å²	36.3	13%	0.129	19%	0.194	C	C	.	.	H	α-helix	trans	-57.7	-45.9	175.2	165	83.3	0	0	0	112.6	R873 R877 L988 D1100 A1106 R1107 R1108	R873-W1104 HydrophobicContact CG-CB 4.22Å; R873-W1104 HydrophobicContact CG-CG 4.38Å; R877-W1104 HydrophobicContact CB-CH2 3.9Å; R877-W1104 HydrophobicContact CB-CZ2 3.98Å; R877-W1104 HydrophobicContact CG-CH2 4.38Å; R877-W1104 HydrophobicContact CG-CZ2 4.12Å; L988-W1104 HydrophobicContact CD2-CZ2 4.01Å; D1100-W1104 PolarHBondContact O-N 3.4Å; D1100-W1104 VanDerWaalsContact O-N 3.15Å; W1104-A1106 VanDerWaalsContact C-N 3.35Å; W1104-A1106 PolarHBondContact O-N 3.26Å; W1104-R1107 PolarHBondContact O-N 3.38Å; W1104-R1108 PolarHBondContact O-N 2.8Å
1105	L	84.6	Confident	82.2	Confident	7 Å²	7	37.3 Å²	37.3	4%	0.037	20%	0.197	C	C	.	.	H	α-helix	trans	-63.8	-42	178.9	-166.6	73.3	0	0	0	111.1	L880 F888 L889 L893 S1101 D1103 R1108 I1109 I1118	L880-L1105 HydrophobicContact CD1-CD1 4.2Å; F888-L1105 HydrophobicContact CE1-CD1 4.05Å; F888-L1105 HydrophobicContact CE1-CD2 4.04Å; L889-L1105 HydrophobicContact CD2-CD2 4.16Å; L893-L1105 HydrophobicContact CD1-CD2 3.78Å; S1101-L1105 VanDerWaalsContact O-CB 3.27Å; S1101-L1105 WeakPolarHBondContact O-CB 3.44Å; S1101-L1105 PolarHBondContact O-N 3.27Å; D1103-L1105 PolarHBondContact O-N 3.13Å; L1105-R1108 PolarHBondContact O-N 3.11Å; L1105-I1109 HydrophobicContact CD1-CD1 3.73Å; L1105-I1109 HydrophobicContact CD1-CG1 4.42Å; L1105-I1109 HydrophobicContact CD2-CD1 4.41Å; L1105-I1109 HydrophobicContact CG-CD1 3.71Å; L1105-I1109 HydrophobicContact CG-CG1 4.48Å; L1105-I1109 WeakPolarHBondContact O-CG1 3.34Å; L1105-I1109 PolarHBondContact O-N 2.97Å; L1105-I1118 HydrophobicContact CB-CD1 4.42Å; L1105-I1118 HydrophobicContact CD2-CD1 4.1Å; L1105-I1118 HydrophobicContact CG-CD1 4.26Å
1106	A	85.7	Confident	82.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.4	-41.6	176.8	0	0	0	0	0	112.4	L1102 D1103 W1104 R1108 T1114 I1118 L1177 I1180 Y1181	L1102-A1106 VanDerWaalsContact O-CB 3.29Å; L1102-A1106 WeakPolarHBondContact O-CB 3.27Å; L1102-A1106 PolarHBondContact O-N 3.36Å; D1103-A1106 PolarHBondContact O-N 2.9Å; W1104-A1106 VanDerWaalsContact C-N 3.35Å; W1104-A1106 PolarHBondContact O-N 3.26Å; A1106-R1108 VanDerWaalsContact C-N 3.32Å; A1106-R1108 PolarHBondContact O-N 3.49Å; A1106-T1114 HydrophobicContact CB-CG2 4.04Å; A1106-T1114 PolarHBondContact O-OG1 2.89Å; A1106-I1118 HydrophobicContact CB-CD1 4Å; A1106-L1177 HydrophobicContact CB-CD2 3.37Å; A1106-I1180 HydrophobicContact CB-CD1 4.49Å; A1106-Y1181 PolarHBondContact O-OH 3.28Å
1107	R	83.2	Confident	83.1	Confident	108 Å²	108	39.4 Å²	39.4	41%	0.408	20%	0.198	S	C	.	.	H	α-helix	trans	-60.6	-36.2	177.6	-68.5	-177.2	-159.2	-160.8	9.1	112.8	E1014 D1103 W1104 I1180	E1014-R1107 IonicContact OE1-CZ 3.6Å; E1014-R1107 IonicContact OE1-NH1 2.94Å; E1014-R1107 PolarHBondContact OE1-NH1 3.47Å; E1014-R1107 IonicContact OE1-NH2 3.52Å; D1103-R1107 WeakPolarHBondContact O-CG 3.41Å; D1103-R1107 PolarHBondContact O-N 3.24Å; D1103-R1107 IonicContact OD2-CZ 2.68Å; D1103-R1107 VanDerWaalsContact OD2-CZ 3.23Å; D1103-R1107 IonicContact OD2-NE 2.53Å; D1103-R1107 PolarHBondContact OD2-NE 2.77Å; D1103-R1107 IonicContact OD2-NH2 2.92Å; D1103-R1107 PolarHBondContact OD2-NH2 3.4Å; W1104-R1107 PolarHBondContact O-N 3.38Å; R1107-I1180 HydrophobicContact CG-CD1 3.77Å; R1107-I1180 HydrophobicContact CG-CG1 4.25Å
1108	R	81.1	Confident	83.7	Confident	80 Å²	80	39 Å²	39	30%	0.302	19%	0.194	S	C	.	.	H	α-helix	trans	-92	-26.7	-172.9	-68.4	-160.6	177.7	-160.6	6.6	116.6	S987 D991 W1104 L1105 A1106	S987-R1108 PolarHBondContact O-NH1 3.26Å; D991-R1108 IonicContact OD1-NH1 3.69Å; D991-R1108 IonicContact OD1-NH2 3.08Å; D991-R1108 PolarHBondContact OD1-NH2 2.7Å; D991-R1108 IonicContact OD2-CZ 3.87Å; D991-R1108 VanDerWaalsContact OD2-CZ 3.23Å; D991-R1108 IonicContact OD2-NH1 3.45Å; D991-R1108 PolarHBondContact OD2-NH1 2.98Å; D991-R1108 IonicContact OD2-NH2 2.97Å; D991-R1108 PolarHBondContact OD2-NH2 3.01Å; W1104-R1108 PolarHBondContact O-N 2.8Å; L1105-R1108 PolarHBondContact O-N 3.11Å; A1106-R1108 VanDerWaalsContact C-N 3.32Å; A1106-R1108 PolarHBondContact O-N 3.49Å
1109	I	81.9	Confident	84	Confident	29 Å²	29	39.1 Å²	39.1	15%	0.149	20%	0.195	C	C	.	.	H	α-helix	trans	-92.6	-10.9	-179.9	-39.3	171.8	0	0	0	112.5	L889 L1105 M1113	L889-I1109 HydrophobicContact CD1-CD1 4.14Å; L889-I1109 HydrophobicContact CD2-CD1 3.72Å; L889-I1109 HydrophobicContact CG-CD1 4.39Å; L1105-I1109 HydrophobicContact CD1-CD1 3.73Å; L1105-I1109 HydrophobicContact CD1-CG1 4.42Å; L1105-I1109 HydrophobicContact CD2-CD1 4.41Å; L1105-I1109 HydrophobicContact CG-CD1 3.71Å; L1105-I1109 HydrophobicContact CG-CG1 4.48Å; L1105-I1109 WeakPolarHBondContact O-CG1 3.34Å; L1105-I1109 PolarHBondContact O-N 2.97Å; I1109-M1113 HydrophobicContact CB-CB 4.25Å; I1109-M1113 HydrophobicContact CG2-CB 3.48Å; I1109-M1113 VanDerWaalsContact CG2-CB 3.48Å; I1109-M1113 HydrophobicContact CG2-CG 3.75Å
1110	G	79.7	Confident	84.2	Confident	18 Å²	18	44.1 Å²	44.1	19%	0.186	22%	0.216	C	C	.	.			trans	78.5	176.4	174.7	0	0	0	0	0	114.8	V1112 T1114 Y1181	G1110-V1112 PolarHBondContact O-N 2.87Å; G1110-T1114 VanDerWaalsContact O-CB 3.28Å; G1110-T1114 WeakPolarHBondContact O-CB 3.49Å; G1110-T1114 PolarHBondContact O-N 3.5Å; G1110-T1114 PolarHBondContact O-OG1 3.46Å; G1110-Y1181 WeakPolarHBondContact CA-OH 3.29Å; G1110-Y1181 PolarHBondContact O-OH 3.15Å
1111	P	79.8	Confident	84.4	Confident	66 Å²	66	43.3 Å²	43.3	43%	0.429	21%	0.209	S	C	.	.	H	α-helix	trans	-68.4	-43.6	-160.3	21.7	-29.9	0	0	0	113.3	M1113 T1114 I1115 Y1181	P1111-M1113 PolarHBondContact O-N 2.85Å; P1111-T1114 PolarHBondContact O-N 3.06Å; P1111-I1115 WeakPolarHBondContact O-CB 3.12Å; P1111-I1115 WeakPolarHBondContact O-CD1 3.13Å; P1111-I1115 VanDerWaalsContact O-CG1 3.25Å; P1111-I1115 WeakPolarHBondContact O-CG1 3.19Å; P1111-I1115 PolarHBondContact O-N 2.99Å; P1111-Y1181 HydrophobicContact CB-CD1 3.74Å; P1111-Y1181 HydrophobicContact CB-CE1 3.56Å; P1111-Y1181 HydrophobicContact CB-CG 4.49Å; P1111-Y1181 HydrophobicContact CG-CD1 4.41Å; P1111-Y1181 HydrophobicContact CG-CE1 4.04Å
1112	V	81.3	Confident	84.7	Confident	114 Å²	114	43.2 Å²	43.2	69%	0.691	21%	0.208	S	C	*	.	H	α-helix	trans	-64.3	-45.1	-173.6	-177.5	0	0	0	0	111.4	G1110 I1115 K1116	G1110-V1112 PolarHBondContact O-N 2.87Å; V1112-I1115 PolarHBondContact O-N 3.22Å; V1112-K1116 WeakPolarHBondContact O-CB 3.36Å; V1112-K1116 PolarHBondContact O-N 3.23Å
1113	M	79.9	Confident	84.7	Confident	52 Å²	52	43.4 Å²	43.4	26%	0.256	21%	0.209	S	C	.	.	H	α-helix	trans	-72.7	-36.6	177	-67.2	-59.4	-158.4	0	0	112	I1109 P1111 I1115 K1116 Y1117	I1109-M1113 HydrophobicContact CB-CB 4.25Å; I1109-M1113 HydrophobicContact CG2-CB 3.48Å; I1109-M1113 VanDerWaalsContact CG2-CB 3.48Å; I1109-M1113 HydrophobicContact CG2-CG 3.75Å; P1111-M1113 PolarHBondContact O-N 2.85Å; M1113-I1115 VanDerWaalsContact C-N 3.32Å; M1113-I1115 PolarHBondContact O-N 3.09Å; M1113-K1116 PolarHBondContact O-N 3.34Å; M1113-Y1117 PolarHBondContact O-N 3.44Å; M1113-Y1117 HydrophobicContact SD-CD2 4.27Å; M1113-Y1117 HydrophobicContact SD-CE2 3.82Å
1114	T	85.5	Confident	84.7	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.226	C	C	.	.	I	π-helix	trans	-59	-43.2	173.2	-61.7	0	0	0	0	111.2	A1106 G1110 P1111 I1118 V1119 L1177 Y1181	A1106-T1114 HydrophobicContact CB-CG2 4.04Å; A1106-T1114 PolarHBondContact O-OG1 2.89Å; G1110-T1114 VanDerWaalsContact O-CB 3.28Å; G1110-T1114 WeakPolarHBondContact O-CB 3.49Å; G1110-T1114 PolarHBondContact O-N 3.5Å; G1110-T1114 PolarHBondContact O-OG1 3.46Å; P1111-T1114 PolarHBondContact O-N 3.06Å; T1114-I1118 HydrophobicContact CG2-CB 4.15Å; T1114-I1118 HydrophobicContact CG2-CD1 4.24Å; T1114-I1118 WeakPolarHBondContact O-CA 3.35Å; T1114-I1118 WeakPolarHBondContact O-CB 3.44Å; T1114-I1118 PolarHBondContact O-N 3.35Å; T1114-V1119 HydrophobicContact CG2-CG2 4.42Å; T1114-V1119 PolarHBondContact O-N 3.11Å; T1114-L1177 HydrophobicContact CG2-CD1 4Å; T1114-L1177 HydrophobicContact CG2-CD2 3.82Å; T1114-Y1181 HydrophobicContact CG2-CE2 3.93Å; T1114-Y1181 PolarHBondContact OG1-OH 3.45Å
1115	I	86	Confident	84.5	Confident	60 Å²	60	44.5 Å²	44.5	31%	0.308	22%	0.22	S	C	.	.	I	π-helix	trans	-66.6	-46.4	175.7	-68	161.2	0	0	0	111	P1111 V1112 M1113 Y1117 I1185 V1189	P1111-I1115 WeakPolarHBondContact O-CB 3.12Å; P1111-I1115 WeakPolarHBondContact O-CD1 3.13Å; P1111-I1115 VanDerWaalsContact O-CG1 3.25Å; P1111-I1115 WeakPolarHBondContact O-CG1 3.19Å; P1111-I1115 PolarHBondContact O-N 2.99Å; V1112-I1115 PolarHBondContact O-N 3.22Å; M1113-I1115 VanDerWaalsContact C-N 3.32Å; M1113-I1115 PolarHBondContact O-N 3.09Å; I1115-Y1117 PolarHBondContact O-N 2.76Å; I1115-I1185 HydrophobicContact CD1-CD1 4.45Å; I1115-I1185 HydrophobicContact CD1-CG1 4.44Å; I1115-I1185 HydrophobicContact CG1-CD1 4.06Å; I1115-I1185 HydrophobicContact CG1-CG1 4.37Å; I1115-V1189 HydrophobicContact CD1-CG2 3.85Å; I1115-V1189 HydrophobicContact CG1-CG2 4.21Å; I1115-V1189 HydrophobicContact CG2-CG1 4.16Å; I1115-V1189 HydrophobicContact CG2-CG2 4.36Å
1116	K	83.1	Confident	84.5	Confident	118 Å²	118	44.4 Å²	44.4	51%	0.513	22%	0.219	S	C	.	.	I	π-helix	trans	-64.2	-38.9	-176.4	-174.1	179.7	175.8	-159	0	113.6	V1112 M1113 K1120	V1112-K1116 WeakPolarHBondContact O-CB 3.36Å; V1112-K1116 PolarHBondContact O-N 3.23Å; M1113-K1116 PolarHBondContact O-N 3.34Å; K1116-K1120 WeakPolarHBondContact O-CB 3.07Å
1117	Y	86.1	Confident	84.4	Confident	30 Å²	30	44.8 Å²	44.8	12%	0.118	22%	0.221	C	C	.	.	I	π-helix	trans	-110.9	-68.5	-175.2	-62.9	-82.2	0	0	0	112.3	L889 V890 M1113 I1115 V1119 K1120 Y1121	L889-Y1117 HydrophobicContact CB-CD1 4.29Å; L889-Y1117 HydrophobicContact CB-CG 4.36Å; L889-Y1117 HydrophobicContact CD1-CD2 4.19Å; L889-Y1117 HydrophobicContact CD1-CE2 4.39Å; V890-Y1117 HydrophobicContact CG2-CE1 4.23Å; M1113-Y1117 PolarHBondContact O-N 3.44Å; M1113-Y1117 HydrophobicContact SD-CD2 4.27Å; M1113-Y1117 HydrophobicContact SD-CE2 3.82Å; I1115-Y1117 PolarHBondContact O-N 2.76Å; Y1117-V1119 PolarHBondContact O-N 3.33Å; Y1117-K1120 PolarHBondContact O-N 2.86Å; Y1117-Y1121 HydrophobicContact CD1-CE2 4.44Å; Y1117-Y1121 WeakPolarHBondContact O-CD2 3.41Å; Y1117-Y1121 PolarHBondContact O-N 3.25Å; Y1117-Y1121 VanDerWaalsContact O-N 3.09Å
1118	I	88.7	Confident	84.3	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.217	C	C	.	.	I	π-helix	trans	-59.7	-50.7	-170.6	-60.3	172.9	0	0	0	111.7	L893 L1102 L1105 A1106 T1114 Y1121 L1122 L1177	L893-I1118 HydrophobicContact CD1-CG1 4.34Å; L893-I1118 HydrophobicContact CD2-CG1 3.82Å; L1102-I1118 HydrophobicContact CD2-CG2 4.4Å; L1105-I1118 HydrophobicContact CB-CD1 4.42Å; L1105-I1118 HydrophobicContact CD2-CD1 4.1Å; L1105-I1118 HydrophobicContact CG-CD1 4.26Å; A1106-I1118 HydrophobicContact CB-CD1 4Å; T1114-I1118 HydrophobicContact CG2-CB 4.15Å; T1114-I1118 HydrophobicContact CG2-CD1 4.24Å; T1114-I1118 WeakPolarHBondContact O-CA 3.35Å; T1114-I1118 WeakPolarHBondContact O-CB 3.44Å; T1114-I1118 PolarHBondContact O-N 3.35Å; I1118-Y1121 PolarHBondContact O-N 2.94Å; I1118-L1122 HydrophobicContact CG2-CD1 3.78Å; I1118-L1122 HydrophobicContact CG2-CG 4.37Å; I1118-L1122 WeakPolarHBondContact O-CB 3.42Å; I1118-L1122 WeakPolarHBondContact O-CG 3.28Å; I1118-L1122 PolarHBondContact O-N 2.96Å; I1118-L1177 HydrophobicContact CG2-CD1 4.28Å
1119	V	88.9	Confident	84.2	Confident	3 Å²	3	38.7 Å²	38.7	2%	0.018	20%	0.203	C	C	.	.	I	π-helix	trans	-65.1	-41.6	179	171.1	0	0	0	0	111.8	T1114 Y1117 Y1121 L1122 L1123 L1177 V1189 Y1190	T1114-V1119 HydrophobicContact CG2-CG2 4.42Å; T1114-V1119 PolarHBondContact O-N 3.11Å; Y1117-V1119 PolarHBondContact O-N 3.33Å; V1119-Y1121 VanDerWaalsContact C-N 3.3Å; V1119-Y1121 PolarHBondContact O-N 3.1Å; V1119-L1122 PolarHBondContact O-N 3.28Å; V1119-L1123 HydrophobicContact CG1-CD1 3.63Å; V1119-L1123 HydrophobicContact CG1-CG 4.1Å; V1119-L1123 WeakPolarHBondContact O-CG 3.31Å; V1119-L1123 PolarHBondContact O-N 3.13Å; V1119-L1177 HydrophobicContact CG2-CD1 3.62Å; V1119-V1189 HydrophobicContact CG1-CG1 4.38Å; V1119-Y1190 HydrophobicContact CG1-CD1 4.47Å; V1119-Y1190 HydrophobicContact CG1-CE1 3.78Å; V1119-Y1190 HydrophobicContact CG2-CE1 4.36Å
1120	K	86.9	Confident	84.3	Confident	124 Å²	124	37.3 Å²	37.3	54%	0.539	20%	0.196	S	C	.	.	H	α-helix	trans	-55.2	-46.5	177.3	-178.9	-177	176.3	-177.9	0	111.2	K1116 Y1117 T1124	K1116-K1120 WeakPolarHBondContact O-CB 3.07Å; Y1117-K1120 PolarHBondContact O-N 2.86Å; K1120-T1124 PolarHBondContact O-N 3.15Å; K1120-T1124 PolarHBondContact O-OG1 3.4Å
1121	Y	86.8	Confident	84.2	Confident	43 Å²	43	40.1 Å²	40.1	17%	0.169	20%	0.204	C	C	.	.	H	α-helix	trans	-70.5	-50.3	178	-64.8	-59.4	0	0	0	111.5	L893 P894 T897 Y1117 I1118 V1119 L1123 T1124 T1125	L893-Y1121 HydrophobicContact CD2-CD2 4.15Å; L893-Y1121 HydrophobicContact CD2-CE2 4.38Å; L893-Y1121 HydrophobicContact CG-CD2 4.29Å; P894-Y1121 HydrophobicContact CB-CD1 4.48Å; P894-Y1121 HydrophobicContact CB-CE1 4.36Å; P894-Y1121 HydrophobicContact CG-CD1 4.46Å; P894-Y1121 HydrophobicContact CG-CE1 3.97Å; P894-Y1121 HydrophobicContact CG-CE2 4.12Å; T897-Y1121 WeakPolarHBondContact OG1-CB 3.28Å; Y1117-Y1121 HydrophobicContact CD1-CE2 4.44Å; Y1117-Y1121 WeakPolarHBondContact O-CD2 3.41Å; Y1117-Y1121 PolarHBondContact O-N 3.25Å; Y1117-Y1121 VanDerWaalsContact O-N 3.09Å; I1118-Y1121 PolarHBondContact O-N 2.94Å; V1119-Y1121 VanDerWaalsContact C-N 3.3Å; V1119-Y1121 PolarHBondContact O-N 3.1Å; Y1121-L1123 VanDerWaalsContact C-N 3.32Å; Y1121-L1123 PolarHBondContact O-N 3.37Å; Y1121-T1124 CarbonylContact O-C 3.55Å; Y1121-T1124 WeakPolarHBondContact O-CA 3.45Å; Y1121-T1124 VanDerWaalsContact O-CB 3.29Å; Y1121-T1124 WeakPolarHBondContact O-CB 3.13Å; Y1121-T1124 PolarHBondContact O-N 2.85Å; Y1121-T1125 PolarHBondContact O-N 2.92Å; Y1121-T1125 PolarHBondContact O-OG1 2.95Å
1122	L	89	Confident	83.7	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-55.6	-39.8	-179.7	-72.4	173	0	0	0	113.9	T897 L900 L1102 I1118 V1119 T1124 T1125 L1126 V1170 C1173 L1174 L1177	T897-L1122 HydrophobicContact CG2-CD2 4.19Å; T897-L1122 HydrophobicContact CG2-CG 4.37Å; L900-L1122 HydrophobicContact CD1-CD2 3.58Å; L1102-L1122 HydrophobicContact CD1-CD2 4.43Å; I1118-L1122 HydrophobicContact CG2-CD1 3.78Å; I1118-L1122 HydrophobicContact CG2-CG 4.37Å; I1118-L1122 WeakPolarHBondContact O-CB 3.42Å; I1118-L1122 WeakPolarHBondContact O-CG 3.28Å; I1118-L1122 PolarHBondContact O-N 2.96Å; V1119-L1122 PolarHBondContact O-N 3.28Å; L1122-T1124 VanDerWaalsContact C-N 3.31Å; L1122-T1124 PolarHBondContact O-N 3Å; L1122-T1125 WeakPolarHBondContact O-CB 3.39Å; L1122-T1125 PolarHBondContact O-N 3.49Å; L1122-L1126 WeakPolarHBondContact O-CB 3.24Å; L1122-L1126 PolarHBondContact O-N 3.47Å; L1122-V1170 HydrophobicContact CB-CG1 4.24Å; L1122-V1170 HydrophobicContact CD2-CG1 4Å; L1122-V1170 WeakPolarHBondContact O-CG1 3.38Å; L1122-C1173 HydrophobicContact CD1-CB 3.86Å; L1122-C1173 HydrophobicContact CD2-CB 4.05Å; L1122-L1174 HydrophobicContact CB-CD1 4.45Å; L1122-L1174 HydrophobicContact CB-CD2 3.76Å; L1122-L1174 HydrophobicContact CB-CG 4.07Å; L1122-L1174 HydrophobicContact CD1-CD2 3.95Å; L1122-L1174 HydrophobicContact CD1-CG 4.21Å; L1122-L1177 HydrophobicContact CD1-CD1 4.13Å
1123	L	88.3	Confident	83.3	Confident	11 Å²	11	38.1 Å²	38.1	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-69.1	-29.6	176.5	-68.2	174	0	0	0	112.7	V1119 Y1121 T1127 L1174 Y1193 L1261	V1119-L1123 HydrophobicContact CG1-CD1 3.63Å; V1119-L1123 HydrophobicContact CG1-CG 4.1Å; V1119-L1123 WeakPolarHBondContact O-CG 3.31Å; V1119-L1123 PolarHBondContact O-N 3.13Å; Y1121-L1123 VanDerWaalsContact C-N 3.32Å; Y1121-L1123 PolarHBondContact O-N 3.37Å; L1123-T1127 PolarHBondContact O-N 3.16Å; L1123-T1127 PolarHBondContact O-OG1 3.49Å; L1123-L1174 HydrophobicContact CD2-CD1 3.99Å; L1123-L1174 HydrophobicContact CD2-CD2 4.29Å; L1123-L1174 HydrophobicContact CG-CD2 4.46Å; L1123-Y1193 HydrophobicContact CB-CE1 4.37Å; L1123-Y1193 HydrophobicContact CB-CE2 4.43Å; L1123-Y1193 HydrophobicContact CD1-CD1 4.17Å; L1123-Y1193 HydrophobicContact CD1-CD2 4.02Å; L1123-Y1193 HydrophobicContact CD1-CE1 4.3Å; L1123-Y1193 HydrophobicContact CD1-CE2 4.12Å; L1123-Y1193 HydrophobicContact CD1-CG 4.04Å; L1123-Y1193 HydrophobicContact CD2-CD1 4.37Å; L1123-Y1193 HydrophobicContact CD2-CE1 4.24Å; L1123-L1261 HydrophobicContact CD2-CD2 3.55Å
1124	T	84.3	Confident	83	Confident	69 Å²	69	38.7 Å²	38.7	42%	0.423	19%	0.192	S	C	.	.	H	α-helix	trans	-71.2	-47.1	170.7	-53.4	0	0	0	0	110.5	K1120 Y1121 L1122 L1126 T1127 L1128	K1120-T1124 PolarHBondContact O-N 3.15Å; K1120-T1124 PolarHBondContact O-OG1 3.4Å; Y1121-T1124 CarbonylContact O-C 3.55Å; Y1121-T1124 WeakPolarHBondContact O-CA 3.45Å; Y1121-T1124 VanDerWaalsContact O-CB 3.29Å; Y1121-T1124 WeakPolarHBondContact O-CB 3.13Å; Y1121-T1124 PolarHBondContact O-N 2.85Å; L1122-T1124 VanDerWaalsContact C-N 3.31Å; L1122-T1124 PolarHBondContact O-N 3Å; T1124-L1126 VanDerWaalsContact C-N 3.29Å; T1124-L1126 PolarHBondContact O-N 3.29Å; T1124-T1127 VanDerWaalsContact O-CB 3.32Å; T1124-T1127 WeakPolarHBondContact O-CB 3.38Å; T1124-T1127 PolarHBondContact O-N 3.46Å; T1124-L1128 PolarHBondContact O-N 2.77Å
1125	T	83	Confident	82.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-54.7	-44	175.3	-45.9	0	0	0	0	111.5	T897 I901 Y1121 L1122 T1127 L1128 C1129 V1170	T897-T1125 WeakPolarHBondContact O-CG2 3.33Å; I901-T1125 HydrophobicContact CD1-CG2 3.63Å; I901-T1125 HydrophobicContact CG1-CG2 3.51Å; Y1121-T1125 PolarHBondContact O-N 2.92Å; Y1121-T1125 PolarHBondContact O-OG1 2.95Å; L1122-T1125 WeakPolarHBondContact O-CB 3.39Å; L1122-T1125 PolarHBondContact O-N 3.49Å; T1125-T1127 PolarHBondContact O-N 2.77Å; T1125-L1128 PolarHBondContact O-N 3.24Å; T1125-L1128 VanDerWaalsContact O-N 3.12Å; T1125-C1129 PolarHBondContact O-N 2.9Å; T1125-C1129 PolarHBondContact O-SG 3.28Å; T1125-V1170 HydrophobicContact CG2-CG1 4.38Å; T1125-V1170 HydrophobicContact CG2-CG2 3.59Å
1126	L	85.3	Confident	82	Confident	4 Å²	4	37 Å²	37	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-62	-29.1	178.4	-177	59.5	0	0	0	113.5	L1122 T1124 Y1130 A1167 V1170 V1171 L1174 L1261	L1122-L1126 WeakPolarHBondContact O-CB 3.24Å; L1122-L1126 PolarHBondContact O-N 3.47Å; T1124-L1126 VanDerWaalsContact C-N 3.29Å; T1124-L1126 PolarHBondContact O-N 3.29Å; L1126-Y1130 HydrophobicContact CD1-CE2 4.24Å; L1126-Y1130 WeakPolarHBondContact O-CD2 3.31Å; L1126-A1167 HydrophobicContact CD1-CB 3.83Å; L1126-V1170 HydrophobicContact CB-CG1 3.93Å; L1126-V1171 HydrophobicContact CD1-CG2 3.77Å; L1126-L1174 HydrophobicContact CD2-CD1 4.13Å; L1126-L1261 HydrophobicContact CD2-CB 4.01Å; L1126-L1261 HydrophobicContact CD2-CD1 4.08Å; L1126-L1261 HydrophobicContact CD2-CD2 4.42Å; L1126-L1261 HydrophobicContact CD2-CG 4.39Å
1127	T	84	Confident	81.7	Confident	8 Å²	8	32.9 Å²	32.9	5%	0.049	17%	0.169	C	C	.	.	H	α-helix	trans	-68.6	-47.3	173.7	-62.6	0	0	0	0	110.5	L1123 T1124 T1125 C1129 Y1130 A1253 R1254	L1123-T1127 PolarHBondContact O-N 3.16Å; L1123-T1127 PolarHBondContact O-OG1 3.49Å; T1124-T1127 VanDerWaalsContact O-CB 3.32Å; T1124-T1127 WeakPolarHBondContact O-CB 3.38Å; T1124-T1127 PolarHBondContact O-N 3.46Å; T1125-T1127 PolarHBondContact O-N 2.77Å; T1127-C1129 VanDerWaalsContact C-N 3.25Å; T1127-C1129 PolarHBondContact O-N 3.41Å; T1127-Y1130 PolarHBondContact O-N 3.09Å; T1127-Y1130 VanDerWaalsContact O-N 3.14Å; T1127-A1253 HydrophobicContact CG2-CB 4.42Å; T1127-R1254 HydrophobicContact CG2-CB 4.36Å; T1127-R1254 HydrophobicContact CG2-CG 3.37Å
1128	L	80	Confident	80.8	Confident	59 Å²	59	33.1 Å²	33.1	31%	0.309	17%	0.174	S	C	.	.	H	α-helix	trans	-63	-29.9	-178	-61.3	171.4	0	0	0	112.6	F898 I901 T1124 T1125 Y1130 E1131	F898-L1128 HydrophobicContact CD1-CD1 4.21Å; F898-L1128 HydrophobicContact CE1-CD1 3.65Å; I901-L1128 HydrophobicContact CD1-CB 3.89Å; I901-L1128 HydrophobicContact CD1-CD1 4.37Å; T1124-L1128 PolarHBondContact O-N 2.77Å; T1125-L1128 PolarHBondContact O-N 3.24Å; T1125-L1128 VanDerWaalsContact O-N 3.12Å; L1128-Y1130 PolarHBondContact O-N 3.27Å; L1128-E1131 PolarHBondContact O-N 2.98Å; L1128-E1131 VanDerWaalsContact O-N 3.15Å
1129	C	80.9	Confident	79.7	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.014	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-20.7	174.8	-61.3	0	0	0	0	114.6	T1125 T1127 G1163 S1166 A1167	T1125-C1129 PolarHBondContact O-N 2.9Å; T1125-C1129 PolarHBondContact O-SG 3.28Å; T1127-C1129 VanDerWaalsContact C-N 3.25Å; T1127-C1129 PolarHBondContact O-N 3.41Å; C1129-G1163 VanDerWaalsContact O-CA 3.3Å; C1129-G1163 WeakPolarHBondContact O-CA 3.29Å; C1129-S1166 PolarHBondContact SG-O 3.01Å; C1129-A1167 HydrophobicContact CB-CB 3.93Å
1130	Y	82.1	Confident	77.7	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	8	-179.5	-65.5	-74.4	0	0	0	113.8	L1126 T1127 L1128 L1161 D1164 A1167 A1253 V1256 T1260 K1314	L1126-Y1130 HydrophobicContact CD1-CE2 4.24Å; L1126-Y1130 WeakPolarHBondContact O-CD2 3.31Å; T1127-Y1130 PolarHBondContact O-N 3.09Å; T1127-Y1130 VanDerWaalsContact O-N 3.14Å; L1128-Y1130 PolarHBondContact O-N 3.27Å; Y1130-L1161 HydrophobicContact CE1-CD1 4.32Å; Y1130-D1164 WeakPolarHBondContact CE1-OD1 3.45Å; Y1130-D1164 PolarHBondContact OH-OD1 3.37Å; Y1130-D1164 VanDerWaalsContact OH-OD1 3.05Å; Y1130-A1167 HydrophobicContact CE2-CB 3.77Å; Y1130-A1167 WeakPolarHBondContact OH-CB 3.38Å; Y1130-A1253 VanDerWaalsContact C-CB 3.48Å; Y1130-A1253 WeakPolarHBondContact O-CB 3.31Å; Y1130-V1256 HydrophobicContact CD1-CG1 3.54Å; Y1130-V1256 HydrophobicContact CD2-CG1 4.32Å; Y1130-V1256 HydrophobicContact CE1-CG1 3.81Å; Y1130-V1256 HydrophobicContact CG-CB 4.37Å; Y1130-V1256 HydrophobicContact CG-CG1 3.82Å; Y1130-T1260 PolarHBondContact OH-OG1 2.94Å; Y1130-K1314 PolarHBondContact OH-NZ 3.44Å
1131	E	78.7	Confident	75.6	Confident	77 Å²	77	40.9 Å²	40.9	36%	0.36	22%	0.222	S	C	.	.			trans	-79.6	138.2	179.8	-170.9	153.1	-153.8	0	0	111.7	L1128 Q1135 H1250 A1253	L1128-E1131 PolarHBondContact O-N 2.98Å; L1128-E1131 VanDerWaalsContact O-N 3.15Å; E1131-Q1135 VanDerWaalsContact O-CG 3.31Å; E1131-Q1135 WeakPolarHBondContact O-CG 3.47Å; E1131-H1250 WeakPolarHBondContact OE1-CB 3.3Å; E1131-H1250 IonicContact OE2-CD2 2.71Å; E1131-A1253 HydrophobicContact CB-CB 4.25Å
1132	G	70.1	Confident	73	Confident	23 Å²	23	46.3 Å²	46.3	24%	0.237	25%	0.254	C	S	.	.	S	Bend	trans	92.7	156.4	-177.8	0	0	0	0	0	115	T1134	G1132-T1134 VanDerWaalsContact C-N 3.34Å; G1132-T1134 PolarHBondContact O-N 2.98Å
1133	K	71.6	Confident	70	Confident	114 Å²	114	52 Å²	52	50%	0.496	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-31	-172.1	-169	-179.5	175.8	-174.2	0	113.7	Y1249	K1133-Y1249 HydrophobicContact CB-CE1 3.9Å; K1133-Y1249 HydrophobicContact CG-CE1 4.43Å
1134	T	73.1	Confident	67.1	Low	64 Å²	64	59.5 Å²	59.5	39%	0.393	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-46.3	-179	46.8	0	0	0	0	111.9	G1132 L1136 S1137	G1132-T1134 VanDerWaalsContact C-N 3.34Å; G1132-T1134 PolarHBondContact O-N 2.98Å; T1134-L1136 PolarHBondContact O-N 2.8Å; T1134-S1137 WeakPolarHBondContact O-CB 3.32Å; T1134-S1137 PolarHBondContact O-N 3.3Å; T1134-S1137 PolarHBondContact O-OG 3.44Å
1135	Q	75.9	Confident	64.3	Low	22 Å²	22	61.6 Å²	61.6	10%	0.103	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-29.8	-178.9	-56.9	-57.1	-17	0	0	112.9	E1131 S1137 I1162 G1163	E1131-Q1135 VanDerWaalsContact O-CG 3.31Å; E1131-Q1135 WeakPolarHBondContact O-CG 3.47Å; Q1135-S1137 VanDerWaalsContact C-N 3.33Å; Q1135-I1162 PolarHBondContact O-N 3.36Å; Q1135-G1163 PolarHBondContact O-N 3.49Å
1136	L	75.1	Confident	61.6	Low	3 Å²	3	67.5 Å²	67.5	2%	0.016	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-4.1	177.9	-65.1	165.5	0	0	0	114	T1134 Y1249 L1252 V1256 I1306 A1310	T1134-L1136 PolarHBondContact O-N 2.8Å; L1136-Y1249 HydrophobicContact CD1-CD1 4.02Å; L1136-Y1249 HydrophobicContact CD1-CE1 4.44Å; L1136-L1252 HydrophobicContact CD1-CD2 3.53Å; L1136-L1252 HydrophobicContact CD1-CG 3.97Å; L1136-L1252 HydrophobicContact CD2-CG 4.37Å; L1136-V1256 HydrophobicContact CD2-CB 4.4Å; L1136-V1256 HydrophobicContact CD2-CG1 4.39Å; L1136-V1256 HydrophobicContact CD2-CG2 4Å; L1136-I1306 HydrophobicContact CB-CG2 4.3Å; L1136-I1306 VanDerWaalsContact O-CG2 3.24Å; L1136-I1306 WeakPolarHBondContact O-CG2 3.37Å; L1136-A1310 HydrophobicContact CB-CB 4.49Å; L1136-A1310 HydrophobicContact CD2-CB 4.17Å
1137	S	76.3	Confident	58.8	Low	31 Å²	31	76 Å²	76	22%	0.217	42%	0.421	C	S	.	.	S	Bend	trans	-83.4	157.1	177.9	73.8	0	0	0	0	112.6	T1134 Q1135 L1161 I1162	T1134-S1137 WeakPolarHBondContact O-CB 3.32Å; T1134-S1137 PolarHBondContact O-N 3.3Å; T1134-S1137 PolarHBondContact O-OG 3.44Å; Q1135-S1137 VanDerWaalsContact C-N 3.33Å; S1137-L1161 CarbonylContact O-C 3.46Å; S1137-L1161 WeakPolarHBondContact O-CA 3.43Å; S1137-I1162 PolarHBondContact O-N 3.31Å; S1137-I1162 VanDerWaalsContact OG-CD1 3.28Å; S1137-I1162 WeakPolarHBondContact OG-CD1 3.14Å
1138	V	68.9	Low	56.1	Low	35 Å²	35	81.8 Å²	81.8	21%	0.212	45%	0.446	C	S	.	.	B	Isolated β-bridge	trans	-82.5	131.3	176.9	173.5	0	0	0	0	110	M1140 R1159 L1161 Y1313	V1138-M1140 PolarHBondContact O-N 3.31Å; V1138-R1159 HydrophobicContact CG1-CB 4.11Å; V1138-R1159 HydrophobicContact CG2-CB 4.43Å; V1138-L1161 HydrophobicContact CG2-CD2 4.34Å; V1138-Y1313 HydrophobicContact CG2-CD2 4.17Å; V1138-Y1313 HydrophobicContact CG2-CE2 3.61Å
1139	N	64.7	Low	53.7	Low	40 Å²	40	83 Å²	83	21%	0.214	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-69.5	118.8	171.3	-175.5	13.3	0	0	0	110.9	V1141 S1160 I1162 R1165	N1139-V1141 WeakPolarHBondContact OD1-CG2 3.27Å; N1139-V1141 PolarHBondContact OD1-N 3.07Å; N1139-S1160 PolarHBondContact N-O 2.92Å; N1139-I1162 HydrophobicContact CB-CG1 4.39Å; N1139-R1165 PolarHBondContact ND2-NH2 3.41Å
1140	M	47.1	Very low	51.5	Low	141 Å²	141	85.1 Å²	85.1	70%	0.695	47%	0.469	S	S	*	.			trans	-100.5	5.3	-173.8	-75.1	-72.8	-147.9	0	0	114.5	V1138 N1142 R1159	V1138-M1140 PolarHBondContact O-N 3.31Å; M1140-N1142 PolarHBondContact O-N 2.93Å; M1140-R1159 PolarHBondContact SD-NH1 2.95Å; M1140-R1159 VanDerWaalsContact SD-NH1 3.44Å
1141	V	43.2	Very low	49.4	Very low	111 Å²	111	91.4 Å²	91.4	67%	0.673	50%	0.499	S	S	*	.			trans	-78.5	79.9	-170	-172.2	0	0	0	0	112.7	N1139 N1143	N1139-V1141 WeakPolarHBondContact OD1-CG2 3.27Å; N1139-V1141 PolarHBondContact OD1-N 3.07Å; V1141-N1143 VanDerWaalsContact C-N 3.32Å; V1141-N1143 PolarHBondContact O-N 3.04Å
1142	N	30.6	Very low	47.7	Very low	157 Å²	157	88.4 Å²	88.4	84%	0.84	48%	0.484	S	S	*	.			trans	-77.4	78.3	157.4	-79.7	-7.2	0	0	0	109.4	M1140	M1140-N1142 PolarHBondContact O-N 2.93Å
1143	N	27.1	Very low	46.5	Very low	121 Å²	121	89.4 Å²	89.4	65%	0.647	49%	0.488	S	S	*	.			trans	-160.5	117.1	165.2	-109.2	-29.2	0	0	0	115	V1141 S1145	V1141-N1143 VanDerWaalsContact C-N 3.32Å; V1141-N1143 PolarHBondContact O-N 3.04Å; N1143-S1145 PolarHBondContact O-N 3.28Å
1144	I	27.1	Very low	45.3	Very low	169 Å²	169	89 Å²	89	87%	0.867	49%	0.491	S	S	*	.			trans	16.4	84.1	144.9	-43.6	176.6	0	0	0	116.5
1145	S	26.2	Very low	44.3	Very low	112 Å²	112	87.2 Å²	87.2	78%	0.783	48%	0.478	S	S	*	.			trans	-162.3	145.9	148.9	45.5	0	0	0	0	110.3	N1143 E1147	N1143-S1145 PolarHBondContact O-N 3.28Å; S1145-E1147 PolarHBondContact O-N 3.06Å
1146	S	25.6	Very low	43.3	Very low	125 Å²	125	88.1 Å²	88.1	87%	0.874	48%	0.483	S	S	*	.			trans	-103.1	67.6	-160.5	47.7	0	0	0	0	114.6
1147	E	26.5	Very low	42.5	Very low	183 Å²	183	88.8 Å²	88.8	86%	0.855	49%	0.486	S	S	*	.			trans	-114.8	129.7	166.5	-67.7	-159	143.2	0	0	112.4	S1145 C1149	S1145-E1147 PolarHBondContact O-N 3.06Å; E1147-C1149 VanDerWaalsContact C-N 3.26Å; E1147-C1149 PolarHBondContact O-N 3.33Å
1148	K	28.2	Very low	42	Very low	128 Å²	128	91.9 Å²	91.9	56%	0.557	50%	0.501	S	S	*	.			trans	-79.8	67.1	-174.5	-62.1	-171.5	-175.4	-176	0	111.9	L1150 N1897 Y1898	K1148-L1150 HydrophobicContact CB-CD2 4.3Å; K1148-L1150 WeakPolarHBondContact O-CD2 3.49Å; K1148-L1150 WeakPolarHBondContact O-CG 3.47Å; K1148-L1150 PolarHBondContact O-N 3.17Å; K1148-L1150 VanDerWaalsContact O-N 3.15Å; K1148-N1897 PolarHBondContact NZ-OD1 2.81Å; K1148-Y1898 HydrophobicContact CD-CD2 3.94Å; K1148-Y1898 HydrophobicContact CD-CE2 3.54Å
1149	C	29.8	Very low	42	Very low	86 Å²	86	93.8 Å²	93.8	58%	0.581	50%	0.504	S	S	*	.			trans	-68.2	108	167	-164.2	0	0	0	0	108.6	E1147 Q1151	E1147-C1149 VanDerWaalsContact C-N 3.26Å; E1147-C1149 PolarHBondContact O-N 3.33Å; C1149-Q1151 PolarHBondContact O-N 3.37Å
1150	L	34.7	Very low	42.4	Very low	46 Å²	46	93.3 Å²	93.3	24%	0.241	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-73.8	116.4	-162.4	-58.4	171.9	0	0	0	111.1	K1148 F1168 Y1898 L1899	K1148-L1150 HydrophobicContact CB-CD2 4.3Å; K1148-L1150 WeakPolarHBondContact O-CD2 3.49Å; K1148-L1150 WeakPolarHBondContact O-CG 3.47Å; K1148-L1150 PolarHBondContact O-N 3.17Å; K1148-L1150 VanDerWaalsContact O-N 3.15Å; L1150-F1168 HydrophobicContact CB-CE2 4.25Å; L1150-F1168 HydrophobicContact CB-CZ 4.03Å; L1150-F1168 HydrophobicContact CD1-CZ 4.34Å; L1150-Y1898 HydrophobicContact CD1-CD1 4.11Å; L1150-Y1898 HydrophobicContact CD1-CE1 4.24Å; L1150-Y1898 HydrophobicContact CD2-CD1 3.39Å; L1150-Y1898 HydrophobicContact CD2-CD2 4.39Å; L1150-Y1898 HydrophobicContact CD2-CE1 3.87Å; L1150-Y1898 HydrophobicContact CD2-CG 3.67Å; L1150-Y1898 HydrophobicContact CG-CD1 4.41Å; L1150-L1899 HydrophobicContact CB-CD2 4.24Å; L1150-L1899 HydrophobicContact CD1-CD1 3.78Å
1151	Q	37.1	Very low	44	Very low	132 Å²	132	86.7 Å²	86.7	62%	0.617	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-60	142	-178.9	-69.6	176.7	-74.2	0	0	111.4	C1149 S1153	C1149-Q1151 PolarHBondContact O-N 3.37Å; Q1151-S1153 PolarHBondContact O-N 2.86Å
1152	F	43.7	Very low	45.5	Very low	13 Å²	13	84.2 Å²	84.2	6%	0.057	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-54.9	123.8	159.1	-87.6	-120.2	0	0	0	108.1	L1154 Q1155 D1164 F1168 V1171 T1260 Y1263 Q1264	F1152-L1154 PolarHBondContact O-N 3.09Å; F1152-Q1155 HydrophobicContact CB-CG 3.77Å; F1152-Q1155 PolarHBondContact O-N 3.42Å; F1152-D1164 HydrophobicContact CE2-CB 4.26Å; F1152-D1164 WeakPolarHBondContact CE2-O 3.5Å; F1152-F1168 HydrophobicContact CD2-CD2 4.4Å; F1152-F1168 HydrophobicContact CE2-CB 4.16Å; F1152-F1168 HydrophobicContact CE2-CD2 4.2Å; F1152-V1171 HydrophobicContact CE1-CG1 4.37Å; F1152-V1171 HydrophobicContact CZ-CG1 4.49Å; F1152-V1171 HydrophobicContact CZ-CG2 4.38Å; F1152-T1260 HydrophobicContact CE1-CG2 3.6Å; F1152-T1260 HydrophobicContact CZ-CG2 4.13Å; F1152-Y1263 HydrophobicContact CB-CE1 4.48Å; F1152-Y1263 HydrophobicContact CD1-CD1 4.32Å; F1152-Y1263 HydrophobicContact CD1-CE1 4.02Å; F1152-Q1264 HydrophobicContact CD1-CG 4.46Å; F1152-Q1264 HydrophobicContact CE1-CG 4.26Å
1153	S	43.7	Very low	47.7	Very low	45 Å²	45	76.8 Å²	76.8	32%	0.315	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	110.9	-177.1	45	0	0	0	0	111.3	Q1151 Y1263	Q1151-S1153 PolarHBondContact O-N 2.86Å; S1153-Y1263 PolarHBondContact O-OH 3.04Å
1154	L	47.4	Very low	50.3	Low	106 Å²	106	71.4 Å²	71.4	56%	0.555	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	50.1	-177.1	-59.1	128.6	0	0	0	116.6	F1152 I1156 Y1263	F1152-L1154 PolarHBondContact O-N 3.09Å; L1154-I1156 VanDerWaalsContact C-N 3.33Å; L1154-I1156 VanDerWaalsContact O-CD1 3.28Å; L1154-I1156 WeakPolarHBondContact O-CD1 3.26Å; L1154-I1156 PolarHBondContact O-N 2.65Å; L1154-Y1263 PolarHBondContact O-OH 3.23Å
1155	Q	50.8	Low	52.5	Low	26 Å²	26	70.5 Å²	70.5	12%	0.121	37%	0.371	C	S	.	.			trans	-72.3	84.3	160	-74.9	-159.6	-0.5	0	0	111.9	F1152 N1157 N1158 D1164 Y1263	F1152-Q1155 HydrophobicContact CB-CG 3.77Å; F1152-Q1155 PolarHBondContact O-N 3.42Å; Q1155-N1157 PolarHBondContact O-N 3.23Å; Q1155-N1157 VanDerWaalsContact O-N 3.16Å; Q1155-N1158 PolarHBondContact O-N 3.29Å; Q1155-D1164 PolarHBondContact NE2-OD2 3.45Å; Q1155-Y1263 PolarHBondContact N-OH 3.34Å
1156	I	56	Low	54.7	Low	41 Å²	41	66.2 Å²	66.2	21%	0.21	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-42	-179.8	-46.1	96.4	0	0	0	113	L1154 N1158 N1317 Y1320	L1154-I1156 VanDerWaalsContact C-N 3.33Å; L1154-I1156 VanDerWaalsContact O-CD1 3.28Å; L1154-I1156 WeakPolarHBondContact O-CD1 3.26Å; L1154-I1156 PolarHBondContact O-N 2.65Å; I1156-N1158 VanDerWaalsContact C-N 3.33Å; I1156-N1158 PolarHBondContact O-N 3.45Å; I1156-N1317 HydrophobicContact CD1-CB 4.41Å; I1156-Y1320 HydrophobicContact CD1-CD1 3.45Å; I1156-Y1320 VanDerWaalsContact CD1-CD1 3.45Å; I1156-Y1320 HydrophobicContact CD1-CD2 4.5Å; I1156-Y1320 HydrophobicContact CD1-CE1 4.13Å; I1156-Y1320 HydrophobicContact CD1-CG 3.65Å; I1156-Y1320 HydrophobicContact CG1-CD1 3.37Å; I1156-Y1320 HydrophobicContact CG1-CD2 4.15Å; I1156-Y1320 HydrophobicContact CG1-CE1 3.53Å; I1156-Y1320 HydrophobicContact CG1-CE2 4.32Å; I1156-Y1320 HydrophobicContact CG1-CG 3.69Å; I1156-Y1320 HydrophobicContact CG2-CE2 4.32Å
1157	N	59	Low	57.5	Low	16 Å²	16	60.3 Å²	60.3	9%	0.086	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-12.2	-169.8	-62.6	-19.4	0	0	0	114.2	Q1155 R1159 Y1313 N1317 M1421	Q1155-N1157 PolarHBondContact O-N 3.23Å; Q1155-N1157 VanDerWaalsContact O-N 3.16Å; N1157-R1159 HydrophobicContact CB-CB 4.37Å; N1157-R1159 WeakPolarHBondContact O-CG 3.41Å; N1157-R1159 PolarHBondContact O-N 3.41Å; N1157-Y1313 PolarHBondContact ND2-O 3.07Å; N1157-N1317 PolarHBondContact ND2-OD1 2.9Å; N1157-M1421 HydrophobicContact CB-SD 4.36Å
1158	N	64.3	Low	60.1	Low	96 Å²	96	54.1 Å²	54.1	51%	0.513	27%	0.27	S	S	.	.			trans	51.6	9.7	-167.8	-78.6	-23.7	0	0	0	115.9	Q1155 I1156	Q1155-N1158 PolarHBondContact O-N 3.29Å; I1156-N1158 VanDerWaalsContact C-N 3.33Å; I1156-N1158 PolarHBondContact O-N 3.45Å
1159	R	68.9	Low	62.6	Low	75 Å²	75	48 Å²	48	28%	0.283	24%	0.244	S	C	.	.			trans	-102.9	64.6	-178.1	-64.5	-77.6	-171.9	-171.3	9.8	110.7	V1138 M1140 N1157 Y1313 D1417 M1421	V1138-R1159 HydrophobicContact CG1-CB 4.11Å; V1138-R1159 HydrophobicContact CG2-CB 4.43Å; M1140-R1159 PolarHBondContact SD-NH1 2.95Å; M1140-R1159 VanDerWaalsContact SD-NH1 3.44Å; N1157-R1159 HydrophobicContact CB-CB 4.37Å; N1157-R1159 WeakPolarHBondContact O-CG 3.41Å; N1157-R1159 PolarHBondContact O-N 3.41Å; R1159-Y1313 HydrophobicContact CB-CD2 4.49Å; R1159-D1417 IonicContact NH2-OD2 3.97Å; R1159-D1417 PolarHBondContact NH2-OD2 2.76Å; R1159-M1421 HydrophobicContact CG-SD 3.96Å
1160	S	72.6	Confident	65.3	Low	31 Å²	31	44 Å²	44	22%	0.217	22%	0.216	C	C	.	.			trans	-60.9	137.4	176.6	61.9	0	0	0	0	111.6	N1139	N1139-S1160 PolarHBondContact N-O 2.92Å
1161	L	81.8	Confident	67.8	Low	2 Å²	2	42.1 Å²	42.1	1%	0.01	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-77.9	150.7	170	-53	-179.6	0	0	0	109.4	Y1130 S1137 V1138 G1163 D1164 V1256 A1310 Y1313 K1314	Y1130-L1161 HydrophobicContact CE1-CD1 4.32Å; S1137-L1161 CarbonylContact O-C 3.46Å; S1137-L1161 WeakPolarHBondContact O-CA 3.43Å; V1138-L1161 HydrophobicContact CG2-CD2 4.34Å; L1161-G1163 VanDerWaalsContact C-N 3.26Å; L1161-G1163 PolarHBondContact O-N 3.22Å; L1161-D1164 PolarHBondContact N-OD2 3.01Å; L1161-D1164 VanDerWaalsContact O-CB 3.24Å; L1161-D1164 WeakPolarHBondContact O-CB 3.27Å; L1161-D1164 PolarHBondContact O-N 2.84Å; L1161-V1256 HydrophobicContact CD1-CG1 3.85Å; L1161-A1310 HydrophobicContact CD1-CB 3.87Å; L1161-A1310 HydrophobicContact CD2-CB 4.11Å; L1161-Y1313 HydrophobicContact CD2-CD2 4.49Å; L1161-K1314 HydrophobicContact CD1-CG 4.47Å
1162	I	75	Confident	70.1	Confident	59 Å²	59	41.3 Å²	41.3	30%	0.303	20%	0.198	S	C	.	.	H	α-helix	trans	-59.3	-40.9	178	-63.2	-174.5	0	0	0	110.9	Q1135 S1137 N1139 D1164 R1165	Q1135-I1162 PolarHBondContact O-N 3.36Å; S1137-I1162 PolarHBondContact O-N 3.31Å; S1137-I1162 VanDerWaalsContact OG-CD1 3.28Å; S1137-I1162 WeakPolarHBondContact OG-CD1 3.14Å; N1139-I1162 HydrophobicContact CB-CG1 4.39Å; I1162-D1164 PolarHBondContact O-N 2.97Å; I1162-D1164 VanDerWaalsContact O-N 3.13Å; I1162-R1165 WeakPolarHBondContact O-CB 3.33Å; I1162-R1165 PolarHBondContact O-N 2.98Å; I1162-R1165 VanDerWaalsContact O-N 3.15Å
1163	G	77.2	Confident	72.1	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-16.4	176.4	0	0	0	0	0	115.2	C1129 Q1135 L1161 R1165 S1166 A1167	C1129-G1163 VanDerWaalsContact O-CA 3.3Å; C1129-G1163 WeakPolarHBondContact O-CA 3.29Å; Q1135-G1163 PolarHBondContact O-N 3.49Å; L1161-G1163 VanDerWaalsContact C-N 3.26Å; L1161-G1163 PolarHBondContact O-N 3.22Å; G1163-R1165 PolarHBondContact O-N 3.35Å; G1163-S1166 PolarHBondContact O-N 3.41Å; G1163-A1167 WeakPolarHBondContact O-CB 3.5Å; G1163-A1167 PolarHBondContact O-N 3.17Å
1164	D	79.9	Confident	74.3	Confident	8 Å²	8	39 Å²	39	4%	0.043	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-32.7	174.9	-66.7	1.1	0	0	0	111.3	Y1130 F1152 Q1155 L1161 I1162 A1167 F1168 K1314	Y1130-D1164 WeakPolarHBondContact CE1-OD1 3.45Å; Y1130-D1164 PolarHBondContact OH-OD1 3.37Å; Y1130-D1164 VanDerWaalsContact OH-OD1 3.05Å; F1152-D1164 HydrophobicContact CE2-CB 4.26Å; F1152-D1164 WeakPolarHBondContact CE2-O 3.5Å; Q1155-D1164 PolarHBondContact NE2-OD2 3.45Å; L1161-D1164 PolarHBondContact N-OD2 3.01Å; L1161-D1164 VanDerWaalsContact O-CB 3.24Å; L1161-D1164 WeakPolarHBondContact O-CB 3.27Å; L1161-D1164 PolarHBondContact O-N 2.84Å; I1162-D1164 PolarHBondContact O-N 2.97Å; I1162-D1164 VanDerWaalsContact O-N 3.13Å; D1164-A1167 PolarHBondContact O-N 3.5Å; D1164-F1168 PolarHBondContact O-N 3.22Å; D1164-F1168 VanDerWaalsContact O-N 3.15Å; D1164-K1314 WeakPolarHBondContact OD1-CE 3.35Å; D1164-K1314 IonicContact OD1-NZ 3.42Å; D1164-K1314 PolarHBondContact OD1-NZ 2.99Å; D1164-K1314 IonicContact OD2-NZ 3.74Å; D1164-K1314 PolarHBondContact OD2-NZ 2.96Å
1165	R	74.7	Confident	76.2	Confident	151 Å²	151	34.8 Å²	34.8	57%	0.57	16%	0.162	S	C	*	.	H	α-helix	trans	-64.2	-44.8	175.9	-69	178.3	162.8	-175.7	-7.3	111.1	N1139 I1162 G1163	N1139-R1165 PolarHBondContact ND2-NH2 3.41Å; I1162-R1165 WeakPolarHBondContact O-CB 3.33Å; I1162-R1165 PolarHBondContact O-N 2.98Å; I1162-R1165 VanDerWaalsContact O-N 3.15Å; G1163-R1165 PolarHBondContact O-N 3.35Å
1166	S	72.9	Confident	77.8	Confident	22 Å²	22	35.2 Å²	35.2	15%	0.154	16%	0.164	C	C	.	.	H	α-helix	trans	-70.7	-34.2	178.6	-47.8	0	0	0	0	112.4	C1129 G1163 S1169	C1129-S1166 PolarHBondContact SG-O 3.01Å; G1163-S1166 PolarHBondContact O-N 3.41Å; S1166-S1169 PolarHBondContact O-OG 3.08Å
1167	A	83	Confident	79.3	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-76.5	-23.8	-179.4	0	0	0	0	0	114	L1126 C1129 Y1130 G1163 D1164 S1169 V1170 V1171	L1126-A1167 HydrophobicContact CD1-CB 3.83Å; C1129-A1167 HydrophobicContact CB-CB 3.93Å; Y1130-A1167 HydrophobicContact CE2-CB 3.77Å; Y1130-A1167 WeakPolarHBondContact OH-CB 3.38Å; G1163-A1167 WeakPolarHBondContact O-CB 3.5Å; G1163-A1167 PolarHBondContact O-N 3.17Å; D1164-A1167 PolarHBondContact O-N 3.5Å; A1167-S1169 VanDerWaalsContact C-N 3.35Å; A1167-S1169 PolarHBondContact O-N 3.23Å; A1167-V1170 PolarHBondContact O-N 3.49Å; A1167-V1171 HydrophobicContact CB-CG2 4.44Å; A1167-V1171 VanDerWaalsContact O-CB 3.31Å; A1167-V1171 WeakPolarHBondContact O-CB 3.05Å; A1167-V1171 VanDerWaalsContact O-CG2 3.29Å; A1167-V1171 WeakPolarHBondContact O-CG2 3.38Å; A1167-V1171 PolarHBondContact O-N 3.18Å
1168	F	82.3	Confident	80.7	Confident	53 Å²	53	33 Å²	33	23%	0.232	15%	0.152	C	C	.	.	H	α-helix	trans	-53	-45.4	-172.5	174.3	-98.2	0	0	0	114	L1150 F1152 D1164 R1172 L1899	L1150-F1168 HydrophobicContact CB-CE2 4.25Å; L1150-F1168 HydrophobicContact CB-CZ 4.03Å; L1150-F1168 HydrophobicContact CD1-CZ 4.34Å; F1152-F1168 HydrophobicContact CD2-CD2 4.4Å; F1152-F1168 HydrophobicContact CE2-CB 4.16Å; F1152-F1168 HydrophobicContact CE2-CD2 4.2Å; D1164-F1168 PolarHBondContact O-N 3.22Å; D1164-F1168 VanDerWaalsContact O-N 3.15Å; F1168-R1172 VanDerWaalsContact O-CB 3.26Å; F1168-R1172 WeakPolarHBondContact O-CB 3.31Å; F1168-R1172 PolarHBondContact O-N 3.12Å; F1168-L1899 HydrophobicContact CE2-CD2 4.32Å; F1168-L1899 HydrophobicContact CZ-CD2 4.35Å
1169	S	80.9	Confident	81.6	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.007	15%	0.152	C	C	.	.	H	α-helix	trans	-64.8	-49.8	179.9	49.6	0	0	0	0	112.3	L900 I1095 S1166 A1167 R1172 C1173	L900-S1169 PolarHBondContact O-OG 3.03Å; I1095-S1169 VanDerWaalsContact CD1-CB 3.43Å; S1166-S1169 PolarHBondContact O-OG 3.08Å; A1167-S1169 VanDerWaalsContact C-N 3.35Å; A1167-S1169 PolarHBondContact O-N 3.23Å; S1169-R1172 PolarHBondContact O-N 3.32Å; S1169-C1173 PolarHBondContact O-N 3.05Å; S1169-C1173 PolarHBondContact O-SG 3.23Å; S1169-C1173 VanDerWaalsContact O-SG 3.41Å
1170	V	86.3	Confident	82.3	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.8	-46	179.1	-173.2	0	0	0	0	110.8	L900 L1122 T1125 L1126 A1167 R1172 C1173 L1174	L900-V1170 HydrophobicContact CB-CG2 3.89Å; L900-V1170 HydrophobicContact CD1-CG2 4.2Å; L1122-V1170 HydrophobicContact CB-CG1 4.24Å; L1122-V1170 HydrophobicContact CD2-CG1 4Å; L1122-V1170 WeakPolarHBondContact O-CG1 3.38Å; T1125-V1170 HydrophobicContact CG2-CG1 4.38Å; T1125-V1170 HydrophobicContact CG2-CG2 3.59Å; L1126-V1170 HydrophobicContact CB-CG1 3.93Å; A1167-V1170 PolarHBondContact O-N 3.49Å; V1170-R1172 VanDerWaalsContact C-N 3.35Å; V1170-R1172 PolarHBondContact O-N 3.41Å; V1170-C1173 PolarHBondContact O-N 3.32Å; V1170-L1174 HydrophobicContact CG1-CD1 4.38Å; V1170-L1174 WeakPolarHBondContact O-CG 3.48Å; V1170-L1174 PolarHBondContact O-N 3.34Å
1171	V	86.7	Confident	82.9	Confident	7 Å²	7	33.4 Å²	33.4	4%	0.042	15%	0.151	C	C	.	.	H	α-helix	trans	-59.2	-45.1	174.1	163.6	0	0	0	0	111	L1126 F1152 A1167 L1174 V1175 Q1264	L1126-V1171 HydrophobicContact CD1-CG2 3.77Å; F1152-V1171 HydrophobicContact CE1-CG1 4.37Å; F1152-V1171 HydrophobicContact CZ-CG1 4.49Å; F1152-V1171 HydrophobicContact CZ-CG2 4.38Å; A1167-V1171 HydrophobicContact CB-CG2 4.44Å; A1167-V1171 VanDerWaalsContact O-CB 3.31Å; A1167-V1171 WeakPolarHBondContact O-CB 3.05Å; A1167-V1171 VanDerWaalsContact O-CG2 3.29Å; A1167-V1171 WeakPolarHBondContact O-CG2 3.38Å; A1167-V1171 PolarHBondContact O-N 3.18Å; V1171-L1174 PolarHBondContact O-N 3.41Å; V1171-V1175 WeakPolarHBondContact O-CG2 3.38Å; V1171-V1175 PolarHBondContact O-N 3.1Å; V1171-Q1264 HydrophobicContact CG1-CB 4.39Å; V1171-Q1264 HydrophobicContact CG1-CG 3.67Å
1172	R	84.6	Confident	82.9	Confident	115 Å²	115	34.8 Å²	34.8	43%	0.434	17%	0.165	S	C	.	.	H	α-helix	trans	-66.7	-37.8	179.8	178.2	165.9	159.2	175.7	0.7	112.2	M1099 F1168 S1169 V1170 V1175 Q1176	M1099-R1172 HydrophobicContact CE-CB 3.73Å; M1099-R1172 HydrophobicContact CE-CG 3.52Å; F1168-R1172 VanDerWaalsContact O-CB 3.26Å; F1168-R1172 WeakPolarHBondContact O-CB 3.31Å; F1168-R1172 PolarHBondContact O-N 3.12Å; S1169-R1172 PolarHBondContact O-N 3.32Å; V1170-R1172 VanDerWaalsContact C-N 3.35Å; V1170-R1172 PolarHBondContact O-N 3.41Å; R1172-V1175 PolarHBondContact O-N 3.27Å; R1172-Q1176 WeakPolarHBondContact O-CG 3.3Å; R1172-Q1176 PolarHBondContact O-N 3.4Å
1173	C	85.9	Confident	83.3	Confident	6 Å²	6	34.2 Å²	34.2	4%	0.041	16%	0.164	C	C	.	.	H	α-helix	trans	-58.3	-50	168.9	-68.5	0	0	0	0	111.7	L1122 S1169 V1170 V1175 Q1176 L1177	L1122-C1173 HydrophobicContact CD1-CB 3.86Å; L1122-C1173 HydrophobicContact CD2-CB 4.05Å; S1169-C1173 PolarHBondContact O-N 3.05Å; S1169-C1173 PolarHBondContact O-SG 3.23Å; S1169-C1173 VanDerWaalsContact O-SG 3.41Å; V1170-C1173 PolarHBondContact O-N 3.32Å; C1173-V1175 PolarHBondContact O-N 3.2Å; C1173-Q1176 PolarHBondContact O-N 3.47Å; C1173-Q1176 VanDerWaalsContact O-N 3.13Å; C1173-L1177 WeakPolarHBondContact O-CG 3.49Å; C1173-L1177 PolarHBondContact O-N 2.8Å
1174	L	89.6	Confident	83.4	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-60.2	-34.6	179.2	-70.9	167.4	0	0	0	112.5	L1122 L1123 L1126 V1170 V1171 V1178 Y1190 L1261	L1122-L1174 HydrophobicContact CB-CD1 4.45Å; L1122-L1174 HydrophobicContact CB-CD2 3.76Å; L1122-L1174 HydrophobicContact CB-CG 4.07Å; L1122-L1174 HydrophobicContact CD1-CD2 3.95Å; L1122-L1174 HydrophobicContact CD1-CG 4.21Å; L1123-L1174 HydrophobicContact CD2-CD1 3.99Å; L1123-L1174 HydrophobicContact CD2-CD2 4.29Å; L1123-L1174 HydrophobicContact CG-CD2 4.46Å; L1126-L1174 HydrophobicContact CD2-CD1 4.13Å; V1170-L1174 HydrophobicContact CG1-CD1 4.38Å; V1170-L1174 WeakPolarHBondContact O-CG 3.48Å; V1170-L1174 PolarHBondContact O-N 3.34Å; V1171-L1174 PolarHBondContact O-N 3.41Å; L1174-V1178 WeakPolarHBondContact O-CG2 3.38Å; L1174-V1178 PolarHBondContact O-N 2.96Å; L1174-Y1190 HydrophobicContact CD2-CE1 3.99Å; L1174-Y1190 WeakPolarHBondContact CD2-OH 3.17Å; L1174-Y1190 PolarHBondContact O-OH 3.19Å; L1174-Y1190 VanDerWaalsContact O-OH 3.11Å; L1174-L1261 HydrophobicContact CD1-CD1 3.89Å
1175	V	86.9	Confident	83.7	Confident	19 Å²	19	36.2 Å²	36.2	12%	0.115	18%	0.178	C	C	.	.	H	α-helix	trans	-71.4	-40.4	173.7	166.2	0	0	0	0	112.3	V1171 R1172 C1173 L1177 V1178 Q1179 Q1264 Y1268	V1171-V1175 WeakPolarHBondContact O-CG2 3.38Å; V1171-V1175 PolarHBondContact O-N 3.1Å; R1172-V1175 PolarHBondContact O-N 3.27Å; C1173-V1175 PolarHBondContact O-N 3.2Å; V1175-L1177 VanDerWaalsContact C-N 3.26Å; V1175-L1177 PolarHBondContact O-N 3.38Å; V1175-V1178 WeakPolarHBondContact O-CA 3.48Å; V1175-V1178 WeakPolarHBondContact O-CB 3.29Å; V1175-V1178 PolarHBondContact O-N 3.09Å; V1175-Q1179 PolarHBondContact O-N 2.81Å; V1175-Q1179 VanDerWaalsContact O-N 3.12Å; V1175-Q1264 HydrophobicContact CG2-CB 4.48Å; V1175-Y1268 HydrophobicContact CG1-CE2 3.99Å; V1175-Y1268 VanDerWaalsContact CG1-OH 3.26Å; V1175-Y1268 WeakPolarHBondContact CG1-OH 3.43Å; V1175-Y1268 HydrophobicContact CG2-CE2 4.36Å
1176	Q	85.6	Confident	84.2	Confident	35 Å²	35	29 Å²	29	16%	0.164	15%	0.151	C	C	.	.	H	α-helix	trans	-60.6	-36.9	173.3	-76.5	173.1	-119.8	0	0	111.4	D1103 R1172 C1173 V1178 Q1179 I1180	D1103-Q1176 WeakPolarHBondContact OD1-CB 3.23Å; D1103-Q1176 PolarHBondContact OD1-NE2 3.38Å; R1172-Q1176 WeakPolarHBondContact O-CG 3.3Å; R1172-Q1176 PolarHBondContact O-N 3.4Å; C1173-Q1176 PolarHBondContact O-N 3.47Å; C1173-Q1176 VanDerWaalsContact O-N 3.13Å; Q1176-V1178 VanDerWaalsContact C-N 3.29Å; Q1176-V1178 PolarHBondContact O-N 3.48Å; Q1176-Q1179 WeakPolarHBondContact O-CA 3.32Å; Q1176-Q1179 WeakPolarHBondContact O-CB 3.34Å; Q1176-Q1179 PolarHBondContact O-N 3.24Å; Q1176-I1180 WeakPolarHBondContact O-CG1 3.47Å; Q1176-I1180 PolarHBondContact O-N 3.06Å
1177	L	87.9	Confident	84.7	Confident	5 Å²	5	30.5 Å²	30.5	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-62.9	-31	171.7	-61.8	-177.6	0	0	0	113.4	A1106 T1114 I1118 V1119 L1122 C1173 V1175 Q1179 I1180 Y1181	A1106-L1177 HydrophobicContact CB-CD2 3.37Å; T1114-L1177 HydrophobicContact CG2-CD1 4Å; T1114-L1177 HydrophobicContact CG2-CD2 3.82Å; I1118-L1177 HydrophobicContact CG2-CD1 4.28Å; V1119-L1177 HydrophobicContact CG2-CD1 3.62Å; L1122-L1177 HydrophobicContact CD1-CD1 4.13Å; C1173-L1177 WeakPolarHBondContact O-CG 3.49Å; C1173-L1177 PolarHBondContact O-N 2.8Å; V1175-L1177 VanDerWaalsContact C-N 3.26Å; V1175-L1177 PolarHBondContact O-N 3.38Å; L1177-Q1179 VanDerWaalsContact C-N 3.33Å; L1177-I1180 HydrophobicContact CD2-CD1 4.44Å; L1177-Y1181 HydrophobicContact CD2-CE2 4.39Å; L1177-Y1181 WeakPolarHBondContact O-CB 3.42Å; L1177-Y1181 WeakPolarHBondContact O-CD2 3.24Å; L1177-Y1181 PolarHBondContact O-N 3.14Å
1178	V	87.2	Confident	84.7	Confident	5 Å²	5	35.9 Å²	35.9	3%	0.03	19%	0.186	C	C	.	.	H	α-helix	trans	-70.3	-31.5	171	-172.9	0	0	0	0	111.6	L1174 V1175 Q1176 G1182 I1185 V1186 Y1190 Y1268	L1174-V1178 WeakPolarHBondContact O-CG2 3.38Å; L1174-V1178 PolarHBondContact O-N 2.96Å; V1175-V1178 WeakPolarHBondContact O-CA 3.48Å; V1175-V1178 WeakPolarHBondContact O-CB 3.29Å; V1175-V1178 PolarHBondContact O-N 3.09Å; Q1176-V1178 VanDerWaalsContact C-N 3.29Å; Q1176-V1178 PolarHBondContact O-N 3.48Å; V1178-G1182 CarbonylContact O-C 3.53Å; V1178-G1182 WeakPolarHBondContact O-CA 3.33Å; V1178-G1182 PolarHBondContact O-N 3.2Å; V1178-I1185 HydrophobicContact CB-CG2 4.4Å; V1178-I1185 HydrophobicContact CG2-CG2 3.98Å; V1178-V1186 HydrophobicContact CB-CG2 4.41Å; V1178-V1186 HydrophobicContact CG1-CG2 3.75Å; V1178-V1186 HydrophobicContact CG2-CG2 3.67Å; V1178-Y1190 HydrophobicContact CG2-CD2 4.3Å; V1178-Y1190 HydrophobicContact CG2-CE2 3.66Å; V1178-Y1268 HydrophobicContact CG1-CD1 3.85Å; V1178-Y1268 HydrophobicContact CG1-CD2 4.49Å; V1178-Y1268 HydrophobicContact CG1-CG 3.75Å
1179	Q	83.3	Confident	84.9	Confident	107 Å²	107	35 Å²	35	50%	0.5	18%	0.184	S	C	.	.	H	α-helix	trans	-73.8	-35.8	177.4	-65.4	172.2	7.6	0	0	111.6	V1175 Q1176 L1177 Y1268	V1175-Q1179 PolarHBondContact O-N 2.81Å; V1175-Q1179 VanDerWaalsContact O-N 3.12Å; Q1176-Q1179 WeakPolarHBondContact O-CA 3.32Å; Q1176-Q1179 WeakPolarHBondContact O-CB 3.34Å; Q1176-Q1179 PolarHBondContact O-N 3.24Å; L1177-Q1179 VanDerWaalsContact C-N 3.33Å; Q1179-Y1268 HydrophobicContact CG-CE1 4.43Å; Q1179-Y1268 PolarHBondContact NE2-OH 3.09Å
1180	I	83.8	Confident	85.3	Confident	56 Å²	56	35 Å²	35	29%	0.287	18%	0.184	S	C	.	.	H	α-helix	trans	-73.1	-48	174.6	-64.6	163.9	0	0	0	111.8	A1106 R1107 Q1176 L1177	A1106-I1180 HydrophobicContact CB-CD1 4.49Å; R1107-I1180 HydrophobicContact CG-CD1 3.77Å; R1107-I1180 HydrophobicContact CG-CG1 4.25Å; Q1176-I1180 WeakPolarHBondContact O-CG1 3.47Å; Q1176-I1180 PolarHBondContact O-N 3.06Å; L1177-I1180 HydrophobicContact CD2-CD1 4.44Å
1181	Y	84.9	Confident	85.4	Confident	48 Å²	48	35.3 Å²	35.3	19%	0.188	19%	0.186	C	C	.	.	H	α-helix	trans	-101.5	-2	-170.3	-67	-66.3	0	0	0	115.2	A1106 G1110 P1111 T1114 L1177 I1185	A1106-Y1181 PolarHBondContact O-OH 3.28Å; G1110-Y1181 WeakPolarHBondContact CA-OH 3.29Å; G1110-Y1181 PolarHBondContact O-OH 3.15Å; P1111-Y1181 HydrophobicContact CB-CD1 3.74Å; P1111-Y1181 HydrophobicContact CB-CE1 3.56Å; P1111-Y1181 HydrophobicContact CB-CG 4.49Å; P1111-Y1181 HydrophobicContact CG-CD1 4.41Å; P1111-Y1181 HydrophobicContact CG-CE1 4.04Å; T1114-Y1181 HydrophobicContact CG2-CE2 3.93Å; T1114-Y1181 PolarHBondContact OG1-OH 3.45Å; L1177-Y1181 HydrophobicContact CD2-CE2 4.39Å; L1177-Y1181 WeakPolarHBondContact O-CB 3.42Å; L1177-Y1181 WeakPolarHBondContact O-CD2 3.24Å; L1177-Y1181 PolarHBondContact O-N 3.14Å; Y1181-I1185 HydrophobicContact CD2-CD1 4.17Å; Y1181-I1185 HydrophobicContact CG-CD1 4.44Å
1182	G	81.8	Confident	85.4	Confident	30 Å²	30	37.9 Å²	37.9	31%	0.309	20%	0.203	S	C	.	.			trans	70.3	-172.3	-179	0	0	0	0	0	114.1	V1178 S1184 I1185	V1178-G1182 CarbonylContact O-C 3.53Å; V1178-G1182 WeakPolarHBondContact O-CA 3.33Å; V1178-G1182 PolarHBondContact O-N 3.2Å; G1182-S1184 PolarHBondContact O-N 3.13Å; G1182-I1185 PolarHBondContact O-N 2.9Å
1183	V	83.4	Confident	85.5	Confident	47 Å²	47	35 Å²	35	29%	0.285	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-19.3	-171.4	-164.8	0	0	0	0	113.2	I1185 V1186 I1187 Y1268	V1183-I1185 VanDerWaalsContact C-N 3.27Å; V1183-I1185 PolarHBondContact O-N 3.18Å; V1183-V1186 HydrophobicContact CG1-CB 4.32Å; V1183-V1186 HydrophobicContact CG1-CG1 4.46Å; V1183-V1186 WeakPolarHBondContact O-CA 3.3Å; V1183-V1186 VanDerWaalsContact O-CB 3.27Å; V1183-V1186 WeakPolarHBondContact O-CB 3.36Å; V1183-V1186 PolarHBondContact O-N 3.33Å; V1183-I1187 HydrophobicContact CG1-CD1 3.9Å; V1183-I1187 HydrophobicContact CG1-CG1 4.21Å; V1183-I1187 PolarHBondContact O-N 2.79Å; V1183-I1187 VanDerWaalsContact O-N 3.12Å; V1183-Y1268 WeakPolarHBondContact CG1-O 3.22Å; V1183-Y1268 VanDerWaalsContact CG2-O 3.27Å; V1183-Y1268 WeakPolarHBondContact CG2-O 3.38Å
1184	S	79.9	Confident	85.6	Confident	44 Å²	44	34.8 Å²	34.8	31%	0.308	19%	0.191	S	C	.	.	H	α-helix	trans	-58.1	-37.5	177.2	-59.5	0	0	0	0	112.6	G1182 V1186 I1187 D1188	G1182-S1184 PolarHBondContact O-N 3.13Å; S1184-V1186 PolarHBondContact O-N 3.49Å; S1184-I1187 PolarHBondContact O-N 2.68Å; S1184-D1188 VanDerWaalsContact O-CB 3.29Å; S1184-D1188 WeakPolarHBondContact O-CB 3.28Å; S1184-D1188 PolarHBondContact O-N 3.34Å
1185	I	86.2	Confident	85.4	Confident	6 Å²	6	36.6 Å²	36.6	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-67	-26.9	177.1	-149.9	169.6	0	0	0	112.6	I1115 V1178 Y1181 G1182 V1183 V1189 Y1190	I1115-I1185 HydrophobicContact CD1-CD1 4.45Å; I1115-I1185 HydrophobicContact CD1-CG1 4.44Å; I1115-I1185 HydrophobicContact CG1-CD1 4.06Å; I1115-I1185 HydrophobicContact CG1-CG1 4.37Å; V1178-I1185 HydrophobicContact CB-CG2 4.4Å; V1178-I1185 HydrophobicContact CG2-CG2 3.98Å; Y1181-I1185 HydrophobicContact CD2-CD1 4.17Å; Y1181-I1185 HydrophobicContact CG-CD1 4.44Å; G1182-I1185 PolarHBondContact O-N 2.9Å; V1183-I1185 VanDerWaalsContact C-N 3.27Å; V1183-I1185 PolarHBondContact O-N 3.18Å; I1185-V1189 HydrophobicContact CG1-CB 4.3Å; I1185-V1189 HydrophobicContact CG1-CG2 4.05Å; I1185-V1189 WeakPolarHBondContact O-CB 3.31Å; I1185-V1189 PolarHBondContact O-N 3.2Å; I1185-Y1190 HydrophobicContact CG2-CE2 4.06Å; I1185-Y1190 PolarHBondContact O-N 3.08Å; I1185-Y1190 VanDerWaalsContact O-N 3.1Å
1186	V	85.2	Confident	85.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.216	C	C	.	.	I	π-helix	trans	-69.1	-47.8	172.6	157.7	0	0	0	0	111.2	V1178 V1183 S1184 Y1190 L1191 I1265 I1269	V1178-V1186 HydrophobicContact CB-CG2 4.41Å; V1178-V1186 HydrophobicContact CG1-CG2 3.75Å; V1178-V1186 HydrophobicContact CG2-CG2 3.67Å; V1183-V1186 HydrophobicContact CG1-CB 4.32Å; V1183-V1186 HydrophobicContact CG1-CG1 4.46Å; V1183-V1186 WeakPolarHBondContact O-CA 3.3Å; V1183-V1186 VanDerWaalsContact O-CB 3.27Å; V1183-V1186 WeakPolarHBondContact O-CB 3.36Å; V1183-V1186 PolarHBondContact O-N 3.33Å; S1184-V1186 PolarHBondContact O-N 3.49Å; V1186-Y1190 HydrophobicContact CG2-CD2 4.04Å; V1186-Y1190 PolarHBondContact O-N 2.94Å; V1186-L1191 WeakPolarHBondContact O-CB 3.01Å; V1186-L1191 PolarHBondContact O-N 2.75Å; V1186-I1265 HydrophobicContact CB-CG2 4.16Å; V1186-I1265 HydrophobicContact CG1-CG2 3.36Å; V1186-I1265 HydrophobicContact CG2-CG1 4.48Å; V1186-I1265 HydrophobicContact CG2-CG2 3.87Å; V1186-I1269 HydrophobicContact CG1-CD1 4.2Å; V1186-I1269 HydrophobicContact CG1-CG1 3.72Å
1187	I	83.6	Confident	85.1	Confident	54 Å²	54	39.6 Å²	39.6	28%	0.277	21%	0.212	S	C	.	.	I	π-helix	trans	-78.4	-43.3	-172.7	-62.3	167.5	0	0	0	111.4	V1183 S1184 P1192 E1273	V1183-I1187 HydrophobicContact CG1-CD1 3.9Å; V1183-I1187 HydrophobicContact CG1-CG1 4.21Å; V1183-I1187 PolarHBondContact O-N 2.79Å; V1183-I1187 VanDerWaalsContact O-N 3.12Å; S1184-I1187 PolarHBondContact O-N 2.68Å; I1187-P1192 WeakPolarHBondContact O-CD 3.37Å; I1187-P1192 WeakPolarHBondContact O-CG 3.26Å; I1187-E1273 VanDerWaalsContact CD1-OE2 3.23Å; I1187-E1273 WeakPolarHBondContact CD1-OE2 3.49Å
1188	D	82.5	Confident	84.9	Confident	113 Å²	113	39.4 Å²	39.4	60%	0.604	21%	0.211	S	C	*	.	I	π-helix	trans	-89.4	-21	-171.2	-59.3	-44.3	0	0	0	113.4	S1184	S1184-D1188 VanDerWaalsContact O-CB 3.29Å; S1184-D1188 WeakPolarHBondContact O-CB 3.28Å; S1184-D1188 PolarHBondContact O-N 3.34Å
1189	V	86.8	Confident	84.7	Confident	34 Å²	34	41 Å²	41	21%	0.206	22%	0.221	C	C	.	.	I	π-helix	trans	-122.6	-55.7	-175.1	-170.1	0	0	0	0	112.6	I1115 V1119 I1185 Y1193	I1115-V1189 HydrophobicContact CD1-CG2 3.85Å; I1115-V1189 HydrophobicContact CG1-CG2 4.21Å; I1115-V1189 HydrophobicContact CG2-CG1 4.16Å; I1115-V1189 HydrophobicContact CG2-CG2 4.36Å; V1119-V1189 HydrophobicContact CG1-CG1 4.38Å; I1185-V1189 HydrophobicContact CG1-CB 4.3Å; I1185-V1189 HydrophobicContact CG1-CG2 4.05Å; I1185-V1189 WeakPolarHBondContact O-CB 3.31Å; I1185-V1189 PolarHBondContact O-N 3.2Å; V1189-Y1193 WeakPolarHBondContact O-CB 3.48Å; V1189-Y1193 PolarHBondContact O-N 3.23Å
1190	Y	90	Very high	84.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.208	C	C	.	.	I	π-helix	trans	-75.6	-46.2	-171.3	-60.5	-28.3	0	0	0	113.6	V1119 L1174 V1178 I1185 V1186 Y1193 V1194 I1265	V1119-Y1190 HydrophobicContact CG1-CD1 4.47Å; V1119-Y1190 HydrophobicContact CG1-CE1 3.78Å; V1119-Y1190 HydrophobicContact CG2-CE1 4.36Å; L1174-Y1190 HydrophobicContact CD2-CE1 3.99Å; L1174-Y1190 WeakPolarHBondContact CD2-OH 3.17Å; L1174-Y1190 PolarHBondContact O-OH 3.19Å; L1174-Y1190 VanDerWaalsContact O-OH 3.11Å; V1178-Y1190 HydrophobicContact CG2-CD2 4.3Å; V1178-Y1190 HydrophobicContact CG2-CE2 3.66Å; I1185-Y1190 HydrophobicContact CG2-CE2 4.06Å; I1185-Y1190 PolarHBondContact O-N 3.08Å; I1185-Y1190 VanDerWaalsContact O-N 3.1Å; V1186-Y1190 HydrophobicContact CG2-CD2 4.04Å; V1186-Y1190 PolarHBondContact O-N 2.94Å; Y1190-Y1193 WeakPolarHBondContact O-CB 3.46Å; Y1190-Y1193 PolarHBondContact O-N 2.81Å; Y1190-V1194 WeakPolarHBondContact O-CG2 3.3Å; Y1190-V1194 PolarHBondContact O-N 2.86Å; Y1190-I1265 VanDerWaalsContact CB-CD1 3.44Å; Y1190-I1265 HydrophobicContact CD2-CD1 3.39Å; Y1190-I1265 HydrophobicContact CD2-CG1 4.22Å; Y1190-I1265 HydrophobicContact CE2-CD1 4.3Å; Y1190-I1265 HydrophobicContact CG-CD1 3.71Å
1191	L	87.7	Confident	84.4	Confident	8 Å²	8	35 Å²	35	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-63.5	-41.5	179	-165.5	76.3	0	0	0	112.6	V1186 Y1193 V1194 I1195 L1262 L1277 I1282 I1286	V1186-L1191 WeakPolarHBondContact O-CB 3.01Å; V1186-L1191 PolarHBondContact O-N 2.75Å; L1191-Y1193 VanDerWaalsContact C-N 3.33Å; L1191-Y1193 PolarHBondContact O-N 3.48Å; L1191-V1194 WeakPolarHBondContact O-CB 3.31Å; L1191-V1194 PolarHBondContact O-N 3.11Å; L1191-I1195 HydrophobicContact CG-CD1 4.16Å; L1191-I1195 WeakPolarHBondContact O-CG1 3.44Å; L1191-I1195 PolarHBondContact O-N 3.03Å; L1191-L1262 HydrophobicContact CD1-CD1 4.05Å; L1191-L1277 HydrophobicContact CD2-CD1 3.98Å; L1191-L1277 HydrophobicContact CD2-CD2 3.88Å; L1191-L1277 HydrophobicContact CD2-CG 4.48Å; L1191-I1282 HydrophobicContact CD1-CD1 4.41Å; L1191-I1282 HydrophobicContact CD1-CG1 4.3Å; L1191-I1286 HydrophobicContact CD1-CD1 4.29Å
1192	P	85.9	Confident	83.9	Confident	61 Å²	61	34 Å²	34	40%	0.396	19%	0.193	S	C	.	.	H	α-helix	trans	-63.6	-35.1	173.2	-25.5	37.3	0	0	0	113.2	I1187 I1195 K1196	I1187-P1192 WeakPolarHBondContact O-CD 3.37Å; I1187-P1192 WeakPolarHBondContact O-CG 3.26Å; P1192-I1195 PolarHBondContact O-N 3.38Å; P1192-K1196 WeakPolarHBondContact O-CB 3.39Å; P1192-K1196 PolarHBondContact O-N 3.12Å
1193	Y	87.5	Confident	83.5	Confident	55 Å²	55	37.6 Å²	37.6	22%	0.216	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-44.9	173.4	178	-91.2	0	0	0	111.8	L1123 V1189 Y1190 L1191 I1195 K1196 T1197 V1258 L1261	L1123-Y1193 HydrophobicContact CB-CE1 4.37Å; L1123-Y1193 HydrophobicContact CB-CE2 4.43Å; L1123-Y1193 HydrophobicContact CD1-CD1 4.17Å; L1123-Y1193 HydrophobicContact CD1-CD2 4.02Å; L1123-Y1193 HydrophobicContact CD1-CE1 4.3Å; L1123-Y1193 HydrophobicContact CD1-CE2 4.12Å; L1123-Y1193 HydrophobicContact CD1-CG 4.04Å; L1123-Y1193 HydrophobicContact CD2-CD1 4.37Å; L1123-Y1193 HydrophobicContact CD2-CE1 4.24Å; V1189-Y1193 WeakPolarHBondContact O-CB 3.48Å; V1189-Y1193 PolarHBondContact O-N 3.23Å; Y1190-Y1193 WeakPolarHBondContact O-CB 3.46Å; Y1190-Y1193 PolarHBondContact O-N 2.81Å; L1191-Y1193 VanDerWaalsContact C-N 3.33Å; L1191-Y1193 PolarHBondContact O-N 3.48Å; Y1193-I1195 PolarHBondContact O-N 3.46Å; Y1193-K1196 PolarHBondContact O-N 3.22Å; Y1193-T1197 HydrophobicContact CD1-CG2 4.3Å; Y1193-T1197 HydrophobicContact CD2-CG2 4.38Å; Y1193-T1197 HydrophobicContact CE1-CG2 3.92Å; Y1193-T1197 HydrophobicContact CE2-CG2 4.04Å; Y1193-T1197 WeakPolarHBondContact O-CB 3.48Å; Y1193-T1197 WeakPolarHBondContact O-CG2 3.32Å; Y1193-T1197 PolarHBondContact O-N 3.47Å; Y1193-T1197 PolarHBondContact O-OG1 2.78Å; Y1193-V1258 HydrophobicContact CE1-CG2 4.15Å; Y1193-L1261 HydrophobicContact CD1-CD2 4.47Å
1194	V	87.2	Confident	82.8	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-57.7	-48	175.3	167.9	0	0	0	0	111.1	Y1190 L1191 T1197 I1198 V1258 L1261 I1286	Y1190-V1194 WeakPolarHBondContact O-CG2 3.3Å; Y1190-V1194 PolarHBondContact O-N 2.86Å; L1191-V1194 WeakPolarHBondContact O-CB 3.31Å; L1191-V1194 PolarHBondContact O-N 3.11Å; V1194-T1197 PolarHBondContact O-OG1 2.81Å; V1194-I1198 HydrophobicContact CG1-CD1 4.2Å; V1194-I1198 WeakPolarHBondContact O-CG1 3.44Å; V1194-I1198 PolarHBondContact O-N 2.9Å; V1194-V1258 HydrophobicContact CB-CG1 4.06Å; V1194-V1258 HydrophobicContact CG1-CG1 3.7Å; V1194-V1258 HydrophobicContact CG2-CG1 4.07Å; V1194-L1261 HydrophobicContact CG2-CD2 4.31Å; V1194-I1286 HydrophobicContact CG1-CD1 3.55Å; V1194-I1286 HydrophobicContact CG1-CG1 4.05Å; V1194-I1286 HydrophobicContact CG1-CG2 4.35Å
1195	I	85.8	Confident	81.9	Confident	40 Å²	40	38.1 Å²	38.1	21%	0.205	20%	0.203	C	C	.	.	H	α-helix	trans	-68.8	-43.5	-179	-65.4	166.3	0	0	0	111.7	L1191 P1192 Y1193 T1199 D1285 I1286	L1191-I1195 HydrophobicContact CG-CD1 4.16Å; L1191-I1195 WeakPolarHBondContact O-CG1 3.44Å; L1191-I1195 PolarHBondContact O-N 3.03Å; P1192-I1195 PolarHBondContact O-N 3.38Å; Y1193-I1195 PolarHBondContact O-N 3.46Å; I1195-T1199 VanDerWaalsContact O-CB 3.29Å; I1195-T1199 WeakPolarHBondContact O-CB 3.37Å; I1195-T1199 PolarHBondContact O-N 3.42Å; I1195-T1199 PolarHBondContact O-OG1 2.92Å; I1195-D1285 HydrophobicContact CG2-CB 4.23Å; I1195-I1286 HydrophobicContact CG1-CD1 4.08Å; I1195-I1286 HydrophobicContact CG1-CG1 4.08Å
1196	K	84	Confident	80.2	Confident	105 Å²	105	41.5 Å²	41.5	46%	0.457	22%	0.221	S	C	.	.	H	α-helix	trans	-63.3	-41.1	178.7	-176.2	175.6	175.8	-179.3	0	111.8	L954 P1192 Y1193 S1200	L954-K1196 PolarHBondContact O-NZ 3.38Å; P1192-K1196 WeakPolarHBondContact O-CB 3.39Å; P1192-K1196 PolarHBondContact O-N 3.12Å; Y1193-K1196 PolarHBondContact O-N 3.22Å; K1196-S1200 VanDerWaalsContact O-CB 3.23Å; K1196-S1200 WeakPolarHBondContact O-CB 3.45Å; K1196-S1200 PolarHBondContact O-N 2.76Å
1197	T	83.4	Confident	77.9	Confident	13 Å²	13	45.3 Å²	45.3	8%	0.08	25%	0.246	C	C	.	.	H	α-helix	trans	-69.9	-46.8	179.9	47.7	0	0	0	0	112.7	Y1193 V1194 T1199 S1200 I1201 V1258	Y1193-T1197 HydrophobicContact CD1-CG2 4.3Å; Y1193-T1197 HydrophobicContact CD2-CG2 4.38Å; Y1193-T1197 HydrophobicContact CE1-CG2 3.92Å; Y1193-T1197 HydrophobicContact CE2-CG2 4.04Å; Y1193-T1197 WeakPolarHBondContact O-CB 3.48Å; Y1193-T1197 WeakPolarHBondContact O-CG2 3.32Å; Y1193-T1197 PolarHBondContact O-N 3.47Å; Y1193-T1197 PolarHBondContact O-OG1 2.78Å; V1194-T1197 PolarHBondContact O-OG1 2.81Å; T1197-T1199 PolarHBondContact O-N 2.79Å; T1197-S1200 PolarHBondContact O-N 2.85Å; T1197-I1201 VanDerWaalsContact O-CG1 3.3Å; T1197-I1201 WeakPolarHBondContact O-CG1 3.46Å; T1197-I1201 PolarHBondContact O-N 3.27Å; T1197-V1258 WeakPolarHBondContact OG1-CG2 3.3Å
1198	I	83.5	Confident	75.3	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-44.6	176.5	-68.3	173.9	0	0	0	111	V1194 S1200 I1201 I1202 L1255 V1258 I1286 K1289	V1194-I1198 HydrophobicContact CG1-CD1 4.2Å; V1194-I1198 WeakPolarHBondContact O-CG1 3.44Å; V1194-I1198 PolarHBondContact O-N 2.9Å; I1198-S1200 PolarHBondContact O-N 3.43Å; I1198-I1201 PolarHBondContact O-N 2.96Å; I1198-I1202 HydrophobicContact CG2-CD1 3.86Å; I1198-I1202 WeakPolarHBondContact O-CG1 3.47Å; I1198-I1202 PolarHBondContact O-N 2.94Å; I1198-I1202 VanDerWaalsContact O-N 3.09Å; I1198-L1255 HydrophobicContact CD1-CD1 4.41Å; I1198-L1255 HydrophobicContact CG1-CD1 3.91Å; I1198-V1258 HydrophobicContact CD1-CG1 3.91Å; I1198-V1258 HydrophobicContact CG1-CG1 3.94Å; I1198-I1286 HydrophobicContact CD1-CB 4.06Å; I1198-I1286 HydrophobicContact CD1-CG1 4.26Å; I1198-I1286 HydrophobicContact CD1-CG2 3.41Å; I1198-I1286 VanDerWaalsContact CD1-CG2 3.41Å; I1198-K1289 HydrophobicContact CG2-CB 4.26Å
1199	T	82.1	Confident	72.7	Confident	38 Å²	38	51.3 Å²	51.3	23%	0.233	28%	0.282	C	S	.	.	H	α-helix	trans	-65.9	-39.3	179.6	-57	0	0	0	0	111.9	I1195 T1197 I1202 N1203	I1195-T1199 VanDerWaalsContact O-CB 3.29Å; I1195-T1199 WeakPolarHBondContact O-CB 3.37Å; I1195-T1199 PolarHBondContact O-N 3.42Å; I1195-T1199 PolarHBondContact O-OG1 2.92Å; T1197-T1199 PolarHBondContact O-N 2.79Å; T1199-I1202 PolarHBondContact O-N 2.84Å; T1199-N1203 WeakPolarHBondContact O-CB 3.37Å; T1199-N1203 PolarHBondContact O-N 2.76Å; T1199-N1203 PolarHBondContact O-OD1 3.42Å
1200	S	81.7	Confident	69.7	Low	33 Å²	33	54.8 Å²	54.8	23%	0.231	31%	0.308	C	S	.	.	H	α-helix	trans	-61.6	-45.5	173.6	171.7	0	0	0	0	112.4	K1196 T1197 I1198 I1202 N1203 N1204	K1196-S1200 VanDerWaalsContact O-CB 3.23Å; K1196-S1200 WeakPolarHBondContact O-CB 3.45Å; K1196-S1200 PolarHBondContact O-N 2.76Å; T1197-S1200 PolarHBondContact O-N 2.85Å; I1198-S1200 PolarHBondContact O-N 3.43Å; S1200-I1202 VanDerWaalsContact C-N 3.32Å; S1200-I1202 PolarHBondContact O-N 3.03Å; S1200-N1203 PolarHBondContact O-N 3.18Å; S1200-N1204 VanDerWaalsContact O-CG 3.28Å; S1200-N1204 PolarHBondContact O-N 2.85Å; S1200-N1204 VanDerWaalsContact O-N 3.16Å; S1200-N1204 PolarHBondContact O-OD1 3.44Å
1201	I	79.9	Confident	66.5	Low	5 Å²	5	63.5 Å²	63.5	3%	0.026	35%	0.349	C	S	.	.	H	α-helix	trans	-60	-42.9	178.2	-68.9	165.5	0	0	0	110.9	T1197 I1198 N1204 L1205 F1247 Y1251 R1254 L1255 M1293	T1197-I1201 VanDerWaalsContact O-CG1 3.3Å; T1197-I1201 WeakPolarHBondContact O-CG1 3.46Å; T1197-I1201 PolarHBondContact O-N 3.27Å; I1198-I1201 PolarHBondContact O-N 2.96Å; I1201-N1204 PolarHBondContact O-N 3.02Å; I1201-L1205 HydrophobicContact CG2-CD1 4.04Å; I1201-L1205 WeakPolarHBondContact O-CD1 3.25Å; I1201-L1205 VanDerWaalsContact O-CG 3.29Å; I1201-L1205 WeakPolarHBondContact O-CG 3.3Å; I1201-F1247 HydrophobicContact CG2-CE2 3.91Å; I1201-Y1251 HydrophobicContact CG1-CD1 4.02Å; I1201-R1254 HydrophobicContact CD1-CB 4.11Å; I1201-L1255 HydrophobicContact CD1-CB 4.25Å; I1201-M1293 HydrophobicContact CG2-CE 4.08Å; I1201-M1293 HydrophobicContact CG2-SD 3.98Å
1202	I	74.1	Confident	63.4	Low	26 Å²	26	69 Å²	69	13%	0.133	39%	0.388	C	S	.	.	H	α-helix	trans	-72.1	-39.1	-178.1	-71.6	168.2	0	0	0	112.3	I1198 T1199 S1200 N1204 L1205 K1289 M1293	I1198-I1202 HydrophobicContact CG2-CD1 3.86Å; I1198-I1202 WeakPolarHBondContact O-CG1 3.47Å; I1198-I1202 PolarHBondContact O-N 2.94Å; I1198-I1202 VanDerWaalsContact O-N 3.09Å; T1199-I1202 PolarHBondContact O-N 2.84Å; S1200-I1202 VanDerWaalsContact C-N 3.32Å; S1200-I1202 PolarHBondContact O-N 3.03Å; I1202-N1204 VanDerWaalsContact C-N 3.25Å; I1202-N1204 PolarHBondContact O-N 3.18Å; I1202-L1205 PolarHBondContact O-N 2.86Å; I1202-L1205 VanDerWaalsContact O-N 3.1Å; I1202-K1289 HydrophobicContact CD1-CB 3.55Å; I1202-K1289 HydrophobicContact CD1-CD 3.91Å; I1202-K1289 HydrophobicContact CD1-CG 3.83Å; I1202-M1293 HydrophobicContact CD1-CG 4.2Å; I1202-M1293 HydrophobicContact CD1-SD 4.21Å; I1202-M1293 HydrophobicContact CG1-CG 3.88Å; I1202-M1293 HydrophobicContact CG1-SD 3.56Å; I1202-M1293 VanDerWaalsContact CG1-SD 3.56Å
1203	N	73.2	Confident	60.5	Low	106 Å²	106	73.3 Å²	73.3	57%	0.567	41%	0.406	S	S	*	.	H	α-helix	trans	-62.1	-36.3	176.5	-71.6	-5.6	0	0	0	111.4	T1199 S1200 L1205	T1199-N1203 WeakPolarHBondContact O-CB 3.37Å; T1199-N1203 PolarHBondContact O-N 2.76Å; T1199-N1203 PolarHBondContact O-OD1 3.42Å; S1200-N1203 PolarHBondContact O-N 3.18Å; N1203-L1205 PolarHBondContact O-N 2.67Å; N1203-L1205 VanDerWaalsContact O-N 3.17Å
1204	N	68.8	Low	57.5	Low	92 Å²	92	77.4 Å²	77.4	49%	0.492	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	0.2	176.9	-67.1	8.2	0	0	0	114	S1200 I1201 I1202 Y1251	S1200-N1204 VanDerWaalsContact O-CG 3.28Å; S1200-N1204 PolarHBondContact O-N 2.85Å; S1200-N1204 VanDerWaalsContact O-N 3.16Å; S1200-N1204 PolarHBondContact O-OD1 3.44Å; I1201-N1204 PolarHBondContact O-N 3.02Å; I1202-N1204 VanDerWaalsContact C-N 3.25Å; I1202-N1204 PolarHBondContact O-N 3.18Å; N1204-Y1251 PolarHBondContact ND2-OH 3.28Å
1205	L	61.4	Low	54.7	Low	10 Å²	10	84.3 Å²	84.3	5%	0.052	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	12.6	-174	-66.6	171.1	0	0	0	114.3	I1201 I1202 N1203 F1247 M1293 R1296 I1299	I1201-L1205 HydrophobicContact CG2-CD1 4.04Å; I1201-L1205 WeakPolarHBondContact O-CD1 3.25Å; I1201-L1205 VanDerWaalsContact O-CG 3.29Å; I1201-L1205 WeakPolarHBondContact O-CG 3.3Å; I1202-L1205 PolarHBondContact O-N 2.86Å; I1202-L1205 VanDerWaalsContact O-N 3.1Å; N1203-L1205 PolarHBondContact O-N 2.67Å; N1203-L1205 VanDerWaalsContact O-N 3.17Å; L1205-F1247 HydrophobicContact CD1-CD2 3.74Å; L1205-F1247 HydrophobicContact CD1-CE2 4.1Å; L1205-F1247 HydrophobicContact CD1-CG 4.48Å; L1205-F1247 HydrophobicContact CD2-CB 4.09Å; L1205-F1247 HydrophobicContact CD2-CD2 4.18Å; L1205-F1247 HydrophobicContact CD2-CG 4.5Å; L1205-M1293 HydrophobicContact CD1-CE 3.37Å; L1205-M1293 HydrophobicContact CD1-SD 4.31Å; L1205-R1296 PolarHBondContact O-NH2 3.22Å; L1205-R1296 VanDerWaalsContact O-NH2 3.08Å; L1205-I1299 HydrophobicContact CB-CD1 4.11Å; L1205-I1299 HydrophobicContact CD1-CD1 4.22Å; L1205-I1299 HydrophobicContact CD2-CD1 4.33Å; L1205-I1299 HydrophobicContact CG-CD1 4.46Å
1206	N	49.8	Very low	51.8	Low	77 Å²	77	89 Å²	89	41%	0.412	49%	0.494	S	S	.	.			trans	-112.1	124.9	177.1	-73	-29.3	0	0	0	111.3	V1208 R1296	N1206-V1208 PolarHBondContact O-N 2.96Å; N1206-R1296 PolarHBondContact OD1-NH1 2.99Å; N1206-R1296 PolarHBondContact OD1-NH2 2.77Å
1207	P	38.1	Very low	49	Very low	80 Å²	80	90.4 Å²	90.4	52%	0.519	51%	0.507	S	S	.	.			trans	-70.2	121.8	170.9	26.1	-30.4	0	0	0	110.9	F1245	P1207-F1245 HydrophobicContact CB-CZ 4.1Å; P1207-F1245 HydrophobicContact CG-CZ 4.33Å
1208	V	28.4	Very low	46.3	Very low	143 Å²	143	95.9 Å²	95.9	87%	0.867	54%	0.535	S	S	*	.			trans	-85.5	113.3	164.5	-179.6	0	0	0	0	108.1	N1206	N1206-V1208 PolarHBondContact O-N 2.96Å
1209	L	27.1	Very low	43.5	Very low	150 Å²	150	102.4 Å²	102.4	79%	0.785	57%	0.569	S	S	*	*			trans	-112.1	119.1	177	-99	171	0	0	0	110.7
1210	S	24	Very low	40.8	Very low	107 Å²	107	106.2 Å²	106.2	75%	0.748	59%	0.588	S	S	*	*			trans	61.1	144.2	172.7	54.9	0	0	0	0	116.3
1211	E	22.5	Very low	38.1	Very low	183 Å²	183	113.6 Å²	113.6	86%	0.855	62%	0.619	S	S	*	*			cis	-135	143.3	24.2	-63.3	178.2	136.5	0	0	114.3
1212	S	23.4	Very low	35.4	Very low	123 Å²	123	117.5 Å²	117.5	86%	0.86	64%	0.644	S	S	*	*				-175.3	156.6	120.4	34.2	0	0	0	0	110.5
1213	I	24.1	Very low	33.2	Very low	151 Å²	151	123.8 Å²	123.8	77%	0.774	68%	0.677	S	S	*	*			trans	-131.3	141	-172	-72.6	171.6	0	0	0	108.8
1214	N	24.8	Very low	30.8	Very low	141 Å²	141	125.6 Å²	125.6	75%	0.754	69%	0.687	S	S	*	*			trans	67.7	150.1	179.1	-61.1	-23.5	0	0	0	114.6
1215	N	28.1	Very low	28.8	Very low	147 Å²	147	131.6 Å²	131.6	79%	0.786	70%	0.704	S	S	*	*			cis	-140.5	157.1	16.8	-117.2	-29.2	0	0	0	112.7
1216	N	24.9	Very low	27	Very low	137 Å²	137	135.7 Å²	135.7	73%	0.733	73%	0.733	S	S	*	*			trans	-75.4	146.7	165.2	-60.8	-41	0	0	0	110.8
1217	N	26.9	Very low	25.8	Very low	136 Å²	136	139.6 Å²	139.6	73%	0.727	75%	0.751	S	S	*	*				166.5	134.5	108.8	-85	-37	0	0	0	114.1
1218	N	26.6	Very low	25.5	Very low	128 Å²	128	143.3 Å²	143.3	68%	0.684	77%	0.766	S	S	*	*			trans	60.7	124.9	150.3	-54.8	-20.1	0	0	0	119.3
1219	L	24.4	Very low	25.5	Very low	137 Å²	137	141.2 Å²	141.2	72%	0.717	76%	0.756	S	S	*	*			cis	85.6	121.6	42.1	-69.6	162.4	0	0	0	115.2
1220	N	24	Very low	25.4	Very low	118 Å²	118	140.8 Å²	140.8	63%	0.631	75%	0.753	S	S	*	*			trans	68.6	111.3	144.9	-57.5	-13.5	0	0	0	120.2	T1222	N1220-T1222 HydrophobicContact CB-CG2 3.99Å
1221	Q	26.4	Very low	25.4	Very low	188 Å²	188	143.1 Å²	143.1	88%	0.879	75%	0.752	S	S	*	*				-152.2	111.6	98.6	-95.9	156.6	37.8	0	0	107.9
1222	T	23	Very low	25.5	Very low	88 Å²	88	138.4 Å²	138.4	54%	0.54	74%	0.74	S	S	.	*				65.3	109.4	56.2	73.9	0	0	0	0	115	N1220	N1220-T1222 HydrophobicContact CB-CG2 3.99Å
1223	N	27.2	Very low	25.5	Very low	157 Å²	157	138.3 Å²	138.3	84%	0.84	73%	0.733	S	S	*	*				-158.2	109.8	129.7	-100.8	-23.2	0	0	0	110.7
1224	N	23.2	Very low	25.5	Very low	145 Å²	145	135.8 Å²	135.8	78%	0.775	73%	0.725	S	S	*	*			trans	-83.1	149.3	168.9	-59.5	-38.5	0	0	0	109.4
1225	Y	27.5	Very low	25.4	Very low	217 Å²	217	135.3 Å²	135.3	85%	0.851	72%	0.723	S	S	*	*			trans	-148.3	108.7	141.7	-95.3	-66.4	0	0	0	111.7
1226	C	22.9	Very low	25.1	Very low	97 Å²	97	135 Å²	135	66%	0.655	72%	0.721	S	S	*	*			trans	32.3	136.4	137.6	-53.6	0	0	0	0	120.1
1227	M	24.9	Very low	25.1	Very low	159 Å²	159	136.9 Å²	136.9	78%	0.783	73%	0.725	S	S	*	*			cis	-146.4	129.1	36.8	-73.7	-76.2	-175.4	0	0	113.7
1228	N	31.2	Very low	25	Very low	158 Å²	158	136 Å²	136	85%	0.845	73%	0.725	S	S	*	*				-88.7	155	128.3	-73.9	-19.6	0	0	0	106.5
1229	P	29.5	Very low	24.9	Very low	99 Å²	99	137.8 Å²	137.8	64%	0.643	73%	0.734	S	S	*	*				-149.2	167.6	96.3	34.7	-15.8	0	0	0	116.9
1230	L	23.8	Very low	24.9	Very low	140 Å²	140	135.8 Å²	135.8	73%	0.733	74%	0.737	S	S	*	*			trans	96.4	128.8	168.7	-71.7	105.3	0	0	0	119.1
1231	E	24.2	Very low	24.9	Very low	157 Å²	157	135 Å²	135	73%	0.734	74%	0.741	S	S	*	*			cis	-176.3	153.8	-32	-113.4	167.5	-155.8	0	0	106.9
1232	S	24.6	Very low	25	Very low	84 Å²	84	132 Å²	132	59%	0.587	74%	0.736	S	S	*	*			cis	-176.9	-174.5	-30.5	59.6	0	0	0	0	109.1
1233	V	24.2	Very low	25.3	Very low	120 Å²	120	135.8 Å²	135.8	73%	0.727	75%	0.751	S	S	*	*			trans	69.3	124.9	145.1	163.9	0	0	0	0	117.1
1234	T	23.7	Very low	25.7	Very low	99 Å²	99	131.9 Å²	131.9	61%	0.607	74%	0.736	S	S	*	*			cis	-165.4	159.6	-3.1	22.1	0	0	0	0	110.3
1235	N	22.5	Very low	26.7	Very low	131 Å²	131	129.2 Å²	129.2	70%	0.701	72%	0.718	S	S	*	*			trans	41.2	141.7	133.8	-50	-2.7	0	0	0	119.7
1236	N	22.7	Very low	27.8	Very low	139 Å²	139	125.1 Å²	125.1	74%	0.743	71%	0.711	S	S	*	*			cis	-172	-158.8	1.4	-112.6	10.2	0	0	0	106.5
1237	E	25	Very low	29.9	Very low	177 Å²	177	121 Å²	121	83%	0.827	68%	0.682	S	S	*	*			cis	-134.2	176.1	7.5	-96.9	-156.9	106.2	0	0	112.2
1238	V	23.3	Very low	32.4	Very low	119 Å²	119	116.9 Å²	116.9	72%	0.721	66%	0.663	S	S	*	*			trans	-62.3	141	172.3	172.5	0	0	0	0	113.2
1239	N	25	Very low	34.6	Very low	165 Å²	165	113.1 Å²	113.1	88%	0.882	64%	0.637	S	S	*	*			trans	-156	135.3	138.1	-114.2	-25.9	0	0	0	111.3
1240	A	23.8	Very low	37	Very low	94 Å²	94	111.3 Å²	111.3	78%	0.777	62%	0.62	S	S	*	*			trans	-124.6	104.5	-173.5	0	0	0	0	0	111.5
1241	S	24.4	Very low	39.9	Very low	103 Å²	103	107.4 Å²	107.4	72%	0.72	60%	0.596	S	S	*	*			trans	-162.2	171.5	171.7	58.9	0	0	0	0	111.1
1242	T	29.3	Very low	42.7	Very low	125 Å²	125	100 Å²	100	77%	0.767	56%	0.561	S	S	*	*			trans	57.5	73.6	178.5	66.1	0	0	0	0	117.5	S1244	T1242-S1244 PolarHBondContact O-N 3.26Å
1243	I	28.8	Very low	45.6	Very low	166 Å²	166	96 Å²	96	85%	0.851	53%	0.533	S	S	*	.			trans	-65.8	98.1	150.6	-59.6	174.7	0	0	0	107.7
1244	S	34.5	Very low	48.4	Very low	76 Å²	76	93.8 Å²	93.8	53%	0.531	51%	0.512	S	S	.	.			trans	-92.7	134.3	167	48.7	0	0	0	0	110.2	T1242 N1246	T1242-S1244 PolarHBondContact O-N 3.26Å; S1244-N1246 PolarHBondContact O-N 2.86Å
1245	F	44.5	Very low	51.5	Low	89 Å²	89	89.1 Å²	89.1	39%	0.39	48%	0.483	S	S	.	.			trans	-67.9	98.3	178.4	-71.5	-85.6	0	0	0	110.4	P1207 F1247	P1207-F1245 HydrophobicContact CB-CZ 4.1Å; P1207-F1245 HydrophobicContact CG-CZ 4.33Å; F1245-F1247 PolarHBondContact O-N 3.1Å
1246	N	51.9	Low	54.5	Low	131 Å²	131	82.9 Å²	82.9	70%	0.701	45%	0.45	S	S	*	.			trans	-75.2	68.2	-177.9	-81.4	-25.1	0	0	0	112.4	S1244 N1248	S1244-N1246 PolarHBondContact O-N 2.86Å; N1246-N1248 VanDerWaalsContact C-N 3.32Å; N1246-N1248 PolarHBondContact O-N 3.11Å
1247	F	66.7	Low	57.6	Low	11 Å²	11	76.4 Å²	76.4	5%	0.048	42%	0.416	C	S	.	.			trans	-68.6	92.3	162.6	-171.3	-118.7	0	0	0	108.6	I1201 L1205 F1245 L1252 M1293 I1299 F1301 P1302	I1201-F1247 HydrophobicContact CG2-CE2 3.91Å; L1205-F1247 HydrophobicContact CD1-CD2 3.74Å; L1205-F1247 HydrophobicContact CD1-CE2 4.1Å; L1205-F1247 HydrophobicContact CD1-CG 4.48Å; L1205-F1247 HydrophobicContact CD2-CB 4.09Å; L1205-F1247 HydrophobicContact CD2-CD2 4.18Å; L1205-F1247 HydrophobicContact CD2-CG 4.5Å; F1245-F1247 PolarHBondContact O-N 3.1Å; F1247-L1252 HydrophobicContact CE1-CB 4.05Å; F1247-L1252 HydrophobicContact CE1-CD1 4.3Å; F1247-L1252 HydrophobicContact CZ-CB 4.07Å; F1247-L1252 HydrophobicContact CZ-CD1 4.42Å; F1247-M1293 HydrophobicContact CD2-CE 4.43Å; F1247-M1293 HydrophobicContact CE2-CE 3.82Å; F1247-M1293 HydrophobicContact CZ-CE 3.9Å; F1247-I1299 HydrophobicContact CB-CG2 4.04Å; F1247-I1299 HydrophobicContact CD1-CG2 4.46Å; F1247-I1299 HydrophobicContact CG-CG2 4.44Å; F1247-F1301 HydrophobicContact CD1-CD1 4.12Å; F1247-F1301 HydrophobicContact CD1-CE1 4.26Å; F1247-F1301 HydrophobicContact CD1-CG 4.36Å; F1247-F1301 AromaticContact CE1-CD1 3.53Å; F1247-F1301 HydrophobicContact CE1-CD1 3.53Å; F1247-F1301 AromaticContact CE1-CE1 3.49Å; F1247-F1301 HydrophobicContact CE1-CE1 3.49Å; F1247-F1301 VanDerWaalsContact CE1-CE1 3.49Å; F1247-F1301 HydrophobicContact CE1-CG 4.21Å; F1247-F1301 HydrophobicContact CE1-CZ 4.19Å; F1247-F1301 HydrophobicContact CZ-CE1 4.19Å; F1247-P1302 VanDerWaalsContact CD1-CD 3.44Å; F1247-P1302 HydrophobicContact CD1-CG 4.23Å; F1247-P1302 HydrophobicContact CE1-CG 4.47Å; F1247-P1302 VanDerWaalsContact O-CD 3.31Å; F1247-P1302 WeakPolarHBondContact O-CD 2.99Å; F1247-P1302 VanDerWaalsContact O-CG 3.31Å; F1247-P1302 WeakPolarHBondContact O-CG 3.17Å
1248	N	76.2	Confident	60.7	Low	71 Å²	71	68.2 Å²	68.2	38%	0.38	38%	0.378	S	S	.	.			trans	-86.8	167.6	-172.5	67.7	19.5	0	0	0	112.9	N1246 H1250 Y1251 L1252	N1246-N1248 VanDerWaalsContact C-N 3.32Å; N1246-N1248 PolarHBondContact O-N 3.11Å; N1248-H1250 PolarHBondContact O-N 3.12Å; N1248-H1250 WeakPolarHBondContact OD1-CB 3.42Å; N1248-H1250 PolarHBondContact OD1-N 3.12Å; N1248-Y1251 PolarHBondContact O-N 3.22Å; N1248-Y1251 WeakPolarHBondContact OD1-CD2 3.31Å; N1248-Y1251 PolarHBondContact OD1-N 3.47Å; N1248-L1252 PolarHBondContact O-N 3.49Å
1249	Y	78.3	Confident	63.8	Low	79 Å²	79	62.6 Å²	62.6	31%	0.31	34%	0.344	S	S	.	.	H	α-helix	trans	-57	-34.9	179.3	-75.5	-76.7	0	0	0	112.6	K1133 L1136 L1252 A1253 P1302 G1303	K1133-Y1249 HydrophobicContact CB-CE1 3.9Å; K1133-Y1249 HydrophobicContact CG-CE1 4.43Å; L1136-Y1249 HydrophobicContact CD1-CD1 4.02Å; L1136-Y1249 HydrophobicContact CD1-CE1 4.44Å; Y1249-L1252 PolarHBondContact O-N 3.14Å; Y1249-A1253 VanDerWaalsContact O-CB 3.22Å; Y1249-A1253 WeakPolarHBondContact O-CB 3.24Å; Y1249-A1253 PolarHBondContact O-N 2.89Å; Y1249-P1302 HydrophobicContact CD1-CB 3.8Å; Y1249-P1302 HydrophobicContact CD1-CG 4.3Å; Y1249-P1302 HydrophobicContact CD2-CB 3.98Å; Y1249-P1302 VanDerWaalsContact CE1-C 3.47Å; Y1249-P1302 HydrophobicContact CE1-CB 3.82Å; Y1249-P1302 HydrophobicContact CE2-CB 4Å; Y1249-P1302 HydrophobicContact CG-CB 3.88Å; Y1249-P1302 HydrophobicContact CG-CG 4.47Å; Y1249-G1303 WeakPolarHBondContact OH-CA 3.32Å; Y1249-G1303 PolarHBondContact OH-N 3.29Å; Y1249-G1303 VanDerWaalsContact OH-N 3.14Å
1250	H	80.4	Confident	66.8	Low	61 Å²	61	54.8 Å²	54.8	28%	0.282	30%	0.302	S	S	.	.	H	α-helix	trans	-62.4	-44.8	176.6	-177.6	-108.7	0	0	0	112.7	E1131 N1248 L1252 A1253 R1254	E1131-H1250 WeakPolarHBondContact OE1-CB 3.3Å; E1131-H1250 IonicContact OE2-CD2 2.71Å; N1248-H1250 PolarHBondContact O-N 3.12Å; N1248-H1250 WeakPolarHBondContact OD1-CB 3.42Å; N1248-H1250 PolarHBondContact OD1-N 3.12Å; H1250-L1252 PolarHBondContact O-N 3.12Å; H1250-A1253 PolarHBondContact O-N 3.01Å; H1250-R1254 WeakPolarHBondContact O-CG 3.44Å; H1250-R1254 PolarHBondContact O-N 3.31Å
1251	Y	83.6	Confident	69.9	Low	59 Å²	59	50.5 Å²	50.5	23%	0.231	27%	0.266	C	S	.	.	H	α-helix	trans	-65.5	-37.6	175.4	-73.1	-57	0	0	0	112.5	I1201 N1204 N1248 L1255	I1201-Y1251 HydrophobicContact CG1-CD1 4.02Å; N1204-Y1251 PolarHBondContact ND2-OH 3.28Å; N1248-Y1251 PolarHBondContact O-N 3.22Å; N1248-Y1251 WeakPolarHBondContact OD1-CD2 3.31Å; N1248-Y1251 PolarHBondContact OD1-N 3.47Å; Y1251-L1255 PolarHBondContact O-N 2.94Å; Y1251-L1255 VanDerWaalsContact O-N 3.13Å
1252	L	84.6	Confident	73	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.9	-44.4	173.1	177.4	56.7	0	0	0	111.7	L1136 F1247 N1248 Y1249 H1250 L1255 V1256 F1301 P1302 I1311	L1136-L1252 HydrophobicContact CD1-CD2 3.53Å; L1136-L1252 HydrophobicContact CD1-CG 3.97Å; L1136-L1252 HydrophobicContact CD2-CG 4.37Å; F1247-L1252 HydrophobicContact CE1-CB 4.05Å; F1247-L1252 HydrophobicContact CE1-CD1 4.3Å; F1247-L1252 HydrophobicContact CZ-CB 4.07Å; F1247-L1252 HydrophobicContact CZ-CD1 4.42Å; N1248-L1252 PolarHBondContact O-N 3.49Å; Y1249-L1252 PolarHBondContact O-N 3.14Å; H1250-L1252 PolarHBondContact O-N 3.12Å; L1252-L1255 PolarHBondContact O-N 3.3Å; L1252-V1256 HydrophobicContact CD1-CG2 4.15Å; L1252-V1256 WeakPolarHBondContact O-CG2 3.33Å; L1252-V1256 PolarHBondContact O-N 2.6Å; L1252-F1301 HydrophobicContact CD1-CD1 4.27Å; L1252-P1302 HydrophobicContact CB-CG 3.96Å; L1252-P1302 HydrophobicContact CD2-CG 3.74Å; L1252-P1302 WeakPolarHBondContact CD2-O 3.47Å; L1252-I1311 HydrophobicContact CD1-CD1 3.44Å; L1252-I1311 VanDerWaalsContact CD1-CD1 3.44Å; L1252-I1311 HydrophobicContact CD1-CG1 3.8Å
1253	A	83.9	Confident	75.7	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.1	-43.7	177	0	0	0	0	0	111.9	T1127 Y1130 E1131 Y1249 H1250 L1255 V1256 G1257	T1127-A1253 HydrophobicContact CG2-CB 4.42Å; Y1130-A1253 VanDerWaalsContact C-CB 3.48Å; Y1130-A1253 WeakPolarHBondContact O-CB 3.31Å; E1131-A1253 HydrophobicContact CB-CB 4.25Å; Y1249-A1253 VanDerWaalsContact O-CB 3.22Å; Y1249-A1253 WeakPolarHBondContact O-CB 3.24Å; Y1249-A1253 PolarHBondContact O-N 2.89Å; H1250-A1253 PolarHBondContact O-N 3.01Å; A1253-L1255 PolarHBondContact O-N 3.18Å; A1253-V1256 PolarHBondContact O-N 2.8Å; A1253-G1257 PolarHBondContact O-N 2.94Å
1254	R	84.6	Confident	78.4	Confident	75 Å²	75	33.2 Å²	33.2	28%	0.283	16%	0.162	S	C	.	.	H	α-helix	trans	-55.9	-48.9	171.8	-73.1	-178	108.6	163.7	6.9	111.2	T1127 I1201 H1250 G1257 V1258	T1127-R1254 HydrophobicContact CG2-CB 4.36Å; T1127-R1254 HydrophobicContact CG2-CG 3.37Å; I1201-R1254 HydrophobicContact CD1-CB 4.11Å; H1250-R1254 WeakPolarHBondContact O-CG 3.44Å; H1250-R1254 PolarHBondContact O-N 3.31Å; R1254-G1257 PolarHBondContact O-N 3.44Å; R1254-V1258 WeakPolarHBondContact O-CB 3.49Å; R1254-V1258 WeakPolarHBondContact O-CG2 3.12Å; R1254-V1258 PolarHBondContact O-N 2.85Å
1255	L	87.2	Confident	80.9	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-64.1	-41.9	-178.6	-174.4	58.7	0	0	0	112.5	I1198 I1201 Y1251 L1252 A1253 L1259 M1293 I1311	I1198-L1255 HydrophobicContact CD1-CD1 4.41Å; I1198-L1255 HydrophobicContact CG1-CD1 3.91Å; I1201-L1255 HydrophobicContact CD1-CB 4.25Å; Y1251-L1255 PolarHBondContact O-N 2.94Å; Y1251-L1255 VanDerWaalsContact O-N 3.13Å; L1252-L1255 PolarHBondContact O-N 3.3Å; A1253-L1255 PolarHBondContact O-N 3.18Å; L1255-L1259 HydrophobicContact CG-CD1 4.49Å; L1255-L1259 WeakPolarHBondContact O-CG 3.44Å; L1255-L1259 PolarHBondContact O-N 3.04Å; L1255-M1293 HydrophobicContact CD2-CE 4.49Å; L1255-M1293 HydrophobicContact CD2-SD 4.2Å; L1255-I1311 HydrophobicContact CD2-CD1 3.72Å; L1255-I1311 HydrophobicContact CD2-CG1 4.19Å; L1255-I1311 HydrophobicContact CG-CG1 4.49Å
1256	V	87.1	Confident	82.7	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-69.2	-41	177.5	172.4	0	0	0	0	112	Y1130 L1136 L1161 L1252 A1253 T1260 A1310 I1311 K1314	Y1130-V1256 HydrophobicContact CD1-CG1 3.54Å; Y1130-V1256 HydrophobicContact CD2-CG1 4.32Å; Y1130-V1256 HydrophobicContact CE1-CG1 3.81Å; Y1130-V1256 HydrophobicContact CG-CB 4.37Å; Y1130-V1256 HydrophobicContact CG-CG1 3.82Å; L1136-V1256 HydrophobicContact CD2-CB 4.4Å; L1136-V1256 HydrophobicContact CD2-CG1 4.39Å; L1136-V1256 HydrophobicContact CD2-CG2 4Å; L1161-V1256 HydrophobicContact CD1-CG1 3.85Å; L1252-V1256 HydrophobicContact CD1-CG2 4.15Å; L1252-V1256 WeakPolarHBondContact O-CG2 3.33Å; L1252-V1256 PolarHBondContact O-N 2.6Å; A1253-V1256 PolarHBondContact O-N 2.8Å; V1256-T1260 WeakPolarHBondContact O-CB 3.45Å; V1256-T1260 PolarHBondContact O-N 3.34Å; V1256-T1260 PolarHBondContact O-OG1 3.37Å; V1256-A1310 HydrophobicContact CG2-CB 4.36Å; V1256-I1311 HydrophobicContact CG2-CG1 3.96Å; V1256-K1314 HydrophobicContact CG1-CG 4.26Å
1257	G	86.1	Confident	84.2	Confident	3 Å²	3	20.1 Å²	20.1	3%	0.031	9%	0.09	C	C	.	.	H	α-helix	trans	-63.4	-43.7	174.1	0	0	0	0	0	112.3	A1253 R1254 T1260 L1261	A1253-G1257 PolarHBondContact O-N 2.94Å; R1254-G1257 PolarHBondContact O-N 3.44Å; G1257-T1260 PolarHBondContact O-N 2.87Å; G1257-L1261 WeakPolarHBondContact O-CB 3.24Å; G1257-L1261 PolarHBondContact O-N 3.18Å
1258	V	90.3	Very high	85	Confident	5 Å²	5	22.1 Å²	22.1	3%	0.03	10%	0.097	C	C	.	.	H	α-helix	trans	-64.8	-41.7	177.6	164.3	0	0	0	0	112.5	Y1193 V1194 T1197 I1198 R1254 L1261 L1262	Y1193-V1258 HydrophobicContact CE1-CG2 4.15Å; V1194-V1258 HydrophobicContact CB-CG1 4.06Å; V1194-V1258 HydrophobicContact CG1-CG1 3.7Å; V1194-V1258 HydrophobicContact CG2-CG1 4.07Å; T1197-V1258 WeakPolarHBondContact OG1-CG2 3.3Å; I1198-V1258 HydrophobicContact CD1-CG1 3.91Å; I1198-V1258 HydrophobicContact CG1-CG1 3.94Å; R1254-V1258 WeakPolarHBondContact O-CB 3.49Å; R1254-V1258 WeakPolarHBondContact O-CG2 3.12Å; R1254-V1258 PolarHBondContact O-N 2.85Å; V1258-L1261 PolarHBondContact O-N 3.17Å; V1258-L1262 PolarHBondContact O-N 2.65Å
1259	L	88.6	Confident	85.4	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-66.9	-36.1	173	-72.2	171	0	0	0	112.2	L1255 L1262 Y1263 I1286 A1290 I1311 K1314 V1318	L1255-L1259 HydrophobicContact CG-CD1 4.49Å; L1255-L1259 WeakPolarHBondContact O-CG 3.44Å; L1255-L1259 PolarHBondContact O-N 3.04Å; L1259-L1262 PolarHBondContact O-N 2.88Å; L1259-Y1263 WeakPolarHBondContact O-CB 3.48Å; L1259-Y1263 PolarHBondContact O-N 3.22Å; L1259-I1286 HydrophobicContact CD2-CG2 4.27Å; L1259-A1290 HydrophobicContact CD1-CB 4.48Å; L1259-A1290 HydrophobicContact CD2-CB 4.47Å; L1259-I1311 HydrophobicContact CD1-CG2 3.96Å; L1259-K1314 HydrophobicContact CB-CB 4.03Å; L1259-K1314 HydrophobicContact CD1-CB 4.41Å; L1259-V1318 WeakPolarHBondContact O-CG2 3.41Å
1260	T	88	Confident	85.7	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.006	8%	0.08	C	C	.	.	H	α-helix	trans	-69.1	-35.8	175.5	-56.3	0	0	0	0	112.1	Y1130 F1152 V1256 G1257 Q1264 K1314	Y1130-T1260 PolarHBondContact OH-OG1 2.94Å; F1152-T1260 HydrophobicContact CE1-CG2 3.6Å; F1152-T1260 HydrophobicContact CZ-CG2 4.13Å; V1256-T1260 WeakPolarHBondContact O-CB 3.45Å; V1256-T1260 PolarHBondContact O-N 3.34Å; V1256-T1260 PolarHBondContact O-OG1 3.37Å; G1257-T1260 PolarHBondContact O-N 2.87Å; T1260-Q1264 PolarHBondContact O-N 3.21Å; T1260-K1314 WeakPolarHBondContact OG1-CD 3.28Å; T1260-K1314 WeakPolarHBondContact OG1-CE 3.44Å; T1260-K1314 PolarHBondContact OG1-NZ 3.4Å
1261	L	89.3	Confident	85.7	Confident	5 Å²	5	16.4 Å²	16.4	3%	0.026	8%	0.077	C	C	.	.	H	α-helix	trans	-64.3	-48	173.6	-174.8	62.1	0	0	0	110.7	L1123 L1126 L1174 Y1193 V1194 G1257 V1258 Y1263 Q1264 I1265	L1123-L1261 HydrophobicContact CD2-CD2 3.55Å; L1126-L1261 HydrophobicContact CD2-CB 4.01Å; L1126-L1261 HydrophobicContact CD2-CD1 4.08Å; L1126-L1261 HydrophobicContact CD2-CD2 4.42Å; L1126-L1261 HydrophobicContact CD2-CG 4.39Å; L1174-L1261 HydrophobicContact CD1-CD1 3.89Å; Y1193-L1261 HydrophobicContact CD1-CD2 4.47Å; V1194-L1261 HydrophobicContact CG2-CD2 4.31Å; G1257-L1261 WeakPolarHBondContact O-CB 3.24Å; G1257-L1261 PolarHBondContact O-N 3.18Å; V1258-L1261 PolarHBondContact O-N 3.17Å; L1261-Y1263 PolarHBondContact O-N 2.97Å; L1261-Q1264 PolarHBondContact O-N 3.36Å; L1261-I1265 HydrophobicContact CD1-CD1 3.69Å; L1261-I1265 HydrophobicContact CD1-CG1 4.34Å; L1261-I1265 HydrophobicContact CD2-CD1 4.4Å; L1261-I1265 HydrophobicContact CG-CD1 3.64Å; L1261-I1265 WeakPolarHBondContact O-CB 3.42Å; L1261-I1265 VanDerWaalsContact O-CG1 3.29Å; L1261-I1265 WeakPolarHBondContact O-CG1 3.34Å; L1261-I1265 PolarHBondContact O-N 3.29Å
1262	L	88.5	Confident	85.5	Confident	1 Å²	1	20 Å²	20	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-59.8	-44.3	177.1	-178.4	65.6	0	0	0	112.4	L1191 V1258 L1259 Q1264 I1265 V1266 I1286 V1318	L1191-L1262 HydrophobicContact CD1-CD1 4.05Å; V1258-L1262 PolarHBondContact O-N 2.65Å; L1259-L1262 PolarHBondContact O-N 2.88Å; L1262-Q1264 VanDerWaalsContact C-N 3.28Å; L1262-Q1264 PolarHBondContact O-N 2.78Å; L1262-I1265 PolarHBondContact O-N 2.86Å; L1262-I1265 VanDerWaalsContact O-N 3.12Å; L1262-V1266 HydrophobicContact CD1-CG2 3.86Å; L1262-V1266 HydrophobicContact CG-CG2 4.14Å; L1262-V1266 WeakPolarHBondContact O-CG2 3.24Å; L1262-V1266 PolarHBondContact O-N 3.19Å; L1262-I1286 HydrophobicContact CD1-CD1 4.32Å; L1262-I1286 HydrophobicContact CD2-CB 4.44Å; L1262-I1286 HydrophobicContact CD2-CD1 3.95Å; L1262-I1286 HydrophobicContact CD2-CG2 3.52Å; L1262-V1318 HydrophobicContact CD2-CG1 3.95Å; L1262-V1318 HydrophobicContact CG-CG1 4.25Å
1263	Y	87.4	Confident	85.3	Confident	8 Å²	8	23.7 Å²	23.7	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-52.1	-44	176.4	169.6	-97.3	0	0	0	112.6	F1152 S1153 L1154 Q1155 L1259 L1261 N1317 I1321	F1152-Y1263 HydrophobicContact CB-CE1 4.48Å; F1152-Y1263 HydrophobicContact CD1-CD1 4.32Å; F1152-Y1263 HydrophobicContact CD1-CE1 4.02Å; S1153-Y1263 PolarHBondContact O-OH 3.04Å; L1154-Y1263 PolarHBondContact O-OH 3.23Å; Q1155-Y1263 PolarHBondContact N-OH 3.34Å; L1259-Y1263 WeakPolarHBondContact O-CB 3.48Å; L1259-Y1263 PolarHBondContact O-N 3.22Å; L1261-Y1263 PolarHBondContact O-N 2.97Å; Y1263-N1317 HydrophobicContact CD2-CB 3.77Å; Y1263-N1317 HydrophobicContact CE2-CB 3.66Å; Y1263-I1321 HydrophobicContact CD2-CD1 3.77Å; Y1263-I1321 HydrophobicContact CD2-CG1 4.22Å; Y1263-I1321 HydrophobicContact CE1-CD1 4.25Å; Y1263-I1321 HydrophobicContact CE2-CD1 3.23Å; Y1263-I1321 HydrophobicContact CE2-CG1 3.73Å; Y1263-I1321 HydrophobicContact CG-CD1 4.48Å
1264	Q	86	Confident	85.3	Confident	22 Å²	22	23.8 Å²	23.8	10%	0.103	12%	0.118	C	C	.	.	H	α-helix	trans	-76.9	-33.3	177.6	-70.8	-72.4	5.8	0	0	113.2	F1152 V1171 V1175 T1260 L1261 L1262 I1267	F1152-Q1264 HydrophobicContact CD1-CG 4.46Å; F1152-Q1264 HydrophobicContact CE1-CG 4.26Å; V1171-Q1264 HydrophobicContact CG1-CB 4.39Å; V1171-Q1264 HydrophobicContact CG1-CG 3.67Å; V1175-Q1264 HydrophobicContact CG2-CB 4.48Å; T1260-Q1264 PolarHBondContact O-N 3.21Å; L1261-Q1264 PolarHBondContact O-N 3.36Å; L1262-Q1264 VanDerWaalsContact C-N 3.28Å; L1262-Q1264 PolarHBondContact O-N 2.78Å; Q1264-I1267 WeakPolarHBondContact O-CB 3.35Å
1265	I	85.3	Confident	85.1	Confident	5 Å²	5	22 Å²	22	3%	0.026	12%	0.115	C	C	.	.	H	α-helix	trans	-77.8	-33.6	-174.6	-77.4	177.9	0	0	0	113.1	V1186 Y1190 L1261 L1262 I1267 Y1268	V1186-I1265 HydrophobicContact CB-CG2 4.16Å; V1186-I1265 HydrophobicContact CG1-CG2 3.36Å; V1186-I1265 HydrophobicContact CG2-CG1 4.48Å; V1186-I1265 HydrophobicContact CG2-CG2 3.87Å; Y1190-I1265 VanDerWaalsContact CB-CD1 3.44Å; Y1190-I1265 HydrophobicContact CD2-CD1 3.39Å; Y1190-I1265 HydrophobicContact CD2-CG1 4.22Å; Y1190-I1265 HydrophobicContact CE2-CD1 4.3Å; Y1190-I1265 HydrophobicContact CG-CD1 3.71Å; L1261-I1265 HydrophobicContact CD1-CD1 3.69Å; L1261-I1265 HydrophobicContact CD1-CG1 4.34Å; L1261-I1265 HydrophobicContact CD2-CD1 4.4Å; L1261-I1265 HydrophobicContact CG-CD1 3.64Å; L1261-I1265 WeakPolarHBondContact O-CB 3.42Å; L1261-I1265 VanDerWaalsContact O-CG1 3.29Å; L1261-I1265 WeakPolarHBondContact O-CG1 3.34Å; L1261-I1265 PolarHBondContact O-N 3.29Å; L1262-I1265 PolarHBondContact O-N 2.86Å; L1262-I1265 VanDerWaalsContact O-N 3.12Å; I1265-I1267 PolarHBondContact O-N 3.01Å; I1265-Y1268 PolarHBondContact O-N 3.37Å
1266	V	83.8	Confident	84.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-22	177.8	163.4	0	0	0	0	112.2	L1262 L1274 I1321 I1322 R1325	L1262-V1266 HydrophobicContact CD1-CG2 3.86Å; L1262-V1266 HydrophobicContact CG-CG2 4.14Å; L1262-V1266 WeakPolarHBondContact O-CG2 3.24Å; L1262-V1266 PolarHBondContact O-N 3.19Å; V1266-L1274 HydrophobicContact CG1-CD1 4.37Å; V1266-I1321 HydrophobicContact CG1-CG2 3.97Å; V1266-I1322 HydrophobicContact CG1-CG1 3.8Å; V1266-I1322 HydrophobicContact CG2-CG1 4.3Å; V1266-R1325 PolarHBondContact O-NH1 2.94Å
1267	I	82.9	Confident	84.3	Confident	16 Å²	16	30.5 Å²	30.5	8%	0.082	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-39.9	171.3	-69.5	173.6	0	0	0	111.6	Q1264 I1265 I1269 I1321 R1325 K1902 P1903	Q1264-I1267 WeakPolarHBondContact O-CB 3.35Å; I1265-I1267 PolarHBondContact O-N 3.01Å; I1267-I1269 PolarHBondContact O-N 3.36Å; I1267-I1321 HydrophobicContact CD1-CD1 4.45Å; I1267-I1321 HydrophobicContact CG1-CG2 4.41Å; I1267-R1325 PolarHBondContact O-NH1 3.26Å; I1267-K1902 VanDerWaalsContact CG2-O 3.29Å; I1267-K1902 WeakPolarHBondContact CG2-O 2.99Å; I1267-P1903 HydrophobicContact CB-CG 4.32Å; I1267-P1903 HydrophobicContact CG2-CG 3.77Å; I1267-P1903 WeakPolarHBondContact O-CG 2.78Å
1268	Y	83.4	Confident	83.8	Confident	52 Å²	52	30.4 Å²	30.4	20%	0.204	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-10.8	-169.2	-66.5	-86.6	0	0	0	115.1	V1175 V1178 Q1179 V1183 I1265	V1175-Y1268 HydrophobicContact CG1-CE2 3.99Å; V1175-Y1268 VanDerWaalsContact CG1-OH 3.26Å; V1175-Y1268 WeakPolarHBondContact CG1-OH 3.43Å; V1175-Y1268 HydrophobicContact CG2-CE2 4.36Å; V1178-Y1268 HydrophobicContact CG1-CD1 3.85Å; V1178-Y1268 HydrophobicContact CG1-CD2 4.49Å; V1178-Y1268 HydrophobicContact CG1-CG 3.75Å; Q1179-Y1268 HydrophobicContact CG-CE1 4.43Å; Q1179-Y1268 PolarHBondContact NE2-OH 3.09Å; V1183-Y1268 WeakPolarHBondContact CG1-O 3.22Å; V1183-Y1268 VanDerWaalsContact CG2-O 3.27Å; V1183-Y1268 WeakPolarHBondContact CG2-O 3.38Å; I1265-Y1268 PolarHBondContact O-N 3.37Å
1269	I	84.8	Confident	82.7	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.01	18%	0.179	C	C	.	.	S	Bend	trans	-75.6	133.2	179.6	-53.2	175.3	0	0	0	110.4	V1186 I1267 E1273 L1274 L1277 R1325	V1186-I1269 HydrophobicContact CG1-CD1 4.2Å; V1186-I1269 HydrophobicContact CG1-CG1 3.72Å; I1267-I1269 PolarHBondContact O-N 3.36Å; I1269-E1273 HydrophobicContact CG2-CB 4Å; I1269-L1274 HydrophobicContact CB-CB 4.47Å; I1269-L1274 HydrophobicContact CD1-CD1 4.48Å; I1269-L1274 HydrophobicContact CG2-CB 3.93Å; I1269-L1277 HydrophobicContact CD1-CD1 4.37Å; I1269-L1277 HydrophobicContact CG2-CD1 4.3Å; I1269-R1325 VanDerWaalsContact O-CZ 3.22Å; I1269-R1325 PolarHBondContact O-NH1 3.06Å; I1269-R1325 PolarHBondContact O-NH2 3.32Å
1270	P	83.3	Confident	81.7	Confident	51 Å²	51	42.7 Å²	42.7	33%	0.331	21%	0.212	S	C	.	.			trans	-70.1	150.2	174.1	30.4	-35.9	0	0	0	111.6	N1272 E1273 L1274	P1270-N1272 VanDerWaalsContact C-N 3.27Å; P1270-N1272 PolarHBondContact O-N 3.5Å; P1270-N1272 VanDerWaalsContact O-N 3.13Å; P1270-E1273 VanDerWaalsContact CD-OE2 3.22Å; P1270-E1273 WeakPolarHBondContact CD-OE2 3.07Å; P1270-E1273 HydrophobicContact CG-CB 4.07Å; P1270-E1273 VanDerWaalsContact CG-CD 3.41Å; P1270-E1273 HydrophobicContact CG-CG 3.98Å; P1270-E1273 WeakPolarHBondContact CG-OE2 3.38Å; P1270-E1273 PolarHBondContact O-N 3.38Å; P1270-E1273 VanDerWaalsContact O-N 3.11Å; P1270-L1274 PolarHBondContact O-N 3.48Å
1271	D	81.6	Confident	80.9	Confident	38 Å²	38	43.9 Å²	43.9	20%	0.203	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-32.4	-165.6	-51.6	-75.7	0	0	0	114	V1275 R1325 T1904	D1271-V1275 WeakPolarHBondContact O-CG2 3.32Å; D1271-V1275 PolarHBondContact O-N 3.47Å; D1271-R1325 IonicContact OD1-CZ 3.33Å; D1271-R1325 IonicContact OD1-NE 3.78Å; D1271-R1325 IonicContact OD1-NH2 2.71Å; D1271-R1325 PolarHBondContact OD1-NH2 3.41Å; D1271-R1325 IonicContact OD2-NH2 3.86Å; D1271-T1904 WeakPolarHBondContact OD1-CG2 3.19Å
1272	N	78.8	Confident	80.4	Confident	134 Å²	134	43.6 Å²	43.6	72%	0.717	22%	0.219	S	C	*	.	H	α-helix	trans	-63.5	-50.9	175.7	-64	-6.8	0	0	0	112	P1270 L1274 V1275 E1276	P1270-N1272 VanDerWaalsContact C-N 3.27Å; P1270-N1272 PolarHBondContact O-N 3.5Å; P1270-N1272 VanDerWaalsContact O-N 3.13Å; N1272-L1274 VanDerWaalsContact C-N 3.32Å; N1272-L1274 PolarHBondContact O-N 3.36Å; N1272-V1275 PolarHBondContact O-N 2.87Å; N1272-E1276 PolarHBondContact O-N 3.22Å; N1272-E1276 VanDerWaalsContact O-N 3.13Å
1273	E	80.3	Confident	80.1	Confident	79 Å²	79	44.2 Å²	44.2	37%	0.369	22%	0.222	S	C	.	.	H	α-helix	trans	-69.5	-33.6	-178.4	-66.8	167.6	-172.3	0	0	110.6	I1187 I1269 P1270 E1276 L1277	I1187-E1273 VanDerWaalsContact CD1-OE2 3.23Å; I1187-E1273 WeakPolarHBondContact CD1-OE2 3.49Å; I1269-E1273 HydrophobicContact CG2-CB 4Å; P1270-E1273 VanDerWaalsContact CD-OE2 3.22Å; P1270-E1273 WeakPolarHBondContact CD-OE2 3.07Å; P1270-E1273 HydrophobicContact CG-CB 4.07Å; P1270-E1273 VanDerWaalsContact CG-CD 3.41Å; P1270-E1273 HydrophobicContact CG-CG 3.98Å; P1270-E1273 WeakPolarHBondContact CG-OE2 3.38Å; P1270-E1273 PolarHBondContact O-N 3.38Å; P1270-E1273 VanDerWaalsContact O-N 3.11Å; E1273-E1276 PolarHBondContact O-N 3.29Å; E1273-L1277 WeakPolarHBondContact O-CB 3.35Å; E1273-L1277 VanDerWaalsContact O-CG 3.23Å; E1273-L1277 WeakPolarHBondContact O-CG 3.14Å; E1273-L1277 PolarHBondContact O-N 3.31Å
1274	L	83.7	Confident	79.8	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-44.5	172.2	-177.9	60.1	0	0	0	111.5	V1266 I1269 P1270 N1272 E1276 L1277 L1278 I1282 R1325 V1326	V1266-L1274 HydrophobicContact CG1-CD1 4.37Å; I1269-L1274 HydrophobicContact CB-CB 4.47Å; I1269-L1274 HydrophobicContact CD1-CD1 4.48Å; I1269-L1274 HydrophobicContact CG2-CB 3.93Å; P1270-L1274 PolarHBondContact O-N 3.48Å; N1272-L1274 VanDerWaalsContact C-N 3.32Å; N1272-L1274 PolarHBondContact O-N 3.36Å; L1274-E1276 VanDerWaalsContact C-N 3.31Å; L1274-E1276 PolarHBondContact O-N 2.79Å; L1274-L1277 PolarHBondContact O-N 3.17Å; L1274-L1278 HydrophobicContact CD1-CD1 4.08Å; L1274-L1278 HydrophobicContact CD1-CG 4.18Å; L1274-L1278 HydrophobicContact CG-CD1 3.91Å; L1274-L1278 HydrophobicContact CG-CG 4.48Å; L1274-L1278 WeakPolarHBondContact O-CB 3.39Å; L1274-L1278 WeakPolarHBondContact O-CD1 3.12Å; L1274-L1278 WeakPolarHBondContact O-CG 3.5Å; L1274-L1278 PolarHBondContact O-N 3.04Å; L1274-I1282 HydrophobicContact CD1-CD1 4.35Å; L1274-R1325 HydrophobicContact CD2-CB 4.17Å; L1274-V1326 HydrophobicContact CD2-CG2 3.98Å; L1274-V1326 HydrophobicContact CG-CG2 4.28Å
1275	V	80.7	Confident	79.5	Confident	39 Å²	39	50.7 Å²	50.7	24%	0.236	25%	0.254	C	S	.	.	H	α-helix	trans	-66.5	-30.6	177.4	169.1	0	0	0	0	112.5	D1271 N1272 Q1279 V1326	D1271-V1275 WeakPolarHBondContact O-CG2 3.32Å; D1271-V1275 PolarHBondContact O-N 3.47Å; N1272-V1275 PolarHBondContact O-N 2.87Å; V1275-Q1279 WeakPolarHBondContact O-CG 3.38Å; V1275-Q1279 PolarHBondContact O-NE2 2.87Å; V1275-V1326 HydrophobicContact CG2-CG1 3.63Å
1276	E	81.2	Confident	79.4	Confident	139 Å²	139	50.4 Å²	50.4	65%	0.65	25%	0.253	S	S	*	.	H	α-helix	trans	-73.3	-50	172.7	-70.4	179.6	-179.8	0	0	111.6	N1272 E1273 L1274 L1278 Q1279	N1272-E1276 PolarHBondContact O-N 3.22Å; N1272-E1276 VanDerWaalsContact O-N 3.13Å; E1273-E1276 PolarHBondContact O-N 3.29Å; L1274-E1276 VanDerWaalsContact C-N 3.31Å; L1274-E1276 PolarHBondContact O-N 2.79Å; E1276-L1278 VanDerWaalsContact C-N 3.26Å; E1276-L1278 PolarHBondContact O-N 3.37Å; E1276-Q1279 PolarHBondContact O-N 3.03Å; E1276-Q1279 VanDerWaalsContact O-N 3.15Å
1277	L	77.1	Confident	79.5	Confident	40 Å²	40	50.4 Å²	50.4	21%	0.209	25%	0.253	C	S	.	.	H	α-helix	trans	-63.5	-27.3	179.6	-69.7	168.5	0	0	0	113.7	L1191 I1269 E1273 L1274 S1281 I1282	L1191-L1277 HydrophobicContact CD2-CD1 3.98Å; L1191-L1277 HydrophobicContact CD2-CD2 3.88Å; L1191-L1277 HydrophobicContact CD2-CG 4.48Å; I1269-L1277 HydrophobicContact CD1-CD1 4.37Å; I1269-L1277 HydrophobicContact CG2-CD1 4.3Å; E1273-L1277 WeakPolarHBondContact O-CB 3.35Å; E1273-L1277 VanDerWaalsContact O-CG 3.23Å; E1273-L1277 WeakPolarHBondContact O-CG 3.14Å; E1273-L1277 PolarHBondContact O-N 3.31Å; L1274-L1277 PolarHBondContact O-N 3.17Å; L1277-S1281 PolarHBondContact O-N 3.32Å; L1277-S1281 PolarHBondContact O-OG 3.24Å; L1277-S1281 VanDerWaalsContact O-OG 3.05Å; L1277-I1282 HydrophobicContact CB-CD1 3.76Å; L1277-I1282 HydrophobicContact CB-CG1 4.22Å; L1277-I1282 PolarHBondContact O-N 3.16Å
1278	L	74.5	Confident	79.6	Confident	1 Å²	1	51 Å²	51	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-71	-27.3	175.6	-78	166.1	0	0	0	113.9	L1274 E1276 E1280 I1282 I1283 I1322 V1326	L1274-L1278 HydrophobicContact CD1-CD1 4.08Å; L1274-L1278 HydrophobicContact CD1-CG 4.18Å; L1274-L1278 HydrophobicContact CG-CD1 3.91Å; L1274-L1278 HydrophobicContact CG-CG 4.48Å; L1274-L1278 WeakPolarHBondContact O-CB 3.39Å; L1274-L1278 WeakPolarHBondContact O-CD1 3.12Å; L1274-L1278 WeakPolarHBondContact O-CG 3.5Å; L1274-L1278 PolarHBondContact O-N 3.04Å; E1276-L1278 VanDerWaalsContact C-N 3.26Å; E1276-L1278 PolarHBondContact O-N 3.37Å; L1278-E1280 VanDerWaalsContact C-N 3.29Å; L1278-E1280 PolarHBondContact O-N 3.18Å; L1278-I1282 HydrophobicContact CD2-CB 4.14Å; L1278-I1282 HydrophobicContact CD2-CG2 3.99Å; L1278-I1283 HydrophobicContact CB-CD1 4.39Å; L1278-I1283 HydrophobicContact CD2-CD1 4.26Å; L1278-I1283 HydrophobicContact CD2-CG1 3.97Å; L1278-I1283 WeakPolarHBondContact O-CB 3.18Å; L1278-I1283 VanDerWaalsContact O-CD1 3.25Å; L1278-I1283 WeakPolarHBondContact O-CD1 3.46Å; L1278-I1283 WeakPolarHBondContact O-CG1 3.29Å; L1278-I1322 HydrophobicContact CD1-CG2 3.84Å; L1278-I1322 HydrophobicContact CD2-CD1 4.28Å; L1278-I1322 HydrophobicContact CD2-CG2 3.65Å; L1278-I1322 HydrophobicContact CG-CG2 4.41Å; L1278-V1326 HydrophobicContact CD1-CG2 3.53Å
1279	Q	67.6	Low	79.6	Confident	117 Å²	117	50.9 Å²	50.9	55%	0.547	26%	0.256	S	S	.	.	H	α-helix	trans	-67.8	-28.9	-172.7	-76.7	169	72.1	0	0	113.1	V1275 E1276	V1275-Q1279 WeakPolarHBondContact O-CG 3.38Å; V1275-Q1279 PolarHBondContact O-NE2 2.87Å; E1276-Q1279 PolarHBondContact O-N 3.03Å; E1276-Q1279 VanDerWaalsContact O-N 3.15Å
1280	E	67.8	Low	79.5	Confident	146 Å²	146	50.9 Å²	50.9	68%	0.682	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130	-68.8	178	-62.1	-172.6	152.5	0	0	111.9	L1278 Q1284	L1278-E1280 VanDerWaalsContact C-N 3.29Å; L1278-E1280 PolarHBondContact O-N 3.18Å; E1280-Q1284 VanDerWaalsContact O-CB 3.3Å; E1280-Q1284 WeakPolarHBondContact O-CB 3.42Å; E1280-Q1284 WeakPolarHBondContact O-CG 3.43Å; E1280-Q1284 PolarHBondContact O-N 3.23Å
1281	S	71.6	Confident	79.6	Confident	25 Å²	25	48.5 Å²	48.5	18%	0.175	24%	0.241	C	C	.	.	I	π-helix	trans	-67	-52.3	-163.6	65.4	0	0	0	0	114.7	L1277 I1283 D1285	L1277-S1281 PolarHBondContact O-N 3.32Å; L1277-S1281 PolarHBondContact O-OG 3.24Å; L1277-S1281 VanDerWaalsContact O-OG 3.05Å; S1281-I1283 PolarHBondContact O-N 3.04Å; S1281-D1285 WeakPolarHBondContact O-CA 3.5Å; S1281-D1285 VanDerWaalsContact O-CB 3.29Å; S1281-D1285 WeakPolarHBondContact O-CB 3.31Å; S1281-D1285 PolarHBondContact O-N 2.99Å
1282	I	78.3	Confident	79.7	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	I	π-helix	trans	-69.7	-39	-173.2	-62.6	176	0	0	0	111.4	L1191 L1274 L1277 L1278 I1286 L1287 I1322	L1191-I1282 HydrophobicContact CD1-CD1 4.41Å; L1191-I1282 HydrophobicContact CD1-CG1 4.3Å; L1274-I1282 HydrophobicContact CD1-CD1 4.35Å; L1277-I1282 HydrophobicContact CB-CD1 3.76Å; L1277-I1282 HydrophobicContact CB-CG1 4.22Å; L1277-I1282 PolarHBondContact O-N 3.16Å; L1278-I1282 HydrophobicContact CD2-CB 4.14Å; L1278-I1282 HydrophobicContact CD2-CG2 3.99Å; I1282-I1286 HydrophobicContact CG1-CD1 4.35Å; I1282-I1286 HydrophobicContact CG2-CD1 4.48Å; I1282-I1286 WeakPolarHBondContact O-CB 3.44Å; I1282-L1287 HydrophobicContact CG2-CD1 4.16Å; I1282-L1287 WeakPolarHBondContact O-CG 3.48Å; I1282-L1287 PolarHBondContact O-N 2.97Å; I1282-L1287 VanDerWaalsContact O-N 3.1Å; I1282-I1322 HydrophobicContact CG2-CD1 4.14Å
1283	I	81.4	Confident	79.8	Confident	14 Å²	14	46 Å²	46	7%	0.072	22%	0.224	C	C	.	.	I	π-helix	trans	-74.8	-47.9	-178.9	-67.5	-172.3	0	0	0	111.2	L1278 S1281 I1288 Q1334 L1335 I1338	L1278-I1283 HydrophobicContact CB-CD1 4.39Å; L1278-I1283 HydrophobicContact CD2-CD1 4.26Å; L1278-I1283 HydrophobicContact CD2-CG1 3.97Å; L1278-I1283 WeakPolarHBondContact O-CB 3.18Å; L1278-I1283 VanDerWaalsContact O-CD1 3.25Å; L1278-I1283 WeakPolarHBondContact O-CD1 3.46Å; L1278-I1283 WeakPolarHBondContact O-CG1 3.29Å; S1281-I1283 PolarHBondContact O-N 3.04Å; I1283-I1288 HydrophobicContact CG2-CD1 3.77Å; I1283-I1288 HydrophobicContact CG2-CG1 4.31Å; I1283-I1288 WeakPolarHBondContact O-CB 3.11Å; I1283-I1288 VanDerWaalsContact O-CG1 3.29Å; I1283-I1288 WeakPolarHBondContact O-CG1 3.48Å; I1283-I1288 PolarHBondContact O-N 2.86Å; I1283-Q1334 HydrophobicContact CD1-CB 4.28Å; I1283-L1335 HydrophobicContact CD1-CD2 3.98Å; I1283-I1338 HydrophobicContact CB-CD1 4.4Å; I1283-I1338 HydrophobicContact CD1-CD1 4.31Å; I1283-I1338 HydrophobicContact CG1-CD1 4.03Å; I1283-I1338 HydrophobicContact CG2-CD1 3.93Å; I1283-I1338 HydrophobicContact CG2-CG1 4.08Å
1284	Q	81.9	Confident	79.8	Confident	112 Å²	112	42.2 Å²	42.2	52%	0.523	21%	0.206	S	C	.	.	I	π-helix	trans	-84.8	-46.9	-174.9	-56.1	-168.4	37.3	0	0	113.2	E1280 K1289	E1280-Q1284 VanDerWaalsContact O-CB 3.3Å; E1280-Q1284 WeakPolarHBondContact O-CB 3.42Å; E1280-Q1284 WeakPolarHBondContact O-CG 3.43Å; E1280-Q1284 PolarHBondContact O-N 3.23Å; Q1284-K1289 WeakPolarHBondContact O-CG 3.22Å
1285	D	79.4	Confident	79.4	Confident	53 Å²	53	42.3 Å²	42.3	28%	0.283	21%	0.207	S	C	.	.	I	π-helix	trans	-84.3	-13.7	-172.7	-67.2	-52.8	0	0	0	114.8	I1195 S1281 K1289	I1195-D1285 HydrophobicContact CG2-CB 4.23Å; S1281-D1285 WeakPolarHBondContact O-CA 3.5Å; S1281-D1285 VanDerWaalsContact O-CB 3.29Å; S1281-D1285 WeakPolarHBondContact O-CB 3.31Å; S1281-D1285 PolarHBondContact O-N 2.99Å; D1285-K1289 WeakPolarHBondContact O-CD 3.31Å; D1285-K1289 IonicContact OD1-NZ 3.6Å; D1285-K1289 PolarHBondContact OD1-NZ 3.11Å
1286	I	82.8	Confident	79.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.204	C	C	.	.	I	π-helix	trans	-118.5	-67.6	178.2	-50.7	171.7	0	0	0	110.4	L1191 V1194 I1195 I1198 L1259 L1262 I1282 A1290	L1191-I1286 HydrophobicContact CD1-CD1 4.29Å; V1194-I1286 HydrophobicContact CG1-CD1 3.55Å; V1194-I1286 HydrophobicContact CG1-CG1 4.05Å; V1194-I1286 HydrophobicContact CG1-CG2 4.35Å; I1195-I1286 HydrophobicContact CG1-CD1 4.08Å; I1195-I1286 HydrophobicContact CG1-CG1 4.08Å; I1198-I1286 HydrophobicContact CD1-CB 4.06Å; I1198-I1286 HydrophobicContact CD1-CG1 4.26Å; I1198-I1286 HydrophobicContact CD1-CG2 3.41Å; I1198-I1286 VanDerWaalsContact CD1-CG2 3.41Å; L1259-I1286 HydrophobicContact CD2-CG2 4.27Å; L1262-I1286 HydrophobicContact CD1-CD1 4.32Å; L1262-I1286 HydrophobicContact CD2-CB 4.44Å; L1262-I1286 HydrophobicContact CD2-CD1 3.95Å; L1262-I1286 HydrophobicContact CD2-CG2 3.52Å; I1282-I1286 HydrophobicContact CG1-CD1 4.35Å; I1282-I1286 HydrophobicContact CG2-CD1 4.48Å; I1282-I1286 WeakPolarHBondContact O-CB 3.44Å; I1286-A1290 VanDerWaalsContact O-CB 3.31Å; I1286-A1290 WeakPolarHBondContact O-CB 3.42Å; I1286-A1290 PolarHBondContact O-N 2.68Å
1287	L	85.7	Confident	78.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.192	C	C	.	.	I	π-helix	trans	-70.5	-51.9	-165.1	-68	172.8	0	0	0	113.4	I1282 K1289 A1290 V1291 F1315 V1318 V1319 I1322 I1338	I1282-L1287 HydrophobicContact CG2-CD1 4.16Å; I1282-L1287 WeakPolarHBondContact O-CG 3.48Å; I1282-L1287 PolarHBondContact O-N 2.97Å; I1282-L1287 VanDerWaalsContact O-N 3.1Å; L1287-K1289 VanDerWaalsContact C-N 3.33Å; L1287-K1289 PolarHBondContact O-N 3.08Å; L1287-A1290 PolarHBondContact O-N 3.17Å; L1287-V1291 WeakPolarHBondContact O-CG2 3.36Å; L1287-V1291 PolarHBondContact O-N 3.08Å; L1287-V1291 VanDerWaalsContact O-N 3.08Å; L1287-F1315 HydrophobicContact CB-CE2 4.28Å; L1287-F1315 HydrophobicContact CD2-CD2 3.88Å; L1287-F1315 HydrophobicContact CD2-CE2 4.01Å; L1287-V1318 HydrophobicContact CD2-CB 4.35Å; L1287-V1318 HydrophobicContact CD2-CG1 3.82Å; L1287-V1319 HydrophobicContact CD1-CG2 4.36Å; L1287-V1319 HydrophobicContact CD2-CG2 4.18Å; L1287-I1322 HydrophobicContact CD1-CD1 3.85Å; L1287-I1338 HydrophobicContact CB-CD1 4.05Å; L1287-I1338 HydrophobicContact CD1-CD1 3.74Å
1288	I	85.5	Confident	78.5	Confident	28 Å²	28	41.6 Å²	41.6	14%	0.144	20%	0.203	C	C	.	.	I	π-helix	trans	-61.6	-43.9	178.4	-71.9	171.9	0	0	0	110.5	I1283 V1291 Q1292 I1338 I1341	I1283-I1288 HydrophobicContact CG2-CD1 3.77Å; I1283-I1288 HydrophobicContact CG2-CG1 4.31Å; I1283-I1288 WeakPolarHBondContact O-CB 3.11Å; I1283-I1288 VanDerWaalsContact O-CG1 3.29Å; I1283-I1288 WeakPolarHBondContact O-CG1 3.48Å; I1283-I1288 PolarHBondContact O-N 2.86Å; I1288-V1291 PolarHBondContact O-N 3.49Å; I1288-Q1292 HydrophobicContact CG2-CG 4.27Å; I1288-Q1292 WeakPolarHBondContact O-CB 3.41Å; I1288-Q1292 VanDerWaalsContact O-CG 3.27Å; I1288-Q1292 WeakPolarHBondContact O-CG 3.44Å; I1288-Q1292 PolarHBondContact O-N 3.33Å; I1288-I1338 HydrophobicContact CG1-CG1 4.49Å; I1288-I1341 HydrophobicContact CD1-CD1 4.08Å; I1288-I1341 HydrophobicContact CG1-CD1 4.04Å; I1288-I1341 HydrophobicContact CG2-CD1 4.33Å
1289	K	84.1	Confident	78.4	Confident	50 Å²	50	41.8 Å²	41.8	22%	0.217	20%	0.203	C	C	.	.	H	α-helix	trans	-59.7	-44.3	177	-85.8	-179.8	-169	167.7	0	113	I1198 I1202 Q1284 D1285 L1287 Q1292 M1293	I1198-K1289 HydrophobicContact CG2-CB 4.26Å; I1202-K1289 HydrophobicContact CD1-CB 3.55Å; I1202-K1289 HydrophobicContact CD1-CD 3.91Å; I1202-K1289 HydrophobicContact CD1-CG 3.83Å; Q1284-K1289 WeakPolarHBondContact O-CG 3.22Å; D1285-K1289 WeakPolarHBondContact O-CD 3.31Å; D1285-K1289 IonicContact OD1-NZ 3.6Å; D1285-K1289 PolarHBondContact OD1-NZ 3.11Å; L1287-K1289 VanDerWaalsContact C-N 3.33Å; L1287-K1289 PolarHBondContact O-N 3.08Å; K1289-Q1292 PolarHBondContact O-N 2.78Å; K1289-M1293 PolarHBondContact O-N 2.95Å
1290	A	83.1	Confident	78.5	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-65.5	-41.8	177	0	0	0	0	0	112.9	L1259 I1286 L1287 M1293 S1294	L1259-A1290 HydrophobicContact CD1-CB 4.48Å; L1259-A1290 HydrophobicContact CD2-CB 4.47Å; I1286-A1290 VanDerWaalsContact O-CB 3.31Å; I1286-A1290 WeakPolarHBondContact O-CB 3.42Å; I1286-A1290 PolarHBondContact O-N 2.68Å; L1287-A1290 PolarHBondContact O-N 3.17Å; A1290-M1293 PolarHBondContact O-N 3.14Å; A1290-S1294 PolarHBondContact O-N 3.48Å
1291	V	85.5	Confident	78.9	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-64.6	-46.5	175.5	175.7	0	0	0	0	110.9	L1287 I1288 M1293 S1294 G1295 F1315 I1341 L1345	L1287-V1291 WeakPolarHBondContact O-CG2 3.36Å; L1287-V1291 PolarHBondContact O-N 3.08Å; L1287-V1291 VanDerWaalsContact O-N 3.08Å; I1288-V1291 PolarHBondContact O-N 3.49Å; V1291-M1293 VanDerWaalsContact C-N 3.3Å; V1291-M1293 PolarHBondContact O-N 3.28Å; V1291-S1294 PolarHBondContact O-N 3.09Å; V1291-S1294 VanDerWaalsContact O-N 3.12Å; V1291-S1294 PolarHBondContact O-OG 3.37Å; V1291-G1295 PolarHBondContact O-N 2.83Å; V1291-F1315 HydrophobicContact CG2-CD1 4Å; V1291-F1315 HydrophobicContact CG2-CD2 3.54Å; V1291-F1315 HydrophobicContact CG2-CE1 3.68Å; V1291-F1315 HydrophobicContact CG2-CE2 3.17Å; V1291-F1315 HydrophobicContact CG2-CG 3.94Å; V1291-F1315 HydrophobicContact CG2-CZ 3.24Å; V1291-I1341 HydrophobicContact CG1-CG2 3.95Å; V1291-L1345 HydrophobicContact CG1-CD1 3.74Å
1292	Q	82.6	Confident	78.9	Confident	111 Å²	111	32.7 Å²	32.7	52%	0.519	17%	0.168	S	C	.	.	H	α-helix	trans	-59.2	-39.7	178.1	-75.3	176.2	-3.3	0	0	112.3	I1288 K1289 G1295 R1296	I1288-Q1292 HydrophobicContact CG2-CG 4.27Å; I1288-Q1292 WeakPolarHBondContact O-CB 3.41Å; I1288-Q1292 VanDerWaalsContact O-CG 3.27Å; I1288-Q1292 WeakPolarHBondContact O-CG 3.44Å; I1288-Q1292 PolarHBondContact O-N 3.33Å; K1289-Q1292 PolarHBondContact O-N 2.78Å; Q1292-G1295 PolarHBondContact O-N 2.93Å; Q1292-R1296 PolarHBondContact O-N 2.95Å
1293	M	80.3	Confident	78.4	Confident	8 Å²	8	33.6 Å²	33.6	4%	0.039	18%	0.177	C	C	.	.	H	α-helix	trans	-58.4	-48.2	172.4	-86.8	-158.5	66.9	0	0	112.6	I1201 I1202 L1205 F1247 L1255 K1289 A1290 V1291 G1295 R1296	I1201-M1293 HydrophobicContact CG2-CE 4.08Å; I1201-M1293 HydrophobicContact CG2-SD 3.98Å; I1202-M1293 HydrophobicContact CD1-CG 4.2Å; I1202-M1293 HydrophobicContact CD1-SD 4.21Å; I1202-M1293 HydrophobicContact CG1-CG 3.88Å; I1202-M1293 HydrophobicContact CG1-SD 3.56Å; I1202-M1293 VanDerWaalsContact CG1-SD 3.56Å; L1205-M1293 HydrophobicContact CD1-CE 3.37Å; L1205-M1293 HydrophobicContact CD1-SD 4.31Å; F1247-M1293 HydrophobicContact CD2-CE 4.43Å; F1247-M1293 HydrophobicContact CE2-CE 3.82Å; F1247-M1293 HydrophobicContact CZ-CE 3.9Å; L1255-M1293 HydrophobicContact CD2-CE 4.49Å; L1255-M1293 HydrophobicContact CD2-SD 4.2Å; K1289-M1293 PolarHBondContact O-N 2.95Å; A1290-M1293 PolarHBondContact O-N 3.14Å; V1291-M1293 VanDerWaalsContact C-N 3.3Å; V1291-M1293 PolarHBondContact O-N 3.28Å; M1293-G1295 PolarHBondContact O-N 3.43Å; M1293-R1296 PolarHBondContact O-N 3.09Å
1294	S	81.4	Confident	78.4	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.2	-34.1	-179.3	73.1	0	0	0	0	113	A1290 V1291 R1308 L1312	A1290-S1294 PolarHBondContact O-N 3.48Å; V1291-S1294 PolarHBondContact O-N 3.09Å; V1291-S1294 VanDerWaalsContact O-N 3.12Å; V1291-S1294 PolarHBondContact O-OG 3.37Å; S1294-R1308 PolarHBondContact O-NH1 3.47Å; S1294-L1312 WeakPolarHBondContact OG-CD2 3.39Å
1295	G	75.5	Confident	78.4	Confident	2 Å²	2	29.9 Å²	29.9	2%	0.021	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	3.2	-179	0	0	0	0	0	115.9	V1291 Q1292 M1293 R1348	V1291-G1295 PolarHBondContact O-N 2.83Å; Q1292-G1295 PolarHBondContact O-N 2.93Å; M1293-G1295 PolarHBondContact O-N 3.43Å; G1295-R1348 PolarHBondContact O-NH1 3.32Å
1296	R	79.3	Confident	78.5	Confident	47 Å²	47	30.1 Å²	30.1	18%	0.177	17%	0.167	C	C	.	.			trans	-68.8	139.4	-179.1	-88.6	-179.3	87.1	157.4	-4.4	112.6	L1205 N1206 Q1292 M1293 D1298 I1299 R1308	L1205-R1296 PolarHBondContact O-NH2 3.22Å; L1205-R1296 VanDerWaalsContact O-NH2 3.08Å; N1206-R1296 PolarHBondContact OD1-NH1 2.99Å; N1206-R1296 PolarHBondContact OD1-NH2 2.77Å; Q1292-R1296 PolarHBondContact O-N 2.95Å; M1293-R1296 PolarHBondContact O-N 3.09Å; R1296-D1298 VanDerWaalsContact CB-OD1 3.3Å; R1296-D1298 WeakPolarHBondContact CB-OD1 3.45Å; R1296-D1298 WeakPolarHBondContact CG-OD1 3.38Å; R1296-D1298 IonicContact CZ-OD1 2.69Å; R1296-D1298 IonicContact CZ-OD2 3.52Å; R1296-D1298 IonicContact NE-OD1 3.48Å; R1296-D1298 PolarHBondContact NE-OD1 3.28Å; R1296-D1298 IonicContact NE-OD2 3.76Å; R1296-D1298 PolarHBondContact NE-OD2 2.89Å; R1296-D1298 IonicContact NH2-OD1 3.46Å; R1296-D1298 IonicContact NH2-OD2 3.66Å; R1296-D1298 PolarHBondContact NH2-OD2 2.9Å; R1296-I1299 HydrophobicContact CB-CD1 4.46Å; R1296-R1308 PolarHBondContact O-NH1 3.01Å
1297	L	70.8	Confident	78.5	Confident	75 Å²	75	30.1 Å²	30.1	39%	0.393	17%	0.167	S	C	.	.	S	Bend	trans	-95.4	-11.2	-177	-75.4	159.2	0	0	0	112.6	F1407 L1410	L1297-F1407 HydrophobicContact CD2-CD2 4.47Å; L1297-L1410 HydrophobicContact CD2-CD1 3.45Å; L1297-L1410 VanDerWaalsContact CD2-CD1 3.45Å; L1297-L1410 HydrophobicContact CG-CD1 4.25Å
1298	D	69.8	Low	78.5	Confident	82 Å²	82	30.1 Å²	30.1	44%	0.439	17%	0.167	S	C	.	.	S	Bend	trans	-108.2	-0.2	-170.7	58.3	-44.4	0	0	0	113.4	R1296	R1296-D1298 VanDerWaalsContact CB-OD1 3.3Å; R1296-D1298 WeakPolarHBondContact CB-OD1 3.45Å; R1296-D1298 WeakPolarHBondContact CG-OD1 3.38Å; R1296-D1298 IonicContact CZ-OD1 2.69Å; R1296-D1298 IonicContact CZ-OD2 3.52Å; R1296-D1298 IonicContact NE-OD1 3.48Å; R1296-D1298 PolarHBondContact NE-OD1 3.28Å; R1296-D1298 IonicContact NE-OD2 3.76Å; R1296-D1298 PolarHBondContact NE-OD2 2.89Å; R1296-D1298 IonicContact NH2-OD1 3.46Å; R1296-D1298 IonicContact NH2-OD2 3.66Å; R1296-D1298 PolarHBondContact NH2-OD2 2.9Å
1299	I	73.2	Confident	78.5	Confident	4 Å²	4	30.9 Å²	30.9	2%	0.021	17%	0.168	C	C	.	.			trans	-128.1	131.3	179.3	-52.9	176.7	0	0	0	108	L1205 F1247 R1296 R1308	L1205-I1299 HydrophobicContact CB-CD1 4.11Å; L1205-I1299 HydrophobicContact CD1-CD1 4.22Å; L1205-I1299 HydrophobicContact CD2-CD1 4.33Å; L1205-I1299 HydrophobicContact CG-CD1 4.46Å; F1247-I1299 HydrophobicContact CB-CG2 4.04Å; F1247-I1299 HydrophobicContact CD1-CG2 4.46Å; F1247-I1299 HydrophobicContact CG-CG2 4.44Å; R1296-I1299 HydrophobicContact CB-CD1 4.46Å; I1299-R1308 PolarHBondContact O-NH2 3.46Å
1300	S	69.7	Low	78.5	Confident	71 Å²	71	28.6 Å²	28.6	50%	0.497	16%	0.158	S	C	.	.	P	Polyproline II helix	trans	-92.4	139.8	165.7	47.5	0	0	0	0	109.9
1301	F	76.1	Confident	78.7	Confident	10 Å²	10	28.6 Å²	28.6	4%	0.044	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-89.1	144.3	-178.9	-80	-117.8	0	0	0	111.6	F1247 L1252 G1303 G1304 R1308 I1311 E1409	F1247-F1301 HydrophobicContact CD1-CD1 4.12Å; F1247-F1301 HydrophobicContact CD1-CE1 4.26Å; F1247-F1301 HydrophobicContact CD1-CG 4.36Å; F1247-F1301 AromaticContact CE1-CD1 3.53Å; F1247-F1301 HydrophobicContact CE1-CD1 3.53Å; F1247-F1301 AromaticContact CE1-CE1 3.49Å; F1247-F1301 HydrophobicContact CE1-CE1 3.49Å; F1247-F1301 VanDerWaalsContact CE1-CE1 3.49Å; F1247-F1301 HydrophobicContact CE1-CG 4.21Å; F1247-F1301 HydrophobicContact CE1-CZ 4.19Å; F1247-F1301 HydrophobicContact CZ-CE1 4.19Å; L1252-F1301 HydrophobicContact CD1-CD1 4.27Å; F1301-G1303 PolarHBondContact O-N 3.22Å; F1301-G1304 WeakPolarHBondContact O-CA 3.49Å; F1301-G1304 PolarHBondContact O-N 3.02Å; F1301-R1308 HydrophobicContact CB-CG 3.91Å; F1301-R1308 HydrophobicContact CD1-CG 3.83Å; F1301-R1308 HydrophobicContact CD2-CG 3.57Å; F1301-R1308 HydrophobicContact CE1-CG 4.3Å; F1301-R1308 HydrophobicContact CE2-CG 4.04Å; F1301-R1308 HydrophobicContact CG-CG 3.47Å; F1301-R1308 VanDerWaalsContact CG-CG 3.47Å; F1301-R1308 HydrophobicContact CZ-CG 4.39Å; F1301-I1311 HydrophobicContact CD1-CD1 4.11Å; F1301-I1311 HydrophobicContact CE1-CD1 3.47Å; F1301-I1311 VanDerWaalsContact CE1-CD1 3.47Å; F1301-I1311 HydrophobicContact CZ-CD1 4.46Å; F1301-E1409 WeakPolarHBondContact CB-OE1 3.44Å; F1301-E1409 PolarHBondContact N-OE1 2.88Å
1302	P	70	Confident	78.9	Confident	17 Å²	17	28.5 Å²	28.5	11%	0.11	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	122.6	173.5	29.3	-32.9	0	0	0	108.6	F1247 Y1249 L1252 G1304	F1247-P1302 VanDerWaalsContact CD1-CD 3.44Å; F1247-P1302 HydrophobicContact CD1-CG 4.23Å; F1247-P1302 HydrophobicContact CE1-CG 4.47Å; F1247-P1302 VanDerWaalsContact O-CD 3.31Å; F1247-P1302 WeakPolarHBondContact O-CD 2.99Å; F1247-P1302 VanDerWaalsContact O-CG 3.31Å; F1247-P1302 WeakPolarHBondContact O-CG 3.17Å; Y1249-P1302 HydrophobicContact CD1-CB 3.8Å; Y1249-P1302 HydrophobicContact CD1-CG 4.3Å; Y1249-P1302 HydrophobicContact CD2-CB 3.98Å; Y1249-P1302 VanDerWaalsContact CE1-C 3.47Å; Y1249-P1302 HydrophobicContact CE1-CB 3.82Å; Y1249-P1302 HydrophobicContact CE2-CB 4Å; Y1249-P1302 HydrophobicContact CG-CB 3.88Å; Y1249-P1302 HydrophobicContact CG-CG 4.47Å; L1252-P1302 HydrophobicContact CB-CG 3.96Å; L1252-P1302 HydrophobicContact CD2-CG 3.74Å; L1252-P1302 WeakPolarHBondContact CD2-O 3.47Å; P1302-G1304 VanDerWaalsContact C-N 3.31Å
1303	G	69.2	Low	79.1	Confident	19 Å²	19	23.9 Å²	23.9	20%	0.196	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.6	-2.4	-168.3	0	0	0	0	0	114.6	Y1249 F1301	Y1249-G1303 WeakPolarHBondContact OH-CA 3.32Å; Y1249-G1303 PolarHBondContact OH-N 3.29Å; Y1249-G1303 VanDerWaalsContact OH-N 3.14Å; F1301-G1303 PolarHBondContact O-N 3.22Å
1304	G	80.2	Confident	79.4	Confident	20 Å²	20	24 Å²	24	21%	0.206	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	-130.2	177.6	0	0	0	0	0	112.9	F1301 P1302 I1306 G1307 R1308 E1409	F1301-G1304 WeakPolarHBondContact O-CA 3.49Å; F1301-G1304 PolarHBondContact O-N 3.02Å; P1302-G1304 VanDerWaalsContact C-N 3.31Å; G1304-I1306 PolarHBondContact O-N 2.91Å; G1304-G1307 WeakPolarHBondContact O-CA 3.26Å; G1304-G1307 PolarHBondContact O-N 3.26Å; G1304-R1308 PolarHBondContact O-N 3.01Å; G1304-E1409 VanDerWaalsContact C-OE1 3.24Å; G1304-E1409 WeakPolarHBondContact CA-OE1 3.49Å
1305	V	81.3	Confident	79.8	Confident	28 Å²	28	24.1 Å²	24.1	17%	0.17	14%	0.136	C	C	.	.	H	α-helix	trans	-44.7	-42.1	179.1	174.8	0	0	0	0	113.2	G1307 R1309 E1409 E1412 T1413	V1305-G1307 PolarHBondContact O-N 3.44Å; V1305-R1309 HydrophobicContact CG1-CG 4.38Å; V1305-R1309 WeakPolarHBondContact O-CB 3.32Å; V1305-R1309 WeakPolarHBondContact O-CG 3.33Å; V1305-R1309 PolarHBondContact O-N 3.24Å; V1305-E1409 HydrophobicContact CG2-CG 4.02Å; V1305-E1412 HydrophobicContact CG1-CB 4.3Å; V1305-E1412 WeakPolarHBondContact CG1-O 3.11Å; V1305-E1412 HydrophobicContact CG2-CB 3.55Å; V1305-T1413 HydrophobicContact CB-CG2 3.97Å; V1305-T1413 HydrophobicContact CG1-CG2 3.75Å; V1305-T1413 HydrophobicContact CG2-CG2 4.14Å
1306	I	81.9	Confident	80.4	Confident	58 Å²	58	24 Å²	24	30%	0.297	14%	0.135	S	C	.	.	H	α-helix	trans	-61.7	-46	179.9	-60.1	174.1	0	0	0	110.4	L1136 G1304 R1309 A1310	L1136-I1306 HydrophobicContact CB-CG2 4.3Å; L1136-I1306 VanDerWaalsContact O-CG2 3.24Å; L1136-I1306 WeakPolarHBondContact O-CG2 3.37Å; G1304-I1306 PolarHBondContact O-N 2.91Å; I1306-R1309 PolarHBondContact O-N 3.3Å; I1306-A1310 WeakPolarHBondContact O-CB 3.38Å; I1306-A1310 PolarHBondContact O-N 2.91Å
1307	G	82.6	Confident	80.7	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66.6	-41.2	-178.7	0	0	0	0	0	113.6	G1304 V1305	G1304-G1307 WeakPolarHBondContact O-CA 3.26Å; G1304-G1307 PolarHBondContact O-N 3.26Å; V1305-G1307 PolarHBondContact O-N 3.44Å
1308	R	87.1	Confident	81.5	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.1	-45.9	174.1	-65.6	-166	-159.5	-126.2	5.1	112.1	S1294 R1296 I1299 F1301 G1304 A1310 I1311 L1312 E1409 T1413	S1294-R1308 PolarHBondContact O-NH1 3.47Å; R1296-R1308 PolarHBondContact O-NH1 3.01Å; I1299-R1308 PolarHBondContact O-NH2 3.46Å; F1301-R1308 HydrophobicContact CB-CG 3.91Å; F1301-R1308 HydrophobicContact CD1-CG 3.83Å; F1301-R1308 HydrophobicContact CD2-CG 3.57Å; F1301-R1308 HydrophobicContact CE1-CG 4.3Å; F1301-R1308 HydrophobicContact CE2-CG 4.04Å; F1301-R1308 HydrophobicContact CG-CG 3.47Å; F1301-R1308 VanDerWaalsContact CG-CG 3.47Å; F1301-R1308 HydrophobicContact CZ-CG 4.39Å; G1304-R1308 PolarHBondContact O-N 3.01Å; R1308-A1310 VanDerWaalsContact C-N 3.3Å; R1308-A1310 PolarHBondContact O-N 3.48Å; R1308-I1311 PolarHBondContact O-N 3.49Å; R1308-L1312 WeakPolarHBondContact O-CG 3.29Å; R1308-L1312 PolarHBondContact O-N 3.47Å; R1308-L1312 VanDerWaalsContact O-N 3.11Å; R1308-E1409 IonicContact CZ-OE1 2.68Å; R1308-E1409 IonicContact CZ-OE2 3.53Å; R1308-E1409 IonicContact NE-OE1 3.84Å; R1308-E1409 PolarHBondContact NE-OE1 3.2Å; R1308-E1409 IonicContact NE-OE2 3.76Å; R1308-E1409 PolarHBondContact NE-OE2 3.45Å; R1308-E1409 VanDerWaalsContact NH2-CD 3.34Å; R1308-E1409 IonicContact NH2-OE1 2.75Å; R1308-E1409 IonicContact NH2-OE2 2.84Å; R1308-E1409 PolarHBondContact NH2-OE2 2.92Å; R1308-T1413 HydrophobicContact CB-CG2 3.76Å; R1308-T1413 HydrophobicContact CG-CG2 4.45Å
1309	R	84.8	Confident	82.4	Confident	44 Å²	44	14.8 Å²	14.8	17%	0.166	9%	0.09	C	C	.	.	H	α-helix	trans	-60	-39.2	178.1	-76.6	-178.9	-175.1	-117.9	17.5	111.7	V1305 I1306 I1311 L1312 Y1313 E1412 T1413 D1415	V1305-R1309 HydrophobicContact CG1-CG 4.38Å; V1305-R1309 WeakPolarHBondContact O-CB 3.32Å; V1305-R1309 WeakPolarHBondContact O-CG 3.33Å; V1305-R1309 PolarHBondContact O-N 3.24Å; I1306-R1309 PolarHBondContact O-N 3.3Å; R1309-I1311 PolarHBondContact O-N 3.06Å; R1309-L1312 PolarHBondContact O-N 2.72Å; R1309-L1312 VanDerWaalsContact O-N 3.17Å; R1309-Y1313 HydrophobicContact CB-CD2 4.42Å; R1309-Y1313 HydrophobicContact CB-CE2 3.84Å; R1309-Y1313 PolarHBondContact NH1-OH 2.69Å; R1309-Y1313 VanDerWaalsContact O-CD2 3.26Å; R1309-Y1313 WeakPolarHBondContact O-CD2 2.97Å; R1309-Y1313 VanDerWaalsContact O-CG 3.22Å; R1309-Y1313 PolarHBondContact O-N 2.97Å; R1309-E1412 PolarHBondContact NE-O 3.24Å; R1309-E1412 PolarHBondContact NH2-O 3.23Å; R1309-T1413 HydrophobicContact CG-CG2 4.25Å; R1309-D1415 IonicContact CZ-OD1 2.76Å; R1309-D1415 IonicContact CZ-OD2 3.01Å; R1309-D1415 VanDerWaalsContact CZ-OD2 3.23Å; R1309-D1415 VanDerWaalsContact NH1-CG 3.32Å; R1309-D1415 IonicContact NH1-OD1 3.8Å; R1309-D1415 PolarHBondContact NH1-OD1 3.22Å; R1309-D1415 IonicContact NH1-OD2 2.64Å; R1309-D1415 PolarHBondContact NH1-OD2 2.65Å; R1309-D1415 IonicContact NH2-OD1 3.42Å; R1309-D1415 IonicContact NH2-OD2 3.81Å; R1309-D1415 PolarHBondContact NH2-OD2 3.07Å
1310	A	84.8	Confident	83.1	Confident	1 Å²	1	15.7 Å²	15.7	1%	0.008	9%	0.093	C	C	.	.	H	α-helix	trans	-56.4	-45.5	176.4	0	0	0	0	0	113	L1136 L1161 V1256 I1306 R1308 K1314	L1136-A1310 HydrophobicContact CB-CB 4.49Å; L1136-A1310 HydrophobicContact CD2-CB 4.17Å; L1161-A1310 HydrophobicContact CD1-CB 3.87Å; L1161-A1310 HydrophobicContact CD2-CB 4.11Å; V1256-A1310 HydrophobicContact CG2-CB 4.36Å; I1306-A1310 WeakPolarHBondContact O-CB 3.38Å; I1306-A1310 PolarHBondContact O-N 2.91Å; R1308-A1310 VanDerWaalsContact C-N 3.3Å; R1308-A1310 PolarHBondContact O-N 3.48Å; A1310-K1314 WeakPolarHBondContact O-CG 3.41Å; A1310-K1314 PolarHBondContact O-N 3.22Å
1311	I	87.6	Confident	83.9	Confident	1 Å²	1	12.7 Å²	12.7	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-63.2	-48.3	174	-67.2	160.8	0	0	0	110.8	L1252 L1255 V1256 L1259 F1301 R1308 R1309 Y1313 K1314 F1315	L1252-I1311 HydrophobicContact CD1-CD1 3.44Å; L1252-I1311 VanDerWaalsContact CD1-CD1 3.44Å; L1252-I1311 HydrophobicContact CD1-CG1 3.8Å; L1255-I1311 HydrophobicContact CD2-CD1 3.72Å; L1255-I1311 HydrophobicContact CD2-CG1 4.19Å; L1255-I1311 HydrophobicContact CG-CG1 4.49Å; V1256-I1311 HydrophobicContact CG2-CG1 3.96Å; L1259-I1311 HydrophobicContact CD1-CG2 3.96Å; F1301-I1311 HydrophobicContact CD1-CD1 4.11Å; F1301-I1311 HydrophobicContact CE1-CD1 3.47Å; F1301-I1311 VanDerWaalsContact CE1-CD1 3.47Å; F1301-I1311 HydrophobicContact CZ-CD1 4.46Å; R1308-I1311 PolarHBondContact O-N 3.49Å; R1309-I1311 PolarHBondContact O-N 3.06Å; I1311-Y1313 PolarHBondContact O-N 2.94Å; I1311-K1314 PolarHBondContact O-N 2.89Å; I1311-F1315 WeakPolarHBondContact O-CB 3.31Å; I1311-F1315 PolarHBondContact O-N 3.46Å
1312	L	88.8	Confident	84.4	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-63.5	-38.9	-174.8	-69.4	170.8	0	0	0	112.3	S1294 R1308 R1309 F1315 I1316 F1342 F1414 L1418	S1294-L1312 WeakPolarHBondContact OG-CD2 3.39Å; R1308-L1312 WeakPolarHBondContact O-CG 3.29Å; R1308-L1312 PolarHBondContact O-N 3.47Å; R1308-L1312 VanDerWaalsContact O-N 3.11Å; R1309-L1312 PolarHBondContact O-N 2.72Å; R1309-L1312 VanDerWaalsContact O-N 3.17Å; L1312-F1315 PolarHBondContact O-N 2.96Å; L1312-I1316 VanDerWaalsContact O-CG1 3.31Å; L1312-I1316 WeakPolarHBondContact O-CG1 3.35Å; L1312-I1316 PolarHBondContact O-N 2.75Å; L1312-F1342 HydrophobicContact CD2-CE2 4.13Å; L1312-F1414 HydrophobicContact CD1-CE1 4.23Å; L1312-F1414 HydrophobicContact CD1-CZ 3.95Å; L1312-L1418 HydrophobicContact CB-CD1 4.39Å; L1312-L1418 HydrophobicContact CD1-CD2 3.88Å
1313	Y	86.9	Confident	85.2	Confident	15 Å²	15	11.6 Å²	11.6	6%	0.059	7%	0.066	C	C	.	.	H	α-helix	trans	-64.8	-41.3	174.2	-61.1	-31.5	0	0	0	112.6	V1138 N1157 R1159 L1161 R1309 I1311 N1317 L1418 M1421	V1138-Y1313 HydrophobicContact CG2-CD2 4.17Å; V1138-Y1313 HydrophobicContact CG2-CE2 3.61Å; N1157-Y1313 PolarHBondContact ND2-O 3.07Å; R1159-Y1313 HydrophobicContact CB-CD2 4.49Å; L1161-Y1313 HydrophobicContact CD2-CD2 4.49Å; R1309-Y1313 HydrophobicContact CB-CD2 4.42Å; R1309-Y1313 HydrophobicContact CB-CE2 3.84Å; R1309-Y1313 PolarHBondContact NH1-OH 2.69Å; R1309-Y1313 VanDerWaalsContact O-CD2 3.26Å; R1309-Y1313 WeakPolarHBondContact O-CD2 2.97Å; R1309-Y1313 VanDerWaalsContact O-CG 3.22Å; R1309-Y1313 PolarHBondContact O-N 2.97Å; I1311-Y1313 PolarHBondContact O-N 2.94Å; Y1313-N1317 VanDerWaalsContact O-CG 3.31Å; Y1313-N1317 PolarHBondContact O-N 3.29Å; Y1313-L1418 HydrophobicContact CD1-CD1 4.12Å; Y1313-L1418 HydrophobicContact CE1-CD1 3.85Å; Y1313-M1421 HydrophobicContact CE1-CE 3.67Å
1314	K	86.2	Confident	86	Confident	10 Å²	10	14.5 Å²	14.5	4%	0.043	8%	0.076	C	C	.	.	H	α-helix	trans	-67.4	-40.8	175.2	-65.8	-64.1	-174.9	163.3	0	112	Y1130 L1161 D1164 V1256 L1259 T1260 A1310 I1311 N1317 V1318	Y1130-K1314 PolarHBondContact OH-NZ 3.44Å; L1161-K1314 HydrophobicContact CD1-CG 4.47Å; D1164-K1314 WeakPolarHBondContact OD1-CE 3.35Å; D1164-K1314 IonicContact OD1-NZ 3.42Å; D1164-K1314 PolarHBondContact OD1-NZ 2.99Å; D1164-K1314 IonicContact OD2-NZ 3.74Å; D1164-K1314 PolarHBondContact OD2-NZ 2.96Å; V1256-K1314 HydrophobicContact CG1-CG 4.26Å; L1259-K1314 HydrophobicContact CB-CB 4.03Å; L1259-K1314 HydrophobicContact CD1-CB 4.41Å; T1260-K1314 WeakPolarHBondContact OG1-CD 3.28Å; T1260-K1314 WeakPolarHBondContact OG1-CE 3.44Å; T1260-K1314 PolarHBondContact OG1-NZ 3.4Å; A1310-K1314 WeakPolarHBondContact O-CG 3.41Å; A1310-K1314 PolarHBondContact O-N 3.22Å; I1311-K1314 PolarHBondContact O-N 2.89Å; K1314-N1317 WeakPolarHBondContact O-CB 3.15Å; K1314-N1317 PolarHBondContact O-N 3.28Å; K1314-V1318 WeakPolarHBondContact O-CG2 3.19Å; K1314-V1318 PolarHBondContact O-N 3.02Å
1315	F	89.9	Confident	86.2	Confident	2 Å²	2	15 Å²	15	1%	0.009	7%	0.072	C	C	.	.	H	α-helix	trans	-59.1	-47.9	175.7	161.7	-96.6	0	0	0	112.2	L1287 V1291 I1311 L1312 N1317 V1318 V1319 I1338 F1342	L1287-F1315 HydrophobicContact CB-CE2 4.28Å; L1287-F1315 HydrophobicContact CD2-CD2 3.88Å; L1287-F1315 HydrophobicContact CD2-CE2 4.01Å; V1291-F1315 HydrophobicContact CG2-CD1 4Å; V1291-F1315 HydrophobicContact CG2-CD2 3.54Å; V1291-F1315 HydrophobicContact CG2-CE1 3.68Å; V1291-F1315 HydrophobicContact CG2-CE2 3.17Å; V1291-F1315 HydrophobicContact CG2-CG 3.94Å; V1291-F1315 HydrophobicContact CG2-CZ 3.24Å; I1311-F1315 WeakPolarHBondContact O-CB 3.31Å; I1311-F1315 PolarHBondContact O-N 3.46Å; L1312-F1315 PolarHBondContact O-N 2.96Å; F1315-N1317 VanDerWaalsContact C-N 3.31Å; F1315-N1317 PolarHBondContact O-N 3.37Å; F1315-V1318 PolarHBondContact O-N 3.35Å; F1315-V1319 HydrophobicContact CD2-CG2 4.04Å; F1315-V1319 HydrophobicContact CE1-CG2 4.28Å; F1315-V1319 HydrophobicContact CE2-CG2 3.47Å; F1315-V1319 VanDerWaalsContact CE2-CG2 3.47Å; F1315-V1319 HydrophobicContact CZ-CG2 3.61Å; F1315-V1319 WeakPolarHBondContact O-CG2 3.23Å; F1315-V1319 PolarHBondContact O-N 3.34Å; F1315-I1338 HydrophobicContact CE2-CG2 3.85Å; F1315-I1338 HydrophobicContact CZ-CG2 3.48Å; F1315-I1338 VanDerWaalsContact CZ-CG2 3.48Å; F1315-F1342 HydrophobicContact CD1-CD2 4.08Å; F1315-F1342 HydrophobicContact CD1-CE2 4.28Å; F1315-F1342 HydrophobicContact CE1-CB 4.39Å; F1315-F1342 AromaticContact CE1-CD2 3.5Å; F1315-F1342 HydrophobicContact CE1-CD2 3.5Å; F1315-F1342 VanDerWaalsContact CE1-CD2 3.5Å; F1315-F1342 HydrophobicContact CE1-CE2 4.08Å; F1315-F1342 HydrophobicContact CE1-CG 4.18Å; F1315-F1342 HydrophobicContact CZ-CD2 4.45Å
1316	I	88.7	Confident	86.3	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-57.3	-45.4	176.5	-70	163.4	0	0	0	110.6	L1312 V1318 V1319 Y1320 F1342 L1418 A1422 F1426	L1312-I1316 VanDerWaalsContact O-CG1 3.31Å; L1312-I1316 WeakPolarHBondContact O-CG1 3.35Å; L1312-I1316 PolarHBondContact O-N 2.75Å; I1316-V1318 PolarHBondContact O-N 3.42Å; I1316-V1319 PolarHBondContact O-N 3.47Å; I1316-Y1320 WeakPolarHBondContact O-CB 3.13Å; I1316-Y1320 PolarHBondContact O-N 3.4Å; I1316-F1342 HydrophobicContact CD1-CE2 4.41Å; I1316-F1342 HydrophobicContact CD1-CZ 4.19Å; I1316-F1342 HydrophobicContact CG1-CE2 4.4Å; I1316-F1342 HydrophobicContact CG1-CZ 4.49Å; I1316-L1418 HydrophobicContact CD1-CD1 3.88Å; I1316-A1422 HydrophobicContact CD1-CB 3.96Å; I1316-A1422 HydrophobicContact CG1-CB 4.43Å; I1316-F1426 HydrophobicContact CG1-CZ 4.33Å; I1316-F1426 HydrophobicContact CG2-CE1 4.47Å
1317	N	85.5	Confident	86.4	Confident	10 Å²	10	13.2 Å²	13.2	5%	0.053	7%	0.069	C	C	.	.	H	α-helix	trans	-60.7	-42.3	178.1	-72.2	-10.8	0	0	0	112.6	I1156 N1157 Y1263 Y1313 K1314 F1315 Y1320 I1321	I1156-N1317 HydrophobicContact CD1-CB 4.41Å; N1157-N1317 PolarHBondContact ND2-OD1 2.9Å; Y1263-N1317 HydrophobicContact CD2-CB 3.77Å; Y1263-N1317 HydrophobicContact CE2-CB 3.66Å; Y1313-N1317 VanDerWaalsContact O-CG 3.31Å; Y1313-N1317 PolarHBondContact O-N 3.29Å; K1314-N1317 WeakPolarHBondContact O-CB 3.15Å; K1314-N1317 PolarHBondContact O-N 3.28Å; F1315-N1317 VanDerWaalsContact C-N 3.31Å; F1315-N1317 PolarHBondContact O-N 3.37Å; N1317-Y1320 PolarHBondContact O-N 3.09Å; N1317-I1321 PolarHBondContact O-N 3Å
1318	V	87.9	Confident	86.4	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.006	9%	0.089	C	C	.	.	H	α-helix	trans	-63.7	-49.2	176.5	175.9	0	0	0	0	111	L1259 L1262 L1287 K1314 F1315 I1316 Y1320 I1321 I1322	L1259-V1318 WeakPolarHBondContact O-CG2 3.41Å; L1262-V1318 HydrophobicContact CD2-CG1 3.95Å; L1262-V1318 HydrophobicContact CG-CG1 4.25Å; L1287-V1318 HydrophobicContact CD2-CB 4.35Å; L1287-V1318 HydrophobicContact CD2-CG1 3.82Å; K1314-V1318 WeakPolarHBondContact O-CG2 3.19Å; K1314-V1318 PolarHBondContact O-N 3.02Å; F1315-V1318 PolarHBondContact O-N 3.35Å; I1316-V1318 PolarHBondContact O-N 3.42Å; V1318-Y1320 VanDerWaalsContact C-N 3.25Å; V1318-Y1320 PolarHBondContact O-N 2.97Å; V1318-I1321 PolarHBondContact O-N 3.07Å; V1318-I1322 HydrophobicContact CG1-CD1 3.75Å; V1318-I1322 HydrophobicContact CG1-CG1 4.46Å; V1318-I1322 WeakPolarHBondContact O-CG1 3.47Å; V1318-I1322 PolarHBondContact O-N 3.34Å; V1318-I1322 VanDerWaalsContact O-N 3.08Å
1319	V	88.7	Confident	86.1	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.4	-37.3	-179.8	173.4	0	0	0	0	111.4	L1287 F1315 I1316 G1323 I1338 F1339 F1426	L1287-V1319 HydrophobicContact CD1-CG2 4.36Å; L1287-V1319 HydrophobicContact CD2-CG2 4.18Å; F1315-V1319 HydrophobicContact CD2-CG2 4.04Å; F1315-V1319 HydrophobicContact CE1-CG2 4.28Å; F1315-V1319 HydrophobicContact CE2-CG2 3.47Å; F1315-V1319 VanDerWaalsContact CE2-CG2 3.47Å; F1315-V1319 HydrophobicContact CZ-CG2 3.61Å; F1315-V1319 WeakPolarHBondContact O-CG2 3.23Å; F1315-V1319 PolarHBondContact O-N 3.34Å; I1316-V1319 PolarHBondContact O-N 3.47Å; V1319-G1323 PolarHBondContact O-N 2.66Å; V1319-I1338 HydrophobicContact CG2-CG2 4.19Å; V1319-F1339 HydrophobicContact CG1-CE1 3.74Å; V1319-F1426 HydrophobicContact CB-CE1 4.23Å; V1319-F1426 HydrophobicContact CG1-CD1 4.42Å; V1319-F1426 HydrophobicContact CG1-CE1 3.77Å; V1319-F1426 HydrophobicContact CG1-CZ 4.3Å
1320	Y	87.4	Confident	85.9	Confident	23 Å²	23	24.5 Å²	24.5	9%	0.09	12%	0.124	C	C	.	.	H	α-helix	trans	-68.7	-44.5	178.9	-172.1	-85.1	0	0	0	113.4	I1156 I1316 N1317 V1318 I1322 G1323 L1324 H1428 L1429	I1156-Y1320 HydrophobicContact CD1-CD1 3.45Å; I1156-Y1320 VanDerWaalsContact CD1-CD1 3.45Å; I1156-Y1320 HydrophobicContact CD1-CD2 4.5Å; I1156-Y1320 HydrophobicContact CD1-CE1 4.13Å; I1156-Y1320 HydrophobicContact CD1-CG 3.65Å; I1156-Y1320 HydrophobicContact CG1-CD1 3.37Å; I1156-Y1320 HydrophobicContact CG1-CD2 4.15Å; I1156-Y1320 HydrophobicContact CG1-CE1 3.53Å; I1156-Y1320 HydrophobicContact CG1-CE2 4.32Å; I1156-Y1320 HydrophobicContact CG1-CG 3.69Å; I1156-Y1320 HydrophobicContact CG2-CE2 4.32Å; I1316-Y1320 WeakPolarHBondContact O-CB 3.13Å; I1316-Y1320 PolarHBondContact O-N 3.4Å; N1317-Y1320 PolarHBondContact O-N 3.09Å; V1318-Y1320 VanDerWaalsContact C-N 3.25Å; V1318-Y1320 PolarHBondContact O-N 2.97Å; Y1320-I1322 VanDerWaalsContact C-N 3.34Å; Y1320-I1322 PolarHBondContact O-N 2.9Å; Y1320-G1323 PolarHBondContact O-N 3.12Å; Y1320-L1324 HydrophobicContact CD1-CD1 3.89Å; Y1320-L1324 HydrophobicContact CD1-CG 4.04Å; Y1320-L1324 HydrophobicContact CE1-CD1 3.35Å; Y1320-L1324 HydrophobicContact CE1-CD2 4.36Å; Y1320-L1324 HydrophobicContact CE1-CG 3.71Å; Y1320-L1324 PolarHBondContact O-N 2.77Å; Y1320-H1428 HydrophobicContact CE2-CB 4.39Å; Y1320-H1428 PolarHBondContact OH-ND1 3.3Å; Y1320-L1429 HydrophobicContact CD2-CD1 3.8Å; Y1320-L1429 HydrophobicContact CD2-CD2 3.72Å; Y1320-L1429 HydrophobicContact CD2-CG 3.78Å; Y1320-L1429 HydrophobicContact CE2-CD2 3.84Å; Y1320-L1429 HydrophobicContact CE2-CG 4.05Å; Y1320-L1429 HydrophobicContact CG-CD1 4.28Å; Y1320-L1429 HydrophobicContact CG-CD2 4.1Å; Y1320-L1429 HydrophobicContact CG-CG 4.5Å
1321	I	86.8	Confident	85.9	Confident	8 Å²	8	24.5 Å²	24.5	4%	0.041	12%	0.124	C	C	.	.	H	α-helix	trans	-64.1	-39.3	175.5	-75.9	-164.8	0	0	0	111.5	Y1263 V1266 I1267 N1317 V1318 R1325	Y1263-I1321 HydrophobicContact CD2-CD1 3.77Å; Y1263-I1321 HydrophobicContact CD2-CG1 4.22Å; Y1263-I1321 HydrophobicContact CE1-CD1 4.25Å; Y1263-I1321 HydrophobicContact CE2-CD1 3.23Å; Y1263-I1321 HydrophobicContact CE2-CG1 3.73Å; Y1263-I1321 HydrophobicContact CG-CD1 4.48Å; V1266-I1321 HydrophobicContact CG1-CG2 3.97Å; I1267-I1321 HydrophobicContact CD1-CD1 4.45Å; I1267-I1321 HydrophobicContact CG1-CG2 4.41Å; N1317-I1321 PolarHBondContact O-N 3Å; V1318-I1321 PolarHBondContact O-N 3.07Å; I1321-R1325 WeakPolarHBondContact O-CB 3.45Å; I1321-R1325 PolarHBondContact O-N 2.83Å; I1321-R1325 VanDerWaalsContact O-N 3.11Å
1322	I	87.1	Confident	85.9	Confident	1 Å²	1	27 Å²	27	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-60.5	-51.3	173.4	-65.1	167.9	0	0	0	109.9	V1266 L1278 I1282 L1287 V1318 Y1320 L1324 R1325 V1326 L1335	V1266-I1322 HydrophobicContact CG1-CG1 3.8Å; V1266-I1322 HydrophobicContact CG2-CG1 4.3Å; L1278-I1322 HydrophobicContact CD1-CG2 3.84Å; L1278-I1322 HydrophobicContact CD2-CD1 4.28Å; L1278-I1322 HydrophobicContact CD2-CG2 3.65Å; L1278-I1322 HydrophobicContact CG-CG2 4.41Å; I1282-I1322 HydrophobicContact CG2-CD1 4.14Å; L1287-I1322 HydrophobicContact CD1-CD1 3.85Å; V1318-I1322 HydrophobicContact CG1-CD1 3.75Å; V1318-I1322 HydrophobicContact CG1-CG1 4.46Å; V1318-I1322 WeakPolarHBondContact O-CG1 3.47Å; V1318-I1322 PolarHBondContact O-N 3.34Å; V1318-I1322 VanDerWaalsContact O-N 3.08Å; Y1320-I1322 VanDerWaalsContact C-N 3.34Å; Y1320-I1322 PolarHBondContact O-N 2.9Å; I1322-L1324 PolarHBondContact O-N 3.17Å; I1322-R1325 PolarHBondContact O-N 3.46Å; I1322-R1325 VanDerWaalsContact O-N 3.11Å; I1322-V1326 HydrophobicContact CG2-CG2 4.16Å; I1322-V1326 WeakPolarHBondContact O-CG2 3.3Å; I1322-V1326 PolarHBondContact O-N 3.12Å; I1322-L1335 HydrophobicContact CG2-CD1 4.1Å; I1322-L1335 HydrophobicContact CG2-CD2 4.19Å
1323	G	85.7	Confident	85.6	Confident	2 Å²	2	31.9 Å²	31.9	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-59.5	-42.1	-178.8	0	0	0	0	0	113.7	V1319 Y1320 R1325 G1327 T1331	V1319-G1323 PolarHBondContact O-N 2.66Å; Y1320-G1323 PolarHBondContact O-N 3.12Å; G1323-R1325 VanDerWaalsContact C-N 3.35Å; G1323-R1325 PolarHBondContact O-N 3.41Å; G1323-G1327 WeakPolarHBondContact O-CA 3.19Å; G1323-G1327 PolarHBondContact O-N 3.44Å; G1323-T1331 VanDerWaalsContact CA-OG1 3.28Å; G1323-T1331 WeakPolarHBondContact CA-OG1 3.42Å; G1323-T1331 PolarHBondContact O-OG1 3.31Å; G1323-T1331 VanDerWaalsContact O-OG1 3.13Å
1324	L	85.3	Confident	85.3	Confident	80 Å²	80	33 Å²	33	42%	0.419	17%	0.169	S	C	.	.	H	α-helix	trans	-60.8	-41.9	174.1	-81.6	-171.8	0	0	0	112.5	Y1320 I1322 L1429	Y1320-L1324 HydrophobicContact CD1-CD1 3.89Å; Y1320-L1324 HydrophobicContact CD1-CG 4.04Å; Y1320-L1324 HydrophobicContact CE1-CD1 3.35Å; Y1320-L1324 HydrophobicContact CE1-CD2 4.36Å; Y1320-L1324 HydrophobicContact CE1-CG 3.71Å; Y1320-L1324 PolarHBondContact O-N 2.77Å; I1322-L1324 PolarHBondContact O-N 3.17Å; L1324-L1429 HydrophobicContact CD2-CD2 4.06Å; L1324-L1429 HydrophobicContact CG-CD2 4Å
1325	R	84.7	Confident	85.3	Confident	30 Å²	30	32.7 Å²	32.7	11%	0.113	17%	0.168	C	C	.	.	H	α-helix	trans	-73.6	-45.3	-175.5	-82.6	-150.7	64.4	-168.2	-1.1	114	V1266 I1267 I1269 D1271 L1274 I1321 I1322 G1323 G1327	V1266-R1325 PolarHBondContact O-NH1 2.94Å; I1267-R1325 PolarHBondContact O-NH1 3.26Å; I1269-R1325 VanDerWaalsContact O-CZ 3.22Å; I1269-R1325 PolarHBondContact O-NH1 3.06Å; I1269-R1325 PolarHBondContact O-NH2 3.32Å; D1271-R1325 IonicContact OD1-CZ 3.33Å; D1271-R1325 IonicContact OD1-NE 3.78Å; D1271-R1325 IonicContact OD1-NH2 2.71Å; D1271-R1325 PolarHBondContact OD1-NH2 3.41Å; D1271-R1325 IonicContact OD2-NH2 3.86Å; L1274-R1325 HydrophobicContact CD2-CB 4.17Å; I1321-R1325 WeakPolarHBondContact O-CB 3.45Å; I1321-R1325 PolarHBondContact O-N 2.83Å; I1321-R1325 VanDerWaalsContact O-N 3.11Å; I1322-R1325 PolarHBondContact O-N 3.46Å; I1322-R1325 VanDerWaalsContact O-N 3.11Å; G1323-R1325 VanDerWaalsContact C-N 3.35Å; G1323-R1325 PolarHBondContact O-N 3.41Å; R1325-G1327 VanDerWaalsContact C-N 3.28Å
1326	V	84.2	Confident	85.2	Confident	24 Å²	24	33.5 Å²	33.5	15%	0.145	17%	0.173	C	C	.	.	H	α-helix	trans	-79.8	-19.2	-179.8	-157.3	0	0	0	0	111.2	L1274 V1275 L1278 I1322 L1330	L1274-V1326 HydrophobicContact CD2-CG2 3.98Å; L1274-V1326 HydrophobicContact CG-CG2 4.28Å; V1275-V1326 HydrophobicContact CG2-CG1 3.63Å; L1278-V1326 HydrophobicContact CD1-CG2 3.53Å; I1322-V1326 HydrophobicContact CG2-CG2 4.16Å; I1322-V1326 WeakPolarHBondContact O-CG2 3.3Å; I1322-V1326 PolarHBondContact O-N 3.12Å; V1326-L1330 HydrophobicContact CB-CB 4.27Å; V1326-L1330 HydrophobicContact CG1-CB 3.48Å; V1326-L1330 VanDerWaalsContact CG1-CB 3.48Å; V1326-L1330 HydrophobicContact CG1-CD1 3.77Å; V1326-L1330 HydrophobicContact CG1-CD2 4.19Å; V1326-L1330 HydrophobicContact CG1-CG 3.99Å
1327	G	83.2	Confident	85	Confident	25 Å²	25	35.8 Å²	35.8	26%	0.258	19%	0.189	S	C	.	.			trans	87.4	174.6	170.8	0	0	0	0	0	114.3	G1323 R1325 E1329 L1330 T1331	G1323-G1327 WeakPolarHBondContact O-CA 3.19Å; G1323-G1327 PolarHBondContact O-N 3.44Å; R1325-G1327 VanDerWaalsContact C-N 3.28Å; G1327-E1329 PolarHBondContact O-N 3.16Å; G1327-L1330 PolarHBondContact O-N 3.15Å; G1327-T1331 VanDerWaalsContact O-CB 3.26Å; G1327-T1331 WeakPolarHBondContact O-CB 3.48Å; G1327-T1331 PolarHBondContact O-N 3.4Å; G1327-T1331 PolarHBondContact O-OG1 2.98Å
1328	F	82.5	Confident	85.1	Confident	96 Å²	96	35.5 Å²	35.5	42%	0.421	19%	0.187	S	C	.	.	H	α-helix	trans	-57.9	-51.7	-163.8	-167	-108.6	0	0	0	114.5	R1332 L1429 A1430	F1328-R1332 VanDerWaalsContact CZ-NH2 3.31Å; F1328-R1332 WeakPolarHBondContact O-CG 3.29Å; F1328-R1332 PolarHBondContact O-N 3.19Å; F1328-L1429 WeakPolarHBondContact CD2-O 3.41Å; F1328-A1430 WeakPolarHBondContact CZ-O 3.38Å
1329	E	81.1	Confident	85.2	Confident	119 Å²	119	35.6 Å²	35.6	56%	0.556	19%	0.188	S	C	*	.	H	α-helix	trans	-76.4	-36.3	-177	-60.5	-59.1	166.2	0	0	112.8	G1327 R1332 T1333	G1327-E1329 PolarHBondContact O-N 3.16Å; E1329-R1332 WeakPolarHBondContact O-CB 3.49Å; E1329-R1332 PolarHBondContact O-N 3.37Å; E1329-R1332 IonicContact OE1-NH1 3.71Å; E1329-R1332 PolarHBondContact OE1-NH1 3.06Å; E1329-R1332 VanDerWaalsContact OE1-NH1 3.08Å; E1329-R1332 VanDerWaalsContact OE2-CD 3.24Å; E1329-R1332 WeakPolarHBondContact OE2-CD 3.49Å; E1329-R1332 IonicContact OE2-CZ 3.17Å; E1329-R1332 IonicContact OE2-NE 2.63Å; E1329-R1332 IonicContact OE2-NH1 2.63Å; E1329-R1332 PolarHBondContact OE2-NH1 3.42Å; E1329-T1333 PolarHBondContact O-N 3.12Å
1330	L	80.7	Confident	85.2	Confident	67 Å²	67	39.7 Å²	39.7	35%	0.351	21%	0.207	S	C	.	.	H	α-helix	trans	-68.7	-37.6	176.7	-97.1	151.3	0	0	0	111.8	V1326 G1327 R1332 T1333 Q1334	V1326-L1330 HydrophobicContact CB-CB 4.27Å; V1326-L1330 HydrophobicContact CG1-CB 3.48Å; V1326-L1330 VanDerWaalsContact CG1-CB 3.48Å; V1326-L1330 HydrophobicContact CG1-CD1 3.77Å; V1326-L1330 HydrophobicContact CG1-CD2 4.19Å; V1326-L1330 HydrophobicContact CG1-CG 3.99Å; G1327-L1330 PolarHBondContact O-N 3.15Å; L1330-R1332 VanDerWaalsContact C-N 3.28Å; L1330-R1332 PolarHBondContact O-N 3.15Å; L1330-T1333 WeakPolarHBondContact CA-OG1 3.31Å; L1330-T1333 PolarHBondContact O-N 3.37Å; L1330-T1333 PolarHBondContact O-OG1 3.37Å; L1330-Q1334 PolarHBondContact O-N 3.41Å
1331	T	85	Confident	85.2	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-50.2	-48.8	169.3	-70.8	0	0	0	0	111.4	G1323 G1327 T1333 Q1334 L1335 F1339 L1429 A1430	G1323-T1331 VanDerWaalsContact CA-OG1 3.28Å; G1323-T1331 WeakPolarHBondContact CA-OG1 3.42Å; G1323-T1331 PolarHBondContact O-OG1 3.31Å; G1323-T1331 VanDerWaalsContact O-OG1 3.13Å; G1327-T1331 VanDerWaalsContact O-CB 3.26Å; G1327-T1331 WeakPolarHBondContact O-CB 3.48Å; G1327-T1331 PolarHBondContact O-N 3.4Å; G1327-T1331 PolarHBondContact O-OG1 2.98Å; T1331-T1333 VanDerWaalsContact C-N 3.3Å; T1331-T1333 PolarHBondContact O-N 3.23Å; T1331-Q1334 PolarHBondContact O-N 3.31Å; T1331-L1335 HydrophobicContact CG2-CB 4.41Å; T1331-L1335 HydrophobicContact CG2-CD1 4.12Å; T1331-L1335 WeakPolarHBondContact O-CB 3.47Å; T1331-L1335 PolarHBondContact O-N 3.37Å; T1331-F1339 HydrophobicContact CG2-CE2 4.01Å; T1331-F1339 HydrophobicContact CG2-CZ 3.95Å; T1331-L1429 HydrophobicContact CG2-CB 4.11Å; T1331-A1430 HydrophobicContact CG2-CB 4.22Å
1332	R	86.9	Confident	85.3	Confident	52 Å²	52	40.8 Å²	40.8	20%	0.196	21%	0.214	C	C	.	.	H	α-helix	trans	-63	-33.1	177.4	-67.5	166.8	160.4	-173.9	-7.1	113.3	F1328 E1329 L1330 T1336 A1430 Y1434	F1328-R1332 VanDerWaalsContact CZ-NH2 3.31Å; F1328-R1332 WeakPolarHBondContact O-CG 3.29Å; F1328-R1332 PolarHBondContact O-N 3.19Å; E1329-R1332 WeakPolarHBondContact O-CB 3.49Å; E1329-R1332 PolarHBondContact O-N 3.37Å; E1329-R1332 IonicContact OE1-NH1 3.71Å; E1329-R1332 PolarHBondContact OE1-NH1 3.06Å; E1329-R1332 VanDerWaalsContact OE1-NH1 3.08Å; E1329-R1332 VanDerWaalsContact OE2-CD 3.24Å; E1329-R1332 WeakPolarHBondContact OE2-CD 3.49Å; E1329-R1332 IonicContact OE2-CZ 3.17Å; E1329-R1332 IonicContact OE2-NE 2.63Å; E1329-R1332 IonicContact OE2-NH1 2.63Å; E1329-R1332 PolarHBondContact OE2-NH1 3.42Å; L1330-R1332 VanDerWaalsContact C-N 3.28Å; L1330-R1332 PolarHBondContact O-N 3.15Å; R1332-T1336 PolarHBondContact O-OG1 3.44Å; R1332-A1430 HydrophobicContact CG-CB 4.07Å; R1332-A1430 PolarHBondContact NE-O 3.35Å; R1332-A1430 PolarHBondContact NH2-O 3.25Å; R1332-Y1434 HydrophobicContact CB-CE1 3.91Å; R1332-Y1434 HydrophobicContact CB-CE2 4.11Å; R1332-Y1434 HydrophobicContact CG-CD1 3.86Å; R1332-Y1434 HydrophobicContact CG-CD2 4.24Å; R1332-Y1434 HydrophobicContact CG-CE1 3.61Å; R1332-Y1434 HydrophobicContact CG-CE2 4.02Å; R1332-Y1434 HydrophobicContact CG-CG 4.17Å; R1332-Y1434 PolarHBondContact O-OH 2.86Å
1333	T	83	Confident	85.3	Confident	104 Å²	104	40.8 Å²	40.8	64%	0.638	21%	0.214	S	C	*	.	H	α-helix	trans	-80.7	-34.1	179.1	60.8	0	0	0	0	114.4	E1329 L1330 T1331	E1329-T1333 PolarHBondContact O-N 3.12Å; L1330-T1333 WeakPolarHBondContact CA-OG1 3.31Å; L1330-T1333 PolarHBondContact O-N 3.37Å; L1330-T1333 PolarHBondContact O-OG1 3.37Å; T1331-T1333 VanDerWaalsContact C-N 3.3Å; T1331-T1333 PolarHBondContact O-N 3.23Å
1334	Q	81.8	Confident	85.3	Confident	38 Å²	38	42.2 Å²	42.2	18%	0.178	23%	0.226	C	C	.	.	H	α-helix	trans	-111.9	-34.4	-170.7	-68.1	-171.3	-11.5	0	0	114.7	I1283 L1330 T1331	I1283-Q1334 HydrophobicContact CD1-CB 4.28Å; L1330-Q1334 PolarHBondContact O-N 3.41Å; T1331-Q1334 PolarHBondContact O-N 3.31Å
1335	L	86.2	Confident	85.3	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.021	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-10.5	-174	-60.7	175.7	0	0	0	114	I1283 I1322 T1331 S1337 I1338 F1339	I1283-L1335 HydrophobicContact CD1-CD2 3.98Å; I1322-L1335 HydrophobicContact CG2-CD1 4.1Å; I1322-L1335 HydrophobicContact CG2-CD2 4.19Å; T1331-L1335 HydrophobicContact CG2-CB 4.41Å; T1331-L1335 HydrophobicContact CG2-CD1 4.12Å; T1331-L1335 WeakPolarHBondContact O-CB 3.47Å; T1331-L1335 PolarHBondContact O-N 3.37Å; L1335-S1337 VanDerWaalsContact C-N 3.27Å; L1335-S1337 PolarHBondContact O-N 2.97Å; L1335-I1338 HydrophobicContact CD2-CD1 3.78Å; L1335-I1338 WeakPolarHBondContact O-CA 3.41Å; L1335-I1338 VanDerWaalsContact O-CB 3.31Å; L1335-I1338 WeakPolarHBondContact O-CB 3.48Å; L1335-I1338 PolarHBondContact O-N 2.96Å; L1335-F1339 HydrophobicContact CB-CE1 4.48Å; L1335-F1339 HydrophobicContact CB-CE2 4.15Å; L1335-F1339 HydrophobicContact CB-CZ 3.96Å; L1335-F1339 PolarHBondContact O-N 2.77Å; L1335-F1339 VanDerWaalsContact O-N 3.14Å
1336	T	86.7	Confident	85.2	Confident	18 Å²	18	37.7 Å²	37.7	11%	0.11	20%	0.204	C	C	.	.	H	α-helix	trans	-59	-33.5	-177.9	-62.4	0	0	0	0	113.7	R1332 I1338 F1339 Q1340 Y1434 C1438	R1332-T1336 PolarHBondContact O-OG1 3.44Å; T1336-I1338 VanDerWaalsContact C-N 3.3Å; T1336-I1338 PolarHBondContact O-N 3.18Å; T1336-F1339 PolarHBondContact O-N 2.91Å; T1336-Q1340 WeakPolarHBondContact O-CG 3.24Å; T1336-Q1340 PolarHBondContact O-N 3.09Å; T1336-Y1434 PolarHBondContact OG1-OH 3.47Å; T1336-C1438 HydrophobicContact CG2-CB 4.03Å
1337	S	85.2	Confident	84.8	Confident	49 Å²	49	37.9 Å²	37.9	34%	0.343	20%	0.204	S	C	.	.	H	α-helix	trans	-61.7	-37.7	172.6	55.2	0	0	0	0	112.4	L1335 I1341	L1335-S1337 VanDerWaalsContact C-N 3.27Å; L1335-S1337 PolarHBondContact O-N 2.97Å; S1337-I1341 WeakPolarHBondContact O-CB 3.48Å; S1337-I1341 WeakPolarHBondContact O-CD1 3.23Å; S1337-I1341 VanDerWaalsContact O-CG1 3.23Å; S1337-I1341 WeakPolarHBondContact O-CG1 3.25Å; S1337-I1341 PolarHBondContact O-N 2.97Å
1338	I	88.2	Confident	84.3	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.015	21%	0.213	C	C	.	.	H	α-helix	trans	-69.7	-44.4	178.1	-55.9	-176.6	0	0	0	110.4	I1283 L1287 I1288 F1315 V1319 L1335 T1336 Q1340 I1341 F1342	I1283-I1338 HydrophobicContact CB-CD1 4.4Å; I1283-I1338 HydrophobicContact CD1-CD1 4.31Å; I1283-I1338 HydrophobicContact CG1-CD1 4.03Å; I1283-I1338 HydrophobicContact CG2-CD1 3.93Å; I1283-I1338 HydrophobicContact CG2-CG1 4.08Å; L1287-I1338 HydrophobicContact CB-CD1 4.05Å; L1287-I1338 HydrophobicContact CD1-CD1 3.74Å; I1288-I1338 HydrophobicContact CG1-CG1 4.49Å; F1315-I1338 HydrophobicContact CE2-CG2 3.85Å; F1315-I1338 HydrophobicContact CZ-CG2 3.48Å; F1315-I1338 VanDerWaalsContact CZ-CG2 3.48Å; V1319-I1338 HydrophobicContact CG2-CG2 4.19Å; L1335-I1338 HydrophobicContact CD2-CD1 3.78Å; L1335-I1338 WeakPolarHBondContact O-CA 3.41Å; L1335-I1338 VanDerWaalsContact O-CB 3.31Å; L1335-I1338 WeakPolarHBondContact O-CB 3.48Å; L1335-I1338 PolarHBondContact O-N 2.96Å; T1336-I1338 VanDerWaalsContact C-N 3.3Å; T1336-I1338 PolarHBondContact O-N 3.18Å; I1338-Q1340 VanDerWaalsContact C-N 3.32Å; I1338-Q1340 PolarHBondContact O-N 2.8Å; I1338-I1341 PolarHBondContact O-N 3.01Å; I1338-F1342 WeakPolarHBondContact O-CB 3.46Å; I1338-F1342 PolarHBondContact O-N 2.94Å
1339	F	89	Confident	83.7	Confident	3 Å²	3	39.2 Å²	39.2	1%	0.013	20%	0.202	C	C	.	.	H	α-helix	trans	-58.6	-44.6	175.9	-56.8	-36.1	0	0	0	111.3	V1319 T1331 L1335 T1336 F1342 F1343 F1426 A1430 I1435	V1319-F1339 HydrophobicContact CG1-CE1 3.74Å; T1331-F1339 HydrophobicContact CG2-CE2 4.01Å; T1331-F1339 HydrophobicContact CG2-CZ 3.95Å; L1335-F1339 HydrophobicContact CB-CE1 4.48Å; L1335-F1339 HydrophobicContact CB-CE2 4.15Å; L1335-F1339 HydrophobicContact CB-CZ 3.96Å; L1335-F1339 PolarHBondContact O-N 2.77Å; L1335-F1339 VanDerWaalsContact O-N 3.14Å; T1336-F1339 PolarHBondContact O-N 2.91Å; F1339-F1342 PolarHBondContact O-N 2.95Å; F1339-F1343 WeakPolarHBondContact O-CD2 3.3Å; F1339-F1343 PolarHBondContact O-N 2.96Å; F1339-F1426 HydrophobicContact CD1-CB 4.16Å; F1339-F1426 HydrophobicContact CD1-CD1 4.02Å; F1339-F1426 AromaticContact CD1-CD2 3.56Å; F1339-F1426 HydrophobicContact CD1-CD2 3.56Å; F1339-F1426 HydrophobicContact CD1-CE1 4.3Å; F1339-F1426 AromaticContact CD1-CE2 3.88Å; F1339-F1426 HydrophobicContact CD1-CE2 3.88Å; F1339-F1426 AromaticContact CD1-CG 3.65Å; F1339-F1426 HydrophobicContact CD1-CG 3.65Å; F1339-F1426 HydrophobicContact CD1-CZ 4.24Å; F1339-F1426 HydrophobicContact CE1-CB 3.98Å; F1339-F1426 AromaticContact CE1-CD1 3.54Å; F1339-F1426 HydrophobicContact CE1-CD1 3.54Å; F1339-F1426 AromaticContact CE1-CD2 3.96Å; F1339-F1426 HydrophobicContact CE1-CD2 3.96Å; F1339-F1426 AromaticContact CE1-CE1 3.96Å; F1339-F1426 HydrophobicContact CE1-CE1 3.96Å; F1339-F1426 HydrophobicContact CE1-CE2 4.35Å; F1339-F1426 AromaticContact CE1-CG 3.55Å; F1339-F1426 HydrophobicContact CE1-CG 3.55Å; F1339-F1426 HydrophobicContact CE1-CZ 4.34Å; F1339-F1426 HydrophobicContact CG-CD2 4.39Å; F1339-F1426 HydrophobicContact CZ-CB 4.38Å; F1339-F1426 HydrophobicContact CZ-CD1 4.42Å; F1339-F1426 HydrophobicContact CZ-CG 4.39Å; F1339-A1430 HydrophobicContact CE2-CB 4.45Å; F1339-I1435 HydrophobicContact CD2-CD1 3.95Å; F1339-I1435 HydrophobicContact CE2-CD1 4.21Å
1340	Q	87.9	Confident	82.7	Confident	86 Å²	86	36.5 Å²	36.5	40%	0.402	19%	0.191	S	C	.	.	H	α-helix	trans	-63.4	-46	177	-73.4	174.8	-17.7	0	0	112.5	T1336 I1338 A1344 C1438 L1439	T1336-Q1340 WeakPolarHBondContact O-CG 3.24Å; T1336-Q1340 PolarHBondContact O-N 3.09Å; I1338-Q1340 VanDerWaalsContact C-N 3.32Å; I1338-Q1340 PolarHBondContact O-N 2.8Å; Q1340-A1344 VanDerWaalsContact O-CB 3.25Å; Q1340-A1344 WeakPolarHBondContact O-CB 3.34Å; Q1340-A1344 PolarHBondContact O-N 3.18Å; Q1340-C1438 WeakPolarHBondContact CG-O 3.44Å; Q1340-C1438 PolarHBondContact NE2-O 3.47Å; Q1340-L1439 HydrophobicContact CG-CD2 4.41Å
1341	I	87.4	Confident	81.4	Confident	55 Å²	55	38.7 Å²	38.7	28%	0.282	20%	0.203	S	C	.	.	H	α-helix	trans	-63.7	-42	178.6	-70.4	165.4	0	0	0	111.4	I1288 V1291 S1337 I1338	I1288-I1341 HydrophobicContact CD1-CD1 4.08Å; I1288-I1341 HydrophobicContact CG1-CD1 4.04Å; I1288-I1341 HydrophobicContact CG2-CD1 4.33Å; V1291-I1341 HydrophobicContact CG1-CG2 3.95Å; S1337-I1341 WeakPolarHBondContact O-CB 3.48Å; S1337-I1341 WeakPolarHBondContact O-CD1 3.23Å; S1337-I1341 VanDerWaalsContact O-CG1 3.23Å; S1337-I1341 WeakPolarHBondContact O-CG1 3.25Å; S1337-I1341 PolarHBondContact O-N 2.97Å; I1338-I1341 PolarHBondContact O-N 3.01Å
1342	F	89.5	Confident	79.5	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.8	-51.1	178	174.8	-91.2	0	0	0	111.7	L1312 F1315 I1316 I1338 F1339 A1344 L1345 F1346 L1418 A1422 F1426	L1312-F1342 HydrophobicContact CD2-CE2 4.13Å; F1315-F1342 HydrophobicContact CD1-CD2 4.08Å; F1315-F1342 HydrophobicContact CD1-CE2 4.28Å; F1315-F1342 HydrophobicContact CE1-CB 4.39Å; F1315-F1342 AromaticContact CE1-CD2 3.5Å; F1315-F1342 HydrophobicContact CE1-CD2 3.5Å; F1315-F1342 VanDerWaalsContact CE1-CD2 3.5Å; F1315-F1342 HydrophobicContact CE1-CE2 4.08Å; F1315-F1342 HydrophobicContact CE1-CG 4.18Å; F1315-F1342 HydrophobicContact CZ-CD2 4.45Å; I1316-F1342 HydrophobicContact CD1-CE2 4.41Å; I1316-F1342 HydrophobicContact CD1-CZ 4.19Å; I1316-F1342 HydrophobicContact CG1-CE2 4.4Å; I1316-F1342 HydrophobicContact CG1-CZ 4.49Å; I1338-F1342 WeakPolarHBondContact O-CB 3.46Å; I1338-F1342 PolarHBondContact O-N 2.94Å; F1339-F1342 PolarHBondContact O-N 2.95Å; F1342-A1344 VanDerWaalsContact C-N 3.33Å; F1342-A1344 PolarHBondContact O-N 3.2Å; F1342-L1345 WeakPolarHBondContact O-CB 3.11Å; F1342-L1345 PolarHBondContact O-N 3.14Å; F1342-F1346 HydrophobicContact CD1-CE2 4.37Å; F1342-F1346 AromaticContact CE1-CE2 3.74Å; F1342-F1346 HydrophobicContact CE1-CE2 3.74Å; F1342-F1346 HydrophobicContact CE1-CZ 4.44Å; F1342-F1346 HydrophobicContact CZ-CE2 4.11Å; F1342-L1418 HydrophobicContact CZ-CG 4.46Å; F1342-A1422 HydrophobicContact CD1-CB 4.34Å; F1342-A1422 HydrophobicContact CE1-CB 3.33Å; F1342-A1422 HydrophobicContact CZ-CB 3.57Å; F1342-F1426 HydrophobicContact CD1-CE2 4.09Å; F1342-F1426 HydrophobicContact CE1-CE2 4.39Å
1343	F	88.1	Confident	77.1	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-72.7	-23.4	-177.7	-79.1	-62.3	0	0	0	114	F1339 L1345 F1346 A1422 Y1423 F1426 L1439 N1441 I1445	F1339-F1343 WeakPolarHBondContact O-CD2 3.3Å; F1339-F1343 PolarHBondContact O-N 2.96Å; F1343-L1345 PolarHBondContact O-N 3.49Å; F1343-F1346 HydrophobicContact CD1-CD2 4.04Å; F1343-F1346 HydrophobicContact CD1-CE2 4.03Å; F1343-F1346 HydrophobicContact CE1-CE2 4.37Å; F1343-F1346 PolarHBondContact O-N 3.26Å; F1343-A1422 HydrophobicContact CE1-CB 4.49Å; F1343-A1422 HydrophobicContact CZ-CB 4.18Å; F1343-Y1423 HydrophobicContact CZ-CD2 4.31Å; F1343-F1426 AromaticContact CE2-CD2 3.83Å; F1343-F1426 HydrophobicContact CE2-CD2 3.83Å; F1343-F1426 HydrophobicContact CE2-CE2 4.33Å; F1343-F1426 HydrophobicContact CZ-CD2 4.31Å; F1343-L1439 HydrophobicContact CB-CD1 4.36Å; F1343-L1439 HydrophobicContact CB-CD2 4.01Å; F1343-L1439 HydrophobicContact CD2-CD1 3.36Å; F1343-L1439 HydrophobicContact CD2-CD2 3.64Å; F1343-L1439 HydrophobicContact CD2-CG 4.15Å; F1343-L1439 HydrophobicContact CE2-CD1 3.64Å; F1343-L1439 HydrophobicContact CG-CD1 3.89Å; F1343-L1439 HydrophobicContact CG-CD2 4.21Å; F1343-L1439 HydrophobicContact CZ-CD1 4.42Å; F1343-N1441 PolarHBondContact O-ND2 2.95Å; F1343-I1445 HydrophobicContact CB-CD1 3.96Å; F1343-I1445 HydrophobicContact CD1-CD1 3.42Å; F1343-I1445 VanDerWaalsContact CD1-CD1 3.42Å; F1343-I1445 HydrophobicContact CD1-CG1 4.1Å; F1343-I1445 HydrophobicContact CE1-CD1 4.01Å; F1343-I1445 HydrophobicContact CE1-CG2 4.23Å; F1343-I1445 HydrophobicContact CG-CD1 3.75Å
1344	A	85.3	Confident	75.1	Confident	33 Å²	33	40.6 Å²	40.6	27%	0.273	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.8	171.1	0	0	0	0	0	113.9	Q1340 F1342 Y1440	Q1340-A1344 VanDerWaalsContact O-CB 3.25Å; Q1340-A1344 WeakPolarHBondContact O-CB 3.34Å; Q1340-A1344 PolarHBondContact O-N 3.18Å; F1342-A1344 VanDerWaalsContact C-N 3.33Å; F1342-A1344 PolarHBondContact O-N 3.2Å; A1344-Y1440 HydrophobicContact CB-CE1 4.25Å
1345	L	84	Confident	73.2	Confident	14 Å²	14	41.7 Å²	41.7	7%	0.073	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-34.7	174	-63.7	-176.8	0	0	0	112.6	V1291 F1342 F1343 D1347 R1348 F1414	V1291-L1345 HydrophobicContact CG1-CD1 3.74Å; F1342-L1345 WeakPolarHBondContact O-CB 3.11Å; F1342-L1345 PolarHBondContact O-N 3.14Å; F1343-L1345 PolarHBondContact O-N 3.49Å; L1345-D1347 VanDerWaalsContact C-N 3.25Å; L1345-D1347 PolarHBondContact O-N 3.1Å; L1345-R1348 WeakPolarHBondContact O-CB 3.27Å; L1345-R1348 PolarHBondContact O-N 2.6Å; L1345-R1348 VanDerWaalsContact O-N 3.16Å; L1345-F1414 HydrophobicContact CB-CD1 4.23Å; L1345-F1414 HydrophobicContact CB-CE1 3.61Å; L1345-F1414 HydrophobicContact CB-CZ 3.82Å; L1345-F1414 HydrophobicContact CD1-CE1 3.95Å; L1345-F1414 HydrophobicContact CD1-CZ 3.69Å; L1345-F1414 HydrophobicContact CG-CE1 4.44Å; L1345-F1414 HydrophobicContact CG-CZ 4.4Å
1346	F	84.1	Confident	70.8	Confident	1 Å²	1	50.1 Å²	50.1	0%	0.004	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-31.4	179.8	-73.3	-94.3	0	0	0	112.7	F1342 F1343 R1348 V1349 I1350 F1414 L1418 A1419 L1448	F1342-F1346 HydrophobicContact CD1-CE2 4.37Å; F1342-F1346 AromaticContact CE1-CE2 3.74Å; F1342-F1346 HydrophobicContact CE1-CE2 3.74Å; F1342-F1346 HydrophobicContact CE1-CZ 4.44Å; F1342-F1346 HydrophobicContact CZ-CE2 4.11Å; F1343-F1346 HydrophobicContact CD1-CD2 4.04Å; F1343-F1346 HydrophobicContact CD1-CE2 4.03Å; F1343-F1346 HydrophobicContact CE1-CE2 4.37Å; F1343-F1346 PolarHBondContact O-N 3.26Å; F1346-R1348 PolarHBondContact O-N 3.33Å; F1346-R1348 VanDerWaalsContact O-N 3.15Å; F1346-V1349 PolarHBondContact O-N 3.22Å; F1346-I1350 HydrophobicContact CB-CD1 3.93Å; F1346-I1350 WeakPolarHBondContact O-CG1 3.46Å; F1346-I1350 PolarHBondContact O-N 3.34Å; F1346-F1414 HydrophobicContact CD1-CB 3.78Å; F1346-F1414 HydrophobicContact CD1-CD1 4.1Å; F1346-F1414 HydrophobicContact CD1-CG 4.43Å; F1346-F1414 AromaticContact CD2-CD1 3.95Å; F1346-F1414 HydrophobicContact CD2-CD1 3.95Å; F1346-F1414 HydrophobicContact CE1-CB 3.85Å; F1346-F1414 AromaticContact CE1-CD1 3.95Å; F1346-F1414 HydrophobicContact CE1-CD1 3.95Å; F1346-F1414 HydrophobicContact CE1-CG 4.43Å; F1346-F1414 AromaticContact CE2-CD1 3.8Å; F1346-F1414 HydrophobicContact CE2-CD1 3.8Å; F1346-F1414 HydrophobicContact CE2-CE1 4.36Å; F1346-F1414 HydrophobicContact CG-CB 4.4Å; F1346-F1414 HydrophobicContact CG-CD1 4.11Å; F1346-F1414 AromaticContact CZ-CD1 3.81Å; F1346-F1414 HydrophobicContact CZ-CD1 3.81Å; F1346-L1418 HydrophobicContact CZ-CB 4.49Å; F1346-L1418 HydrophobicContact CZ-CD2 4.16Å; F1346-L1418 HydrophobicContact CZ-CG 4.19Å; F1346-A1419 HydrophobicContact CD1-CB 4.43Å; F1346-A1419 HydrophobicContact CE1-CB 3.69Å; F1346-A1419 HydrophobicContact CZ-CB 3.9Å; F1346-L1448 HydrophobicContact CD1-CD1 4.5Å
1347	D	75.7	Confident	68.3	Low	27 Å²	27	52.5 Å²	52.5	14%	0.144	30%	0.299	C	S	.	.	H	α-helix	trans	-59.6	-26.8	177.6	-86.9	24	0	0	0	113.5	L1345 V1349 I1350 N1351 Y1440 N1441	L1345-D1347 VanDerWaalsContact C-N 3.25Å; L1345-D1347 PolarHBondContact O-N 3.1Å; D1347-V1349 PolarHBondContact O-N 3.26Å; D1347-I1350 PolarHBondContact O-N 3.01Å; D1347-N1351 PolarHBondContact O-N 3.07Å; D1347-N1351 PolarHBondContact OD2-ND2 3.36Å; D1347-Y1440 WeakPolarHBondContact OD2-CE2 3.46Å; D1347-Y1440 PolarHBondContact OD2-OH 3.43Å; D1347-N1441 WeakPolarHBondContact OD1-CB 3.37Å; D1347-N1441 PolarHBondContact OD1-ND2 3.39Å
1348	R	71.6	Confident	66.1	Low	118 Å²	118	55.5 Å²	55.5	45%	0.445	31%	0.31	S	S	.	.	H	α-helix	trans	-64.7	-29.5	176.4	-61	-176.9	174.7	-165.7	-6	112	G1295 L1345 F1346	G1295-R1348 PolarHBondContact O-NH1 3.32Å; L1345-R1348 WeakPolarHBondContact O-CB 3.27Å; L1345-R1348 PolarHBondContact O-N 2.6Å; L1345-R1348 VanDerWaalsContact O-N 3.16Å; F1346-R1348 PolarHBondContact O-N 3.33Å; F1346-R1348 VanDerWaalsContact O-N 3.15Å
1349	V	69.4	Low	63.6	Low	31 Å²	31	61.8 Å²	61.8	19%	0.188	34%	0.343	C	S	.	.	H	α-helix	trans	-86.9	-44.2	174.6	172.7	0	0	0	0	110.7	F1346 D1347 I1411 F1414	F1346-V1349 PolarHBondContact O-N 3.22Å; D1347-V1349 PolarHBondContact O-N 3.26Å; V1349-I1411 HydrophobicContact CG1-CB 4.49Å; V1349-I1411 HydrophobicContact CG1-CG1 4.11Å; V1349-I1411 HydrophobicContact CG2-CG1 4.44Å; V1349-F1414 HydrophobicContact CG2-CB 4.18Å
1350	I	61.1	Low	61	Low	63 Å²	63	66 Å²	66	32%	0.323	37%	0.369	S	S	.	.	H	α-helix	trans	-73.5	-39.9	-169.5	-62.7	163	0	0	0	113.5	F1346 D1347 L1448	F1346-I1350 HydrophobicContact CB-CD1 3.93Å; F1346-I1350 WeakPolarHBondContact O-CG1 3.46Å; F1346-I1350 PolarHBondContact O-N 3.34Å; D1347-I1350 PolarHBondContact O-N 3.01Å; I1350-L1448 HydrophobicContact CD1-CD1 3.87Å; I1350-L1448 HydrophobicContact CG1-CD1 4.4Å
1351	N	52.3	Low	58.2	Low	112 Å²	112	68.3 Å²	68.3	60%	0.599	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	8.3	-163.8	-75	-38.2	0	0	0	115.8	D1347 A1353	D1347-N1351 PolarHBondContact O-N 3.07Å; D1347-N1351 PolarHBondContact OD2-ND2 3.36Å; N1351-A1353 PolarHBondContact O-N 3.43Å
1352	T	45.2	Very low	55.5	Low	49 Å²	49	72.4 Å²	72.4	30%	0.301	41%	0.406	S	S	.	.			trans	-91.8	101.8	-176.8	55.5	0	0	0	0	113.3	A1354 T1355 F1407	T1352-A1354 PolarHBondContact O-N 2.89Å; T1352-T1355 PolarHBondContact O-N 2.79Å; T1352-T1355 PolarHBondContact O-OG1 3.44Å; T1352-F1407 HydrophobicContact CG2-CZ 4.21Å
1353	A	38	Very low	52.5	Low	95 Å²	95	81.5 Å²	81.5	79%	0.785	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-13.8	177.8	0	0	0	0	0	114.9	N1351 T1355	N1351-A1353 PolarHBondContact O-N 3.43Å; A1353-T1355 VanDerWaalsContact C-N 3.26Å; A1353-T1355 PolarHBondContact O-N 3.03Å
1354	A	41.5	Very low	49.5	Very low	54 Å²	54	88.9 Å²	88.9	45%	0.446	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.3	175.6	0	0	0	0	0	114.1	T1352 K1356 S1357	T1352-A1354 PolarHBondContact O-N 2.89Å; A1354-K1356 PolarHBondContact O-N 2.86Å; A1354-K1356 VanDerWaalsContact O-N 3.15Å; A1354-S1357 PolarHBondContact O-N 3.02Å; A1354-S1357 VanDerWaalsContact O-N 3.13Å; A1354-S1357 PolarHBondContact O-OG 2.96Å; A1354-S1357 VanDerWaalsContact O-OG 3.1Å
1355	T	41.4	Very low	46.8	Very low	61 Å²	61	97.7 Å²	97.7	37%	0.374	52%	0.517	S	S	.	.	H	α-helix	trans	-59.5	-25.2	178.8	48.6	0	0	0	0	113.5	T1352 A1353 F1407	T1352-T1355 PolarHBondContact O-N 2.79Å; T1352-T1355 PolarHBondContact O-OG1 3.44Å; A1353-T1355 VanDerWaalsContact C-N 3.26Å; A1353-T1355 PolarHBondContact O-N 3.03Å; T1355-F1407 HydrophobicContact CG2-CE1 4.41Å
1356	K	35	Very low	44.1	Very low	180 Å²	180	100.7 Å²	100.7	78%	0.783	55%	0.552	S	S	*	*	H	α-helix	trans	-85.9	-10.4	177.4	-85.5	-172	173.6	-178.5	0	115.8	A1354 T1360	A1354-K1356 PolarHBondContact O-N 2.86Å; A1354-K1356 VanDerWaalsContact O-N 3.15Å; K1356-T1360 VanDerWaalsContact O-CG2 3.3Å; K1356-T1360 WeakPolarHBondContact O-CG2 3.39Å
1357	S	35.2	Very low	41.3	Very low	69 Å²	69	103.9 Å²	103.9	48%	0.483	59%	0.585	S	S	.	*	H	α-helix	trans	-104.4	-16.6	179.7	58	0	0	0	0	114.2	A1354 T1360	A1354-S1357 PolarHBondContact O-N 3.02Å; A1354-S1357 VanDerWaalsContact O-N 3.13Å; A1354-S1357 PolarHBondContact O-OG 2.96Å; A1354-S1357 VanDerWaalsContact O-OG 3.1Å; S1357-T1360 PolarHBondContact O-OG1 3.26Å
1358	I	39	Very low	38.8	Very low	112 Å²	112	110 Å²	110	57%	0.574	62%	0.617	S	S	*	*	H	α-helix	trans	-87.7	-24.1	-179.5	-62.5	174.6	0	0	0	111.6
1359	L	35	Very low	36.6	Very low	135 Å²	135	110.4 Å²	110.4	71%	0.707	63%	0.629	S	S	*	*	S	Bend	trans	-91.8	-9.5	-179.9	-74.9	167.7	0	0	0	114.6
1360	T	33.3	Very low	34.7	Very low	90 Å²	90	115.3 Å²	115.3	55%	0.552	65%	0.654	S	S	*	*	S	Bend	trans	-84.3	-26.2	-175.5	44.6	0	0	0	0	114.6	K1356 S1357	K1356-T1360 VanDerWaalsContact O-CG2 3.3Å; K1356-T1360 WeakPolarHBondContact O-CG2 3.39Å; S1357-T1360 PolarHBondContact O-OG1 3.26Å
1361	D	29.5	Very low	33.2	Very low	135 Å²	135	117.9 Å²	117.9	72%	0.722	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-4.6	-164.7	-66.8	9.9	0	0	0	113.6
1362	N	32.1	Very low	32	Very low	142 Å²	142	123 Å²	123	76%	0.759	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	9	-175	-82.2	-21.5	0	0	0	115.4
1363	F	26	Very low	31	Very low	190 Å²	190	125.9 Å²	125.9	83%	0.833	70%	0.7	S	S	*	*			trans	-117.2	58.2	-178.8	-87.5	-75.9	0	0	0	113.5
1364	L	24.7	Very low	30.3	Very low	155 Å²	155	129.6 Å²	129.6	81%	0.812	70%	0.701	S	S	*	*			trans	-150	47.1	178.9	-123.7	172.7	0	0	0	116.9
1365	F	29.4	Very low	29.5	Very low	218 Å²	218	134.3 Å²	134.3	96%	0.956	71%	0.714	S	S	*	*			trans	-154.3	136.9	150.6	-104.8	-75.1	0	0	0	110.9
1366	G	26.6	Very low	28.5	Very low	78 Å²	78	141.2 Å²	141.2	80%	0.804	73%	0.733	S	S	*	*			trans	-94	-179.2	171.4	0	0	0	0	0	112.1
1367	G	24.8	Very low	28	Very low	67 Å²	67	138.3 Å²	138.3	69%	0.691	73%	0.734	S	S	*	*			cis	148.6	157.1	2.3	0	0	0	0	0	110.9
1368	N	24.3	Very low	27.5	Very low	155 Å²	155	140.3 Å²	140.3	83%	0.829	76%	0.755	S	S	*	*			trans	67.9	150.9	179.4	-62.8	-4.5	0	0	0	114.9
1369	N	25.7	Very low	26.7	Very low	128 Å²	128	138.7 Å²	138.7	68%	0.684	77%	0.766	S	S	*	*			cis	-160.4	167.3	2.8	-120.7	1.9	0	0	0	112
1370	N	28	Very low	26.3	Very low	134 Å²	134	140 Å²	140	72%	0.717	77%	0.773	S	S	*	*			trans	72.9	147.4	164.4	-57.7	2.1	0	0	0	117.4
1371	D	29.5	Very low	26.1	Very low	117 Å²	117	141 Å²	141	63%	0.626	78%	0.782	S	S	*	*			cis	-150	142.2	2.4	-121.7	-41.7	0	0	0	114
1372	R	26.8	Very low	25.8	Very low	219 Å²	219	142.4 Å²	142.4	83%	0.826	78%	0.784	S	S	*	*			trans	44.2	115.4	147.3	-70.1	163.7	-167.8	-133.5	-4.9	126.3
1373	C	25.2	Very low	25.4	Very low	110 Å²	110	141.8 Å²	141.8	74%	0.743	78%	0.78	S	S	*	*				72.4	113.7	116.4	-60.8	0	0	0	0	125.7
1374	Q	23.5	Very low	25.2	Very low	172 Å²	172	140.7 Å²	140.7	80%	0.804	78%	0.778	S	S	*	*				72.1	115.6	124.9	-70.6	-173.9	-41.6	0	0	125
1375	Q	23.5	Very low	25.1	Very low	153 Å²	153	139.1 Å²	139.1	72%	0.715	77%	0.774	S	S	*	*			trans	75.8	125.9	132.4	-78.1	-161.6	4.3	0	0	124.7
1376	R	21.9	Very low	24.7	Very low	207 Å²	207	134.9 Å²	134.9	78%	0.781	77%	0.766	S	S	*	*			trans	81.2	112.6	140.3	-74.1	-178.7	176.3	-162	-0.7	121.5
1377	C	23.2	Very low	24.5	Very low	119 Å²	119	135.5 Å²	135.5	80%	0.804	76%	0.758	S	S	*	*			trans	66.9	117.1	138.5	-52.3	0	0	0	0	121.2
1378	A	25	Very low	24.4	Very low	110 Å²	110	138.3 Å²	138.3	91%	0.909	76%	0.762	S	S	*	*			trans	54	118.8	146.4	0	0	0	0	0	120
1379	G	22.6	Very low	24.4	Very low	79 Å²	79	135.1 Å²	135.1	81%	0.814	75%	0.752	S	S	*	*			trans	162.7	89.5	167.8	0	0	0	0	0	114.5
1380	D	26.4	Very low	24.2	Very low	161 Å²	161	137.8 Å²	137.8	86%	0.861	76%	0.76	S	S	*	*			trans	-65.1	158.2	152.9	-71.4	-58	0	0	0	109.4
1381	P	30.1	Very low	24.1	Very low	111 Å²	111	137.5 Å²	137.5	72%	0.721	76%	0.763	S	S	*	*			cis	-149.6	168	40.3	43.7	-23.3	0	0	0	119.8
1382	E	21.7	Very low	23.8	Very low	165 Å²	165	137 Å²	137	77%	0.771	76%	0.764	S	S	*	*			trans	49.3	134	139.5	-74	-160.7	129	0	0	125.4
1383	L	24.7	Very low	23.6	Very low	129 Å²	129	133.6 Å²	133.6	68%	0.675	76%	0.762	S	S	*	*			trans	93.7	126.5	135.2	-77.9	164.7	0	0	0	123
1384	Q	21.9	Very low	23.8	Very low	168 Å²	168	134.8 Å²	134.8	79%	0.785	77%	0.766	S	S	*	*			trans	73.8	146.8	151.7	-65	174.6	22.1	0	0	119.9
1385	V	22.2	Very low	23.8	Very low	121 Å²	121	135.4 Å²	135.4	73%	0.733	77%	0.769	S	S	*	*			cis	161.9	151.4	-28.2	142.1	0	0	0	0	107.4
1386	T	21.9	Very low	24.1	Very low	130 Å²	130	136.9 Å²	136.9	80%	0.798	78%	0.776	S	S	*	*			trans	77.8	155.2	-176.7	73.9	0	0	0	0	117.6
1387	S	22.1	Very low	24.4	Very low	90 Å²	90	133.2 Å²	133.2	63%	0.629	77%	0.772	S	S	*	*			cis	-169.8	162.6	-36.8	62.8	0	0	0	0	111.6
1388	T	22.5	Very low	24.8	Very low	126 Å²	126	131.2 Å²	131.2	77%	0.773	76%	0.764	S	S	*	*			trans	59.3	145.8	146.2	49.3	0	0	0	0	121.4
1389	S	23.3	Very low	25.2	Very low	89 Å²	89	134.3 Å²	134.3	62%	0.622	76%	0.759	S	S	*	*			cis	-179.3	161.9	-11.6	54.5	0	0	0	0	112.3
1390	Q	22.6	Very low	25.8	Very low	184 Å²	184	138.1 Å²	138.1	86%	0.86	75%	0.754	S	S	*	*			trans	70.3	159.2	165.6	-56.2	176.1	0.3	0	0	115.3
1391	V	25	Very low	26.6	Very low	128 Å²	128	132.9 Å²	132.9	78%	0.776	73%	0.729	S	S	*	*			cis	-134.7	165.9	22.7	173.7	0	0	0	0	112.6
1392	T	23	Very low	27.5	Very low	106 Å²	106	132.9 Å²	132.9	65%	0.65	72%	0.723	S	S	*	*			trans	-64.7	166.9	-167.4	57.3	0	0	0	0	121.4
1393	N	24.3	Very low	28.8	Very low	147 Å²	147	130.4 Å²	130.4	79%	0.786	72%	0.715	S	S	*	*			trans	89.2	146.4	154.3	-57.6	-26.2	0	0	0	117.8
1394	V	27.9	Very low	30.2	Very low	135 Å²	135	127.3 Å²	127.3	82%	0.818	70%	0.701	S	S	*	*			cis	-127.4	152.3	9.5	177.2	0	0	0	0	111.5
1395	E	24.5	Very low	32.1	Very low	186 Å²	186	123.8 Å²	123.8	87%	0.869	69%	0.688	S	S	*	*			trans	-81.8	115.6	175.5	-59.4	165.3	119.9	0	0	112.6
1396	E	28.5	Very low	34.2	Very low	184 Å²	184	118.9 Å²	118.9	86%	0.86	66%	0.657	S	S	*	*			trans	-163.1	-27.3	160.7	-125.6	173.9	-158.7	0	0	114	A1398	E1396-A1398 PolarHBondContact O-N 3.14Å
1397	N	28.3	Very low	36.4	Very low	130 Å²	130	115.6 Å²	115.6	70%	0.695	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-7.5	-173.1	-78.7	-47.6	0	0	0	116.5	Q1399 K1400 S1401	N1397-Q1399 VanDerWaalsContact C-N 3.32Å; N1397-Q1399 PolarHBondContact O-N 3.02Å; N1397-K1400 PolarHBondContact O-N 3.43Å; N1397-S1401 PolarHBondContact O-N 2.65Å
1398	A	31.9	Very low	38.8	Very low	76 Å²	76	114.5 Å²	114.5	63%	0.628	62%	0.622	S	S	*	*	H	α-helix	trans	-66	-23.5	-166.3	0	0	0	0	0	115.7	E1396 S1401	E1396-A1398 PolarHBondContact O-N 3.14Å; A1398-S1401 PolarHBondContact O-OG 3.31Å; A1398-S1401 VanDerWaalsContact O-OG 3.14Å
1399	Q	34.8	Very low	41.5	Very low	175 Å²	175	109.1 Å²	109.1	82%	0.818	59%	0.588	S	S	*	*	H	α-helix	trans	-79.7	-24.8	177.1	-74	-172	-13	0	0	113.5	N1397	N1397-Q1399 VanDerWaalsContact C-N 3.32Å; N1397-Q1399 PolarHBondContact O-N 3.02Å
1400	K	34.9	Very low	44.1	Very low	160 Å²	160	105.3 Å²	105.3	70%	0.696	56%	0.56	S	S	*	*	H	α-helix	trans	-80.5	-37.7	177.3	-77.2	-179.4	177.5	173.1	0	112.2	N1397 N1402 L1403 T1404	N1397-K1400 PolarHBondContact O-N 3.43Å; K1400-N1402 PolarHBondContact O-N 3.25Å; K1400-L1403 PolarHBondContact O-N 2.8Å; K1400-T1404 PolarHBondContact O-N 3.01Å; K1400-T1404 PolarHBondContact O-OG1 2.79Å
1401	S	43.3	Very low	46.6	Very low	50 Å²	50	100 Å²	100	35%	0.35	54%	0.537	S	S	.	.	H	α-helix	trans	-62.6	-42.1	-175.3	52.3	0	0	0	0	113.8	N1397 A1398 T1404 N1405	N1397-S1401 PolarHBondContact O-N 2.65Å; A1398-S1401 PolarHBondContact O-OG 3.31Å; A1398-S1401 VanDerWaalsContact O-OG 3.14Å; S1401-T1404 WeakPolarHBondContact CA-OG1 3.42Å; S1401-T1404 PolarHBondContact O-N 2.97Å; S1401-T1404 PolarHBondContact O-OG1 3.01Å; S1401-N1405 WeakPolarHBondContact O-CB 3.35Å; S1401-N1405 PolarHBondContact O-N 3.47Å; S1401-N1405 PolarHBondContact O-ND2 3.46Å; S1401-N1405 PolarHBondContact O-OD1 2.99Å
1402	N	48.6	Very low	49	Very low	111 Å²	111	99.4 Å²	99.4	59%	0.594	53%	0.526	S	S	*	.	H	α-helix	trans	-65.9	-39.3	176.9	-83.8	-8	0	0	0	112.3	K1400 N1405 I1406	K1400-N1402 PolarHBondContact O-N 3.25Å; N1402-N1405 PolarHBondContact O-N 3.4Å; N1402-I1406 WeakPolarHBondContact O-CG1 3.37Å; N1402-I1406 PolarHBondContact O-N 2.68Å
1403	L	48.9	Very low	51.7	Low	114 Å²	114	94.3 Å²	94.3	60%	0.597	50%	0.495	S	S	*	.	H	α-helix	trans	-67.3	-40.2	176.4	-102	163.8	0	0	0	112.1	K1400 F1407	K1400-L1403 PolarHBondContact O-N 2.8Å; L1403-F1407 WeakPolarHBondContact O-CB 3.46Å; L1403-F1407 PolarHBondContact O-N 3.45Å
1404	T	53.7	Low	54.5	Low	64 Å²	64	87.8 Å²	87.8	39%	0.393	46%	0.459	S	S	.	.	H	α-helix	trans	-64.7	-41	173.1	49.6	0	0	0	0	111.8	K1400 S1401 F1407 T1408	K1400-T1404 PolarHBondContact O-N 3.01Å; K1400-T1404 PolarHBondContact O-OG1 2.79Å; S1401-T1404 WeakPolarHBondContact CA-OG1 3.42Å; S1401-T1404 PolarHBondContact O-N 2.97Å; S1401-T1404 PolarHBondContact O-OG1 3.01Å; T1404-F1407 PolarHBondContact O-N 3.24Å; T1404-T1408 PolarHBondContact O-N 3.31Å; T1404-T1408 PolarHBondContact O-OG1 3.15Å
1405	N	61.9	Low	57	Low	94 Å²	94	83.4 Å²	83.4	50%	0.503	43%	0.431	S	S	.	.	H	α-helix	trans	-66	-40.1	-179.2	-69.6	-2.8	0	0	0	112.4	S1401 N1402 F1407 T1408 E1409	S1401-N1405 WeakPolarHBondContact O-CB 3.35Å; S1401-N1405 PolarHBondContact O-N 3.47Å; S1401-N1405 PolarHBondContact O-ND2 3.46Å; S1401-N1405 PolarHBondContact O-OD1 2.99Å; N1402-N1405 PolarHBondContact O-N 3.4Å; N1405-F1407 VanDerWaalsContact C-N 3.34Å; N1405-T1408 WeakPolarHBondContact CA-OG1 3.46Å; N1405-T1408 PolarHBondContact O-OG1 2.96Å; N1405-E1409 VanDerWaalsContact O-CB 3.3Å; N1405-E1409 WeakPolarHBondContact O-CB 3.26Å; N1405-E1409 PolarHBondContact O-N 3.23Å
1406	I	67.3	Low	59.6	Low	17 Å²	17	76 Å²	76	9%	0.087	40%	0.4	C	S	.	.	H	α-helix	trans	-68.8	-34.5	173.6	-66.6	167	0	0	0	110.7	N1402 E1409 L1410	N1402-I1406 WeakPolarHBondContact O-CG1 3.37Å; N1402-I1406 PolarHBondContact O-N 2.68Å; I1406-E1409 WeakPolarHBondContact O-CB 3.47Å; I1406-E1409 PolarHBondContact O-N 3.12Å; I1406-L1410 HydrophobicContact CG2-CD1 4.13Å; I1406-L1410 WeakPolarHBondContact O-CG 3.22Å; I1406-L1410 PolarHBondContact O-N 3.2Å
1407	F	67.9	Low	61.9	Low	61 Å²	61	68.6 Å²	68.6	27%	0.268	37%	0.366	S	S	.	.	H	α-helix	trans	-71.5	-38.4	177.5	-154.7	-100.5	0	0	0	112.5	L1297 T1352 T1355 L1403 T1404 N1405 L1410 I1411	L1297-F1407 HydrophobicContact CD2-CD2 4.47Å; T1352-F1407 HydrophobicContact CG2-CZ 4.21Å; T1355-F1407 HydrophobicContact CG2-CE1 4.41Å; L1403-F1407 WeakPolarHBondContact O-CB 3.46Å; L1403-F1407 PolarHBondContact O-N 3.45Å; T1404-F1407 PolarHBondContact O-N 3.24Å; N1405-F1407 VanDerWaalsContact C-N 3.34Å; F1407-L1410 PolarHBondContact O-N 3.38Å; F1407-I1411 HydrophobicContact CD1-CD1 3.63Å; F1407-I1411 HydrophobicContact CD1-CG1 4.22Å; F1407-I1411 HydrophobicContact CE1-CD1 3.83Å; F1407-I1411 HydrophobicContact CE1-CG1 4.22Å; F1407-I1411 VanDerWaalsContact O-CG1 3.29Å; F1407-I1411 WeakPolarHBondContact O-CG1 3.35Å; F1407-I1411 PolarHBondContact O-N 2.9Å
1408	T	70.8	Confident	64.6	Low	67 Å²	67	62.4 Å²	62.4	41%	0.411	33%	0.333	S	S	.	.	H	α-helix	trans	-66.1	-39.5	170.5	51.3	0	0	0	0	111.5	T1404 N1405 L1410 I1411 E1412	T1404-T1408 PolarHBondContact O-N 3.31Å; T1404-T1408 PolarHBondContact O-OG1 3.15Å; N1405-T1408 WeakPolarHBondContact CA-OG1 3.46Å; N1405-T1408 PolarHBondContact O-OG1 2.96Å; T1408-L1410 VanDerWaalsContact C-N 3.26Å; T1408-L1410 PolarHBondContact O-N 3.43Å; T1408-I1411 PolarHBondContact O-N 2.96Å; T1408-E1412 WeakPolarHBondContact O-CB 3.48Å; T1408-E1412 WeakPolarHBondContact O-CG 3.24Å; T1408-E1412 PolarHBondContact O-N 3.44Å
1409	E	79.4	Confident	67.1	Low	13 Å²	13	58.8 Å²	58.8	6%	0.061	30%	0.303	C	S	.	.	H	α-helix	trans	-58.1	-37.8	172.5	-167.3	-163.7	171.8	0	0	111.9	F1301 G1304 V1305 R1308 N1405 I1406 T1413	F1301-E1409 WeakPolarHBondContact CB-OE1 3.44Å; F1301-E1409 PolarHBondContact N-OE1 2.88Å; G1304-E1409 VanDerWaalsContact C-OE1 3.24Å; G1304-E1409 WeakPolarHBondContact CA-OE1 3.49Å; V1305-E1409 HydrophobicContact CG2-CG 4.02Å; R1308-E1409 IonicContact CZ-OE1 2.68Å; R1308-E1409 IonicContact CZ-OE2 3.53Å; R1308-E1409 IonicContact NE-OE1 3.84Å; R1308-E1409 PolarHBondContact NE-OE1 3.2Å; R1308-E1409 IonicContact NE-OE2 3.76Å; R1308-E1409 PolarHBondContact NE-OE2 3.45Å; R1308-E1409 VanDerWaalsContact NH2-CD 3.34Å; R1308-E1409 IonicContact NH2-OE1 2.75Å; R1308-E1409 IonicContact NH2-OE2 2.84Å; R1308-E1409 PolarHBondContact NH2-OE2 2.92Å; N1405-E1409 VanDerWaalsContact O-CB 3.3Å; N1405-E1409 WeakPolarHBondContact O-CB 3.26Å; N1405-E1409 PolarHBondContact O-N 3.23Å; I1406-E1409 WeakPolarHBondContact O-CB 3.47Å; I1406-E1409 PolarHBondContact O-N 3.12Å; E1409-T1413 WeakPolarHBondContact O-CB 3.2Å; E1409-T1413 WeakPolarHBondContact O-CG2 3.44Å; E1409-T1413 PolarHBondContact O-N 2.96Å; E1409-T1413 VanDerWaalsContact O-N 3.11Å; E1409-T1413 PolarHBondContact O-OG1 3.09Å
1410	L	79.4	Confident	69.2	Low	9 Å²	9	53.7 Å²	53.7	5%	0.047	28%	0.276	C	S	.	.	H	α-helix	trans	-74.2	-39.3	176.5	-74.4	168	0	0	0	113	L1297 I1406 F1407 T1408 E1412 T1413 F1414	L1297-L1410 HydrophobicContact CD2-CD1 3.45Å; L1297-L1410 VanDerWaalsContact CD2-CD1 3.45Å; L1297-L1410 HydrophobicContact CG-CD1 4.25Å; I1406-L1410 HydrophobicContact CG2-CD1 4.13Å; I1406-L1410 WeakPolarHBondContact O-CG 3.22Å; I1406-L1410 PolarHBondContact O-N 3.2Å; F1407-L1410 PolarHBondContact O-N 3.38Å; T1408-L1410 VanDerWaalsContact C-N 3.26Å; T1408-L1410 PolarHBondContact O-N 3.43Å; L1410-E1412 VanDerWaalsContact C-N 3.34Å; L1410-T1413 VanDerWaalsContact CA-OG1 3.31Å; L1410-T1413 WeakPolarHBondContact CA-OG1 3.41Å; L1410-T1413 PolarHBondContact O-N 3.22Å; L1410-T1413 PolarHBondContact O-OG1 3.44Å; L1410-T1413 VanDerWaalsContact O-OG1 3.09Å; L1410-F1414 HydrophobicContact CD2-CD2 4.14Å; L1410-F1414 HydrophobicContact CD2-CE2 3.81Å; L1410-F1414 PolarHBondContact O-N 3.26Å; L1410-F1414 VanDerWaalsContact O-N 3.13Å
1411	I	74.9	Confident	71.4	Confident	72 Å²	72	47.2 Å²	47.2	37%	0.369	25%	0.249	S	C	.	.	H	α-helix	trans	-60.8	-44	172.1	-67	160.7	0	0	0	110.7	V1349 F1407 T1408 T1413	V1349-I1411 HydrophobicContact CG1-CB 4.49Å; V1349-I1411 HydrophobicContact CG1-CG1 4.11Å; V1349-I1411 HydrophobicContact CG2-CG1 4.44Å; F1407-I1411 HydrophobicContact CD1-CD1 3.63Å; F1407-I1411 HydrophobicContact CD1-CG1 4.22Å; F1407-I1411 HydrophobicContact CE1-CD1 3.83Å; F1407-I1411 HydrophobicContact CE1-CG1 4.22Å; F1407-I1411 VanDerWaalsContact O-CG1 3.29Å; F1407-I1411 WeakPolarHBondContact O-CG1 3.35Å; F1407-I1411 PolarHBondContact O-N 2.9Å; T1408-I1411 PolarHBondContact O-N 2.96Å; I1411-T1413 VanDerWaalsContact C-N 3.31Å; I1411-T1413 PolarHBondContact O-N 3.48Å
1412	E	74.3	Confident	73.4	Confident	116 Å²	116	44.9 Å²	44.9	54%	0.542	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-6.8	-178.9	-71.6	179.8	-168.3	0	0	114.2	V1305 R1309 T1408 L1410	V1305-E1412 HydrophobicContact CG1-CB 4.3Å; V1305-E1412 WeakPolarHBondContact CG1-O 3.11Å; V1305-E1412 HydrophobicContact CG2-CB 3.55Å; R1309-E1412 PolarHBondContact NE-O 3.24Å; R1309-E1412 PolarHBondContact NH2-O 3.23Å; T1408-E1412 WeakPolarHBondContact O-CB 3.48Å; T1408-E1412 WeakPolarHBondContact O-CG 3.24Å; T1408-E1412 PolarHBondContact O-N 3.44Å; L1410-E1412 VanDerWaalsContact C-N 3.34Å
1413	T	80.5	Confident	75.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-40.3	174.8	43.8	0	0	0	0	113	V1305 R1308 R1309 E1409 L1410 I1411 D1415 L1418	V1305-T1413 HydrophobicContact CB-CG2 3.97Å; V1305-T1413 HydrophobicContact CG1-CG2 3.75Å; V1305-T1413 HydrophobicContact CG2-CG2 4.14Å; R1308-T1413 HydrophobicContact CB-CG2 3.76Å; R1308-T1413 HydrophobicContact CG-CG2 4.45Å; R1309-T1413 HydrophobicContact CG-CG2 4.25Å; E1409-T1413 WeakPolarHBondContact O-CB 3.2Å; E1409-T1413 WeakPolarHBondContact O-CG2 3.44Å; E1409-T1413 PolarHBondContact O-N 2.96Å; E1409-T1413 VanDerWaalsContact O-N 3.11Å; E1409-T1413 PolarHBondContact O-OG1 3.09Å; L1410-T1413 VanDerWaalsContact CA-OG1 3.31Å; L1410-T1413 WeakPolarHBondContact CA-OG1 3.41Å; L1410-T1413 PolarHBondContact O-N 3.22Å; L1410-T1413 PolarHBondContact O-OG1 3.44Å; L1410-T1413 VanDerWaalsContact O-OG1 3.09Å; I1411-T1413 VanDerWaalsContact C-N 3.31Å; I1411-T1413 PolarHBondContact O-N 3.48Å; T1413-D1415 VanDerWaalsContact C-N 3.29Å; T1413-D1415 PolarHBondContact O-N 3.2Å; T1413-L1418 VanDerWaalsContact O-CD2 3.29Å; T1413-L1418 WeakPolarHBondContact O-CD2 3.29Å
1414	F	82.9	Confident	76.8	Confident	10 Å²	10	37.5 Å²	37.5	4%	0.044	19%	0.192	C	C	.	.	S	Bend	trans	-91.5	58.9	-180	-70.3	-82.8	0	0	0	111.7	L1312 L1345 F1346 V1349 L1410 L1418	L1312-F1414 HydrophobicContact CD1-CE1 4.23Å; L1312-F1414 HydrophobicContact CD1-CZ 3.95Å; L1345-F1414 HydrophobicContact CB-CD1 4.23Å; L1345-F1414 HydrophobicContact CB-CE1 3.61Å; L1345-F1414 HydrophobicContact CB-CZ 3.82Å; L1345-F1414 HydrophobicContact CD1-CE1 3.95Å; L1345-F1414 HydrophobicContact CD1-CZ 3.69Å; L1345-F1414 HydrophobicContact CG-CE1 4.44Å; L1345-F1414 HydrophobicContact CG-CZ 4.4Å; F1346-F1414 HydrophobicContact CD1-CB 3.78Å; F1346-F1414 HydrophobicContact CD1-CD1 4.1Å; F1346-F1414 HydrophobicContact CD1-CG 4.43Å; F1346-F1414 AromaticContact CD2-CD1 3.95Å; F1346-F1414 HydrophobicContact CD2-CD1 3.95Å; F1346-F1414 HydrophobicContact CE1-CB 3.85Å; F1346-F1414 AromaticContact CE1-CD1 3.95Å; F1346-F1414 HydrophobicContact CE1-CD1 3.95Å; F1346-F1414 HydrophobicContact CE1-CG 4.43Å; F1346-F1414 AromaticContact CE2-CD1 3.8Å; F1346-F1414 HydrophobicContact CE2-CD1 3.8Å; F1346-F1414 HydrophobicContact CE2-CE1 4.36Å; F1346-F1414 HydrophobicContact CG-CB 4.4Å; F1346-F1414 HydrophobicContact CG-CD1 4.11Å; F1346-F1414 AromaticContact CZ-CD1 3.81Å; F1346-F1414 HydrophobicContact CZ-CD1 3.81Å; V1349-F1414 HydrophobicContact CG2-CB 4.18Å; L1410-F1414 HydrophobicContact CD2-CD2 4.14Å; L1410-F1414 HydrophobicContact CD2-CE2 3.81Å; L1410-F1414 PolarHBondContact O-N 3.26Å; L1410-F1414 VanDerWaalsContact O-N 3.13Å; F1414-L1418 HydrophobicContact CD1-CD2 4.15Å; F1414-L1418 HydrophobicContact CE1-CD2 4.38Å
1415	D	79.6	Confident	78	Confident	43 Å²	43	34.8 Å²	34.8	23%	0.23	18%	0.175	C	C	.	.			trans	-86.1	172.8	-178.1	72.6	-12	0	0	0	114.1	R1309 T1413 D1417 L1418 A1419	R1309-D1415 IonicContact CZ-OD1 2.76Å; R1309-D1415 IonicContact CZ-OD2 3.01Å; R1309-D1415 VanDerWaalsContact CZ-OD2 3.23Å; R1309-D1415 VanDerWaalsContact NH1-CG 3.32Å; R1309-D1415 IonicContact NH1-OD1 3.8Å; R1309-D1415 PolarHBondContact NH1-OD1 3.22Å; R1309-D1415 IonicContact NH1-OD2 2.64Å; R1309-D1415 PolarHBondContact NH1-OD2 2.65Å; R1309-D1415 IonicContact NH2-OD1 3.42Å; R1309-D1415 IonicContact NH2-OD2 3.81Å; R1309-D1415 PolarHBondContact NH2-OD2 3.07Å; T1413-D1415 VanDerWaalsContact C-N 3.29Å; T1413-D1415 PolarHBondContact O-N 3.2Å; D1415-D1417 PolarHBondContact O-N 3.08Å; D1415-D1417 PolarHBondContact OD1-N 2.57Å; D1415-L1418 PolarHBondContact O-N 3.19Å; D1415-L1418 VanDerWaalsContact OD1-CB 3.23Å; D1415-L1418 WeakPolarHBondContact OD1-CB 3.43Å; D1415-L1418 PolarHBondContact OD1-N 3.01Å; D1415-A1419 PolarHBondContact O-N 3.18Å
1416	C	79.3	Confident	79.2	Confident	31 Å²	31	30.4 Å²	30.4	21%	0.209	15%	0.152	C	C	.	.	H	α-helix	trans	-60.4	-29.7	177.5	-56.5	0	0	0	0	112.8	R1420 L1448 L1452	C1416-R1420 VanDerWaalsContact O-CB 3.26Å; C1416-R1420 WeakPolarHBondContact O-CB 3.4Å; C1416-R1420 PolarHBondContact O-N 3.37Å; C1416-L1448 HydrophobicContact CB-CB 4.33Å; C1416-L1448 WeakPolarHBondContact CB-O 3.48Å; C1416-L1448 PolarHBondContact SG-O 3Å; C1416-L1452 HydrophobicContact CB-CB 4.21Å; C1416-L1452 HydrophobicContact CB-CD1 3.81Å
1417	D	78	Confident	80.1	Confident	28 Å²	28	30.5 Å²	30.5	15%	0.15	15%	0.154	C	C	.	.	H	α-helix	trans	-75.5	-43	-177.2	-130.9	12.5	0	0	0	111.4	R1159 D1415 R1420 M1421 L1452	R1159-D1417 IonicContact NH2-OD2 3.97Å; R1159-D1417 PolarHBondContact NH2-OD2 2.76Å; D1415-D1417 PolarHBondContact O-N 3.08Å; D1415-D1417 PolarHBondContact OD1-N 2.57Å; D1417-R1420 PolarHBondContact O-N 2.81Å; D1417-R1420 IonicContact OD1-CZ 3.68Å; D1417-R1420 IonicContact OD1-NE 3.1Å; D1417-R1420 PolarHBondContact OD1-NE 3.3Å; D1417-R1420 IonicContact OD1-NH2 2.66Å; D1417-R1420 PolarHBondContact OD1-NH2 3.1Å; D1417-M1421 WeakPolarHBondContact O-CE 3.48Å; D1417-M1421 WeakPolarHBondContact O-CG 3.47Å; D1417-M1421 PolarHBondContact O-N 2.86Å; D1417-L1452 HydrophobicContact CB-CD1 4.23Å
1418	L	84.5	Confident	80.7	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-42.4	170.8	-177.8	68.2	0	0	0	111.4	L1312 Y1313 I1316 F1342 F1346 T1413 F1414 D1415 R1420 M1421 A1422	L1312-L1418 HydrophobicContact CB-CD1 4.39Å; L1312-L1418 HydrophobicContact CD1-CD2 3.88Å; Y1313-L1418 HydrophobicContact CD1-CD1 4.12Å; Y1313-L1418 HydrophobicContact CE1-CD1 3.85Å; I1316-L1418 HydrophobicContact CD1-CD1 3.88Å; F1342-L1418 HydrophobicContact CZ-CG 4.46Å; F1346-L1418 HydrophobicContact CZ-CB 4.49Å; F1346-L1418 HydrophobicContact CZ-CD2 4.16Å; F1346-L1418 HydrophobicContact CZ-CG 4.19Å; T1413-L1418 VanDerWaalsContact O-CD2 3.29Å; T1413-L1418 WeakPolarHBondContact O-CD2 3.29Å; F1414-L1418 HydrophobicContact CD1-CD2 4.15Å; F1414-L1418 HydrophobicContact CE1-CD2 4.38Å; D1415-L1418 PolarHBondContact O-N 3.19Å; D1415-L1418 VanDerWaalsContact OD1-CB 3.23Å; D1415-L1418 WeakPolarHBondContact OD1-CB 3.43Å; D1415-L1418 PolarHBondContact OD1-N 3.01Å; L1418-R1420 PolarHBondContact O-N 2.97Å; L1418-M1421 PolarHBondContact O-N 3.4Å; L1418-A1422 WeakPolarHBondContact O-CB 3.05Å; L1418-A1422 PolarHBondContact O-N 3.46Å; L1418-A1422 VanDerWaalsContact O-N 3.08Å
1419	A	84.1	Confident	81.3	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.3	-47.2	175	0	0	0	0	0	111.4	F1346 D1415 Y1423	F1346-A1419 HydrophobicContact CD1-CB 4.43Å; F1346-A1419 HydrophobicContact CE1-CB 3.69Å; F1346-A1419 HydrophobicContact CZ-CB 3.9Å; D1415-A1419 PolarHBondContact O-N 3.18Å; A1419-Y1423 WeakPolarHBondContact O-CB 3.01Å; A1419-Y1423 PolarHBondContact O-N 3.1Å
1420	R	79.6	Confident	81.5	Confident	68 Å²	68	29.5 Å²	29.5	26%	0.257	15%	0.145	S	C	.	.	H	α-helix	trans	-61.1	-50.3	178.3	-177.5	174.7	68.4	131.7	-13.5	112.3	C1416 D1417 L1418 A1422 Y1423 I1424 I1449 E1456	C1416-R1420 VanDerWaalsContact O-CB 3.26Å; C1416-R1420 WeakPolarHBondContact O-CB 3.4Å; C1416-R1420 PolarHBondContact O-N 3.37Å; D1417-R1420 PolarHBondContact O-N 2.81Å; D1417-R1420 IonicContact OD1-CZ 3.68Å; D1417-R1420 IonicContact OD1-NE 3.1Å; D1417-R1420 PolarHBondContact OD1-NE 3.3Å; D1417-R1420 IonicContact OD1-NH2 2.66Å; D1417-R1420 PolarHBondContact OD1-NH2 3.1Å; L1418-R1420 PolarHBondContact O-N 2.97Å; R1420-A1422 PolarHBondContact O-N 2.89Å; R1420-Y1423 PolarHBondContact O-N 3.04Å; R1420-I1424 HydrophobicContact CG-CD1 3.81Å; R1420-I1424 WeakPolarHBondContact O-CG1 3.12Å; R1420-I1424 PolarHBondContact O-N 3.02Å; R1420-I1449 HydrophobicContact CB-CG1 4.2Å; R1420-E1456 IonicContact NH2-OE1 2.79Å
1421	M	80.8	Confident	81.5	Confident	24 Å²	24	29.8 Å²	29.8	12%	0.118	15%	0.151	C	C	.	.	H	α-helix	trans	-60.2	-46.5	-179.5	-74.7	-176.2	-75.5	0	0	112.1	N1157 R1159 Y1313 D1417 L1418 S1425	N1157-M1421 HydrophobicContact CB-SD 4.36Å; R1159-M1421 HydrophobicContact CG-SD 3.96Å; Y1313-M1421 HydrophobicContact CE1-CE 3.67Å; D1417-M1421 WeakPolarHBondContact O-CE 3.48Å; D1417-M1421 WeakPolarHBondContact O-CG 3.47Å; D1417-M1421 PolarHBondContact O-N 2.86Å; L1418-M1421 PolarHBondContact O-N 3.4Å; M1421-S1425 VanDerWaalsContact O-CB 3.3Å; M1421-S1425 WeakPolarHBondContact O-CB 3.45Å; M1421-S1425 PolarHBondContact O-N 3.46Å; M1421-S1425 PolarHBondContact O-OG 2.9Å
1422	A	84.8	Confident	81.7	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67.4	-44.4	178.6	0	0	0	0	0	112.4	I1316 F1342 F1343 L1418 R1420 S1425 F1426	I1316-A1422 HydrophobicContact CD1-CB 3.96Å; I1316-A1422 HydrophobicContact CG1-CB 4.43Å; F1342-A1422 HydrophobicContact CD1-CB 4.34Å; F1342-A1422 HydrophobicContact CE1-CB 3.33Å; F1342-A1422 HydrophobicContact CZ-CB 3.57Å; F1343-A1422 HydrophobicContact CE1-CB 4.49Å; F1343-A1422 HydrophobicContact CZ-CB 4.18Å; L1418-A1422 WeakPolarHBondContact O-CB 3.05Å; L1418-A1422 PolarHBondContact O-N 3.46Å; L1418-A1422 VanDerWaalsContact O-N 3.08Å; R1420-A1422 PolarHBondContact O-N 2.89Å; A1422-S1425 PolarHBondContact O-N 2.68Å; A1422-F1426 HydrophobicContact CB-CD2 4.48Å; A1422-F1426 HydrophobicContact CB-CE2 4.06Å; A1422-F1426 WeakPolarHBondContact O-CD2 3.26Å; A1422-F1426 VanDerWaalsContact O-CG 3.25Å; A1422-F1426 WeakPolarHBondContact O-CG 3.46Å; A1422-F1426 PolarHBondContact O-N 3.22Å
1423	Y	85.2	Confident	81.8	Confident	22 Å²	22	25.7 Å²	25.7	9%	0.086	14%	0.141	C	C	.	.	H	α-helix	trans	-64.6	-46.5	-176.8	-178	-91.8	0	0	0	112.4	F1343 A1419 R1420 S1425 F1426 C1427 I1435 D1436 I1445 Q1446 I1449	F1343-Y1423 HydrophobicContact CZ-CD2 4.31Å; A1419-Y1423 WeakPolarHBondContact O-CB 3.01Å; A1419-Y1423 PolarHBondContact O-N 3.1Å; R1420-Y1423 PolarHBondContact O-N 3.04Å; Y1423-S1425 VanDerWaalsContact C-N 3.34Å; Y1423-S1425 PolarHBondContact O-N 3.36Å; Y1423-F1426 PolarHBondContact O-N 3.46Å; Y1423-C1427 VanDerWaalsContact CE1-SG 3.57Å; Y1423-C1427 VanDerWaalsContact O-CB 3.28Å; Y1423-C1427 WeakPolarHBondContact O-CB 3.37Å; Y1423-C1427 PolarHBondContact O-N 3.4Å; Y1423-C1427 PolarHBondContact O-SG 3.04Å; Y1423-I1435 HydrophobicContact CD2-CG2 4.15Å; Y1423-I1435 HydrophobicContact CE2-CG2 3.91Å; Y1423-D1436 PolarHBondContact OH-OD1 3.4Å; Y1423-I1445 HydrophobicContact CD2-CG2 3.92Å; Y1423-I1445 HydrophobicContact CE2-CG2 4.49Å; Y1423-I1445 HydrophobicContact CG-CG2 4.39Å; Y1423-Q1446 PolarHBondContact OH-NE2 3.14Å; Y1423-I1449 HydrophobicContact CD1-CD1 3.74Å; Y1423-I1449 HydrophobicContact CE1-CD1 4.38Å; Y1423-I1449 HydrophobicContact CG-CD1 3.83Å
1424	I	83.1	Confident	82	Confident	49 Å²	49	28.4 Å²	28.4	25%	0.251	15%	0.152	S	C	.	.	H	α-helix	trans	-61.3	-46	176.3	-66.2	172.1	0	0	0	110.1	R1420 F1426 C1427 H1428 L1500	R1420-I1424 HydrophobicContact CG-CD1 3.81Å; R1420-I1424 WeakPolarHBondContact O-CG1 3.12Å; R1420-I1424 PolarHBondContact O-N 3.02Å; I1424-F1426 PolarHBondContact O-N 3.41Å; I1424-C1427 PolarHBondContact O-N 3.3Å; I1424-H1428 PolarHBondContact O-N 3.23Å; I1424-H1428 VanDerWaalsContact O-N 3.12Å; I1424-L1500 HydrophobicContact CD1-CD2 4.31Å; I1424-L1500 HydrophobicContact CD1-CG 4.43Å; I1424-L1500 HydrophobicContact CG1-CD2 4.05Å
1425	S	79.9	Confident	82.1	Confident	7 Å²	7	28 Å²	28	5%	0.049	15%	0.15	C	C	.	.	H	α-helix	trans	-58.8	-46.3	179.5	-61.2	0	0	0	0	112.5	M1421 A1422 Y1423 H1428 L1429	M1421-S1425 VanDerWaalsContact O-CB 3.3Å; M1421-S1425 WeakPolarHBondContact O-CB 3.45Å; M1421-S1425 PolarHBondContact O-N 3.46Å; M1421-S1425 PolarHBondContact O-OG 2.9Å; A1422-S1425 PolarHBondContact O-N 2.68Å; Y1423-S1425 VanDerWaalsContact C-N 3.34Å; Y1423-S1425 PolarHBondContact O-N 3.36Å; S1425-H1428 PolarHBondContact O-N 3.13Å; S1425-L1429 WeakPolarHBondContact O-CG 3.27Å
1426	F	87.9	Confident	82.3	Confident	1 Å²	1	27.2 Å²	27.2	0%	0.004	15%	0.146	C	C	.	.	H	α-helix	trans	-77.5	-30.5	-178.7	-56.5	-25.8	0	0	0	112.9	I1316 V1319 F1339 F1342 F1343 A1422 Y1423 I1424 H1428 L1429 A1430 I1435	I1316-F1426 HydrophobicContact CG1-CZ 4.33Å; I1316-F1426 HydrophobicContact CG2-CE1 4.47Å; V1319-F1426 HydrophobicContact CB-CE1 4.23Å; V1319-F1426 HydrophobicContact CG1-CD1 4.42Å; V1319-F1426 HydrophobicContact CG1-CE1 3.77Å; V1319-F1426 HydrophobicContact CG1-CZ 4.3Å; F1339-F1426 HydrophobicContact CD1-CB 4.16Å; F1339-F1426 HydrophobicContact CD1-CD1 4.02Å; F1339-F1426 AromaticContact CD1-CD2 3.56Å; F1339-F1426 HydrophobicContact CD1-CD2 3.56Å; F1339-F1426 HydrophobicContact CD1-CE1 4.3Å; F1339-F1426 AromaticContact CD1-CE2 3.88Å; F1339-F1426 HydrophobicContact CD1-CE2 3.88Å; F1339-F1426 AromaticContact CD1-CG 3.65Å; F1339-F1426 HydrophobicContact CD1-CG 3.65Å; F1339-F1426 HydrophobicContact CD1-CZ 4.24Å; F1339-F1426 HydrophobicContact CE1-CB 3.98Å; F1339-F1426 AromaticContact CE1-CD1 3.54Å; F1339-F1426 HydrophobicContact CE1-CD1 3.54Å; F1339-F1426 AromaticContact CE1-CD2 3.96Å; F1339-F1426 HydrophobicContact CE1-CD2 3.96Å; F1339-F1426 AromaticContact CE1-CE1 3.96Å; F1339-F1426 HydrophobicContact CE1-CE1 3.96Å; F1339-F1426 HydrophobicContact CE1-CE2 4.35Å; F1339-F1426 AromaticContact CE1-CG 3.55Å; F1339-F1426 HydrophobicContact CE1-CG 3.55Å; F1339-F1426 HydrophobicContact CE1-CZ 4.34Å; F1339-F1426 HydrophobicContact CG-CD2 4.39Å; F1339-F1426 HydrophobicContact CZ-CB 4.38Å; F1339-F1426 HydrophobicContact CZ-CD1 4.42Å; F1339-F1426 HydrophobicContact CZ-CG 4.39Å; F1342-F1426 HydrophobicContact CD1-CE2 4.09Å; F1342-F1426 HydrophobicContact CE1-CE2 4.39Å; F1343-F1426 AromaticContact CE2-CD2 3.83Å; F1343-F1426 HydrophobicContact CE2-CD2 3.83Å; F1343-F1426 HydrophobicContact CE2-CE2 4.33Å; F1343-F1426 HydrophobicContact CZ-CD2 4.31Å; A1422-F1426 HydrophobicContact CB-CD2 4.48Å; A1422-F1426 HydrophobicContact CB-CE2 4.06Å; A1422-F1426 WeakPolarHBondContact O-CD2 3.26Å; A1422-F1426 VanDerWaalsContact O-CG 3.25Å; A1422-F1426 WeakPolarHBondContact O-CG 3.46Å; A1422-F1426 PolarHBondContact O-N 3.22Å; Y1423-F1426 PolarHBondContact O-N 3.46Å; I1424-F1426 PolarHBondContact O-N 3.41Å; F1426-H1428 VanDerWaalsContact C-N 3.25Å; F1426-H1428 PolarHBondContact O-N 2.88Å; F1426-L1429 HydrophobicContact CD1-CD1 4.03Å; F1426-L1429 PolarHBondContact O-N 3.4Å; F1426-L1429 VanDerWaalsContact O-N 3.09Å; F1426-A1430 PolarHBondContact O-N 3.37Å; F1426-A1430 VanDerWaalsContact O-N 3.12Å; F1426-I1435 HydrophobicContact CB-CD1 4.1Å
1427	C	84.8	Confident	82.4	Confident	20 Å²	20	32.4 Å²	32.4	14%	0.135	17%	0.172	C	C	.	.	H	α-helix	trans	-60.2	-35	170	-72.8	0	0	0	0	112.2	Y1423 I1424 L1429 G1431	Y1423-C1427 VanDerWaalsContact CE1-SG 3.57Å; Y1423-C1427 VanDerWaalsContact O-CB 3.28Å; Y1423-C1427 WeakPolarHBondContact O-CB 3.37Å; Y1423-C1427 PolarHBondContact O-N 3.4Å; Y1423-C1427 PolarHBondContact O-SG 3.04Å; I1424-C1427 PolarHBondContact O-N 3.3Å; C1427-L1429 VanDerWaalsContact C-N 3.31Å; C1427-L1429 PolarHBondContact O-N 3.38Å; C1427-G1431 CarbonylContact O-C 3.5Å; C1427-G1431 WeakPolarHBondContact O-CA 3.09Å; C1427-G1431 PolarHBondContact O-N 3.33Å
1428	H	81.3	Confident	82.6	Confident	113 Å²	113	32.3 Å²	32.3	52%	0.523	17%	0.173	S	C	.	.	H	α-helix	trans	-68.6	-27.2	174.7	-168.9	-76.9	0	0	0	113.1	Y1320 I1424 S1425 F1426	Y1320-H1428 HydrophobicContact CE2-CB 4.39Å; Y1320-H1428 PolarHBondContact OH-ND1 3.3Å; I1424-H1428 PolarHBondContact O-N 3.23Å; I1424-H1428 VanDerWaalsContact O-N 3.12Å; S1425-H1428 PolarHBondContact O-N 3.13Å; F1426-H1428 VanDerWaalsContact C-N 3.25Å; F1426-H1428 PolarHBondContact O-N 2.88Å
1429	L	82.7	Confident	82.5	Confident	6 Å²	6	32.8 Å²	32.8	3%	0.031	18%	0.175	C	C	.	.	H	α-helix	trans	-87.1	-35.9	-177.3	-60.7	170	0	0	0	113.8	Y1320 L1324 F1328 T1331 S1425 F1426 C1427	Y1320-L1429 HydrophobicContact CD2-CD1 3.8Å; Y1320-L1429 HydrophobicContact CD2-CD2 3.72Å; Y1320-L1429 HydrophobicContact CD2-CG 3.78Å; Y1320-L1429 HydrophobicContact CE2-CD2 3.84Å; Y1320-L1429 HydrophobicContact CE2-CG 4.05Å; Y1320-L1429 HydrophobicContact CG-CD1 4.28Å; Y1320-L1429 HydrophobicContact CG-CD2 4.1Å; Y1320-L1429 HydrophobicContact CG-CG 4.5Å; L1324-L1429 HydrophobicContact CD2-CD2 4.06Å; L1324-L1429 HydrophobicContact CG-CD2 4Å; F1328-L1429 WeakPolarHBondContact CD2-O 3.41Å; T1331-L1429 HydrophobicContact CG2-CB 4.11Å; S1425-L1429 WeakPolarHBondContact O-CG 3.27Å; F1426-L1429 HydrophobicContact CD1-CD1 4.03Å; F1426-L1429 PolarHBondContact O-N 3.4Å; F1426-L1429 VanDerWaalsContact O-N 3.09Å; C1427-L1429 VanDerWaalsContact C-N 3.31Å; C1427-L1429 PolarHBondContact O-N 3.38Å
1430	A	83	Confident	82.4	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-120.9	-8.6	-173.1	0	0	0	0	0	114.7	F1328 T1331 R1332 F1339 F1426 Y1434 I1435	F1328-A1430 WeakPolarHBondContact CZ-O 3.38Å; T1331-A1430 HydrophobicContact CG2-CB 4.22Å; R1332-A1430 HydrophobicContact CG-CB 4.07Å; R1332-A1430 PolarHBondContact NE-O 3.35Å; R1332-A1430 PolarHBondContact NH2-O 3.25Å; F1339-A1430 HydrophobicContact CE2-CB 4.45Å; F1426-A1430 PolarHBondContact O-N 3.37Å; F1426-A1430 VanDerWaalsContact O-N 3.12Å; A1430-Y1434 HydrophobicContact CB-CD1 3.75Å; A1430-Y1434 HydrophobicContact CB-CE1 4.33Å; A1430-Y1434 WeakPolarHBondContact O-CB 3.42Å; A1430-I1435 HydrophobicContact CB-CD1 4Å; A1430-I1435 HydrophobicContact CB-CG1 4.36Å
1431	G	79.9	Confident	82.4	Confident	16 Å²	16	37.3 Å²	37.3	17%	0.165	19%	0.194	C	C	.	.			trans	88.7	133.2	-174.7	0	0	0	0	0	112.4	C1427 T1433 Y1434 I1435	C1427-G1431 CarbonylContact O-C 3.5Å; C1427-G1431 WeakPolarHBondContact O-CA 3.09Å; C1427-G1431 PolarHBondContact O-N 3.33Å; G1431-T1433 VanDerWaalsContact C-N 3.34Å; G1431-T1433 PolarHBondContact O-N 3.31Å; G1431-Y1434 WeakPolarHBondContact O-CB 3.31Å; G1431-Y1434 PolarHBondContact O-N 3.45Å; G1431-I1435 PolarHBondContact O-N 2.85Å; G1431-I1435 VanDerWaalsContact O-N 3.14Å
1432	G	79.3	Confident	82.3	Confident	21 Å²	21	36.9 Å²	36.9	22%	0.216	19%	0.193	C	C	.	.	H	α-helix	trans	-56	-41.3	-173.6	0	0	0	0	0	114.6	Y1434 I1435 D1436	G1432-Y1434 VanDerWaalsContact C-N 3.28Å; G1432-Y1434 PolarHBondContact O-N 3.24Å; G1432-I1435 PolarHBondContact O-N 2.96Å; G1432-D1436 PolarHBondContact O-N 3.22Å
1433	T	77.3	Confident	81.9	Confident	81 Å²	81	43.9 Å²	43.9	50%	0.497	23%	0.226	S	C	.	.	H	α-helix	trans	-63.6	-32.4	176.3	60.5	0	0	0	0	113.2	G1431 D1437	G1431-T1433 VanDerWaalsContact C-N 3.34Å; G1431-T1433 PolarHBondContact O-N 3.31Å; T1433-D1437 VanDerWaalsContact O-CG 3.28Å; T1433-D1437 PolarHBondContact O-N 3.05Å; T1433-D1437 VanDerWaalsContact O-N 3.15Å
1434	Y	84.7	Confident	81.2	Confident	57 Å²	57	44.1 Å²	44.1	22%	0.224	23%	0.231	C	C	.	.	H	α-helix	trans	-75.7	-38.1	178.6	-179.6	-89.2	0	0	0	111.5	R1332 T1336 A1430 G1431 G1432 D1437 C1438	R1332-Y1434 HydrophobicContact CB-CE1 3.91Å; R1332-Y1434 HydrophobicContact CB-CE2 4.11Å; R1332-Y1434 HydrophobicContact CG-CD1 3.86Å; R1332-Y1434 HydrophobicContact CG-CD2 4.24Å; R1332-Y1434 HydrophobicContact CG-CE1 3.61Å; R1332-Y1434 HydrophobicContact CG-CE2 4.02Å; R1332-Y1434 HydrophobicContact CG-CG 4.17Å; R1332-Y1434 PolarHBondContact O-OH 2.86Å; T1336-Y1434 PolarHBondContact OG1-OH 3.47Å; A1430-Y1434 HydrophobicContact CB-CD1 3.75Å; A1430-Y1434 HydrophobicContact CB-CE1 4.33Å; A1430-Y1434 WeakPolarHBondContact O-CB 3.42Å; G1431-Y1434 WeakPolarHBondContact O-CB 3.31Å; G1431-Y1434 PolarHBondContact O-N 3.45Å; G1432-Y1434 VanDerWaalsContact C-N 3.28Å; G1432-Y1434 PolarHBondContact O-N 3.24Å; Y1434-D1437 PolarHBondContact O-N 3.03Å; Y1434-C1438 HydrophobicContact CE1-CB 4.35Å; Y1434-C1438 WeakPolarHBondContact CE1-SG 3.38Å; Y1434-C1438 VanDerWaalsContact O-CB 3.26Å; Y1434-C1438 WeakPolarHBondContact O-CB 3.26Å; Y1434-C1438 PolarHBondContact O-N 2.78Å; Y1434-C1438 PolarHBondContact O-SG 2.85Å
1435	I	84.7	Confident	81	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-63.1	-44.2	172	-63.9	-61.7	0	0	0	110.3	F1339 Y1423 F1426 A1430 G1431 G1432 D1437 C1438 L1439	F1339-I1435 HydrophobicContact CD2-CD1 3.95Å; F1339-I1435 HydrophobicContact CE2-CD1 4.21Å; Y1423-I1435 HydrophobicContact CD2-CG2 4.15Å; Y1423-I1435 HydrophobicContact CE2-CG2 3.91Å; F1426-I1435 HydrophobicContact CB-CD1 4.1Å; A1430-I1435 HydrophobicContact CB-CD1 4Å; A1430-I1435 HydrophobicContact CB-CG1 4.36Å; G1431-I1435 PolarHBondContact O-N 2.85Å; G1431-I1435 VanDerWaalsContact O-N 3.14Å; G1432-I1435 PolarHBondContact O-N 2.96Å; I1435-D1437 VanDerWaalsContact C-N 3.31Å; I1435-D1437 PolarHBondContact O-N 3.19Å; I1435-C1438 PolarHBondContact O-N 3.08Å; I1435-L1439 HydrophobicContact CG2-CD1 3.64Å; I1435-L1439 HydrophobicContact CG2-CG 4.19Å; I1435-L1439 WeakPolarHBondContact O-CG 3.27Å; I1435-L1439 PolarHBondContact O-N 3.33Å; I1435-L1439 VanDerWaalsContact O-N 3.1Å
1436	D	82.6	Confident	80.8	Confident	27 Å²	27	44.3 Å²	44.3	14%	0.144	23%	0.23	C	C	.	.	H	α-helix	trans	-55	-43.8	175	-89	-2.7	0	0	0	113.1	Y1423 G1432 T1442 Q1446 K1493	Y1423-D1436 PolarHBondContact OH-OD1 3.4Å; G1432-D1436 PolarHBondContact O-N 3.22Å; D1436-T1442 HydrophobicContact CB-CG2 4.14Å; D1436-T1442 PolarHBondContact O-OG1 3.07Å; D1436-T1442 WeakPolarHBondContact OD1-CG2 3.36Å; D1436-Q1446 PolarHBondContact OD1-NE2 3.17Å; D1436-K1493 WeakPolarHBondContact OD2-CE 3.44Å; D1436-K1493 IonicContact OD2-NZ 3.33Å; D1436-K1493 PolarHBondContact OD2-NZ 3.23Å
1437	D	82	Confident	80.1	Confident	140 Å²	140	50.4 Å²	50.4	75%	0.749	26%	0.256	S	S	*	.	H	α-helix	trans	-76.2	-28.1	-179.4	-72.1	-22.9	0	0	0	113.2	T1433 Y1434 I1435	T1433-D1437 VanDerWaalsContact O-CG 3.28Å; T1433-D1437 PolarHBondContact O-N 3.05Å; T1433-D1437 VanDerWaalsContact O-N 3.15Å; Y1434-D1437 PolarHBondContact O-N 3.03Å; I1435-D1437 VanDerWaalsContact C-N 3.31Å; I1435-D1437 PolarHBondContact O-N 3.19Å
1438	C	82.3	Confident	79.6	Confident	26 Å²	26	51 Å²	51	18%	0.176	26%	0.258	C	S	.	.	H	α-helix	trans	-90.8	-17.2	-175.6	-69.5	0	0	0	0	114.3	T1336 Q1340 Y1434 I1435	T1336-C1438 HydrophobicContact CG2-CB 4.03Å; Q1340-C1438 WeakPolarHBondContact CG-O 3.44Å; Q1340-C1438 PolarHBondContact NE2-O 3.47Å; Y1434-C1438 HydrophobicContact CE1-CB 4.35Å; Y1434-C1438 WeakPolarHBondContact CE1-SG 3.38Å; Y1434-C1438 VanDerWaalsContact O-CB 3.26Å; Y1434-C1438 WeakPolarHBondContact O-CB 3.26Å; Y1434-C1438 PolarHBondContact O-N 2.78Å; Y1434-C1438 PolarHBondContact O-SG 2.85Å; I1435-C1438 PolarHBondContact O-N 3.08Å
1439	L	82.1	Confident	79	Confident	10 Å²	10	45.8 Å²	45.8	5%	0.052	23%	0.234	C	C	.	.			trans	-96.4	136.6	174.4	-58.8	-179.5	0	0	0	110	Q1340 F1343 I1435 T1442 I1445	Q1340-L1439 HydrophobicContact CG-CD2 4.41Å; F1343-L1439 HydrophobicContact CB-CD1 4.36Å; F1343-L1439 HydrophobicContact CB-CD2 4.01Å; F1343-L1439 HydrophobicContact CD2-CD1 3.36Å; F1343-L1439 HydrophobicContact CD2-CD2 3.64Å; F1343-L1439 HydrophobicContact CD2-CG 4.15Å; F1343-L1439 HydrophobicContact CE2-CD1 3.64Å; F1343-L1439 HydrophobicContact CG-CD1 3.89Å; F1343-L1439 HydrophobicContact CG-CD2 4.21Å; F1343-L1439 HydrophobicContact CZ-CD1 4.42Å; I1435-L1439 HydrophobicContact CG2-CD1 3.64Å; I1435-L1439 HydrophobicContact CG2-CG 4.19Å; I1435-L1439 WeakPolarHBondContact O-CG 3.27Å; I1435-L1439 PolarHBondContact O-N 3.33Å; I1435-L1439 VanDerWaalsContact O-N 3.1Å; L1439-T1442 WeakPolarHBondContact CB-OG1 3.49Å; L1439-T1442 PolarHBondContact O-OG1 2.97Å; L1439-I1445 HydrophobicContact CD1-CD1 3.98Å
1440	Y	81.5	Confident	78.3	Confident	152 Å²	152	48.9 Å²	48.9	60%	0.596	25%	0.25	S	S	*	.	S	Bend	trans	-87	-20	178.2	72.6	-89.8	0	0	0	112.3	A1344 D1347	A1344-Y1440 HydrophobicContact CB-CE1 4.25Å; D1347-Y1440 WeakPolarHBondContact OD2-CE2 3.46Å; D1347-Y1440 PolarHBondContact OD2-OH 3.43Å
1441	N	80.7	Confident	77.3	Confident	10 Å²	10	54.4 Å²	54.4	5%	0.053	28%	0.276	C	S	.	.			trans	-106.6	18.8	-178	62.7	-12.1	0	0	0	113.4	F1343 D1347 Q1443 S1444 I1445	F1343-N1441 PolarHBondContact O-ND2 2.95Å; D1347-N1441 WeakPolarHBondContact OD1-CB 3.37Å; D1347-N1441 PolarHBondContact OD1-ND2 3.39Å; N1441-Q1443 PolarHBondContact O-N 3Å; N1441-S1444 PolarHBondContact O-N 2.82Å; N1441-S1444 PolarHBondContact O-OG 2.99Å; N1441-I1445 PolarHBondContact O-N 3.31Å; N1441-I1445 VanDerWaalsContact OD1-CD1 3.31Å; N1441-I1445 WeakPolarHBondContact OD1-CD1 3.27Å
1442	T	79	Confident	76.1	Confident	15 Å²	15	54.9 Å²	54.9	9%	0.092	28%	0.275	C	S	.	.	H	α-helix	trans	-44.7	-42.2	177.9	-49	0	0	0	0	113.4	D1436 L1439 S1444 I1445 Q1446	D1436-T1442 HydrophobicContact CB-CG2 4.14Å; D1436-T1442 PolarHBondContact O-OG1 3.07Å; D1436-T1442 WeakPolarHBondContact OD1-CG2 3.36Å; L1439-T1442 WeakPolarHBondContact CB-OG1 3.49Å; L1439-T1442 PolarHBondContact O-OG1 2.97Å; T1442-S1444 PolarHBondContact O-N 3.27Å; T1442-I1445 PolarHBondContact O-N 3.49Å; T1442-Q1446 HydrophobicContact CG2-CG 4.32Å; T1442-Q1446 WeakPolarHBondContact O-CB 3.37Å; T1442-Q1446 WeakPolarHBondContact O-CG 3.33Å; T1442-Q1446 PolarHBondContact O-N 3.06Å
1443	Q	75	Confident	75	Confident	148 Å²	148	57.3 Å²	57.3	69%	0.692	28%	0.282	S	S	*	.	H	α-helix	trans	-69.8	-22.1	-179.4	-65.7	-169.7	11.6	0	0	115.1	N1441 K1447	N1441-Q1443 PolarHBondContact O-N 3Å; Q1443-K1447 WeakPolarHBondContact O-CD 3.4Å; Q1443-K1447 WeakPolarHBondContact O-CE 3.22Å; Q1443-K1447 WeakPolarHBondContact O-CG 3.44Å
1444	S	72.1	Confident	73.7	Confident	27 Å²	27	56.8 Å²	56.8	19%	0.189	28%	0.282	C	S	.	.	H	α-helix	trans	-86.6	-40	173.7	61.9	0	0	0	0	110.7	N1441 T1442 K1447 L1448	N1441-S1444 PolarHBondContact O-N 2.82Å; N1441-S1444 PolarHBondContact O-OG 2.99Å; T1442-S1444 PolarHBondContact O-N 3.27Å; S1444-K1447 WeakPolarHBondContact O-CB 3.5Å; S1444-K1447 PolarHBondContact O-N 3.49Å; S1444-K1447 VanDerWaalsContact O-N 3.14Å; S1444-L1448 WeakPolarHBondContact O-CG 3.17Å; S1444-L1448 PolarHBondContact O-N 3.32Å
1445	I	78.9	Confident	71.9	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59.4	-49.7	174.6	-62.8	161.3	0	0	0	110.9	F1343 Y1423 L1439 N1441 T1442 K1447 L1448 I1449	F1343-I1445 HydrophobicContact CB-CD1 3.96Å; F1343-I1445 HydrophobicContact CD1-CD1 3.42Å; F1343-I1445 VanDerWaalsContact CD1-CD1 3.42Å; F1343-I1445 HydrophobicContact CD1-CG1 4.1Å; F1343-I1445 HydrophobicContact CE1-CD1 4.01Å; F1343-I1445 HydrophobicContact CE1-CG2 4.23Å; F1343-I1445 HydrophobicContact CG-CD1 3.75Å; Y1423-I1445 HydrophobicContact CD2-CG2 3.92Å; Y1423-I1445 HydrophobicContact CE2-CG2 4.49Å; Y1423-I1445 HydrophobicContact CG-CG2 4.39Å; L1439-I1445 HydrophobicContact CD1-CD1 3.98Å; N1441-I1445 PolarHBondContact O-N 3.31Å; N1441-I1445 VanDerWaalsContact OD1-CD1 3.31Å; N1441-I1445 WeakPolarHBondContact OD1-CD1 3.27Å; T1442-I1445 PolarHBondContact O-N 3.49Å; I1445-K1447 VanDerWaalsContact C-N 3.25Å; I1445-K1447 PolarHBondContact O-N 2.9Å; I1445-L1448 PolarHBondContact O-N 3.45Å; I1445-L1448 VanDerWaalsContact O-N 3.16Å; I1445-I1449 HydrophobicContact CG2-CD1 3.99Å; I1445-I1449 WeakPolarHBondContact O-CG1 3.2Å; I1445-I1449 PolarHBondContact O-N 3.15Å
1446	Q	75.9	Confident	69.9	Low	59 Å²	59	61.3 Å²	61.3	28%	0.276	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-30.3	176.8	-71.1	179	-2.3	0	0	112.6	Y1423 D1436 T1442 N1450	Y1423-Q1446 PolarHBondContact OH-NE2 3.14Å; D1436-Q1446 PolarHBondContact OD1-NE2 3.17Å; T1442-Q1446 HydrophobicContact CG2-CG 4.32Å; T1442-Q1446 WeakPolarHBondContact O-CB 3.37Å; T1442-Q1446 WeakPolarHBondContact O-CG 3.33Å; T1442-Q1446 PolarHBondContact O-N 3.06Å; Q1446-N1450 VanDerWaalsContact O-CB 3.3Å; Q1446-N1450 WeakPolarHBondContact O-CB 3.47Å; Q1446-N1450 PolarHBondContact O-N 2.95Å; Q1446-N1450 PolarHBondContact O-ND2 2.92Å
1447	K	73.1	Confident	67.9	Low	129 Å²	129	63.6 Å²	63.6	56%	0.561	33%	0.329	S	S	*	.	H	α-helix	trans	-69.2	-42.2	173.3	-76.7	168.8	-169	165.7	0	112.3	Q1443 S1444 I1445 N1450 Q1451	Q1443-K1447 WeakPolarHBondContact O-CD 3.4Å; Q1443-K1447 WeakPolarHBondContact O-CE 3.22Å; Q1443-K1447 WeakPolarHBondContact O-CG 3.44Å; S1444-K1447 WeakPolarHBondContact O-CB 3.5Å; S1444-K1447 PolarHBondContact O-N 3.49Å; S1444-K1447 VanDerWaalsContact O-N 3.14Å; I1445-K1447 VanDerWaalsContact C-N 3.25Å; I1445-K1447 PolarHBondContact O-N 2.9Å; K1447-N1450 PolarHBondContact O-N 3.32Å; K1447-Q1451 WeakPolarHBondContact O-CG 3.36Å; K1447-Q1451 PolarHBondContact O-N 2.91Å
1448	L	72.7	Confident	65.7	Low	32 Å²	32	62.2 Å²	62.2	17%	0.168	32%	0.322	C	S	.	.	H	α-helix	trans	-62	-44	176.1	-68.7	172.1	0	0	0	111.4	F1346 I1350 C1416 S1444 I1445 Q1451 L1452	F1346-L1448 HydrophobicContact CD1-CD1 4.5Å; I1350-L1448 HydrophobicContact CD1-CD1 3.87Å; I1350-L1448 HydrophobicContact CG1-CD1 4.4Å; C1416-L1448 HydrophobicContact CB-CB 4.33Å; C1416-L1448 WeakPolarHBondContact CB-O 3.48Å; C1416-L1448 PolarHBondContact SG-O 3Å; S1444-L1448 WeakPolarHBondContact O-CG 3.17Å; S1444-L1448 PolarHBondContact O-N 3.32Å; I1445-L1448 PolarHBondContact O-N 3.45Å; I1445-L1448 VanDerWaalsContact O-N 3.16Å; L1448-Q1451 PolarHBondContact O-N 3.05Å; L1448-L1452 PolarHBondContact O-N 3.15Å
1449	I	70.1	Confident	63.3	Low	4 Å²	4	66 Å²	66	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-62.5	-46.5	176.2	-64.3	170.1	0	0	0	110.7	R1420 Y1423 I1445 Q1451 L1452 I1453	R1420-I1449 HydrophobicContact CB-CG1 4.2Å; Y1423-I1449 HydrophobicContact CD1-CD1 3.74Å; Y1423-I1449 HydrophobicContact CE1-CD1 4.38Å; Y1423-I1449 HydrophobicContact CG-CD1 3.83Å; I1445-I1449 HydrophobicContact CG2-CD1 3.99Å; I1445-I1449 WeakPolarHBondContact O-CG1 3.2Å; I1445-I1449 PolarHBondContact O-N 3.15Å; I1449-Q1451 VanDerWaalsContact C-N 3.33Å; I1449-Q1451 PolarHBondContact O-N 3.29Å; I1449-L1452 PolarHBondContact O-N 3.06Å; I1449-I1453 HydrophobicContact CG2-CD1 4.36Å; I1449-I1453 PolarHBondContact O-N 3.38Å
1450	N	66.4	Low	60.9	Low	72 Å²	72	71 Å²	71	39%	0.385	37%	0.372	S	S	.	.	H	α-helix	trans	-66.5	-30.6	179.9	-73.2	-19.1	0	0	0	113.7	Q1446 K1447 L1452 S1454 F1496	Q1446-N1450 VanDerWaalsContact O-CB 3.3Å; Q1446-N1450 WeakPolarHBondContact O-CB 3.47Å; Q1446-N1450 PolarHBondContact O-N 2.95Å; Q1446-N1450 PolarHBondContact O-ND2 2.92Å; K1447-N1450 PolarHBondContact O-N 3.32Å; N1450-L1452 VanDerWaalsContact C-N 3.33Å; N1450-S1454 PolarHBondContact O-N 3.09Å; N1450-F1496 WeakPolarHBondContact OD1-CE2 3.35Å; N1450-F1496 WeakPolarHBondContact OD1-CZ 3.37Å
1451	Q	63.8	Low	58.4	Low	116 Å²	116	71.9 Å²	71.9	54%	0.542	38%	0.383	S	S	.	.	H	α-helix	trans	-62	-42	173.2	-79.6	173.2	-32.9	0	0	111.4	K1447 L1448 I1449 S1454 S1455	K1447-Q1451 WeakPolarHBondContact O-CG 3.36Å; K1447-Q1451 PolarHBondContact O-N 2.91Å; L1448-Q1451 PolarHBondContact O-N 3.05Å; I1449-Q1451 VanDerWaalsContact C-N 3.33Å; I1449-Q1451 PolarHBondContact O-N 3.29Å; Q1451-S1454 PolarHBondContact O-N 3.34Å; Q1451-S1454 VanDerWaalsContact O-N 3.15Å; Q1451-S1454 PolarHBondContact O-OG 3.24Å; Q1451-S1455 PolarHBondContact O-N 3.32Å; Q1451-S1455 PolarHBondContact O-OG 2.84Å
1452	L	54	Low	55.7	Low	26 Å²	26	79.3 Å²	79.3	14%	0.136	42%	0.415	C	S	.	.	H	α-helix	trans	-67.8	-39	-178.1	-164.8	144.7	0	0	0	112.3	C1416 D1417 L1448 I1449 N1450 S1454 S1455 E1456	C1416-L1452 HydrophobicContact CB-CB 4.21Å; C1416-L1452 HydrophobicContact CB-CD1 3.81Å; D1417-L1452 HydrophobicContact CB-CD1 4.23Å; L1448-L1452 PolarHBondContact O-N 3.15Å; I1449-L1452 PolarHBondContact O-N 3.06Å; N1450-L1452 VanDerWaalsContact C-N 3.33Å; L1452-S1454 PolarHBondContact O-N 3.24Å; L1452-S1455 WeakPolarHBondContact CA-OG 3.47Å; L1452-S1455 PolarHBondContact O-N 3.05Å; L1452-S1455 VanDerWaalsContact O-N 3.11Å; L1452-S1455 PolarHBondContact O-OG 3.49Å; L1452-E1456 HydrophobicContact CD2-CG 4.05Å; L1452-E1456 PolarHBondContact O-N 3.13Å
1453	I	56.3	Low	53.1	Low	72 Å²	72	87.8 Å²	87.8	37%	0.369	45%	0.453	S	S	.	.	H	α-helix	trans	-58.7	-36.8	172.7	-62.1	170.4	0	0	0	111	I1449 S1457 F1496 L1500	I1449-I1453 HydrophobicContact CG2-CD1 4.36Å; I1449-I1453 PolarHBondContact O-N 3.38Å; I1453-S1457 PolarHBondContact O-N 3.33Å; I1453-S1457 PolarHBondContact O-OG 3.49Å; I1453-F1496 HydrophobicContact CD1-CE2 4.45Å; I1453-L1500 HydrophobicContact CD1-CD1 4.21Å
1454	S	48.7	Very low	50.7	Low	70 Å²	70	85.7 Å²	85.7	49%	0.49	46%	0.455	S	S	.	.	H	α-helix	trans	-76.5	-17.3	178.3	73	0	0	0	0	114.8	N1450 Q1451 L1452 S1457 N1458	N1450-S1454 PolarHBondContact O-N 3.09Å; Q1451-S1454 PolarHBondContact O-N 3.34Å; Q1451-S1454 VanDerWaalsContact O-N 3.15Å; Q1451-S1454 PolarHBondContact O-OG 3.24Å; L1452-S1454 PolarHBondContact O-N 3.24Å; S1454-S1457 PolarHBondContact O-OG 2.98Å; S1454-N1458 PolarHBondContact O-ND2 3.21Å
1455	S	47.3	Very low	48.4	Very low	56 Å²	56	91 Å²	91	39%	0.392	49%	0.491	S	S	.	.	H	α-helix	trans	-83.7	-46.5	169.2	37.2	0	0	0	0	112.3	Q1451 L1452 S1457 N1458 D1459	Q1451-S1455 PolarHBondContact O-N 3.32Å; Q1451-S1455 PolarHBondContact O-OG 2.84Å; L1452-S1455 WeakPolarHBondContact CA-OG 3.47Å; L1452-S1455 PolarHBondContact O-N 3.05Å; L1452-S1455 VanDerWaalsContact O-N 3.11Å; L1452-S1455 PolarHBondContact O-OG 3.49Å; S1455-S1457 PolarHBondContact O-N 3.42Å; S1455-N1458 PolarHBondContact O-N 3.24Å; S1455-D1459 PolarHBondContact O-N 3.41Å
1456	E	43.2	Very low	45.8	Very low	96 Å²	96	96.4 Å²	96.4	45%	0.449	53%	0.528	S	S	.	.	H	α-helix	trans	-58	-37.2	-177.9	-71.6	-179.4	150.6	0	0	111.6	R1420 L1452 N1458 D1459 T1460	R1420-E1456 IonicContact NH2-OE1 2.79Å; L1452-E1456 HydrophobicContact CD2-CG 4.05Å; L1452-E1456 PolarHBondContact O-N 3.13Å; E1456-N1458 PolarHBondContact O-N 3.39Å; E1456-N1458 VanDerWaalsContact O-N 3.14Å; E1456-D1459 PolarHBondContact O-N 3.24Å; E1456-T1460 WeakPolarHBondContact O-CG2 3.43Å; E1456-T1460 PolarHBondContact O-N 3.36Å; E1456-T1460 PolarHBondContact O-OG1 2.99Å
1457	S	41.4	Very low	43.3	Very low	75 Å²	75	101.2 Å²	101.2	52%	0.524	56%	0.556	S	S	.	*	H	α-helix	trans	-65.1	-12.4	176.3	62.6	0	0	0	0	115.8	I1453 S1454 S1455	I1453-S1457 PolarHBondContact O-N 3.33Å; I1453-S1457 PolarHBondContact O-OG 3.49Å; S1454-S1457 PolarHBondContact O-OG 2.98Å; S1455-S1457 PolarHBondContact O-N 3.42Å
1458	N	35.1	Very low	40.9	Very low	112 Å²	112	103.9 Å²	103.9	60%	0.599	57%	0.571	S	S	*	*	H	α-helix	trans	-101.5	-32.7	-179.7	-79	-71.9	0	0	0	113.1	S1454 S1455 E1456	S1454-N1458 PolarHBondContact O-ND2 3.21Å; S1455-N1458 PolarHBondContact O-N 3.24Å; E1456-N1458 PolarHBondContact O-N 3.39Å; E1456-N1458 VanDerWaalsContact O-N 3.14Å
1459	D	32.9	Very low	38.6	Very low	105 Å²	105	107.5 Å²	107.5	56%	0.561	60%	0.598	S	S	*	*	H	α-helix	trans	-85.4	-22.1	-179.2	-72.3	-42.6	0	0	0	113.1	S1455 E1456 M1461 K1462	S1455-D1459 PolarHBondContact O-N 3.41Å; E1456-D1459 PolarHBondContact O-N 3.24Å; D1459-M1461 PolarHBondContact O-N 3.1Å; D1459-K1462 PolarHBondContact O-N 2.74Å
1460	T	30.6	Very low	36.4	Very low	116 Å²	116	114.9 Å²	114.9	71%	0.712	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-1.6	172.6	54.2	0	0	0	0	114.8	E1456	E1456-T1460 WeakPolarHBondContact O-CG2 3.43Å; E1456-T1460 PolarHBondContact O-N 3.36Å; E1456-T1460 PolarHBondContact O-OG1 2.99Å
1461	M	28.6	Very low	34.4	Very low	170 Å²	170	120.7 Å²	120.7	84%	0.837	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	17	169.6	-66.9	-153	80.6	0	0	114	D1459	D1459-M1461 PolarHBondContact O-N 3.1Å
1462	K	25.4	Very low	32.5	Very low	165 Å²	165	120.9 Å²	120.9	72%	0.717	67%	0.669	S	S	*	*	S	Bend	trans	-125.5	22.8	-178	-76.7	-176.9	-177.8	163.7	0	116.2	D1459	D1459-K1462 PolarHBondContact O-N 2.74Å
1463	Q	23.8	Very low	31	Very low	193 Å²	193	125.4 Å²	125.4	90%	0.902	70%	0.698	S	S	*	*	S	Bend	trans	-145.5	38	177.9	-127.1	167.8	18.6	0	0	117.1
1464	S	24.2	Very low	29.4	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	72%	0.715	S	S	*	*	S	Bend	trans	-154.3	117.3	164.5	61.3	0	0	0	0	112.4
1465	C	24	Very low	28.3	Very low	139 Å²	139	130.8 Å²	130.8	94%	0.939	73%	0.725	S	S	*	*			trans	64	140.1	-178.8	-56.7	0	0	0	0	115
1466	S	24.1	Very low	27.1	Very low	113 Å²	113	133.6 Å²	133.6	79%	0.79	75%	0.745	S	S	*	*			cis	-149.6	166.5	-3.4	56.6	0	0	0	0	110.1
1467	D	24.3	Very low	26.3	Very low	161 Å²	161	134.9 Å²	134.9	86%	0.861	76%	0.759	S	S	*	*			trans	-61.3	163.6	175.4	-87.6	-45.5	0	0	0	114.1
1468	E	22.7	Very low	25.4	Very low	185 Å²	185	139 Å²	139	86%	0.864	78%	0.775	S	S	*	*			trans	-64.6	141.2	-154.3	-53.2	-178	124.8	0	0	116.5
1469	S	23.1	Very low	25	Very low	107 Å²	107	138.9 Å²	138.9	75%	0.748	79%	0.789	S	S	*	*				-174.8	146.6	112.2	43.8	0	0	0	0	115.3
1470	N	25.6	Very low	24.5	Very low	159 Å²	159	138.5 Å²	138.5	85%	0.85	80%	0.801	S	S	*	*			trans	55.8	119.8	153.4	-65.7	-35.6	0	0	0	122.2
1471	K	22.4	Very low	24.1	Very low	194 Å²	194	139.9 Å²	139.9	84%	0.843	81%	0.809	S	S	*	*			trans	-55.9	149.5	162.2	-53.4	158.8	-177.3	170.9	0	111.7
1472	T	24.6	Very low	23.9	Very low	121 Å²	121	138.7 Å²	138.7	74%	0.742	81%	0.806	S	S	*	*				178.3	127.7	107.8	34.6	0	0	0	0	113.7
1473	T	23	Very low	23.9	Very low	121 Å²	121	138.7 Å²	138.7	74%	0.742	81%	0.812	S	S	*	*			trans	62.9	145.4	142	62.1	0	0	0	0	119.8
1474	I	23.4	Very low	23.9	Very low	143 Å²	143	137.7 Å²	137.7	73%	0.733	81%	0.807	S	S	*	*			cis	-159.4	168.9	8.3	-131.1	164.5	0	0	0	113
1475	T	24.9	Very low	23.9	Very low	111 Å²	111	140.1 Å²	140.1	68%	0.681	81%	0.812	S	S	*	*			trans	58.5	105.3	167.4	44.3	0	0	0	0	120.4	T1477	T1475-T1477 HydrophobicContact CG2-CG2 4.19Å
1476	S	21.5	Very low	24	Very low	116 Å²	116	139.6 Å²	139.6	81%	0.811	81%	0.805	S	S	*	*				-86.9	156.1	121.5	54.5	0	0	0	0	109.9
1477	T	27.5	Very low	24.1	Very low	122 Å²	122	143.5 Å²	143.5	75%	0.748	81%	0.81	S	S	*	*			trans	-144.6	140.5	163.5	50.6	0	0	0	0	110.5	T1475	T1475-T1477 HydrophobicContact CG2-CG2 4.19Å
1478	D	22.4	Very low	24.3	Very low	163 Å²	163	143 Å²	143	87%	0.872	81%	0.807	S	S	*	*			trans	-75.5	155	-165.9	-46.8	-92.3	0	0	0	115.7
1479	A	25.6	Very low	24.5	Very low	108 Å²	108	138.2 Å²	138.2	89%	0.893	79%	0.794	S	S	*	*			trans	-158.6	115.6	135.8	0	0	0	0	0	110.2
1480	A	22.1	Very low	24.9	Very low	98 Å²	98	140.2 Å²	140.2	81%	0.81	80%	0.796	S	S	*	*			trans	-117.3	136.4	173.5	0	0	0	0	0	110.8
1481	V	23.7	Very low	25.1	Very low	145 Å²	145	142.4 Å²	142.4	88%	0.879	79%	0.793	S	S	*	*			trans	-146.6	144.9	158.5	176.5	0	0	0	0	109.4
1482	N	24.2	Very low	25.9	Very low	144 Å²	144	136.5 Å²	136.5	77%	0.77	78%	0.776	S	S	*	*			trans	-50	165	174.8	-58.2	-37.4	0	0	0	115.4
1483	I	25.9	Very low	26.5	Very low	165 Å²	165	134.8 Å²	134.8	85%	0.846	76%	0.758	S	S	*	*				-159.5	144.1	123.9	-104.5	155.5	0	0	0	109.9
1484	Q	22.8	Very low	27.2	Very low	172 Å²	172	134.2 Å²	134.2	80%	0.804	75%	0.749	S	S	*	*			trans	-90.4	166.7	169.4	-68.1	175.7	-90.5	0	0	109.9
1485	D	23.9	Very low	27.9	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	74%	0.742	S	S	*	*			trans	65.7	95.3	174.4	-55.9	-24.5	0	0	0	117.7
1486	V	26.1	Very low	28.6	Very low	129 Å²	129	131.1 Å²	131.1	78%	0.782	73%	0.726	S	S	*	*			trans	-139.3	131.9	140.1	176.9	0	0	0	0	109.3	L1488	V1486-L1488 PolarHBondContact O-N 2.99Å
1487	Q	25.7	Very low	29.4	Very low	194 Å²	194	128.7 Å²	128.7	91%	0.907	70%	0.702	S	S	*	*			trans	-73.3	119.7	171.5	-63.6	168.9	-31.1	0	0	110
1488	L	28.7	Very low	29.9	Very low	151 Å²	151	125.4 Å²	125.4	79%	0.791	69%	0.688	S	S	*	*			trans	-106.9	117.5	176.8	-88.3	164.3	0	0	0	112	V1486	V1486-L1488 PolarHBondContact O-N 2.99Å
1489	S	26.6	Very low	30.6	Very low	85 Å²	85	120.8 Å²	120.8	59%	0.594	67%	0.668	S	S	*	*			trans	-76.9	158	-174.3	57.9	0	0	0	0	114.4	R1491	S1489-R1491 PolarHBondContact O-N 2.88Å
1490	N	32.7	Very low	31.1	Very low	149 Å²	149	117 Å²	117	80%	0.797	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-41	2.1	-175.9	-57.9	7.7	0	0	0	121
1491	R	29.9	Very low	31.9	Very low	205 Å²	205	118.6 Å²	118.6	77%	0.774	62%	0.621	S	S	*	*	H	α-helix	trans	-75	-42.7	174.9	-80.7	-172.6	168.5	-172.7	-5.2	113.1	S1489 K1493 I1494 D1495	S1489-R1491 PolarHBondContact O-N 2.88Å; R1491-K1493 PolarHBondContact O-N 3.34Å; R1491-K1493 VanDerWaalsContact O-N 3.1Å; R1491-I1494 PolarHBondContact O-N 2.75Å; R1491-D1495 PolarHBondContact O-N 3.12Å
1492	S	38.3	Very low	32.5	Very low	70 Å²	70	115.1 Å²	115.1	49%	0.49	61%	0.608	S	S	.	*	H	α-helix	trans	-60.3	-25.8	-176.2	51.9	0	0	0	0	114	F1496	S1492-F1496 VanDerWaalsContact O-CB 3.29Å; S1492-F1496 WeakPolarHBondContact O-CB 3.23Å; S1492-F1496 PolarHBondContact O-N 3.16Å
1493	K	37.6	Very low	32.9	Very low	84 Å²	84	112.9 Å²	112.9	37%	0.365	60%	0.603	S	S	.	*	H	α-helix	trans	-69.3	-36.2	176.6	-147.1	-174.3	-175.3	-163.9	0	112.2	D1436 R1491 F1496 E1497	D1436-K1493 WeakPolarHBondContact OD2-CE 3.44Å; D1436-K1493 IonicContact OD2-NZ 3.33Å; D1436-K1493 PolarHBondContact OD2-NZ 3.23Å; R1491-K1493 PolarHBondContact O-N 3.34Å; R1491-K1493 VanDerWaalsContact O-N 3.1Å; K1493-F1496 PolarHBondContact O-N 3.21Å; K1493-E1497 WeakPolarHBondContact O-CB 3.49Å; K1493-E1497 VanDerWaalsContact O-CG 3.31Å; K1493-E1497 WeakPolarHBondContact O-CG 3.47Å; K1493-E1497 PolarHBondContact O-N 3.34Å
1494	I	38.4	Very low	33.3	Very low	109 Å²	109	107.1 Å²	107.1	56%	0.559	58%	0.578	S	S	*	*	H	α-helix	trans	-70.5	-41.2	176.3	-58.1	173.5	0	0	0	110.2	R1491 F1496 E1497 A1498	R1491-I1494 PolarHBondContact O-N 2.75Å; I1494-F1496 VanDerWaalsContact C-N 3.34Å; I1494-E1497 PolarHBondContact O-N 3.44Å; I1494-A1498 WeakPolarHBondContact O-CB 3.46Å; I1494-A1498 PolarHBondContact O-N 3.12Å
1495	D	37.1	Very low	33.6	Very low	109 Å²	109	102.4 Å²	102.4	58%	0.583	57%	0.568	S	S	*	*	H	α-helix	trans	-68.4	-33.8	177.4	-59.7	-42.5	0	0	0	111.9	R1491 S1499	R1491-D1495 PolarHBondContact O-N 3.12Å; D1495-S1499 WeakPolarHBondContact O-CB 3.15Å; D1495-S1499 PolarHBondContact O-N 2.95Å; D1495-S1499 PolarHBondContact O-OG 3.29Å
1496	F	40.3	Very low	33.9	Very low	80 Å²	80	101.1 Å²	101.1	35%	0.351	56%	0.561	S	S	.	*	H	α-helix	trans	-70.7	-46.4	173.5	-174.5	-96.7	0	0	0	112.1	N1450 I1453 S1492 K1493 I1494 S1499 L1500	N1450-F1496 WeakPolarHBondContact OD1-CE2 3.35Å; N1450-F1496 WeakPolarHBondContact OD1-CZ 3.37Å; I1453-F1496 HydrophobicContact CD1-CE2 4.45Å; S1492-F1496 VanDerWaalsContact O-CB 3.29Å; S1492-F1496 WeakPolarHBondContact O-CB 3.23Å; S1492-F1496 PolarHBondContact O-N 3.16Å; K1493-F1496 PolarHBondContact O-N 3.21Å; I1494-F1496 VanDerWaalsContact C-N 3.34Å; F1496-S1499 WeakPolarHBondContact CA-OG 3.46Å; F1496-S1499 PolarHBondContact O-N 2.98Å; F1496-S1499 PolarHBondContact O-OG 3.4Å; F1496-S1499 VanDerWaalsContact O-OG 3.1Å; F1496-L1500 HydrophobicContact CZ-CD1 4.43Å; F1496-L1500 WeakPolarHBondContact O-CB 3.46Å; F1496-L1500 PolarHBondContact O-N 2.88Å
1497	E	36.9	Very low	33.8	Very low	66 Å²	66	101 Å²	101	31%	0.308	56%	0.564	S	S	.	*	H	α-helix	trans	-59.5	-46.8	172.9	-75.7	170.5	-175.4	0	0	110.9	K1493 I1494 S1499 L1500 F1501	K1493-E1497 WeakPolarHBondContact O-CB 3.49Å; K1493-E1497 VanDerWaalsContact O-CG 3.31Å; K1493-E1497 WeakPolarHBondContact O-CG 3.47Å; K1493-E1497 PolarHBondContact O-N 3.34Å; I1494-E1497 PolarHBondContact O-N 3.44Å; E1497-S1499 PolarHBondContact O-N 3.21Å; E1497-L1500 PolarHBondContact O-N 2.98Å; E1497-F1501 HydrophobicContact CB-CD2 4.41Å; E1497-F1501 HydrophobicContact CB-CE2 4.33Å; E1497-F1501 WeakPolarHBondContact O-CD2 3.49Å; E1497-F1501 PolarHBondContact O-N 3.41Å
1498	A	38.2	Very low	33.8	Very low	53 Å²	53	98.2 Å²	98.2	44%	0.438	56%	0.555	S	S	.	*	H	α-helix	trans	-64.1	-36.6	179.6	0	0	0	0	0	113.4	I1494 F1501 A1502	I1494-A1498 WeakPolarHBondContact O-CB 3.46Å; I1494-A1498 PolarHBondContact O-N 3.12Å; A1498-F1501 PolarHBondContact O-N 3.46Å; A1498-A1502 VanDerWaalsContact O-CB 3.26Å; A1498-A1502 WeakPolarHBondContact O-CB 3.25Å; A1498-A1502 PolarHBondContact O-N 3.46Å
1499	S	37.5	Very low	33.7	Very low	65 Å²	65	96.6 Å²	96.6	46%	0.455	55%	0.548	S	S	.	.	H	α-helix	trans	-73.5	-33.1	174	48.5	0	0	0	0	112.7	D1495 F1496 E1497 A1502 S1503	D1495-S1499 WeakPolarHBondContact O-CB 3.15Å; D1495-S1499 PolarHBondContact O-N 2.95Å; D1495-S1499 PolarHBondContact O-OG 3.29Å; F1496-S1499 WeakPolarHBondContact CA-OG 3.46Å; F1496-S1499 PolarHBondContact O-N 2.98Å; F1496-S1499 PolarHBondContact O-OG 3.4Å; F1496-S1499 VanDerWaalsContact O-OG 3.1Å; E1497-S1499 PolarHBondContact O-N 3.21Å; S1499-A1502 PolarHBondContact O-N 2.77Å; S1499-S1503 WeakPolarHBondContact O-CB 3.21Å; S1499-S1503 PolarHBondContact O-N 3.36Å; S1499-S1503 PolarHBondContact O-OG 3.38Å
1500	L	37.5	Very low	33.8	Very low	29 Å²	29	97.3 Å²	97.3	15%	0.152	55%	0.551	C	S	.	*	H	α-helix	trans	-66.1	-40.1	170	-146.3	77.7	0	0	0	111.6	I1424 I1453 F1496 E1497 S1503 S1504	I1424-L1500 HydrophobicContact CD1-CD2 4.31Å; I1424-L1500 HydrophobicContact CD1-CG 4.43Å; I1424-L1500 HydrophobicContact CG1-CD2 4.05Å; I1453-L1500 HydrophobicContact CD1-CD1 4.21Å; F1496-L1500 HydrophobicContact CZ-CD1 4.43Å; F1496-L1500 WeakPolarHBondContact O-CB 3.46Å; F1496-L1500 PolarHBondContact O-N 2.88Å; E1497-L1500 PolarHBondContact O-N 2.98Å; L1500-S1503 PolarHBondContact O-OG 3.28Å; L1500-S1504 WeakPolarHBondContact O-CB 3.33Å; L1500-S1504 PolarHBondContact O-N 3.08Å; L1500-S1504 VanDerWaalsContact O-N 3.09Å; L1500-S1504 PolarHBondContact O-OG 3.12Å
1501	F	37.3	Very low	33.8	Very low	132 Å²	132	91.8 Å²	91.8	58%	0.579	52%	0.522	S	S	*	.	H	α-helix	trans	-70.2	-36.3	174.8	-76.4	-60.2	0	0	0	112.8	E1497 A1498 S1504 A1505	E1497-F1501 HydrophobicContact CB-CD2 4.41Å; E1497-F1501 HydrophobicContact CB-CE2 4.33Å; E1497-F1501 WeakPolarHBondContact O-CD2 3.49Å; E1497-F1501 PolarHBondContact O-N 3.41Å; A1498-F1501 PolarHBondContact O-N 3.46Å; F1501-S1504 WeakPolarHBondContact CA-OG 3.22Å; F1501-S1504 PolarHBondContact O-OG 3Å; F1501-A1505 PolarHBondContact O-N 3.05Å
1502	A	36.1	Very low	34	Very low	71 Å²	71	88.4 Å²	88.4	59%	0.587	51%	0.513	S	S	*	.	H	α-helix	trans	-71.6	-36.2	176.4	0	0	0	0	0	112.8	A1498 S1499 A1505	A1498-A1502 VanDerWaalsContact O-CB 3.26Å; A1498-A1502 WeakPolarHBondContact O-CB 3.25Å; A1498-A1502 PolarHBondContact O-N 3.46Å; S1499-A1502 PolarHBondContact O-N 2.77Å; A1502-A1505 WeakPolarHBondContact O-CB 3.29Å
1503	S	33.1	Very low	34.3	Very low	97 Å²	97	92.4 Å²	92.4	68%	0.678	52%	0.523	S	S	*	.	H	α-helix	trans	-80.7	-13	176.4	54.5	0	0	0	0	114	S1499 L1500	S1499-S1503 WeakPolarHBondContact O-CB 3.21Å; S1499-S1503 PolarHBondContact O-N 3.36Å; S1499-S1503 PolarHBondContact O-OG 3.38Å; L1500-S1503 PolarHBondContact O-OG 3.28Å
1504	S	33.9	Very low	34.3	Very low	45 Å²	45	91.9 Å²	91.9	32%	0.315	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	16	170.9	55	0	0	0	0	113.5	L1500 F1501 L1506	L1500-S1504 WeakPolarHBondContact O-CB 3.33Å; L1500-S1504 PolarHBondContact O-N 3.08Å; L1500-S1504 VanDerWaalsContact O-N 3.09Å; L1500-S1504 PolarHBondContact O-OG 3.12Å; F1501-S1504 WeakPolarHBondContact CA-OG 3.22Å; F1501-S1504 PolarHBondContact O-OG 3Å; S1504-L1506 PolarHBondContact O-N 2.97Å
1505	A	30	Very low	34.2	Very low	73 Å²	73	93.5 Å²	93.5	60%	0.603	52%	0.523	S	S	*	.			trans	-62.8	103	169.3	0	0	0	0	0	110.2	F1501 A1502 C1507	F1501-A1505 PolarHBondContact O-N 3.05Å; A1502-A1505 WeakPolarHBondContact O-CB 3.29Å; A1505-C1507 PolarHBondContact O-N 3.08Å
1506	L	29.2	Very low	34.6	Very low	128 Å²	128	90.4 Å²	90.4	67%	0.67	52%	0.518	S	S	*	.			trans	-59.9	112.8	173.4	-84.7	84.8	0	0	0	109.2	S1504 N1508	S1504-L1506 PolarHBondContact O-N 2.97Å; L1506-N1508 PolarHBondContact O-N 2.79Å; L1506-N1508 VanDerWaalsContact O-N 3.08Å
1507	C	24.5	Very low	34.6	Very low	125 Å²	125	89.6 Å²	89.6	85%	0.845	53%	0.526	S	S	*	.			trans	-74.3	98.8	177.7	-166.3	0	0	0	0	110.1	A1505	A1505-C1507 PolarHBondContact O-N 3.08Å
1508	N	26.5	Very low	34.9	Very low	137 Å²	137	90.6 Å²	90.6	73%	0.733	53%	0.527	S	S	*	.	S	Bend	trans	-162.5	148.2	157.9	-97.7	-32.6	0	0	0	109.7	L1506 C1510	L1506-N1508 PolarHBondContact O-N 2.79Å; L1506-N1508 VanDerWaalsContact O-N 3.08Å; N1508-C1510 PolarHBondContact O-N 3.49Å
1509	D	27	Very low	35.4	Very low	117 Å²	117	95.8 Å²	95.8	63%	0.626	54%	0.535	S	S	*	.			trans	-67	119.9	-169.5	-65.4	-69.1	0	0	0	114	F1896	D1509-F1896 HydrophobicContact CB-CD1 4.07Å; D1509-F1896 HydrophobicContact CB-CD2 4.41Å; D1509-F1896 HydrophobicContact CB-CE1 3.53Å; D1509-F1896 HydrophobicContact CB-CE2 3.92Å; D1509-F1896 HydrophobicContact CB-CG 4.49Å; D1509-F1896 HydrophobicContact CB-CZ 3.45Å; D1509-F1896 VanDerWaalsContact CB-CZ 3.45Å; D1509-F1896 WeakPolarHBondContact O-CD1 3.29Å; D1509-F1896 WeakPolarHBondContact O-CD2 3.36Å; D1509-F1896 WeakPolarHBondContact O-CG 3.27Å
1510	C	27.3	Very low	35.6	Very low	99 Å²	99	99.4 Å²	99.4	67%	0.669	55%	0.545	S	S	*	.			trans	-137.8	97	169	-79.9	0	0	0	0	110.9	N1508	N1508-C1510 PolarHBondContact O-N 3.49Å
1511	N	33.4	Very low	36	Very low	34 Å²	34	101.5 Å²	101.5	18%	0.182	56%	0.558	C	S	.	*			trans	29.8	103.8	156.1	-48.2	-82.1	0	0	0	119.1	H1513 E1894 H1895	N1511-H1513 PolarHBondContact O-N 3.45Å; N1511-E1894 HydrophobicContact CB-CB 4.3Å; N1511-E1894 HydrophobicContact CB-CG 4.02Å; N1511-E1894 WeakPolarHBondContact CB-OE1 3.26Å; N1511-E1894 WeakPolarHBondContact ND2-CB 3.32Å; N1511-H1895 VanDerWaalsContact CG-N 3.33Å; N1511-H1895 PolarHBondContact ND2-N 2.71Å; N1511-H1895 PolarHBondContact ND2-O 3.22Å; N1511-H1895 WeakPolarHBondContact OD1-CB 3.4Å; N1511-H1895 PolarHBondContact OD1-N 2.86Å
1512	F	35.1	Very low	36.3	Very low	133 Å²	133	96.6 Å²	96.6	58%	0.583	54%	0.538	S	S	*	.			trans	-66.3	120.5	150.3	-73.9	-90	0	0	0	109.4	L1514 I1522 F1526	F1512-L1514 PolarHBondContact O-N 3.18Å; F1512-I1522 HydrophobicContact CD1-CG2 4.2Å; F1512-I1522 HydrophobicContact CE1-CG2 3.9Å; F1512-I1522 HydrophobicContact CZ-CG2 4.28Å; F1512-F1526 HydrophobicContact CE1-CE2 4.49Å; F1512-F1526 AromaticContact CZ-CE2 3.94Å; F1512-F1526 HydrophobicContact CZ-CE2 3.94Å; F1512-F1526 HydrophobicContact CZ-CZ 4.43Å
1513	H	42.9	Very low	36.6	Very low	154 Å²	154	95.6 Å²	95.6	71%	0.713	53%	0.526	S	S	*	.	S	Bend	trans	-61.5	-4.3	178.1	-67.4	-52.6	0	0	0	115.1	N1511 E1894	N1511-H1513 PolarHBondContact O-N 3.45Å; H1513-E1894 IonicContact CE1-OE1 3.79Å; H1513-E1894 PolarHBondContact CE1-OE1 2.96Å; H1513-E1894 IonicContact CE1-OE2 2.88Å; H1513-E1894 PolarHBondContact CE1-OE2 3.39Å; H1513-E1894 IonicContact ND1-OE1 3.55Å
1514	L	37.5	Very low	37.2	Very low	74 Å²	74	96.8 Å²	96.8	39%	0.387	52%	0.521	S	S	.	.			trans	-93.5	124.9	-179.2	-72.3	162.4	0	0	0	111.1	F1512 W1518 I1522	F1512-L1514 PolarHBondContact O-N 3.18Å; L1514-W1518 HydrophobicContact CB-CB 4.07Å; L1514-W1518 HydrophobicContact CD1-CB 4.33Å; L1514-W1518 HydrophobicContact CD2-CB 4.08Å; L1514-W1518 HydrophobicContact CD2-CG 4.3Å; L1514-W1518 HydrophobicContact CG-CB 4.39Å; L1514-I1522 HydrophobicContact CD1-CD1 3.45Å; L1514-I1522 VanDerWaalsContact CD1-CD1 3.45Å
1515	R	36.2	Very low	37.6	Very low	142 Å²	142	99.6 Å²	99.6	54%	0.536	53%	0.531	S	S	.	.			trans	-100.2	175.9	169.4	-54.6	-167.7	-161.2	-167.1	8.8	110.3
1516	G	47.1	Very low	38.2	Very low	45 Å²	45	101.5 Å²	101.5	46%	0.464	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	-153.2	175.7	0	0	0	0	0	113.8	W1518 R1519	G1516-W1518 PolarHBondContact O-N 2.92Å; G1516-R1519 WeakPolarHBondContact O-CB 3.49Å; G1516-R1519 PolarHBondContact O-N 2.84Å
1517	A	40.4	Very low	38.7	Very low	63 Å²	63	102.1 Å²	102.1	52%	0.521	53%	0.526	S	S	.	.	H	α-helix	trans	-59.2	-31	-173.8	0	0	0	0	0	113.5	R1519 Q1520 V1521	A1517-R1519 PolarHBondContact O-N 3.44Å; A1517-Q1520 PolarHBondContact O-N 3.14Å; A1517-V1521 PolarHBondContact O-N 3.06Å; A1517-V1521 VanDerWaalsContact O-N 3.07Å
1518	W	43.2	Very low	39.6	Very low	87 Å²	87	101.2 Å²	101.2	33%	0.33	52%	0.516	S	S	.	.	H	α-helix	trans	-58.4	-32.1	175.4	-73.4	99.1	0	0	0	113.2	L1514 G1516 I1522 I1542	L1514-W1518 HydrophobicContact CB-CB 4.07Å; L1514-W1518 HydrophobicContact CD1-CB 4.33Å; L1514-W1518 HydrophobicContact CD2-CB 4.08Å; L1514-W1518 HydrophobicContact CD2-CG 4.3Å; L1514-W1518 HydrophobicContact CG-CB 4.39Å; G1516-W1518 PolarHBondContact O-N 2.92Å; W1518-I1522 WeakPolarHBondContact O-CG1 3.41Å; W1518-I1522 PolarHBondContact O-N 3.2Å; W1518-I1542 HydrophobicContact CH2-CG2 4.45Å; W1518-I1542 HydrophobicContact CZ3-CD1 4.02Å; W1518-I1542 HydrophobicContact CZ3-CG1 4.45Å; W1518-I1542 HydrophobicContact CZ3-CG2 4.34Å
1519	R	47.6	Very low	40.2	Very low	162 Å²	162	98.2 Å²	98.2	61%	0.611	51%	0.506	S	S	*	.	H	α-helix	trans	-67.3	-44	173.7	-174	179.8	171.3	-165.7	-1.9	111.4	G1516 A1517 I1522 C1523	G1516-R1519 WeakPolarHBondContact O-CB 3.49Å; G1516-R1519 PolarHBondContact O-N 2.84Å; A1517-R1519 PolarHBondContact O-N 3.44Å; R1519-I1522 PolarHBondContact O-N 3.46Å; R1519-C1523 WeakPolarHBondContact O-CB 3.3Å; R1519-C1523 PolarHBondContact O-N 3.2Å; R1519-C1523 PolarHBondContact O-SG 2.97Å
1520	Q	42.6	Very low	40.6	Very low	141 Å²	141	101.3 Å²	101.3	66%	0.659	51%	0.514	S	S	*	.	H	α-helix	trans	-64	-45.4	-179.8	-69.1	-175.7	-86.1	0	0	111.6	A1517 I1522 C1523 E1524	A1517-Q1520 PolarHBondContact O-N 3.14Å; Q1520-I1522 VanDerWaalsContact C-N 3.31Å; Q1520-I1522 PolarHBondContact O-N 3.49Å; Q1520-C1523 PolarHBondContact O-N 3Å; Q1520-C1523 VanDerWaalsContact O-N 3.14Å; Q1520-E1524 PolarHBondContact O-N 3.22Å
1521	V	44.9	Very low	41.1	Very low	72 Å²	72	104.8 Å²	104.8	44%	0.436	52%	0.52	S	S	.	.	H	α-helix	trans	-60.3	-40	177.4	175.3	0	0	0	0	111.7	A1517 I1525	A1517-V1521 PolarHBondContact O-N 3.06Å; A1517-V1521 VanDerWaalsContact O-N 3.07Å; V1521-I1525 HydrophobicContact CG1-CD1 4.02Å; V1521-I1525 WeakPolarHBondContact O-CD1 3.12Å; V1521-I1525 VanDerWaalsContact O-CG1 3.23Å; V1521-I1525 WeakPolarHBondContact O-CG1 3.36Å; V1521-I1525 PolarHBondContact O-N 3.35Å; V1521-I1525 VanDerWaalsContact O-N 3.16Å
1522	I	44.8	Very low	41	Very low	30 Å²	30	110.6 Å²	110.6	15%	0.154	55%	0.546	C	S	.	.	H	α-helix	trans	-70.5	-37.7	176.5	-69	171.1	0	0	0	111.4	F1512 L1514 W1518 R1519 Q1520 I1525 F1526	F1512-I1522 HydrophobicContact CD1-CG2 4.2Å; F1512-I1522 HydrophobicContact CE1-CG2 3.9Å; F1512-I1522 HydrophobicContact CZ-CG2 4.28Å; L1514-I1522 HydrophobicContact CD1-CD1 3.45Å; L1514-I1522 VanDerWaalsContact CD1-CD1 3.45Å; W1518-I1522 WeakPolarHBondContact O-CG1 3.41Å; W1518-I1522 PolarHBondContact O-N 3.2Å; R1519-I1522 PolarHBondContact O-N 3.46Å; Q1520-I1522 VanDerWaalsContact C-N 3.31Å; Q1520-I1522 PolarHBondContact O-N 3.49Å; I1522-I1525 PolarHBondContact O-N 3.15Å; I1522-F1526 HydrophobicContact CG2-CD2 4.14Å; I1522-F1526 HydrophobicContact CG2-CE2 4.36Å; I1522-F1526 PolarHBondContact O-N 3.46Å; I1522-F1526 VanDerWaalsContact O-N 3.07Å
1523	C	42.5	Very low	40.8	Very low	49 Å²	49	110 Å²	110	33%	0.331	56%	0.559	S	S	.	*	H	α-helix	trans	-63.4	-44.7	173.5	-70.9	0	0	0	0	112.3	R1519 Q1520 I1525 F1526 E1527	R1519-C1523 WeakPolarHBondContact O-CB 3.3Å; R1519-C1523 PolarHBondContact O-N 3.2Å; R1519-C1523 PolarHBondContact O-SG 2.97Å; Q1520-C1523 PolarHBondContact O-N 3Å; Q1520-C1523 VanDerWaalsContact O-N 3.14Å; C1523-I1525 VanDerWaalsContact C-N 3.29Å; C1523-I1525 PolarHBondContact O-N 2.98Å; C1523-F1526 PolarHBondContact O-N 3.08Å; C1523-F1526 VanDerWaalsContact O-N 3.08Å; C1523-E1527 WeakPolarHBondContact O-CG 3.38Å; C1523-E1527 PolarHBondContact O-N 3.02Å
1524	E	44.4	Very low	40.2	Very low	123 Å²	123	107.9 Å²	107.9	58%	0.575	57%	0.568	S	S	*	*	H	α-helix	trans	-59.8	-38.2	175.4	-73.7	-178.6	121.1	0	0	112	Q1520 F1526 T1528	Q1520-E1524 PolarHBondContact O-N 3.22Å; E1524-F1526 VanDerWaalsContact C-N 3.33Å; E1524-F1526 PolarHBondContact O-N 3.4Å; E1524-T1528 WeakPolarHBondContact O-CB 3.33Å; E1524-T1528 WeakPolarHBondContact O-CG2 3.29Å; E1524-T1528 PolarHBondContact O-N 3.07Å; E1524-T1528 PolarHBondContact O-OG1 3.32Å
1525	I	43.2	Very low	39.7	Very low	103 Å²	103	108.9 Å²	108.9	53%	0.528	58%	0.581	S	S	.	*	H	α-helix	trans	-66.4	-34	175.7	-70.1	165.7	0	0	0	111.7	V1521 I1522 C1523 T1528	V1521-I1525 HydrophobicContact CG1-CD1 4.02Å; V1521-I1525 WeakPolarHBondContact O-CD1 3.12Å; V1521-I1525 VanDerWaalsContact O-CG1 3.23Å; V1521-I1525 WeakPolarHBondContact O-CG1 3.36Å; V1521-I1525 PolarHBondContact O-N 3.35Å; V1521-I1525 VanDerWaalsContact O-N 3.16Å; I1522-I1525 PolarHBondContact O-N 3.15Å; C1523-I1525 VanDerWaalsContact C-N 3.29Å; C1523-I1525 PolarHBondContact O-N 2.98Å; I1525-T1528 PolarHBondContact O-OG1 3.27Å
1526	F	41.8	Very low	39.4	Very low	114 Å²	114	109.4 Å²	109.4	50%	0.5	59%	0.593	S	S	.	*	H	α-helix	trans	-75.8	-46.5	174.3	-96.3	-85.7	0	0	0	112.5	F1512 I1522 C1523 E1524 T1528 S1529	F1512-F1526 HydrophobicContact CE1-CE2 4.49Å; F1512-F1526 AromaticContact CZ-CE2 3.94Å; F1512-F1526 HydrophobicContact CZ-CE2 3.94Å; F1512-F1526 HydrophobicContact CZ-CZ 4.43Å; I1522-F1526 HydrophobicContact CG2-CD2 4.14Å; I1522-F1526 HydrophobicContact CG2-CE2 4.36Å; I1522-F1526 PolarHBondContact O-N 3.46Å; I1522-F1526 VanDerWaalsContact O-N 3.07Å; C1523-F1526 PolarHBondContact O-N 3.08Å; C1523-F1526 VanDerWaalsContact O-N 3.08Å; E1524-F1526 VanDerWaalsContact C-N 3.33Å; E1524-F1526 PolarHBondContact O-N 3.4Å; F1526-T1528 VanDerWaalsContact C-N 3.33Å; F1526-T1528 PolarHBondContact O-N 3.29Å; F1526-S1529 WeakPolarHBondContact O-CB 3.37Å; F1526-S1529 PolarHBondContact O-N 3.21Å; F1526-S1529 PolarHBondContact O-OG 2.77Å
1527	E	40.3	Very low	38.7	Very low	141 Å²	141	112.5 Å²	112.5	66%	0.659	61%	0.605	S	S	*	*	H	α-helix	trans	-63.4	-37.1	-179.1	-72.1	177	-179.5	0	0	112.1	C1523 S1529	C1523-E1527 WeakPolarHBondContact O-CG 3.38Å; C1523-E1527 PolarHBondContact O-N 3.02Å; E1527-S1529 PolarHBondContact O-N 2.79Å
1528	T	43.1	Very low	38	Very low	106 Å²	106	118 Å²	118	65%	0.65	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-17.7	174.9	49.8	0	0	0	0	114	E1524 I1525 F1526	E1524-T1528 WeakPolarHBondContact O-CB 3.33Å; E1524-T1528 WeakPolarHBondContact O-CG2 3.29Å; E1524-T1528 PolarHBondContact O-N 3.07Å; E1524-T1528 PolarHBondContact O-OG1 3.32Å; I1525-T1528 PolarHBondContact O-OG1 3.27Å; F1526-T1528 VanDerWaalsContact C-N 3.33Å; F1526-T1528 PolarHBondContact O-N 3.29Å
1529	S	38	Very low	37.5	Very low	73 Å²	73	124.5 Å²	124.5	51%	0.51	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.6	-25.1	-178.7	75.8	0	0	0	0	114.3	F1526 E1527	F1526-S1529 WeakPolarHBondContact O-CB 3.37Å; F1526-S1529 PolarHBondContact O-N 3.21Å; F1526-S1529 PolarHBondContact O-OG 2.77Å; E1527-S1529 PolarHBondContact O-N 2.79Å
1530	F	36	Very low	36.8	Very low	182 Å²	182	125.2 Å²	125.2	80%	0.798	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-15	-174.3	-98.7	-91.5	0	0	0	114.8
1531	H	39	Very low	36.5	Very low	173 Å²	173	121 Å²	121	80%	0.801	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	6.2	-170.2	-86.9	-58.1	0	0	0	116.2
1532	Q	31.2	Very low	36.2	Very low	155 Å²	155	122.7 Å²	122.7	72%	0.724	65%	0.653	S	S	*	*			trans	-133.4	98.7	171.9	-69.6	-168.3	-0.1	0	0	112.4
1533	S	29.4	Very low	36.1	Very low	122 Å²	122	127.9 Å²	127.9	85%	0.853	68%	0.676	S	S	*	*			trans	-67.7	144.4	167.7	46.4	0	0	0	0	111.4
1534	A	30.3	Very low	36.4	Very low	109 Å²	109	132.5 Å²	132.5	90%	0.901	70%	0.703	S	S	*	*	S	Bend	trans	64.6	51.1	170.7	0	0	0	0	0	118.3
1535	S	28.4	Very low	37	Very low	94 Å²	94	128.9 Å²	128.9	66%	0.657	69%	0.694	S	S	*	*	S	Bend	trans	-143.2	155.1	146.1	81.7	0	0	0	0	112.8
1536	I	29.6	Very low	37.9	Very low	154 Å²	154	127.1 Å²	127.1	79%	0.79	70%	0.695	S	S	*	*			trans	-71.1	126.1	-170.6	-60.3	166.1	0	0	0	110.4	K1538	I1536-K1538 PolarHBondContact O-N 2.99Å
1537	P	31.1	Very low	39.3	Very low	110 Å²	110	124.4 Å²	124.4	71%	0.714	68%	0.683	S	S	*	*			trans	-68.1	104	178.9	27.2	-34.1	0	0	0	111.2	Y1539	P1537-Y1539 PolarHBondContact O-N 3.42Å
1538	K	26.9	Very low	40.8	Very low	178 Å²	178	121.2 Å²	121.2	77%	0.774	67%	0.673	S	S	*	*			trans	-75.6	102.9	168.5	-75.7	-176.8	178	176.8	0	109.5	I1536 H1540	I1536-K1538 PolarHBondContact O-N 2.99Å; K1538-H1540 PolarHBondContact O-N 3.24Å; K1538-H1540 PolarHBondContact O-ND1 3.43Å
1539	Y	32.9	Very low	42.3	Very low	224 Å²	224	118.1 Å²	118.1	88%	0.878	66%	0.662	S	S	*	*			trans	-45.9	101.3	168.8	-84.4	-94.8	0	0	0	111.6	P1537 G1541	P1537-Y1539 PolarHBondContact O-N 3.42Å; Y1539-G1541 PolarHBondContact O-N 3.01Å; Y1539-G1541 VanDerWaalsContact O-N 3.07Å
1540	H	31.5	Very low	44.4	Very low	176 Å²	176	116.4 Å²	116.4	82%	0.815	65%	0.646	S	S	*	*			trans	-82.3	71.6	161.1	-76.7	67.2	0	0	0	107.4	K1538	K1538-H1540 PolarHBondContact O-N 3.24Å; K1538-H1540 PolarHBondContact O-ND1 3.43Å
1541	G	36.1	Very low	46.6	Very low	53 Å²	53	115.1 Å²	115.1	55%	0.546	65%	0.646	S	S	.	*			trans	-61.5	140.2	-177.3	0	0	0	0	0	111.5	Y1539 Q1543	Y1539-G1541 PolarHBondContact O-N 3.01Å; Y1539-G1541 VanDerWaalsContact O-N 3.07Å; G1541-Q1543 PolarHBondContact O-N 2.74Å
1542	I	38.8	Very low	48.7	Very low	107 Å²	107	111 Å²	111	55%	0.549	63%	0.63	S	S	.	*			trans	-57.9	106.5	165.8	-60.3	167.2	0	0	0	106.8	W1518 V1544	W1518-I1542 HydrophobicContact CH2-CG2 4.45Å; W1518-I1542 HydrophobicContact CZ3-CD1 4.02Å; W1518-I1542 HydrophobicContact CZ3-CG1 4.45Å; W1518-I1542 HydrophobicContact CZ3-CG2 4.34Å; I1542-V1544 PolarHBondContact O-N 2.76Å
1543	Q	43.4	Very low	51	Low	139 Å²	139	110.3 Å²	110.3	65%	0.65	62%	0.624	S	S	*	*			trans	-64.3	127.3	175.4	-79.4	-165.3	-9.2	0	0	109.3	G1541 A1545 N1617	G1541-Q1543 PolarHBondContact O-N 2.74Å; Q1543-A1545 VanDerWaalsContact C-N 3.34Å; Q1543-A1545 PolarHBondContact O-N 2.9Å; Q1543-N1617 PolarHBondContact OE1-ND2 3.47Å; Q1543-N1617 VanDerWaalsContact OE1-ND2 3.11Å
1544	V	48.7	Very low	53.6	Low	147 Å²	147	107.6 Å²	107.6	89%	0.891	60%	0.599	S	S	*	*			trans	-69	92.8	172.3	-179	0	0	0	0	108.3	I1542 A1546	I1542-V1544 PolarHBondContact O-N 2.76Å; V1544-A1546 PolarHBondContact O-N 3.11Å
1545	A	57.7	Low	56.1	Low	46 Å²	46	105.1 Å²	105.1	38%	0.38	57%	0.571	S	S	.	*			trans	-72.5	121.7	-175.6	0	0	0	0	0	111.8	Q1543 F1547	Q1543-A1545 VanDerWaalsContact C-N 3.34Å; Q1543-A1545 PolarHBondContact O-N 2.9Å; A1545-F1547 HydrophobicContact CB-CE2 3.86Å; A1545-F1547 HydrophobicContact CB-CZ 4.15Å; A1545-F1547 WeakPolarHBondContact O-CD2 3.4Å; A1545-F1547 PolarHBondContact O-N 3.29Å
1546	A	61.6	Low	58.7	Low	66 Å²	66	101.9 Å²	101.9	55%	0.545	55%	0.548	S	S	.	.			trans	-94.8	89.6	-177.7	0	0	0	0	0	112	V1544 T1548	V1544-A1546 PolarHBondContact O-N 3.11Å; A1546-T1548 HydrophobicContact CB-CG2 4.49Å; A1546-T1548 PolarHBondContact O-N 3.44Å; A1546-T1548 PolarHBondContact O-OG1 2.93Å
1547	F	72	Confident	61.4	Low	57 Å²	57	99.5 Å²	99.5	25%	0.25	54%	0.536	C	S	.	.			trans	-65.6	102	177.2	-60.4	-91.6	0	0	0	110.9	A1545 F1566 W1578 L1580 T1583 V1619	A1545-F1547 HydrophobicContact CB-CE2 3.86Å; A1545-F1547 HydrophobicContact CB-CZ 4.15Å; A1545-F1547 WeakPolarHBondContact O-CD2 3.4Å; A1545-F1547 PolarHBondContact O-N 3.29Å; F1547-F1566 HydrophobicContact CB-CZ 4.27Å; F1547-F1566 HydrophobicContact CD1-CE1 4.29Å; F1547-F1566 AromaticContact CD1-CZ 3.89Å; F1547-F1566 HydrophobicContact CD1-CZ 3.89Å; F1547-F1566 HydrophobicContact CD2-CE1 4.39Å; F1547-F1566 AromaticContact CD2-CZ 3.85Å; F1547-F1566 HydrophobicContact CD2-CZ 3.85Å; F1547-F1566 HydrophobicContact CE1-CE1 4.11Å; F1547-F1566 HydrophobicContact CE1-CZ 4.18Å; F1547-F1566 HydrophobicContact CE2-CE1 4.24Å; F1547-F1566 HydrophobicContact CE2-CZ 4.16Å; F1547-F1566 HydrophobicContact CG-CE1 4.43Å; F1547-F1566 AromaticContact CG-CZ 3.73Å; F1547-F1566 HydrophobicContact CG-CZ 3.73Å; F1547-F1566 HydrophobicContact CZ-CE1 4.11Å; F1547-F1566 HydrophobicContact CZ-CZ 4.32Å; F1547-W1578 HydrophobicContact CB-CD2 4.24Å; F1547-W1578 HydrophobicContact CB-CE3 4.11Å; F1547-W1578 HydrophobicContact CB-CH2 4.34Å; F1547-W1578 HydrophobicContact CB-CZ2 4.49Å; F1547-W1578 HydrophobicContact CB-CZ3 4.16Å; F1547-W1578 HydrophobicContact CD1-CB 4.48Å; F1547-W1578 HydrophobicContact CD1-CD2 4.19Å; F1547-W1578 AromaticContact CD1-CE3 3.71Å; F1547-W1578 HydrophobicContact CD1-CE3 3.71Å; F1547-W1578 HydrophobicContact CD1-CZ3 4.28Å; F1547-W1578 HydrophobicContact CG-CE3 4.38Å; F1547-L1580 HydrophobicContact CE1-CD2 4.29Å; F1547-L1580 HydrophobicContact CE2-CD2 4.33Å; F1547-L1580 HydrophobicContact CZ-CD2 3.6Å; F1547-T1583 HydrophobicContact CE1-CG2 3.9Å; F1547-T1583 HydrophobicContact CZ-CG2 4.13Å; F1547-V1619 HydrophobicContact CD1-CB 3.83Å; F1547-V1619 HydrophobicContact CD1-CG1 3.88Å; F1547-V1619 HydrophobicContact CD1-CG2 3.82Å; F1547-V1619 HydrophobicContact CE1-CB 4.18Å; F1547-V1619 HydrophobicContact CE1-CG1 3.9Å; F1547-V1619 HydrophobicContact CE1-CG2 3.89Å
1548	T	71.9	Confident	63.9	Low	75 Å²	75	95.2 Å²	95.2	46%	0.46	51%	0.508	S	S	.	.			trans	-119.2	100	-167	34.9	0	0	0	0	111.1	A1546 H1618	A1546-T1548 HydrophobicContact CB-CG2 4.49Å; A1546-T1548 PolarHBondContact O-N 3.44Å; A1546-T1548 PolarHBondContact O-OG1 2.93Å; T1548-H1618 PolarHBondContact OG1-ND1 3.34Å
1549	G	73	Confident	66.4	Low	40 Å²	40	92.9 Å²	92.9	41%	0.412	50%	0.499	S	S	.	.			trans	-159.3	-5.5	-177.8	0	0	0	0	0	117.6	Q1576	G1549-Q1576 PolarHBondContact O-NE2 2.94Å; G1549-Q1576 PolarHBondContact O-OE1 3.35Å
1550	H	82.6	Confident	68.4	Low	38 Å²	38	82.8 Å²	82.8	18%	0.176	46%	0.46	C	S	.	.			trans	-89	145.2	173.6	-87.3	-64.8	0	0	0	112.1	I1554 T1568 S1570 D1572 T1574 Q1576	H1550-I1554 HydrophobicContact CB-CG1 4.28Å; H1550-T1568 PolarHBondContact CD2-OG1 3.23Å; H1550-T1568 WeakPolarHBondContact NE2-CB 3.42Å; H1550-T1568 PolarHBondContact NE2-O 3.04Å; H1550-T1568 PolarHBondContact NE2-OG1 2.71Å; H1550-S1570 VanDerWaalsContact CE1-CB 3.41Å; H1550-S1570 WeakPolarHBondContact CE1-CB 3.45Å; H1550-S1570 WeakPolarHBondContact ND1-CB 3.44Å; H1550-D1572 WeakPolarHBondContact CA-OD2 3.44Å; H1550-D1572 IonicContact CE1-OD1 3.21Å; H1550-D1572 IonicContact CE1-OD2 2.78Å; H1550-D1572 IonicContact CG-OD2 2.77Å; H1550-D1572 IonicContact ND1-OD1 3.23Å; H1550-D1572 PolarHBondContact ND1-OD1 3.31Å; H1550-D1572 IonicContact ND1-OD2 3.47Å; H1550-D1572 PolarHBondContact ND1-OD2 2.96Å; H1550-T1574 PolarHBondContact CE1-OG1 3.38Å; H1550-T1574 VanDerWaalsContact CE1-OG1 3.25Å; H1550-T1574 PolarHBondContact ND1-OG1 3.35Å; H1550-Q1576 VanDerWaalsContact CE1-CG 3.49Å; H1550-Q1576 WeakPolarHBondContact CE1-CG 3.2Å; H1550-Q1576 PolarHBondContact ND1-NE2 3.29Å
1551	I	81.9	Confident	70	Confident	155 Å²	155	78.7 Å²	78.7	80%	0.795	45%	0.445	S	S	*	.	S	Bend	trans	-89.6	-18.3	-177.2	-56.8	171.9	0	0	0	111.2	D1572	I1551-D1572 HydrophobicContact CB-CB 3.95Å; I1551-D1572 PolarHBondContact N-OD2 2.98Å
1552	N	83.2	Confident	71.2	Confident	87 Å²	87	80.9 Å²	80.9	47%	0.465	45%	0.447	S	S	.	.	S	Bend	trans	-144.1	171.7	-175.5	-156.5	-31	0	0	0	110.7	I1554 S1570 R1571 D1572	N1552-I1554 PolarHBondContact O-N 3.31Å; N1552-S1570 VanDerWaalsContact C-OG 3.23Å; N1552-S1570 PolarHBondContact O-OG 3.35Å; N1552-R1571 HydrophobicContact CB-CB 4.05Å; N1552-D1572 HydrophobicContact CB-CB 3.92Å
1553	K	80.6	Confident	72.2	Confident	139 Å²	139	81.2 Å²	81.2	60%	0.604	45%	0.447	S	S	*	.			trans	-50.5	128.2	-177.6	178	173.5	-179	-178.5	0	111.6	S1570 R1571	K1553-S1570 WeakPolarHBondContact O-CA 3.19Å; K1553-S1570 PolarHBondContact O-OG 3.04Å; K1553-R1571 PolarHBondContact O-N 2.96Å; K1553-R1571 VanDerWaalsContact O-N 3.11Å
1554	I	82.6	Confident	73.5	Confident	65 Å²	65	78.9 Å²	78.9	33%	0.333	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	129.9	169.5	-62.4	174.6	0	0	0	108.5	H1550 N1552 I1557 T1568 T1569	H1550-I1554 HydrophobicContact CB-CG1 4.28Å; N1552-I1554 PolarHBondContact O-N 3.31Å; I1554-I1557 HydrophobicContact CG2-CD1 4.14Å; I1554-I1557 HydrophobicContact CG2-CG1 3.68Å; I1554-T1568 HydrophobicContact CD1-CG2 4.47Å; I1554-T1569 CarbonylContact C-O 3.55Å; I1554-T1569 WeakPolarHBondContact CA-O 3.38Å; I1554-T1569 WeakPolarHBondContact CG2-O 3.43Å
1555	N	82.8	Confident	75	Confident	57 Å²	57	72.9 Å²	72.9	31%	0.305	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-35.5	-179.4	-74.1	-26.7	0	0	0	112.4	T1569 R1571 V1632 I1633	N1555-T1569 PolarHBondContact N-O 2.89Å; N1555-R1571 WeakPolarHBondContact ND2-CG 3.49Å; N1555-R1571 WeakPolarHBondContact OD1-CG 3.36Å; N1555-R1571 PolarHBondContact OD1-NE 3.46Å; N1555-V1632 PolarHBondContact ND2-O 2.84Å; N1555-I1633 WeakPolarHBondContact CB-O 3.49Å
1556	C	84.2	Confident	76.4	Confident	27 Å²	27	72.5 Å²	72.5	18%	0.182	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	145.4	-177.3	168.2	0	0	0	0	110.4	T1569 A1634	C1556-T1569 WeakPolarHBondContact CA-OG1 3.42Å; C1556-T1569 WeakPolarHBondContact CB-OG1 3.32Å; C1556-T1569 PolarHBondContact N-OG1 3.4Å; C1556-T1569 VanDerWaalsContact N-OG1 3.07Å; C1556-T1569 PolarHBondContact O-N 3.24Å; C1556-T1569 PolarHBondContact O-OG1 2.86Å; C1556-A1634 HydrophobicContact CB-CB 4.22Å
1557	I	86.8	Confident	77.6	Confident	104 Å²	104	69.5 Å²	69.5	53%	0.533	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	133.7	177.5	-53.3	-176.9	0	0	0	108	I1554 F1566 I1567 T1568	I1554-I1557 HydrophobicContact CG2-CD1 4.14Å; I1554-I1557 HydrophobicContact CG2-CG1 3.68Å; I1557-F1566 HydrophobicContact CG2-CD2 4.26Å; I1557-I1567 CarbonylContact C-O 3.07Å; I1557-I1567 WeakPolarHBondContact CA-O 3.49Å; I1557-T1568 HydrophobicContact CD1-CG2 4.37Å; I1557-T1568 HydrophobicContact CG1-CG2 4.1Å; I1557-T1568 HydrophobicContact CG2-CG2 4.15Å
1558	T	82.2	Confident	78.4	Confident	19 Å²	19	67 Å²	67	12%	0.117	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	139.4	177.2	44.9	0	0	0	0	111.1	I1567 A1635	T1558-I1567 PolarHBondContact N-O 3.31Å; T1558-I1567 PolarHBondContact O-N 3.29Å; T1558-A1635 WeakPolarHBondContact CG2-O 3.49Å; T1558-A1635 PolarHBondContact OG1-O 2.7Å
1559	H	80.2	Confident	79.2	Confident	129 Å²	129	63.5 Å²	63.5	60%	0.597	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	164.5	178	68.9	-86	0	0	0	111.4
1560	L	75.4	Confident	80	Confident	12 Å²	12	61.6 Å²	61.6	6%	0.063	32%	0.316	C	S	.	.			trans	-103.8	142.3	165.9	-72.7	133.6	0	0	0	109.1	T1562 E1563 C1565 I1567 L1577 Y1637	L1560-T1562 PolarHBondContact O-N 3.48Å; L1560-E1563 PolarHBondContact O-N 2.9Å; L1560-C1565 HydrophobicContact CD1-CB 3.59Å; L1560-C1565 PolarHBondContact N-O 2.95Å; L1560-C1565 VanDerWaalsContact N-O 3.16Å; L1560-I1567 HydrophobicContact CD1-CD1 4.35Å; L1560-I1567 HydrophobicContact CD1-CG1 4.22Å; L1560-L1577 HydrophobicContact CD1-CD1 3.57Å; L1560-Y1637 HydrophobicContact CD2-CD1 3.66Å; L1560-Y1637 HydrophobicContact CD2-CD2 3.74Å; L1560-Y1637 HydrophobicContact CD2-CE1 3.86Å; L1560-Y1637 HydrophobicContact CD2-CE2 3.95Å; L1560-Y1637 HydrophobicContact CD2-CG 3.59Å
1561	N	63.9	Low	80.1	Confident	91 Å²	91	66 Å²	66	49%	0.487	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-11.7	-177.4	-66.8	4.8	0	0	0	114.8	E1563 E1639	N1561-E1563 VanDerWaalsContact C-N 3.25Å; N1561-E1639 PolarHBondContact ND2-OE1 2.88Å; N1561-E1639 PolarHBondContact ND2-OE2 3.02Å
1562	T	62	Low	80.4	Confident	98 Å²	98	60 Å²	60	60%	0.601	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-4.6	171.7	53.7	0	0	0	0	114	L1560 N1564	L1560-T1562 PolarHBondContact O-N 3.48Å; T1562-N1564 PolarHBondContact O-N 3.43Å
1563	E	60.6	Low	80.7	Confident	114 Å²	114	60.6 Å²	60.6	53%	0.533	30%	0.299	S	S	.	.	S	Bend	trans	57.4	-29.1	-176.6	-64	-172.7	164.3	0	0	116.8	L1560 N1561 C1565 L1580	L1560-E1563 PolarHBondContact O-N 2.9Å; N1561-E1563 VanDerWaalsContact C-N 3.25Å; E1563-C1565 PolarHBondContact O-N 2.9Å; E1563-L1580 WeakPolarHBondContact O-CD1 3.23Å
1564	N	69.6	Low	81.1	Confident	90 Å²	90	54.7 Å²	54.7	48%	0.481	28%	0.275	S	S	.	.	S	Bend	trans	-67	-3.6	179.3	-67.2	-32	0	0	0	115.2	T1562 S1579 L1580 T1581	T1562-N1564 PolarHBondContact O-N 3.43Å; N1564-S1579 WeakPolarHBondContact O-CA 3.49Å; N1564-S1579 PolarHBondContact O-OG 2.86Å; N1564-L1580 PolarHBondContact O-N 2.74Å; N1564-T1581 HydrophobicContact CB-CG2 4.41Å
1565	C	79.7	Confident	81.5	Confident	22 Å²	22	51.6 Å²	51.6	15%	0.149	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	149	-176	-70.6	0	0	0	0	112.1	L1560 E1563 L1577 W1578 S1579	L1560-C1565 HydrophobicContact CD1-CB 3.59Å; L1560-C1565 PolarHBondContact N-O 2.95Å; L1560-C1565 VanDerWaalsContact N-O 3.16Å; E1563-C1565 PolarHBondContact O-N 2.9Å; C1565-L1577 HydrophobicContact CB-CD1 4.27Å; C1565-W1578 WeakPolarHBondContact CA-O 3.48Å; C1565-W1578 VanDerWaalsContact CB-O 3.3Å; C1565-W1578 WeakPolarHBondContact CB-O 3.27Å; C1565-S1579 PolarHBondContact SG-OG 3.44Å
1566	F	86.7	Confident	81.8	Confident	38 Å²	38	49.3 Å²	49.3	17%	0.167	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	159.4	175.9	66.3	-88.6	0	0	0	112.1	F1547 I1557 T1568 W1578 L1580	F1547-F1566 HydrophobicContact CB-CZ 4.27Å; F1547-F1566 HydrophobicContact CD1-CE1 4.29Å; F1547-F1566 AromaticContact CD1-CZ 3.89Å; F1547-F1566 HydrophobicContact CD1-CZ 3.89Å; F1547-F1566 HydrophobicContact CD2-CE1 4.39Å; F1547-F1566 AromaticContact CD2-CZ 3.85Å; F1547-F1566 HydrophobicContact CD2-CZ 3.85Å; F1547-F1566 HydrophobicContact CE1-CE1 4.11Å; F1547-F1566 HydrophobicContact CE1-CZ 4.18Å; F1547-F1566 HydrophobicContact CE2-CE1 4.24Å; F1547-F1566 HydrophobicContact CE2-CZ 4.16Å; F1547-F1566 HydrophobicContact CG-CE1 4.43Å; F1547-F1566 AromaticContact CG-CZ 3.73Å; F1547-F1566 HydrophobicContact CG-CZ 3.73Å; F1547-F1566 HydrophobicContact CZ-CE1 4.11Å; F1547-F1566 HydrophobicContact CZ-CZ 4.32Å; I1557-F1566 HydrophobicContact CG2-CD2 4.26Å; F1566-T1568 HydrophobicContact CD2-CG2 3.97Å; F1566-T1568 HydrophobicContact CE2-CG2 3.82Å; F1566-W1578 HydrophobicContact CD1-CB 3.92Å; F1566-W1578 HydrophobicContact CD2-CB 4.05Å; F1566-W1578 AromaticContact CD2-CD1 3.79Å; F1566-W1578 HydrophobicContact CD2-CG 4.19Å; F1566-W1578 HydrophobicContact CE1-CB 3.55Å; F1566-W1578 HydrophobicContact CE1-CG 4.27Å; F1566-W1578 HydrophobicContact CE2-CB 3.7Å; F1566-W1578 AromaticContact CE2-CD1 3.36Å; F1566-W1578 AromaticContact CE2-CG 3.59Å; F1566-W1578 HydrophobicContact CE2-CG 3.59Å; F1566-W1578 HydrophobicContact CG-CB 4.16Å; F1566-W1578 HydrophobicContact CZ-CB 3.42Å; F1566-W1578 VanDerWaalsContact CZ-CB 3.42Å; F1566-W1578 AromaticContact CZ-CD1 3.91Å; F1566-W1578 HydrophobicContact CZ-CD2 4.43Å; F1566-W1578 AromaticContact CZ-CG 3.64Å; F1566-W1578 HydrophobicContact CZ-CG 3.64Å; F1566-W1578 PolarHBondContact N-O 3.3Å; F1566-W1578 VanDerWaalsContact N-O 3.11Å; F1566-W1578 PolarHBondContact O-N 3.01Å; F1566-L1580 HydrophobicContact CD1-CD2 4.29Å; F1566-L1580 HydrophobicContact CE1-CD2 3.88Å
1567	I	87.8	Confident	82	Confident	3 Å²	3	49 Å²	49	2%	0.015	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.5	-174.9	-62.4	173.6	0	0	0	109.5	I1557 T1558 L1560 V1575 Q1576 L1577 V1644	I1557-I1567 CarbonylContact C-O 3.07Å; I1557-I1567 WeakPolarHBondContact CA-O 3.49Å; T1558-I1567 PolarHBondContact N-O 3.31Å; T1558-I1567 PolarHBondContact O-N 3.29Å; L1560-I1567 HydrophobicContact CD1-CD1 4.35Å; L1560-I1567 HydrophobicContact CD1-CG1 4.22Å; I1567-V1575 HydrophobicContact CG2-CG1 3.35Å; I1567-Q1576 CarbonylContact C-O 3.48Å; I1567-Q1576 VanDerWaalsContact CA-O 3.31Å; I1567-Q1576 WeakPolarHBondContact CA-O 3.34Å; I1567-L1577 HydrophobicContact CG1-CD1 3.77Å; I1567-V1644 HydrophobicContact CD1-CG2 3.77Å
1568	T	88.9	Confident	81.9	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.031	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143	173.4	58.8	0	0	0	0	111.2	H1550 I1554 I1557 F1566 V1575 Q1576 W1578	H1550-T1568 PolarHBondContact CD2-OG1 3.23Å; H1550-T1568 WeakPolarHBondContact NE2-CB 3.42Å; H1550-T1568 PolarHBondContact NE2-O 3.04Å; H1550-T1568 PolarHBondContact NE2-OG1 2.71Å; I1554-T1568 HydrophobicContact CD1-CG2 4.47Å; I1557-T1568 HydrophobicContact CD1-CG2 4.37Å; I1557-T1568 HydrophobicContact CG1-CG2 4.1Å; I1557-T1568 HydrophobicContact CG2-CG2 4.15Å; F1566-T1568 HydrophobicContact CD2-CG2 3.97Å; F1566-T1568 HydrophobicContact CE2-CG2 3.82Å; T1568-V1575 CarbonylContact O-C 3.41Å; T1568-V1575 WeakPolarHBondContact O-CA 3.33Å; T1568-Q1576 PolarHBondContact N-O 2.6Å; T1568-Q1576 PolarHBondContact O-N 3.22Å; T1568-W1578 PolarHBondContact OG1-NE1 3.34Å
1569	T	89.2	Confident	81.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	143.5	178.4	61.5	0	0	0	0	111	I1554 N1555 C1556 V1575 V1632 A1635	I1554-T1569 CarbonylContact C-O 3.55Å; I1554-T1569 WeakPolarHBondContact CA-O 3.38Å; I1554-T1569 WeakPolarHBondContact CG2-O 3.43Å; N1555-T1569 PolarHBondContact N-O 2.89Å; C1556-T1569 WeakPolarHBondContact CA-OG1 3.42Å; C1556-T1569 WeakPolarHBondContact CB-OG1 3.32Å; C1556-T1569 PolarHBondContact N-OG1 3.4Å; C1556-T1569 VanDerWaalsContact N-OG1 3.07Å; C1556-T1569 PolarHBondContact O-N 3.24Å; C1556-T1569 PolarHBondContact O-OG1 2.86Å; T1569-V1575 HydrophobicContact CG2-CG1 3.98Å; T1569-V1575 HydrophobicContact CG2-CG2 4.02Å; T1569-V1632 HydrophobicContact CG2-CG1 3.93Å; T1569-A1635 HydrophobicContact CG2-CB 3.35Å
1570	S	89.2	Confident	81.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	159.7	-176.9	174.5	0	0	0	0	114.8	H1550 N1552 K1553 D1572 K1573 T1574	H1550-S1570 VanDerWaalsContact CE1-CB 3.41Å; H1550-S1570 WeakPolarHBondContact CE1-CB 3.45Å; H1550-S1570 WeakPolarHBondContact ND1-CB 3.44Å; N1552-S1570 VanDerWaalsContact C-OG 3.23Å; N1552-S1570 PolarHBondContact O-OG 3.35Å; K1553-S1570 WeakPolarHBondContact O-CA 3.19Å; K1553-S1570 PolarHBondContact O-OG 3.04Å; S1570-D1572 WeakPolarHBondContact CB-OD1 3.16Å; S1570-D1572 PolarHBondContact O-N 3.28Å; S1570-D1572 VanDerWaalsContact OG-CG 3.28Å; S1570-D1572 PolarHBondContact OG-N 2.96Å; S1570-D1572 VanDerWaalsContact OG-N 3.1Å; S1570-D1572 PolarHBondContact OG-OD2 3.16Å; S1570-K1573 PolarHBondContact O-N 3.18Å; S1570-K1573 VanDerWaalsContact O-N 3.16Å; S1570-T1574 PolarHBondContact N-O 3.06Å
1571	R	84.6	Confident	80.7	Confident	131 Å²	131	41.7 Å²	41.7	49%	0.494	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-15	166.3	-63.1	-177.3	-178.6	-157.7	-9.1	113.6	N1552 K1553 N1555 K1573	N1552-R1571 HydrophobicContact CB-CB 4.05Å; K1553-R1571 PolarHBondContact O-N 2.96Å; K1553-R1571 VanDerWaalsContact O-N 3.11Å; N1555-R1571 WeakPolarHBondContact ND2-CG 3.49Å; N1555-R1571 WeakPolarHBondContact OD1-CG 3.36Å; N1555-R1571 PolarHBondContact OD1-NE 3.46Å; R1571-K1573 PolarHBondContact O-N 3.37Å
1572	D	87.6	Confident	80.3	Confident	30 Å²	30	41 Å²	41	16%	0.16	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	2.3	171.9	68.4	23	0	0	0	114.6	H1550 I1551 N1552 S1570 T1574	H1550-D1572 WeakPolarHBondContact CA-OD2 3.44Å; H1550-D1572 IonicContact CE1-OD1 3.21Å; H1550-D1572 IonicContact CE1-OD2 2.78Å; H1550-D1572 IonicContact CG-OD2 2.77Å; H1550-D1572 IonicContact ND1-OD1 3.23Å; H1550-D1572 PolarHBondContact ND1-OD1 3.31Å; H1550-D1572 IonicContact ND1-OD2 3.47Å; H1550-D1572 PolarHBondContact ND1-OD2 2.96Å; I1551-D1572 HydrophobicContact CB-CB 3.95Å; I1551-D1572 PolarHBondContact N-OD2 2.98Å; N1552-D1572 HydrophobicContact CB-CB 3.92Å; S1570-D1572 WeakPolarHBondContact CB-OD1 3.16Å; S1570-D1572 PolarHBondContact O-N 3.28Å; S1570-D1572 VanDerWaalsContact OG-CG 3.28Å; S1570-D1572 PolarHBondContact OG-N 2.96Å; S1570-D1572 VanDerWaalsContact OG-N 3.1Å; S1570-D1572 PolarHBondContact OG-OD2 3.16Å; D1572-T1574 VanDerWaalsContact C-N 3.26Å; D1572-T1574 PolarHBondContact O-N 2.86Å; D1572-T1574 WeakPolarHBondContact OD1-CA 3.48Å; D1572-T1574 VanDerWaalsContact OD1-CB 3.29Å; D1572-T1574 WeakPolarHBondContact OD1-CB 3.44Å; D1572-T1574 WeakPolarHBondContact OD1-CG2 3.41Å; D1572-T1574 PolarHBondContact OD1-N 3.45Å; D1572-T1574 PolarHBondContact OD1-OG1 3.41Å
1573	K	90	Very high	79.7	Confident	99 Å²	99	38 Å²	38	43%	0.43	19%	0.188	S	C	.	.	S	Bend	trans	72.2	10.7	-178.6	-39.8	-176	-176.6	-173.4	0	114.5	S1570 R1571 R1629 K1630	S1570-K1573 PolarHBondContact O-N 3.18Å; S1570-K1573 VanDerWaalsContact O-N 3.16Å; R1571-K1573 PolarHBondContact O-N 3.37Å; K1573-R1629 WeakPolarHBondContact CD-O 3.3Å; K1573-R1629 WeakPolarHBondContact CE-O 3.38Å; K1573-R1629 PolarHBondContact NZ-O 3.21Å; K1573-K1630 WeakPolarHBondContact CG-O 3.36Å
1574	T	89.6	Confident	79	Confident	14 Å²	14	39.6 Å²	39.6	9%	0.086	19%	0.19	C	C	.	.			trans	-105.2	153.3	177.1	74.9	0	0	0	0	112.5	H1550 S1570 D1572 Q1576 V1624 Y1625 R1626	H1550-T1574 PolarHBondContact CE1-OG1 3.38Å; H1550-T1574 VanDerWaalsContact CE1-OG1 3.25Å; H1550-T1574 PolarHBondContact ND1-OG1 3.35Å; S1570-T1574 PolarHBondContact N-O 3.06Å; D1572-T1574 VanDerWaalsContact C-N 3.26Å; D1572-T1574 PolarHBondContact O-N 2.86Å; D1572-T1574 WeakPolarHBondContact OD1-CA 3.48Å; D1572-T1574 VanDerWaalsContact OD1-CB 3.29Å; D1572-T1574 WeakPolarHBondContact OD1-CB 3.44Å; D1572-T1574 WeakPolarHBondContact OD1-CG2 3.41Å; D1572-T1574 PolarHBondContact OD1-N 3.45Å; D1572-T1574 PolarHBondContact OD1-OG1 3.41Å; T1574-Q1576 PolarHBondContact OG1-NE2 2.98Å; T1574-V1624 HydrophobicContact CG2-CG1 4.11Å; T1574-Y1625 WeakPolarHBondContact CA-O 3.42Å; T1574-R1626 HydrophobicContact CG2-CG 4.09Å
1575	V	90	Very high	77.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	126.1	165.3	-174.2	0	0	0	0	107.2	I1567 T1568 T1569 Y1625 V1632 A1635 W1654	I1567-V1575 HydrophobicContact CG2-CG1 3.35Å; T1568-V1575 CarbonylContact O-C 3.41Å; T1568-V1575 WeakPolarHBondContact O-CA 3.33Å; T1569-V1575 HydrophobicContact CG2-CG1 3.98Å; T1569-V1575 HydrophobicContact CG2-CG2 4.02Å; V1575-Y1625 HydrophobicContact CB-CD1 4.5Å; V1575-Y1625 HydrophobicContact CG2-CD1 4.46Å; V1575-Y1625 PolarHBondContact N-O 2.82Å; V1575-Y1625 PolarHBondContact O-N 3.45Å; V1575-V1632 HydrophobicContact CG2-CB 4.46Å; V1575-V1632 HydrophobicContact CG2-CG1 4.03Å; V1575-V1632 HydrophobicContact CG2-CG2 3.98Å; V1575-A1635 HydrophobicContact CG1-CB 4.36Å; V1575-W1654 HydrophobicContact CB-CH2 4.46Å; V1575-W1654 HydrophobicContact CB-CZ2 4.01Å; V1575-W1654 HydrophobicContact CG1-CH2 4.25Å; V1575-W1654 HydrophobicContact CG1-CZ2 3.82Å
1576	Q	89.7	Confident	75.4	Confident	10 Å²	10	45 Å²	45	5%	0.047	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.4	-173	-62.6	-173.2	13.3	0	0	110.4	G1549 H1550 I1567 T1568 T1574 W1578 A1621 L1623 V1624	G1549-Q1576 PolarHBondContact O-NE2 2.94Å; G1549-Q1576 PolarHBondContact O-OE1 3.35Å; H1550-Q1576 VanDerWaalsContact CE1-CG 3.49Å; H1550-Q1576 WeakPolarHBondContact CE1-CG 3.2Å; H1550-Q1576 PolarHBondContact ND1-NE2 3.29Å; I1567-Q1576 CarbonylContact C-O 3.48Å; I1567-Q1576 VanDerWaalsContact CA-O 3.31Å; I1567-Q1576 WeakPolarHBondContact CA-O 3.34Å; T1568-Q1576 PolarHBondContact N-O 2.6Å; T1568-Q1576 PolarHBondContact O-N 3.22Å; T1574-Q1576 PolarHBondContact OG1-NE2 2.98Å; Q1576-W1578 HydrophobicContact CB-CZ2 4.47Å; Q1576-W1578 VanDerWaalsContact OE1-CZ2 3.23Å; Q1576-A1621 HydrophobicContact CB-CB 3.95Å; Q1576-A1621 HydrophobicContact CG-CB 4.34Å; Q1576-L1623 WeakPolarHBondContact CA-O 3.39Å; Q1576-V1624 HydrophobicContact CG-CG1 4.11Å; Q1576-V1624 HydrophobicContact CG-CG2 4.13Å
1577	L	88.2	Confident	72.8	Confident	19 Å²	19	46.3 Å²	46.3	10%	0.099	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128	175.3	177.3	66.4	0	0	0	109.4	L1560 C1565 I1567 A1621 R1622 L1623	L1560-L1577 HydrophobicContact CD1-CD1 3.57Å; C1565-L1577 HydrophobicContact CB-CD1 4.27Å; I1567-L1577 HydrophobicContact CG1-CD1 3.77Å; L1577-A1621 CarbonylContact O-C 3.55Å; L1577-A1621 WeakPolarHBondContact O-CA 3.19Å; L1577-R1622 PolarHBondContact O-N 2.77Å; L1577-L1623 HydrophobicContact CB-CB 4.19Å; L1577-L1623 HydrophobicContact CD2-CB 4.42Å; L1577-L1623 PolarHBondContact N-O 3.22Å
1578	W	85.7	Confident	70	Confident	4 Å²	4	55 Å²	55	2%	0.015	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	154.7	-178.2	-59.7	95.2	0	0	0	110.9	F1547 C1565 F1566 T1568 Q1576 V1619 A1621	F1547-W1578 HydrophobicContact CB-CD2 4.24Å; F1547-W1578 HydrophobicContact CB-CE3 4.11Å; F1547-W1578 HydrophobicContact CB-CH2 4.34Å; F1547-W1578 HydrophobicContact CB-CZ2 4.49Å; F1547-W1578 HydrophobicContact CB-CZ3 4.16Å; F1547-W1578 HydrophobicContact CD1-CB 4.48Å; F1547-W1578 HydrophobicContact CD1-CD2 4.19Å; F1547-W1578 AromaticContact CD1-CE3 3.71Å; F1547-W1578 HydrophobicContact CD1-CE3 3.71Å; F1547-W1578 HydrophobicContact CD1-CZ3 4.28Å; F1547-W1578 HydrophobicContact CG-CE3 4.38Å; C1565-W1578 WeakPolarHBondContact CA-O 3.48Å; C1565-W1578 VanDerWaalsContact CB-O 3.3Å; C1565-W1578 WeakPolarHBondContact CB-O 3.27Å; F1566-W1578 HydrophobicContact CD1-CB 3.92Å; F1566-W1578 HydrophobicContact CD2-CB 4.05Å; F1566-W1578 AromaticContact CD2-CD1 3.79Å; F1566-W1578 HydrophobicContact CD2-CG 4.19Å; F1566-W1578 HydrophobicContact CE1-CB 3.55Å; F1566-W1578 HydrophobicContact CE1-CG 4.27Å; F1566-W1578 HydrophobicContact CE2-CB 3.7Å; F1566-W1578 AromaticContact CE2-CD1 3.36Å; F1566-W1578 AromaticContact CE2-CG 3.59Å; F1566-W1578 HydrophobicContact CE2-CG 3.59Å; F1566-W1578 HydrophobicContact CG-CB 4.16Å; F1566-W1578 HydrophobicContact CZ-CB 3.42Å; F1566-W1578 VanDerWaalsContact CZ-CB 3.42Å; F1566-W1578 AromaticContact CZ-CD1 3.91Å; F1566-W1578 HydrophobicContact CZ-CD2 4.43Å; F1566-W1578 AromaticContact CZ-CG 3.64Å; F1566-W1578 HydrophobicContact CZ-CG 3.64Å; F1566-W1578 PolarHBondContact N-O 3.3Å; F1566-W1578 VanDerWaalsContact N-O 3.11Å; F1566-W1578 PolarHBondContact O-N 3.01Å; T1568-W1578 PolarHBondContact OG1-NE1 3.34Å; Q1576-W1578 HydrophobicContact CB-CZ2 4.47Å; Q1576-W1578 VanDerWaalsContact OE1-CZ2 3.23Å; W1578-V1619 HydrophobicContact CE3-CB 4.5Å; W1578-V1619 HydrophobicContact CE3-CG1 4.28Å; W1578-V1619 HydrophobicContact CZ3-CB 4.22Å; W1578-V1619 HydrophobicContact CZ3-CG1 4.41Å; W1578-V1619 WeakPolarHBondContact CZ3-O 3.39Å; W1578-A1621 HydrophobicContact CD2-CB 4.24Å; W1578-A1621 HydrophobicContact CE3-CB 4.17Å; W1578-A1621 HydrophobicContact CH2-CB 4.03Å; W1578-A1621 HydrophobicContact CZ2-CB 4.07Å; W1578-A1621 HydrophobicContact CZ3-CB 4.07Å
1579	S	79.3	Confident	67.2	Low	4 Å²	4	62.7 Å²	62.7	3%	0.028	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.8	177.1	-166.2	0	0	0	0	111.4	N1564 C1565 T1581 D1582	N1564-S1579 WeakPolarHBondContact O-CA 3.49Å; N1564-S1579 PolarHBondContact O-OG 2.86Å; C1565-S1579 PolarHBondContact SG-OG 3.44Å; S1579-T1581 PolarHBondContact OG-OG1 3.05Å; S1579-T1581 VanDerWaalsContact OG-OG1 3.1Å; S1579-D1582 WeakPolarHBondContact CB-OD2 3.35Å
1580	L	68.5	Low	64.1	Low	45 Å²	45	68.6 Å²	68.6	24%	0.236	37%	0.366	C	S	.	.	S	Bend	trans	-86.6	-20.6	179.6	-59	-178.6	0	0	0	112.6	F1547 E1563 N1564 F1566 D1582 T1583 Y1584	F1547-L1580 HydrophobicContact CE1-CD2 4.29Å; F1547-L1580 HydrophobicContact CE2-CD2 4.33Å; F1547-L1580 HydrophobicContact CZ-CD2 3.6Å; E1563-L1580 WeakPolarHBondContact O-CD1 3.23Å; N1564-L1580 PolarHBondContact O-N 2.74Å; F1566-L1580 HydrophobicContact CD1-CD2 4.29Å; F1566-L1580 HydrophobicContact CE1-CD2 3.88Å; L1580-D1582 PolarHBondContact O-N 3.01Å; L1580-T1583 PolarHBondContact O-OG1 3.5Å; L1580-Y1584 WeakPolarHBondContact O-CD2 3.2Å
1581	T	63.4	Low	61	Low	59 Å²	59	75.2 Å²	75.2	36%	0.362	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-67.5	-27.6	177.7	51.5	0	0	0	0	112.7	N1564 S1579 T1583 N1585	N1564-T1581 HydrophobicContact CB-CG2 4.41Å; S1579-T1581 PolarHBondContact OG-OG1 3.05Å; S1579-T1581 VanDerWaalsContact OG-OG1 3.1Å; T1581-T1583 VanDerWaalsContact C-N 3.3Å; T1581-T1583 PolarHBondContact O-N 3.42Å; T1581-N1585 PolarHBondContact O-ND2 3.23Å
1582	D	55.5	Low	58.2	Low	75 Å²	75	73.8 Å²	73.8	40%	0.401	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-83.9	-10.8	-169	-54.5	-11.6	0	0	0	111.1	S1579 L1580 R1622	S1579-D1582 WeakPolarHBondContact CB-OD2 3.35Å; L1580-D1582 PolarHBondContact O-N 3.01Å; D1582-R1622 IonicContact OD1-NH1 3.94Å; D1582-R1622 PolarHBondContact OD1-NH1 3.23Å; D1582-R1622 VanDerWaalsContact OD1-NH1 3.15Å; D1582-R1622 IonicContact OD2-CZ 3.75Å; D1582-R1622 IonicContact OD2-NH1 3.55Å; D1582-R1622 PolarHBondContact OD2-NH1 2.93Å
1583	T	50.1	Low	55.3	Low	35 Å²	35	79.5 Å²	79.5	22%	0.215	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-91.5	-19.1	179	62	0	0	0	0	114.7	F1547 L1580 T1581 V1619	F1547-T1583 HydrophobicContact CE1-CG2 3.9Å; F1547-T1583 HydrophobicContact CZ-CG2 4.13Å; L1580-T1583 PolarHBondContact O-OG1 3.5Å; T1581-T1583 VanDerWaalsContact C-N 3.3Å; T1581-T1583 PolarHBondContact O-N 3.42Å; T1583-V1619 HydrophobicContact CG2-CB 4.34Å; T1583-V1619 HydrophobicContact CG2-CG1 3.82Å; T1583-V1619 HydrophobicContact CG2-CG2 3.52Å
1584	Y	45.1	Very low	52.3	Low	148 Å²	148	79.3 Å²	79.3	58%	0.58	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-12.6	-178.7	-74.6	-85.3	0	0	0	113.7	L1580	L1580-Y1584 WeakPolarHBondContact O-CD2 3.2Å
1585	N	38.8	Very low	49.3	Very low	132 Å²	132	86.6 Å²	86.6	71%	0.706	48%	0.483	S	S	*	.	S	Bend	trans	-95	-1.9	-175.9	-78.8	-52.1	0	0	0	115	T1581 G1587	T1581-N1585 PolarHBondContact O-ND2 3.23Å; N1585-G1587 PolarHBondContact O-N 3.31Å
1586	S	36.5	Very low	46.3	Very low	93 Å²	93	94.3 Å²	94.3	65%	0.65	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	31.4	177.3	60.9	0	0	0	0	113.8
1587	G	31.9	Very low	43.4	Very low	66 Å²	66	100.5 Å²	100.5	68%	0.68	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.3	-0.8	-167.2	0	0	0	0	0	116.6	N1585	N1585-G1587 PolarHBondContact O-N 3.31Å
1588	Q	27.9	Very low	40.5	Very low	185 Å²	185	104.7 Å²	104.7	86%	0.864	58%	0.576	S	S	*	*			trans	-135.7	86.3	174.8	-69.2	-166.4	2.1	0	0	112.1	S1590	Q1588-S1590 PolarHBondContact O-N 3.42Å
1589	H	30.1	Very low	37.6	Very low	167 Å²	167	110.9 Å²	110.9	77%	0.773	61%	0.609	S	S	*	*			trans	-78	109.8	169.1	-91	-77.6	0	0	0	110.9	I1591	H1589-I1591 VanDerWaalsContact C-N 3.27Å; H1589-I1591 PolarHBondContact O-N 2.99Å
1590	S	23.7	Very low	35	Very low	124 Å²	124	117.4 Å²	117.4	87%	0.867	64%	0.644	S	S	*	*			trans	-76.8	71.9	173.7	44.3	0	0	0	0	112.5	Q1588	Q1588-S1590 PolarHBondContact O-N 3.42Å
1591	I	25.8	Very low	32.9	Very low	140 Å²	140	120 Å²	120	72%	0.718	67%	0.665	S	S	*	*			trans	-130.1	125.5	171.3	-63.1	176.6	0	0	0	105.2	H1589	H1589-I1591 VanDerWaalsContact C-N 3.27Å; H1589-I1591 PolarHBondContact O-N 2.99Å
1592	S	25.4	Very low	31.1	Very low	100 Å²	100	123.8 Å²	123.8	70%	0.699	68%	0.683	S	S	*	*			cis	-156.8	160.5	19.4	50	0	0	0	0	114.2
1593	I	27.2	Very low	29.7	Very low	151 Å²	151	127.5 Å²	127.5	77%	0.774	70%	0.703	S	S	*	*			trans	19.7	104.8	134.7	-56.3	174.5	0	0	0	117.7
1594	S	26.5	Very low	28.7	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	73%	0.734	S	S	*	*			trans	35.7	117.8	145.1	70.4	0	0	0	0	123.1
1595	H	27.1	Very low	27.7	Very low	166 Å²	166	132 Å²	132	77%	0.769	74%	0.741	S	S	*	*				72.2	114.6	129.3	-81.1	-31	0	0	0	123.6
1596	K	26.2	Very low	27.1	Very low	162 Å²	162	133 Å²	133	70%	0.704	75%	0.746	S	S	*	*				114.1	127.9	112.3	-89.1	-178.9	178.6	-176.5	0	119.8
1597	I	27.7	Very low	26.6	Very low	141 Å²	141	134.2 Å²	134.2	72%	0.723	75%	0.754	S	S	*	*			trans	74.6	130.4	141.7	-66.3	169.2	0	0	0	116.9
1598	T	27.3	Very low	26.3	Very low	107 Å²	107	138.6 Å²	138.6	66%	0.656	76%	0.763	S	S	*	*			cis	-162.8	150.9	-12.4	26.1	0	0	0	0	111.8
1599	N	25.5	Very low	26.4	Very low	134 Å²	134	140 Å²	140	72%	0.717	77%	0.766	S	S	*	*			trans	58.5	125.9	140.5	-61.4	10.9	0	0	0	124.2
1600	N	25.2	Very low	26.1	Very low	141 Å²	141	136.5 Å²	136.5	75%	0.754	76%	0.76	S	S	*	*			trans	82.6	103.9	131.2	-68	12.5	0	0	0	123.5
1601	S	24.8	Very low	26.2	Very low	98 Å²	98	138 Å²	138	69%	0.685	76%	0.757	S	S	*	*				103.1	135.1	111.7	73.4	0	0	0	0	122
1602	N	25.5	Very low	26.3	Very low	140 Å²	140	136.6 Å²	136.6	75%	0.749	76%	0.757	S	S	*	*			trans	76.5	112.6	151.8	-60	-8.4	0	0	0	121.8
1603	N	25.9	Very low	26.4	Very low	152 Å²	152	139.4 Å²	139.4	81%	0.813	76%	0.763	S	S	*	*			trans	42.5	129.3	137.4	-57.9	-6.2	0	0	0	121.7
1604	V	29	Very low	26.4	Very low	143 Å²	143	139.7 Å²	139.7	87%	0.867	77%	0.766	S	S	*	*				-174.1	158.4	112.5	143	0	0	0	0	111.9
1605	N	24.6	Very low	26.7	Very low	135 Å²	135	140.7 Å²	140.7	72%	0.722	77%	0.773	S	S	*	*			trans	-71.5	164.1	-167.9	-54.3	-33.8	0	0	0	117
1606	N	25.2	Very low	27	Very low	153 Å²	153	137.1 Å²	137.1	82%	0.818	77%	0.767	S	S	*	*			trans	60	122.4	146.9	-65.7	-10.7	0	0	0	120.8
1607	S	26.9	Very low	27.8	Very low	118 Å²	118	134.1 Å²	134.1	83%	0.825	76%	0.759	S	S	*	*				-179.9	157.7	103.3	44.6	0	0	0	0	113.3
1608	N	25.3	Very low	28.8	Very low	159 Å²	159	133.4 Å²	133.4	85%	0.85	75%	0.752	S	S	*	*			trans	-70.9	137.1	176.4	-63.5	-40.5	0	0	0	111.9
1609	K	29.7	Very low	30.3	Very low	214 Å²	214	129.4 Å²	129.4	93%	0.93	73%	0.727	S	S	*	*			trans	-156.7	146.4	150.1	-113.8	155.4	-170.9	173.4	0	113.7
1610	S	23.4	Very low	32.3	Very low	94 Å²	94	128.8 Å²	128.8	66%	0.657	73%	0.728	S	S	*	*			trans	-82.3	148.4	-167.9	50.9	0	0	0	0	115.5
1611	L	25.2	Very low	34.6	Very low	155 Å²	155	122.9 Å²	122.9	81%	0.812	70%	0.698	S	S	*	*			trans	68.3	159.2	152.9	-68.9	162.5	0	0	0	116.6
1612	P	29.6	Very low	37.1	Very low	110 Å²	110	125.5 Å²	125.5	71%	0.714	69%	0.693	S	S	*	*			cis	-111.5	171.9	6.7	40.7	-31.3	0	0	0	115.2
1613	I	27.4	Very low	39.8	Very low	160 Å²	160	120.6 Å²	120.6	82%	0.821	67%	0.667	S	S	*	*			trans	-111.8	105.2	162.9	-61.9	173.5	0	0	0	106.4
1614	D	25.6	Very low	42.8	Very low	157 Å²	157	115.8 Å²	115.8	84%	0.84	64%	0.643	S	S	*	*			trans	-157.3	91.5	174.3	-112.3	-32.4	0	0	0	111.1
1615	S	32.6	Very low	45.6	Very low	116 Å²	116	109.4 Å²	109.4	81%	0.811	60%	0.603	S	S	*	*			trans	-160.8	134.1	156.4	53.7	0	0	0	0	109.3
1616	S	35	Very low	48.7	Very low	91 Å²	91	112.1 Å²	112.1	64%	0.636	60%	0.603	S	S	*	*			trans	-99	115.4	-165.2	50.4	0	0	0	0	113.3	H1618	S1616-H1618 PolarHBondContact O-N 2.71Å
1617	N	42.4	Very low	51.4	Low	99 Å²	99	107 Å²	107	53%	0.529	58%	0.582	S	S	.	*			trans	-75.4	58.6	169.2	-75.4	-7.1	0	0	0	111.4	Q1543 V1619	Q1543-N1617 PolarHBondContact OE1-ND2 3.47Å; Q1543-N1617 VanDerWaalsContact OE1-ND2 3.11Å; N1617-V1619 PolarHBondContact O-N 3.42Å
1618	H	49.4	Very low	54.3	Low	126 Å²	126	101.8 Å²	101.8	58%	0.583	55%	0.545	S	S	*	.			trans	-78.4	96.1	170.7	-77.6	-55.2	0	0	0	110.3	T1548 S1616	T1548-H1618 PolarHBondContact OG1-ND1 3.34Å; S1616-H1618 PolarHBondContact O-N 2.71Å
1619	V	58.9	Low	56.9	Low	23 Å²	23	103.2 Å²	103.2	14%	0.139	54%	0.538	C	S	.	.			trans	-64.9	139	166.9	-160.5	0	0	0	0	109	F1547 W1578 T1583 N1617	F1547-V1619 HydrophobicContact CD1-CB 3.83Å; F1547-V1619 HydrophobicContact CD1-CG1 3.88Å; F1547-V1619 HydrophobicContact CD1-CG2 3.82Å; F1547-V1619 HydrophobicContact CE1-CB 4.18Å; F1547-V1619 HydrophobicContact CE1-CG1 3.9Å; F1547-V1619 HydrophobicContact CE1-CG2 3.89Å; W1578-V1619 HydrophobicContact CE3-CB 4.5Å; W1578-V1619 HydrophobicContact CE3-CG1 4.28Å; W1578-V1619 HydrophobicContact CZ3-CB 4.22Å; W1578-V1619 HydrophobicContact CZ3-CG1 4.41Å; W1578-V1619 WeakPolarHBondContact CZ3-O 3.39Å; T1583-V1619 HydrophobicContact CG2-CB 4.34Å; T1583-V1619 HydrophobicContact CG2-CG1 3.82Å; T1583-V1619 HydrophobicContact CG2-CG2 3.52Å; N1617-V1619 PolarHBondContact O-N 3.42Å
1620	V	66	Low	59.6	Low	121 Å²	121	98.1 Å²	98.1	73%	0.733	52%	0.516	S	S	*	.			trans	-104.1	135.5	176.3	-179.9	0	0	0	0	109.7	R1622	V1620-R1622 PolarHBondContact O-N 2.96Å
1621	A	73.5	Confident	62.5	Low	16 Å²	16	96.3 Å²	96.3	13%	0.132	50%	0.504	C	S	.	.			trans	-63.6	126.1	175.3	0	0	0	0	0	111	Q1576 L1577 W1578 L1623 V1624	Q1576-A1621 HydrophobicContact CB-CB 3.95Å; Q1576-A1621 HydrophobicContact CG-CB 4.34Å; L1577-A1621 CarbonylContact O-C 3.55Å; L1577-A1621 WeakPolarHBondContact O-CA 3.19Å; W1578-A1621 HydrophobicContact CD2-CB 4.24Å; W1578-A1621 HydrophobicContact CE3-CB 4.17Å; W1578-A1621 HydrophobicContact CH2-CB 4.03Å; W1578-A1621 HydrophobicContact CZ2-CB 4.07Å; W1578-A1621 HydrophobicContact CZ3-CB 4.07Å; A1621-L1623 VanDerWaalsContact C-N 3.28Å; A1621-L1623 PolarHBondContact O-N 3.06Å; A1621-V1624 HydrophobicContact CB-CG2 3.97Å
1622	R	77.4	Confident	65.4	Low	153 Å²	153	88.9 Å²	88.9	58%	0.577	47%	0.465	S	S	*	.	S	Bend	trans	-66.7	-27.6	-175	-165.5	172	-175.6	123.2	-9.8	113	L1577 D1582 V1620	L1577-R1622 PolarHBondContact O-N 2.77Å; D1582-R1622 IonicContact OD1-NH1 3.94Å; D1582-R1622 PolarHBondContact OD1-NH1 3.23Å; D1582-R1622 VanDerWaalsContact OD1-NH1 3.15Å; D1582-R1622 IonicContact OD2-CZ 3.75Å; D1582-R1622 IonicContact OD2-NH1 3.55Å; D1582-R1622 PolarHBondContact OD2-NH1 2.93Å; V1620-R1622 PolarHBondContact O-N 2.96Å
1623	L	83.9	Confident	68	Low	38 Å²	38	86.5 Å²	86.5	20%	0.199	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	141.1	169.4	-178.9	140	0	0	0	110.1	Q1576 L1577 A1621 W1654	Q1576-L1623 WeakPolarHBondContact CA-O 3.39Å; L1577-L1623 HydrophobicContact CB-CB 4.19Å; L1577-L1623 HydrophobicContact CD2-CB 4.42Å; L1577-L1623 PolarHBondContact N-O 3.22Å; A1621-L1623 VanDerWaalsContact C-N 3.28Å; A1621-L1623 PolarHBondContact O-N 3.06Å; L1623-W1654 HydrophobicContact CD2-CH2 4.19Å; L1623-W1654 HydrophobicContact CD2-CZ3 3.75Å
1624	V	87.9	Confident	70.8	Confident	50 Å²	50	79.4 Å²	79.4	30%	0.303	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	100.7	177.4	-176.6	0	0	0	0	109.1	T1574 Q1576 A1621 R1626	T1574-V1624 HydrophobicContact CG2-CG1 4.11Å; Q1576-V1624 HydrophobicContact CG-CG1 4.11Å; Q1576-V1624 HydrophobicContact CG-CG2 4.13Å; A1621-V1624 HydrophobicContact CB-CG2 3.97Å; V1624-R1626 HydrophobicContact CG1-CG 4.07Å
1625	Y	88.7	Confident	73.9	Confident	10 Å²	10	71.9 Å²	71.9	4%	0.039	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.7	179.2	-177.3	-108.8	0	0	0	110.8	T1574 V1575 A1627 H1628 I1652 W1654 T1661	T1574-Y1625 WeakPolarHBondContact CA-O 3.42Å; V1575-Y1625 HydrophobicContact CB-CD1 4.5Å; V1575-Y1625 HydrophobicContact CG2-CD1 4.46Å; V1575-Y1625 PolarHBondContact N-O 2.82Å; V1575-Y1625 PolarHBondContact O-N 3.45Å; Y1625-A1627 HydrophobicContact CE1-CB 3.84Å; Y1625-A1627 HydrophobicContact CE2-CB 3.85Å; Y1625-A1627 VanDerWaalsContact CZ-CB 3.45Å; Y1625-A1627 WeakPolarHBondContact OH-CB 3.39Å; Y1625-H1628 AromaticContact CE1-CD2 3.89Å; Y1625-H1628 AromaticContact CE1-NE2 3.68Å; Y1625-I1652 WeakPolarHBondContact OH-CG2 3.47Å; Y1625-W1654 AromaticContact CD1-CD2 3.83Å; Y1625-W1654 HydrophobicContact CD1-CD2 3.83Å; Y1625-W1654 AromaticContact CD1-CE2 3.52Å; Y1625-W1654 HydrophobicContact CD1-CE3 4.28Å; Y1625-W1654 HydrophobicContact CD1-CG 4.31Å; Y1625-W1654 HydrophobicContact CD1-CH2 4.22Å; Y1625-W1654 AromaticContact CD1-CZ2 3.74Å; Y1625-W1654 HydrophobicContact CD1-CZ2 3.74Å; Y1625-W1654 HydrophobicContact CD1-CZ3 4.46Å; Y1625-W1654 AromaticContact CD1-NE1 3.81Å; Y1625-W1654 AromaticContact CD2-CD2 3.77Å; Y1625-W1654 HydrophobicContact CD2-CD2 3.77Å; Y1625-W1654 AromaticContact CD2-CE3 3.56Å; Y1625-W1654 HydrophobicContact CD2-CE3 3.56Å; Y1625-W1654 HydrophobicContact CD2-CG 4.31Å; Y1625-W1654 HydrophobicContact CD2-CH2 4.45Å; Y1625-W1654 AromaticContact CD2-CZ3 3.92Å; Y1625-W1654 HydrophobicContact CD2-CZ3 3.92Å; Y1625-W1654 HydrophobicContact CE1-CB 4.5Å; Y1625-W1654 AromaticContact CE1-CD1 3.58Å; Y1625-W1654 AromaticContact CE1-CD2 3.75Å; Y1625-W1654 HydrophobicContact CE1-CD2 3.75Å; Y1625-W1654 AromaticContact CE1-CE2 3.64Å; Y1625-W1654 AromaticContact CE1-CG 3.72Å; Y1625-W1654 HydrophobicContact CE1-CG 3.72Å; Y1625-W1654 HydrophobicContact CE1-CZ2 4.33Å; Y1625-W1654 AromaticContact CE1-NE1 3.51Å; Y1625-W1654 HydrophobicContact CE2-CB 3.86Å; Y1625-W1654 AromaticContact CE2-CD2 3.7Å; Y1625-W1654 HydrophobicContact CE2-CD2 3.7Å; Y1625-W1654 AromaticContact CE2-CE3 3.84Å; Y1625-W1654 HydrophobicContact CE2-CE3 3.84Å; Y1625-W1654 AromaticContact CE2-CG 3.74Å; Y1625-W1654 HydrophobicContact CE2-CG 3.74Å; Y1625-W1654 AromaticContact CG-CD2 3.82Å; Y1625-W1654 HydrophobicContact CG-CD2 3.82Å; Y1625-W1654 AromaticContact CG-CE2 3.84Å; Y1625-W1654 AromaticContact CG-CE3 3.78Å; Y1625-W1654 HydrophobicContact CG-CE3 3.78Å; Y1625-W1654 AromaticContact CG-CH2 3.87Å; Y1625-W1654 HydrophobicContact CG-CH2 3.87Å; Y1625-W1654 AromaticContact CG-CZ2 3.88Å; Y1625-W1654 HydrophobicContact CG-CZ2 3.88Å; Y1625-W1654 AromaticContact CG-CZ3 3.81Å; Y1625-W1654 HydrophobicContact CG-CZ3 3.81Å; Y1625-W1654 AromaticContact CZ-CD1 3.63Å; Y1625-W1654 AromaticContact CZ-CD2 3.66Å; Y1625-W1654 AromaticContact CZ-CG 3.37Å; Y1625-W1654 WeakPolarHBondContact OH-CB 3.39Å; Y1625-T1661 WeakPolarHBondContact OH-CG2 3.37Å
1626	R	88	Confident	76.5	Confident	191 Å²	191	68.3 Å²	68.3	72%	0.721	34%	0.341	S	S	*	.			trans	-126.2	17.7	-168.1	-61.8	-176	174.8	168.8	-1.3	114.5	T1574 V1624 H1628	T1574-R1626 HydrophobicContact CG2-CG 4.09Å; V1624-R1626 HydrophobicContact CG1-CG 4.07Å; R1626-H1628 VanDerWaalsContact C-N 3.32Å; R1626-H1628 PolarHBondContact O-N 3Å
1627	A	83.6	Confident	79	Confident	45 Å²	45	66 Å²	66	37%	0.372	32%	0.319	S	S	.	.			trans	-78.2	-11.8	-173.5	0	0	0	0	0	114.8	Y1625 T1661	Y1625-A1627 HydrophobicContact CE1-CB 3.84Å; Y1625-A1627 HydrophobicContact CE2-CB 3.85Å; Y1625-A1627 VanDerWaalsContact CZ-CB 3.45Å; Y1625-A1627 WeakPolarHBondContact OH-CB 3.39Å; A1627-T1661 HydrophobicContact CB-CG2 4.29Å
1628	H	86.2	Confident	80.9	Confident	10 Å²	10	61.5 Å²	61.5	5%	0.046	30%	0.295	C	S	.	.			trans	-74.7	142.4	-178	-68.9	-76.2	0	0	0	112.6	Y1625 R1626 V1632 S1646 D1648	Y1625-H1628 AromaticContact CE1-CD2 3.89Å; Y1625-H1628 AromaticContact CE1-NE2 3.68Å; R1626-H1628 VanDerWaalsContact C-N 3.32Å; R1626-H1628 PolarHBondContact O-N 3Å; H1628-V1632 HydrophobicContact CB-CG2 3.93Å; H1628-V1632 VanDerWaalsContact CD2-CG2 3.44Å; H1628-V1632 WeakPolarHBondContact CD2-CG2 3.49Å; H1628-S1646 PolarHBondContact CE1-OG 3.43Å; H1628-S1646 WeakPolarHBondContact NE2-CB 3.25Å; H1628-S1646 PolarHBondContact NE2-OG 2.94Å; H1628-D1648 HydrophobicContact CB-CB 4.09Å; H1628-D1648 IonicContact ND1-OD1 3.72Å; H1628-D1648 IonicContact ND1-OD2 3.77Å
1629	R	81.6	Confident	82.2	Confident	188 Å²	188	60.6 Å²	60.6	71%	0.709	29%	0.29	S	S	*	.	S	Bend	trans	-97.1	-29.7	-178.6	-65.6	-176	175.3	-166	-1.4	111.9	K1573 D1648	K1573-R1629 WeakPolarHBondContact CD-O 3.3Å; K1573-R1629 WeakPolarHBondContact CE-O 3.38Å; K1573-R1629 PolarHBondContact NZ-O 3.21Å; R1629-D1648 PolarHBondContact N-OD2 2.8Å
1630	K	85.9	Confident	83	Confident	107 Å²	107	63.4 Å²	63.4	47%	0.465	31%	0.309	S	S	.	.	S	Bend	trans	-110	178.9	174.9	-70.2	167.7	171.9	-179.3	0	109.9	K1573 D1648	K1573-K1630 WeakPolarHBondContact CG-O 3.36Å; K1630-D1648 HydrophobicContact CB-CB 3.89Å; K1630-D1648 VanDerWaalsContact CB-O 3.26Å; K1630-D1648 WeakPolarHBondContact CB-O 3.23Å; K1630-D1648 WeakPolarHBondContact CD-O 3.32Å; K1630-D1648 PolarHBondContact N-OD2 3.36Å
1631	S	84.9	Confident	83.6	Confident	56 Å²	56	60.1 Å²	60.1	39%	0.392	28%	0.284	S	S	.	.			trans	-64.4	132.8	172.5	49.1	0	0	0	0	110.9	I1633	S1631-I1633 PolarHBondContact O-N 3.4Å
1632	V	86.1	Confident	84.2	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	31%	0.309	C	S	.	.			trans	-72	125.6	177.2	-171	0	0	0	0	109.1	N1555 T1569 V1575 H1628	N1555-V1632 PolarHBondContact ND2-O 2.84Å; T1569-V1632 HydrophobicContact CG2-CG1 3.93Å; V1575-V1632 HydrophobicContact CG2-CB 4.46Å; V1575-V1632 HydrophobicContact CG2-CG1 4.03Å; V1575-V1632 HydrophobicContact CG2-CG2 3.98Å; H1628-V1632 HydrophobicContact CB-CG2 3.93Å; H1628-V1632 VanDerWaalsContact CD2-CG2 3.44Å; H1628-V1632 WeakPolarHBondContact CD2-CG2 3.49Å
1633	I	84.2	Confident	84.6	Confident	59 Å²	59	61.7 Å²	61.7	30%	0.303	29%	0.288	S	S	.	.			trans	-81.5	-54.7	-180	-56.7	179.9	0	0	0	109.3	N1555 S1631 V1647 L1676	N1555-I1633 WeakPolarHBondContact CB-O 3.49Å; S1631-I1633 PolarHBondContact O-N 3.4Å; I1633-V1647 HydrophobicContact CD1-CG1 4.24Å; I1633-V1647 PolarHBondContact N-O 3.49Å; I1633-L1676 WeakPolarHBondContact CD1-O 3.45Å
1634	A	86	Confident	84.8	Confident	11 Å²	11	59.9 Å²	59.9	9%	0.091	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	159	178.3	0	0	0	0	0	111.2	C1556 S1646 V1647 M1679	C1556-A1634 HydrophobicContact CB-CB 4.22Å; A1634-S1646 WeakPolarHBondContact O-CA 3.46Å; A1634-V1647 PolarHBondContact O-N 3.4Å; A1634-V1647 VanDerWaalsContact O-N 3.08Å; A1634-M1679 HydrophobicContact CB-CE 4.32Å
1635	A	89.3	Confident	84.9	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	137.4	168.4	0	0	0	0	0	110.9	T1558 T1569 V1575 V1644 A1645	T1558-A1635 WeakPolarHBondContact CG2-O 3.49Å; T1558-A1635 PolarHBondContact OG1-O 2.7Å; T1569-A1635 HydrophobicContact CG2-CB 3.35Å; V1575-A1635 HydrophobicContact CG1-CB 4.36Å; A1635-V1644 HydrophobicContact CB-CG1 4.02Å; A1635-A1645 CarbonylContact C-O 3.44Å; A1635-A1645 WeakPolarHBondContact CA-O 3.43Å
1636	H	88.3	Confident	84.9	Confident	40 Å²	40	57 Å²	57	19%	0.185	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.4	-179.7	-76.8	93.5	0	0	0	110.2	V1644 A1645 C1681	H1636-V1644 WeakPolarHBondContact O-CA 3.41Å; H1636-A1645 PolarHBondContact N-O 2.96Å; H1636-A1645 PolarHBondContact O-N 3.31Å; H1636-C1681 HydrophobicContact CB-CB 4.5Å; H1636-C1681 VanDerWaalsContact CB-SG 3.58Å
1637	Y	86.8	Confident	84.9	Confident	43 Å²	43	48 Å²	48	17%	0.169	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.8	173.1	173.8	-103.5	0	0	0	110.4	L1560 E1639 V1644 P1656 W1657	L1560-Y1637 HydrophobicContact CD2-CD1 3.66Å; L1560-Y1637 HydrophobicContact CD2-CD2 3.74Å; L1560-Y1637 HydrophobicContact CD2-CE1 3.86Å; L1560-Y1637 HydrophobicContact CD2-CE2 3.95Å; L1560-Y1637 HydrophobicContact CD2-CG 3.59Å; Y1637-E1639 HydrophobicContact CD1-CB 4.35Å; Y1637-E1639 HydrophobicContact CE1-CB 3.8Å; Y1637-E1639 HydrophobicContact CE1-CG 4.46Å; Y1637-V1644 HydrophobicContact CD2-CG2 4.09Å; Y1637-P1656 HydrophobicContact CD2-CG 4.23Å; Y1637-P1656 HydrophobicContact CE2-CG 4.09Å; Y1637-W1657 AromaticContact CE2-CH2 4Å; Y1637-W1657 HydrophobicContact CE2-CH2 4Å; Y1637-W1657 HydrophobicContact CE2-CZ3 4.12Å
1638	L	83.2	Confident	85	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.026	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	88.6	179	-66	174.4	0	0	0	109.9	P1640 Y1641 R1642 L1643 A1645 F1653 C1681 G1687 V1689	L1638-P1640 VanDerWaalsContact C-CD 3.44Å; L1638-Y1641 HydrophobicContact CB-CD2 4.15Å; L1638-Y1641 HydrophobicContact CD1-CD2 4.35Å; L1638-Y1641 CarbonylContact O-C 3.44Å; L1638-Y1641 PolarHBondContact O-N 3.24Å; L1638-R1642 PolarHBondContact O-N 3.14Å; L1638-L1643 WeakPolarHBondContact CB-O 3.38Å; L1638-L1643 PolarHBondContact N-O 3.04Å; L1638-A1645 HydrophobicContact CD1-CB 4.04Å; L1638-A1645 HydrophobicContact CG-CB 4.47Å; L1638-F1653 HydrophobicContact CD1-CD1 4.11Å; L1638-F1653 HydrophobicContact CD1-CE1 3.75Å; L1638-C1681 HydrophobicContact CD2-CB 3.8Å; L1638-G1687 WeakPolarHBondContact CD2-O 3.27Å; L1638-V1689 HydrophobicContact CD1-CG2 3.81Å; L1638-V1689 HydrophobicContact CD2-CG2 4.42Å
1639	E	75.4	Confident	84.7	Confident	106 Å²	106	46.1 Å²	46.1	50%	0.495	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-48.1	-45.5	179.8	177.2	176.5	-118.3	0	0	114.8	N1561 Y1637 Y1641 R1642	N1561-E1639 PolarHBondContact ND2-OE1 2.88Å; N1561-E1639 PolarHBondContact ND2-OE2 3.02Å; Y1637-E1639 HydrophobicContact CD1-CB 4.35Å; Y1637-E1639 HydrophobicContact CE1-CB 3.8Å; Y1637-E1639 HydrophobicContact CE1-CG 4.46Å; E1639-Y1641 PolarHBondContact O-N 3.39Å; E1639-Y1641 VanDerWaalsContact O-N 3.08Å; E1639-R1642 PolarHBondContact O-N 3.42Å
1640	P	76.1	Confident	84.7	Confident	83 Å²	83	38.1 Å²	38.1	54%	0.539	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-61.5	-22.5	-179.1	-24.3	35.3	0	0	0	114.2	L1638	L1638-P1640 VanDerWaalsContact C-CD 3.44Å
1641	Y	79.1	Confident	84.7	Confident	52 Å²	52	33.2 Å²	33.2	20%	0.204	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-112	-11.4	-177.1	-56.9	-61.8	0	0	0	113.4	L1638 E1639 L1643 Y1686 P1703 R1704	L1638-Y1641 HydrophobicContact CB-CD2 4.15Å; L1638-Y1641 HydrophobicContact CD1-CD2 4.35Å; L1638-Y1641 CarbonylContact O-C 3.44Å; L1638-Y1641 PolarHBondContact O-N 3.24Å; E1639-Y1641 PolarHBondContact O-N 3.39Å; E1639-Y1641 VanDerWaalsContact O-N 3.08Å; Y1641-L1643 PolarHBondContact O-N 3.16Å; Y1641-Y1686 WeakPolarHBondContact CE2-O 3.29Å; Y1641-Y1686 VanDerWaalsContact CZ-O 3.31Å; Y1641-Y1686 PolarHBondContact OH-O 2.94Å; Y1641-P1703 HydrophobicContact CD1-CG 4.5Å; Y1641-P1703 HydrophobicContact CD2-CG 3.46Å; Y1641-P1703 VanDerWaalsContact CD2-CG 3.46Å; Y1641-P1703 HydrophobicContact CE1-CG 4.34Å; Y1641-P1703 HydrophobicContact CE2-CG 3.24Å; Y1641-P1703 HydrophobicContact CG-CG 4.11Å; Y1641-R1704 HydrophobicContact CD1-CG 4.46Å; Y1641-R1704 HydrophobicContact CE1-CG 3.65Å; Y1641-R1704 PolarHBondContact OH-NE 3.33Å
1642	R	84.9	Confident	84.9	Confident	174 Å²	174	30.8 Å²	30.8	66%	0.657	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.9	27.8	-172.1	-60.7	-175.3	178.9	-177.7	-1.2	113.9	L1638 E1639 P1656 W1657	L1638-R1642 PolarHBondContact O-N 3.14Å; E1639-R1642 PolarHBondContact O-N 3.42Å; R1642-P1656 VanDerWaalsContact O-CD 3.28Å; R1642-P1656 WeakPolarHBondContact O-CD 3.22Å; R1642-W1657 HydrophobicContact CB-CZ3 3.99Å
1643	L	86.8	Confident	85	Confident	27 Å²	27	31.1 Å²	31.1	14%	0.141	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	152.4	178.9	-59.5	-178.4	0	0	0	110.9	L1638 Y1641 F1653 W1654 D1655 V1662	L1638-L1643 WeakPolarHBondContact CB-O 3.38Å; L1638-L1643 PolarHBondContact N-O 3.04Å; Y1641-L1643 PolarHBondContact O-N 3.16Å; L1643-F1653 HydrophobicContact CD1-CB 4.31Å; L1643-W1654 CarbonylContact C-O 3.52Å; L1643-W1654 WeakPolarHBondContact CA-O 3.4Å; L1643-D1655 HydrophobicContact CD2-CB 4.29Å; L1643-V1662 HydrophobicContact CD1-CB 4.36Å; L1643-V1662 HydrophobicContact CD1-CG1 4.22Å; L1643-V1662 HydrophobicContact CD2-CB 4.45Å; L1643-V1662 HydrophobicContact CD2-CG2 3.77Å
1644	V	88.3	Confident	85.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.2	162.3	177.7	0	0	0	0	108.7	I1567 A1635 H1636 Y1637 F1653 W1654 P1656	I1567-V1644 HydrophobicContact CD1-CG2 3.77Å; A1635-V1644 HydrophobicContact CB-CG1 4.02Å; H1636-V1644 WeakPolarHBondContact O-CA 3.41Å; Y1637-V1644 HydrophobicContact CD2-CG2 4.09Å; V1644-F1653 WeakPolarHBondContact O-CA 3.47Å; V1644-W1654 HydrophobicContact CB-CD2 4.11Å; V1644-W1654 HydrophobicContact CB-CG 4.49Å; V1644-W1654 HydrophobicContact CB-CH2 4.47Å; V1644-W1654 HydrophobicContact CB-CZ2 3.82Å; V1644-W1654 HydrophobicContact CG1-CZ2 3.63Å; V1644-W1654 HydrophobicContact CG2-CH2 4.43Å; V1644-W1654 HydrophobicContact CG2-CZ2 4.21Å; V1644-W1654 PolarHBondContact N-O 2.92Å; V1644-W1654 VanDerWaalsContact O-CD1 3.28Å; V1644-W1654 PolarHBondContact O-N 3.15Å; V1644-P1656 HydrophobicContact CG2-CB 3.8Å; V1644-P1656 HydrophobicContact CG2-CG 3.99Å
1645	A	88.7	Confident	85.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	132	163.6	0	0	0	0	0	108.6	A1635 H1636 L1638 L1651 I1652 F1653 M1679 V1689	A1635-A1645 CarbonylContact C-O 3.44Å; A1635-A1645 WeakPolarHBondContact CA-O 3.43Å; H1636-A1645 PolarHBondContact N-O 2.96Å; H1636-A1645 PolarHBondContact O-N 3.31Å; L1638-A1645 HydrophobicContact CD1-CB 4.04Å; L1638-A1645 HydrophobicContact CG-CB 4.47Å; A1645-L1651 HydrophobicContact CB-CD1 4.32Å; A1645-I1652 WeakPolarHBondContact CA-O 3.47Å; A1645-F1653 HydrophobicContact CB-CD1 3.94Å; A1645-F1653 HydrophobicContact CB-CE1 3.85Å; A1645-M1679 HydrophobicContact CB-CE 4.42Å; A1645-M1679 HydrophobicContact CB-SD 4.17Å; A1645-M1679 WeakPolarHBondContact O-CE 3.37Å; A1645-V1689 HydrophobicContact CB-CG2 4.01Å
1646	S	90.3	Very high	85.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	144.9	176.6	54.9	0	0	0	0	112.1	H1628 A1634 I1652 W1654	H1628-S1646 PolarHBondContact CE1-OG 3.43Å; H1628-S1646 WeakPolarHBondContact NE2-CB 3.25Å; H1628-S1646 PolarHBondContact NE2-OG 2.94Å; A1634-S1646 WeakPolarHBondContact O-CA 3.46Å; S1646-I1652 PolarHBondContact N-O 2.76Å; S1646-I1652 PolarHBondContact O-N 3.21Å; S1646-W1654 PolarHBondContact OG-NE1 3.43Å
1647	V	88.2	Confident	84.8	Confident	1 Å²	1	36 Å²	36	1%	0.006	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.7	-173.4	166.2	0	0	0	0	111.7	I1633 A1634 C1650 L1651 L1676 M1679	I1633-V1647 HydrophobicContact CD1-CG1 4.24Å; I1633-V1647 PolarHBondContact N-O 3.49Å; A1634-V1647 PolarHBondContact O-N 3.4Å; A1634-V1647 VanDerWaalsContact O-N 3.08Å; V1647-C1650 WeakPolarHBondContact CA-O 3.29Å; V1647-L1651 HydrophobicContact CG2-CB 4.2Å; V1647-L1651 HydrophobicContact CG2-CD1 3.62Å; V1647-L1676 HydrophobicContact CG1-CB 3.99Å; V1647-L1676 HydrophobicContact CG2-CD1 4.37Å; V1647-M1679 HydrophobicContact CB-SD 4.31Å; V1647-M1679 HydrophobicContact CG2-CB 4.09Å; V1647-M1679 HydrophobicContact CG2-CE 4.38Å; V1647-M1679 HydrophobicContact CG2-CG 4.24Å; V1647-M1679 HydrophobicContact CG2-SD 3.45Å; V1647-M1679 WeakPolarHBondContact CG2-SD 3.04Å
1648	D	85.6	Confident	84.5	Confident	11 Å²	11	39.5 Å²	39.5	6%	0.059	18%	0.183	C	C	.	.	S	Bend	trans	-118.9	30.3	167.3	73.5	-30.2	0	0	0	111.8	H1628 R1629 K1630 C1650	H1628-D1648 HydrophobicContact CB-CB 4.09Å; H1628-D1648 IonicContact ND1-OD1 3.72Å; H1628-D1648 IonicContact ND1-OD2 3.77Å; R1629-D1648 PolarHBondContact N-OD2 2.8Å; K1630-D1648 HydrophobicContact CB-CB 3.89Å; K1630-D1648 VanDerWaalsContact CB-O 3.26Å; K1630-D1648 WeakPolarHBondContact CB-O 3.23Å; K1630-D1648 WeakPolarHBondContact CD-O 3.32Å; K1630-D1648 PolarHBondContact N-OD2 3.36Å; D1648-C1650 VanDerWaalsContact C-N 3.34Å; D1648-C1650 PolarHBondContact N-O 3.15Å
1649	G	80	Confident	84.2	Confident	5 Å²	5	40.5 Å²	40.5	5%	0.052	20%	0.195	C	C	.	.	S	Bend	trans	91.7	-6.8	-167.3	0	0	0	0	0	113.6	N1675 L1676	G1649-N1675 PolarHBondContact O-N 2.82Å; G1649-L1676 PolarHBondContact O-N 3.13Å
1650	C	81.3	Confident	84.5	Confident	21 Å²	21	41.5 Å²	41.5	14%	0.142	20%	0.198	C	C	.	.	S	Bend	trans	-127.8	149.2	159.9	-70.1	0	0	0	0	108.4	V1647 D1648	V1647-C1650 WeakPolarHBondContact CA-O 3.29Å; D1648-C1650 VanDerWaalsContact C-N 3.34Å; D1648-C1650 PolarHBondContact N-O 3.15Å
1651	L	85.6	Confident	84.9	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	132	177.8	-179	59.9	0	0	0	111.2	A1645 V1647 F1653 L1676 M1679 V1689 I1701	A1645-L1651 HydrophobicContact CB-CD1 4.32Å; V1647-L1651 HydrophobicContact CG2-CB 4.2Å; V1647-L1651 HydrophobicContact CG2-CD1 3.62Å; L1651-F1653 HydrophobicContact CD1-CE2 4.36Å; L1651-F1653 HydrophobicContact CD1-CZ 4.38Å; L1651-F1653 HydrophobicContact CD2-CE2 3.59Å; L1651-F1653 HydrophobicContact CD2-CZ 3.71Å; L1651-F1653 HydrophobicContact CG-CD2 4.32Å; L1651-F1653 HydrophobicContact CG-CE2 3.72Å; L1651-F1653 HydrophobicContact CG-CZ 4.1Å; L1651-L1676 HydrophobicContact CB-CD1 4.04Å; L1651-M1679 HydrophobicContact CD1-SD 3.7Å; L1651-V1689 HydrophobicContact CD1-CG1 4.23Å; L1651-V1689 HydrophobicContact CD2-CG1 4.16Å; L1651-I1701 HydrophobicContact CD2-CD1 3.66Å; L1651-I1701 HydrophobicContact CD2-CG2 4.25Å
1652	I	88.2	Confident	85.1	Confident	4 Å²	4	43.3 Å²	43.3	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	133.7	177.7	-52	-173.5	0	0	0	109.3	Y1625 A1645 S1646 T1661	Y1625-I1652 WeakPolarHBondContact OH-CG2 3.47Å; A1645-I1652 WeakPolarHBondContact CA-O 3.47Å; S1646-I1652 PolarHBondContact N-O 2.76Å; S1646-I1652 PolarHBondContact O-N 3.21Å; I1652-T1661 HydrophobicContact CG2-CG2 4.19Å
1653	F	89.5	Confident	84.7	Confident	7 Å²	7	37.8 Å²	37.8	3%	0.031	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.2	170.8	-61.7	-92.9	0	0	0	109.9	L1638 L1643 V1644 A1645 L1651 V1662 K1663 V1689 P1703	L1638-F1653 HydrophobicContact CD1-CD1 4.11Å; L1638-F1653 HydrophobicContact CD1-CE1 3.75Å; L1643-F1653 HydrophobicContact CD1-CB 4.31Å; V1644-F1653 WeakPolarHBondContact O-CA 3.47Å; A1645-F1653 HydrophobicContact CB-CD1 3.94Å; A1645-F1653 HydrophobicContact CB-CE1 3.85Å; L1651-F1653 HydrophobicContact CD1-CE2 4.36Å; L1651-F1653 HydrophobicContact CD1-CZ 4.38Å; L1651-F1653 HydrophobicContact CD2-CE2 3.59Å; L1651-F1653 HydrophobicContact CD2-CZ 3.71Å; L1651-F1653 HydrophobicContact CG-CD2 4.32Å; L1651-F1653 HydrophobicContact CG-CE2 3.72Å; L1651-F1653 HydrophobicContact CG-CZ 4.1Å; F1653-V1662 PolarHBondContact O-N 3.43Å; F1653-K1663 HydrophobicContact CB-CB 4.12Å; F1653-K1663 HydrophobicContact CD2-CB 4.02Å; F1653-K1663 HydrophobicContact CD2-CD 4.1Å; F1653-K1663 HydrophobicContact CD2-CG 4.42Å; F1653-K1663 HydrophobicContact CE2-CD 4.38Å; F1653-K1663 HydrophobicContact CG-CB 4.49Å; F1653-K1663 PolarHBondContact N-O 3.18Å; F1653-K1663 PolarHBondContact O-N 2.87Å; F1653-K1663 VanDerWaalsContact O-N 3.16Å; F1653-V1689 HydrophobicContact CE1-CG2 3.66Å; F1653-V1689 HydrophobicContact CZ-CB 4.49Å; F1653-V1689 HydrophobicContact CZ-CG2 3.84Å; F1653-P1703 HydrophobicContact CD1-CB 4.18Å; F1653-P1703 HydrophobicContact CE1-CB 3.67Å; F1653-P1703 HydrophobicContact CZ-CB 3.91Å
1654	W	90.5	Very high	84	Confident	3 Å²	3	39.1 Å²	39.1	1%	0.011	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	156.8	-177	58.5	-76.5	0	0	0	112.7	V1575 L1623 Y1625 L1643 V1644 S1646 P1656 K1660	V1575-W1654 HydrophobicContact CB-CH2 4.46Å; V1575-W1654 HydrophobicContact CB-CZ2 4.01Å; V1575-W1654 HydrophobicContact CG1-CH2 4.25Å; V1575-W1654 HydrophobicContact CG1-CZ2 3.82Å; L1623-W1654 HydrophobicContact CD2-CH2 4.19Å; L1623-W1654 HydrophobicContact CD2-CZ3 3.75Å; Y1625-W1654 AromaticContact CD1-CD2 3.83Å; Y1625-W1654 HydrophobicContact CD1-CD2 3.83Å; Y1625-W1654 AromaticContact CD1-CE2 3.52Å; Y1625-W1654 HydrophobicContact CD1-CE3 4.28Å; Y1625-W1654 HydrophobicContact CD1-CG 4.31Å; Y1625-W1654 HydrophobicContact CD1-CH2 4.22Å; Y1625-W1654 AromaticContact CD1-CZ2 3.74Å; Y1625-W1654 HydrophobicContact CD1-CZ2 3.74Å; Y1625-W1654 HydrophobicContact CD1-CZ3 4.46Å; Y1625-W1654 AromaticContact CD1-NE1 3.81Å; Y1625-W1654 AromaticContact CD2-CD2 3.77Å; Y1625-W1654 HydrophobicContact CD2-CD2 3.77Å; Y1625-W1654 AromaticContact CD2-CE3 3.56Å; Y1625-W1654 HydrophobicContact CD2-CE3 3.56Å; Y1625-W1654 HydrophobicContact CD2-CG 4.31Å; Y1625-W1654 HydrophobicContact CD2-CH2 4.45Å; Y1625-W1654 AromaticContact CD2-CZ3 3.92Å; Y1625-W1654 HydrophobicContact CD2-CZ3 3.92Å; Y1625-W1654 HydrophobicContact CE1-CB 4.5Å; Y1625-W1654 AromaticContact CE1-CD1 3.58Å; Y1625-W1654 AromaticContact CE1-CD2 3.75Å; Y1625-W1654 HydrophobicContact CE1-CD2 3.75Å; Y1625-W1654 AromaticContact CE1-CE2 3.64Å; Y1625-W1654 AromaticContact CE1-CG 3.72Å; Y1625-W1654 HydrophobicContact CE1-CG 3.72Å; Y1625-W1654 HydrophobicContact CE1-CZ2 4.33Å; Y1625-W1654 AromaticContact CE1-NE1 3.51Å; Y1625-W1654 HydrophobicContact CE2-CB 3.86Å; Y1625-W1654 AromaticContact CE2-CD2 3.7Å; Y1625-W1654 HydrophobicContact CE2-CD2 3.7Å; Y1625-W1654 AromaticContact CE2-CE3 3.84Å; Y1625-W1654 HydrophobicContact CE2-CE3 3.84Å; Y1625-W1654 AromaticContact CE2-CG 3.74Å; Y1625-W1654 HydrophobicContact CE2-CG 3.74Å; Y1625-W1654 AromaticContact CG-CD2 3.82Å; Y1625-W1654 HydrophobicContact CG-CD2 3.82Å; Y1625-W1654 AromaticContact CG-CE2 3.84Å; Y1625-W1654 AromaticContact CG-CE3 3.78Å; Y1625-W1654 HydrophobicContact CG-CE3 3.78Å; Y1625-W1654 AromaticContact CG-CH2 3.87Å; Y1625-W1654 HydrophobicContact CG-CH2 3.87Å; Y1625-W1654 AromaticContact CG-CZ2 3.88Å; Y1625-W1654 HydrophobicContact CG-CZ2 3.88Å; Y1625-W1654 AromaticContact CG-CZ3 3.81Å; Y1625-W1654 HydrophobicContact CG-CZ3 3.81Å; Y1625-W1654 AromaticContact CZ-CD1 3.63Å; Y1625-W1654 AromaticContact CZ-CD2 3.66Å; Y1625-W1654 AromaticContact CZ-CG 3.37Å; Y1625-W1654 WeakPolarHBondContact OH-CB 3.39Å; L1643-W1654 CarbonylContact C-O 3.52Å; L1643-W1654 WeakPolarHBondContact CA-O 3.4Å; V1644-W1654 HydrophobicContact CB-CD2 4.11Å; V1644-W1654 HydrophobicContact CB-CG 4.49Å; V1644-W1654 HydrophobicContact CB-CH2 4.47Å; V1644-W1654 HydrophobicContact CB-CZ2 3.82Å; V1644-W1654 HydrophobicContact CG1-CZ2 3.63Å; V1644-W1654 HydrophobicContact CG2-CH2 4.43Å; V1644-W1654 HydrophobicContact CG2-CZ2 4.21Å; V1644-W1654 PolarHBondContact N-O 2.92Å; V1644-W1654 VanDerWaalsContact O-CD1 3.28Å; V1644-W1654 PolarHBondContact O-N 3.15Å; S1646-W1654 PolarHBondContact OG-NE1 3.43Å; W1654-P1656 HydrophobicContact CZ3-CB 4.26Å; W1654-K1660 CarbonylContact C-O 3.55Å; W1654-K1660 WeakPolarHBondContact CA-O 3.35Å; W1654-K1660 VanDerWaalsContact CB-O 3.26Å; W1654-K1660 WeakPolarHBondContact CB-O 3.47Å
1655	D	88.7	Confident	82.7	Confident	37 Å²	37	42.2 Å²	42.2	20%	0.198	22%	0.221	C	C	.	.			trans	-86.6	122.9	178.8	-179.8	-47.2	0	0	0	110.3	L1643 W1657 M1658 G1659 K1660	L1643-D1655 HydrophobicContact CD2-CB 4.29Å; D1655-W1657 PolarHBondContact O-N 2.89Å; D1655-W1657 WeakPolarHBondContact OD1-CA 3.47Å; D1655-W1657 PolarHBondContact OD1-N 2.94Å; D1655-M1658 HydrophobicContact CB-CB 4.09Å; D1655-M1658 HydrophobicContact CB-CG 4.42Å; D1655-M1658 PolarHBondContact OD1-N 3.18Å; D1655-G1659 VanDerWaalsContact O-CA 3.3Å; D1655-G1659 WeakPolarHBondContact O-CA 3.34Å; D1655-G1659 PolarHBondContact O-N 3.41Å; D1655-K1660 PolarHBondContact N-O 3.18Å
1656	P	83.4	Confident	80.8	Confident	5 Å²	5	45.6 Å²	45.6	3%	0.032	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-13.6	-175.8	30.1	-32.9	0	0	0	115.2	Y1637 R1642 V1644 W1654	Y1637-P1656 HydrophobicContact CD2-CG 4.23Å; Y1637-P1656 HydrophobicContact CE2-CG 4.09Å; R1642-P1656 VanDerWaalsContact O-CD 3.28Å; R1642-P1656 WeakPolarHBondContact O-CD 3.22Å; V1644-P1656 HydrophobicContact CG2-CB 3.8Å; V1644-P1656 HydrophobicContact CG2-CG 3.99Å; W1654-P1656 HydrophobicContact CZ3-CB 4.26Å
1657	W	80.4	Confident	78.6	Confident	168 Å²	168	54 Å²	54	64%	0.636	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-35.2	173.5	-66.3	-84.8	0	0	0	112	Y1637 R1642 D1655	Y1637-W1657 AromaticContact CE2-CH2 4Å; Y1637-W1657 HydrophobicContact CE2-CH2 4Å; Y1637-W1657 HydrophobicContact CE2-CZ3 4.12Å; R1642-W1657 HydrophobicContact CB-CZ3 3.99Å; D1655-W1657 PolarHBondContact O-N 2.89Å; D1655-W1657 WeakPolarHBondContact OD1-CA 3.47Å; D1655-W1657 PolarHBondContact OD1-N 2.94Å
1658	M	79.4	Confident	76.3	Confident	116 Å²	116	59.8 Å²	59.8	57%	0.571	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-18.8	178.1	-57.4	-161.7	87.6	0	0	113.9	D1655 K1660	D1655-M1658 HydrophobicContact CB-CB 4.09Å; D1655-M1658 HydrophobicContact CB-CG 4.42Å; D1655-M1658 PolarHBondContact OD1-N 3.18Å; M1658-K1660 HydrophobicContact CB-CB 4.25Å; M1658-K1660 HydrophobicContact CB-CD 4.28Å; M1658-K1660 HydrophobicContact CB-CG 4.09Å; M1658-K1660 HydrophobicContact CE-CD 4.35Å; M1658-K1660 PolarHBondContact O-N 3.46Å; M1658-K1660 HydrophobicContact SD-CD 4.42Å
1659	G	78.4	Confident	74.1	Confident	27 Å²	27	67.1 Å²	67.1	28%	0.278	35%	0.353	S	S	.	.			trans	65.5	15.5	-172.7	0	0	0	0	0	114.5	D1655	D1655-G1659 VanDerWaalsContact O-CA 3.3Å; D1655-G1659 WeakPolarHBondContact O-CA 3.34Å; D1655-G1659 PolarHBondContact O-N 3.41Å
1660	K	81.8	Confident	72.2	Confident	127 Å²	127	72.1 Å²	72.1	55%	0.552	38%	0.378	S	S	*	.			trans	-98.1	134.6	-172.7	-71.8	-177.4	-179.8	-179.6	0	112	W1654 D1655 M1658 V1662	W1654-K1660 CarbonylContact C-O 3.55Å; W1654-K1660 WeakPolarHBondContact CA-O 3.35Å; W1654-K1660 VanDerWaalsContact CB-O 3.26Å; W1654-K1660 WeakPolarHBondContact CB-O 3.47Å; D1655-K1660 PolarHBondContact N-O 3.18Å; M1658-K1660 HydrophobicContact CB-CB 4.25Å; M1658-K1660 HydrophobicContact CB-CD 4.28Å; M1658-K1660 HydrophobicContact CB-CG 4.09Å; M1658-K1660 HydrophobicContact CE-CD 4.35Å; M1658-K1660 PolarHBondContact O-N 3.46Å; M1658-K1660 HydrophobicContact SD-CD 4.42Å; K1660-V1662 PolarHBondContact O-N 3.47Å
1661	T	84.5	Confident	70.6	Confident	80 Å²	80	76.3 Å²	76.3	49%	0.491	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	126.6	165.8	47.2	0	0	0	0	110.8	Y1625 A1627 I1652	Y1625-T1661 WeakPolarHBondContact OH-CG2 3.37Å; A1627-T1661 HydrophobicContact CB-CG2 4.29Å; I1652-T1661 HydrophobicContact CG2-CG2 4.19Å
1662	V	81.9	Confident	69.1	Low	92 Å²	92	78.8 Å²	78.8	56%	0.558	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	-38	172.5	177.2	0	0	0	0	110.9	L1643 F1653 K1660	L1643-V1662 HydrophobicContact CD1-CB 4.36Å; L1643-V1662 HydrophobicContact CD1-CG1 4.22Å; L1643-V1662 HydrophobicContact CD2-CB 4.45Å; L1643-V1662 HydrophobicContact CD2-CG2 3.77Å; F1653-V1662 PolarHBondContact O-N 3.43Å; K1660-V1662 PolarHBondContact O-N 3.47Å
1663	K	77.5	Confident	67.8	Low	59 Å²	59	80.4 Å²	80.4	26%	0.257	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	132.5	-177.7	-163.6	-178.9	-169.2	-179	0	110.2	F1653 P1703 A1705	F1653-K1663 HydrophobicContact CB-CB 4.12Å; F1653-K1663 HydrophobicContact CD2-CB 4.02Å; F1653-K1663 HydrophobicContact CD2-CD 4.1Å; F1653-K1663 HydrophobicContact CD2-CG 4.42Å; F1653-K1663 HydrophobicContact CE2-CD 4.38Å; F1653-K1663 HydrophobicContact CG-CB 4.49Å; F1653-K1663 PolarHBondContact N-O 3.18Å; F1653-K1663 PolarHBondContact O-N 2.87Å; F1653-K1663 VanDerWaalsContact O-N 3.16Å; K1663-P1703 PolarHBondContact NZ-O 2.92Å; K1663-A1705 PolarHBondContact NZ-O 3.47Å
1664	S	71.1	Confident	66.5	Low	54 Å²	54	85.6 Å²	85.6	38%	0.378	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	137	174	78.7	0	0	0	0	111.5	N1666	S1664-N1666 PolarHBondContact O-N 2.94Å
1665	N	61.5	Low	65.7	Low	65 Å²	65	88.4 Å²	88.4	35%	0.348	47%	0.471	S	S	.	.			trans	-76.6	22.1	-173.5	-84.2	13.5	0	0	0	115.3	Q1667 W1673	N1665-Q1667 VanDerWaalsContact C-N 3.29Å; N1665-Q1667 PolarHBondContact O-N 3.14Å; N1665-Q1667 VanDerWaalsContact O-N 3.13Å; N1665-W1673 VanDerWaalsContact ND2-CE3 3.32Å
1666	N	49.9	Very low	65.2	Low	72 Å²	72	86.8 Å²	86.8	39%	0.385	46%	0.463	S	S	.	.			trans	-84.3	24.1	-168	-78.2	-49.6	0	0	0	115.6	S1664	S1664-N1666 PolarHBondContact O-N 2.94Å
1667	Q	44	Very low	64.9	Low	175 Å²	175	88.4 Å²	88.4	82%	0.818	47%	0.472	S	S	*	.	S	Bend	trans	-130.3	80.7	-178.9	-68.2	-169.5	-6.4	0	0	114.2	N1665 E1669	N1665-Q1667 VanDerWaalsContact C-N 3.29Å; N1665-Q1667 PolarHBondContact O-N 3.14Å; N1665-Q1667 VanDerWaalsContact O-N 3.13Å; Q1667-E1669 PolarHBondContact O-N 2.71Å
1668	S	39.2	Very low	64.8	Low	123 Å²	123	80.7 Å²	80.7	86%	0.86	45%	0.445	S	S	*	.	S	Bend	trans	60.5	-19.5	137.1	52.6	0	0	0	0	124.3
1669	E	38.9	Very low	65.1	Low	166 Å²	166	75.7 Å²	75.7	78%	0.776	42%	0.42	S	S	*	.	S	Bend	trans	-123.4	-2.3	-174.4	-74.9	-161.7	158.9	0	0	118.1	Q1667	Q1667-E1669 PolarHBondContact O-N 2.71Å
1670	N	39.7	Very low	65.3	Low	109 Å²	109	75.7 Å²	75.7	58%	0.583	41%	0.414	S	S	*	.			trans	-131.7	121.4	173.2	-84.9	-76	0	0	0	113	S1672 S1708	N1670-S1672 PolarHBondContact O-N 2.77Å; N1670-S1708 PolarHBondContact ND2-OG 3.07Å
1671	S	49	Very low	65.2	Low	109 Å²	109	70.8 Å²	70.8	76%	0.762	40%	0.395	S	S	*	.			trans	-91	11.2	-170	62.7	0	0	0	0	115
1672	S	53.9	Low	64.6	Low	56 Å²	56	67 Å²	67	39%	0.392	37%	0.372	S	S	.	.	S	Bend	trans	-72.4	-36.6	-163.7	62.5	0	0	0	0	115.2	N1670	N1670-S1672 PolarHBondContact O-N 2.77Å
1673	W	60.8	Low	63.7	Low	38 Å²	38	65.8 Å²	65.8	14%	0.144	37%	0.371	C	S	.	.	S	Bend	trans	-127.6	65.3	-169.8	-50.5	-28.3	0	0	0	111.7	N1665 L1676 H1699 I1701	N1665-W1673 VanDerWaalsContact ND2-CE3 3.32Å; W1673-L1676 HydrophobicContact CB-CD2 4.45Å; W1673-H1699 AromaticContact CD1-CD2 3.63Å; W1673-H1699 AromaticContact CD1-CE1 3.92Å; W1673-H1699 AromaticContact CD1-CG 3.61Å; W1673-H1699 AromaticContact CD1-ND1 3.79Å; W1673-H1699 AromaticContact CD1-NE2 3.82Å; W1673-H1699 AromaticContact NE1-CG 3.72Å; W1673-H1699 AromaticContact NE1-ND1 3.8Å; W1673-I1701 HydrophobicContact CD2-CD1 3.82Å; W1673-I1701 HydrophobicContact CD2-CG1 4.46Å; W1673-I1701 HydrophobicContact CE3-CD1 3.6Å; W1673-I1701 HydrophobicContact CE3-CG1 4.34Å; W1673-I1701 HydrophobicContact CH2-CB 4.3Å; W1673-I1701 HydrophobicContact CH2-CD1 3.93Å; W1673-I1701 HydrophobicContact CH2-CG1 3.74Å; W1673-I1701 HydrophobicContact CH2-CG2 3.74Å; W1673-I1701 HydrophobicContact CZ2-CD1 4.09Å; W1673-I1701 HydrophobicContact CZ2-CG1 3.82Å; W1673-I1701 HydrophobicContact CZ3-CD1 3.67Å; W1673-I1701 HydrophobicContact CZ3-CG1 4Å; W1673-I1701 HydrophobicContact CZ3-CG2 3.79Å
1674	Q	62.5	Low	62.7	Low	116 Å²	116	65.9 Å²	65.9	54%	0.542	38%	0.377	S	S	.	.			trans	-117.8	152.4	172	-64.6	-170.8	8.4	0	0	110.6
1675	N	72.4	Confident	61.7	Low	63 Å²	63	67.2 Å²	67.2	34%	0.337	38%	0.384	S	S	.	.	S	Bend	trans	59.1	47.1	-175.2	-57.2	-25.3	0	0	0	113	G1649 Q1694	G1649-N1675 PolarHBondContact O-N 2.82Å; N1675-Q1694 HydrophobicContact CB-CG 4.05Å; N1675-Q1694 PolarHBondContact ND2-NE2 3.18Å; N1675-Q1694 PolarHBondContact O-N 3.24Å
1676	L	79.2	Confident	61.6	Low	3 Å²	3	71.6 Å²	71.6	2%	0.016	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	132.6	171.8	-59.9	176.3	0	0	0	110.9	I1633 V1647 G1649 L1651 W1673 C1691 S1692	I1633-L1676 WeakPolarHBondContact CD1-O 3.45Å; V1647-L1676 HydrophobicContact CG1-CB 3.99Å; V1647-L1676 HydrophobicContact CG2-CD1 4.37Å; G1649-L1676 PolarHBondContact O-N 3.13Å; L1651-L1676 HydrophobicContact CB-CD1 4.04Å; W1673-L1676 HydrophobicContact CB-CD2 4.45Å; L1676-C1691 HydrophobicContact CD1-CB 4.12Å; L1676-C1691 HydrophobicContact CD2-CB 4.19Å; L1676-S1692 CarbonylContact C-O 3.56Å; L1676-S1692 WeakPolarHBondContact CA-O 3.16Å
1677	T	76.1	Confident	62.2	Low	38 Å²	38	68.3 Å²	68.3	23%	0.233	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-36.4	-174.8	59.4	0	0	0	0	113.8	S1692 Q1694 L1810	T1677-S1692 PolarHBondContact N-O 3.05Å; T1677-S1692 PolarHBondContact OG1-OG 2.88Å; T1677-Q1694 HydrophobicContact CG2-CB 4.09Å; T1677-L1810 WeakPolarHBondContact CB-O 3.37Å; T1677-L1810 PolarHBondContact OG1-O 2.82Å
1678	A	79	Confident	63.7	Low	7 Å²	7	60.1 Å²	60.1	6%	0.058	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	159.4	178.4	0	0	0	0	0	111.1	C1691 S1692 L1813	A1678-C1691 VanDerWaalsContact O-CA 3.24Å; A1678-C1691 WeakPolarHBondContact O-CA 3.3Å; A1678-C1691 WeakPolarHBondContact O-CB 3.29Å; A1678-S1692 WeakPolarHBondContact CB-OG 3.07Å; A1678-S1692 PolarHBondContact N-OG 2.99Å; A1678-S1692 PolarHBondContact O-N 2.98Å; A1678-S1692 VanDerWaalsContact O-N 3.12Å; A1678-L1813 HydrophobicContact CB-CB 4.37Å; A1678-L1813 HydrophobicContact CB-CD1 4.02Å; A1678-L1813 HydrophobicContact CB-CG 3.99Å
1679	M	86.2	Confident	65.6	Low	10 Å²	10	54.3 Å²	54.3	5%	0.049	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	135.1	177.7	-179.3	-172	70.5	0	0	111.3	A1634 A1645 V1647 L1651 V1689 I1690 C1691	A1634-M1679 HydrophobicContact CB-CE 4.32Å; A1645-M1679 HydrophobicContact CB-CE 4.42Å; A1645-M1679 HydrophobicContact CB-SD 4.17Å; A1645-M1679 WeakPolarHBondContact O-CE 3.37Å; V1647-M1679 HydrophobicContact CB-SD 4.31Å; V1647-M1679 HydrophobicContact CG2-CB 4.09Å; V1647-M1679 HydrophobicContact CG2-CE 4.38Å; V1647-M1679 HydrophobicContact CG2-CG 4.24Å; V1647-M1679 HydrophobicContact CG2-SD 3.45Å; V1647-M1679 WeakPolarHBondContact CG2-SD 3.04Å; L1651-M1679 HydrophobicContact CD1-SD 3.7Å; M1679-V1689 HydrophobicContact CG-CG1 3.68Å; M1679-V1689 HydrophobicContact SD-CG1 3.81Å; M1679-I1690 CarbonylContact C-O 3.54Å; M1679-I1690 VanDerWaalsContact CA-O 3.31Å; M1679-I1690 WeakPolarHBondContact CA-O 3.3Å; M1679-C1691 HydrophobicContact CB-CB 4.4Å
1680	N	82.6	Confident	67.7	Low	28 Å²	28	46.4 Å²	46.4	15%	0.15	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	179	167.1	-147.8	-43.2	0	0	0	109.9	I1690 L1813	N1680-I1690 PolarHBondContact N-O 2.82Å; N1680-I1690 PolarHBondContact O-N 3.22Å; N1680-I1690 VanDerWaalsContact O-O 3.12Å; N1680-L1813 HydrophobicContact CB-CB 4.37Å; N1680-L1813 PolarHBondContact ND2-O 2.89Å
1681	C	79.3	Confident	69.8	Low	23 Å²	23	41.2 Å²	41.2	16%	0.155	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	124	-176.5	-64.3	0	0	0	0	110.5	H1636 L1638 A1688	H1636-C1681 HydrophobicContact CB-CB 4.5Å; H1636-C1681 VanDerWaalsContact CB-SG 3.58Å; L1638-C1681 HydrophobicContact CD2-CB 3.8Å; C1681-A1688 WeakPolarHBondContact CA-O 3.3Å
1682	S	71.1	Confident	71.2	Confident	1 Å²	1	36 Å²	36	1%	0.007	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	138.1	174.8	-172.2	0	0	0	0	110.9	V1684 G1687 A1688 G1819	S1682-V1684 VanDerWaalsContact C-N 3.26Å; S1682-V1684 WeakPolarHBondContact CB-O 3.27Å; S1682-V1684 PolarHBondContact O-N 3.21Å; S1682-V1684 PolarHBondContact OG-N 2.8Å; S1682-V1684 PolarHBondContact OG-O 3.32Å; S1682-G1687 CarbonylContact O-C 3.49Å; S1682-G1687 WeakPolarHBondContact O-CA 3.45Å; S1682-G1687 PolarHBondContact O-N 3.36Å; S1682-A1688 PolarHBondContact N-O 3.21Å; S1682-A1688 PolarHBondContact O-N 2.9Å; S1682-G1819 VanDerWaalsContact OG-CA 3.22Å; S1682-G1819 WeakPolarHBondContact OG-CA 3.45Å; S1682-G1819 PolarHBondContact OG-O 2.83Å
1683	A	64.7	Low	72.2	Confident	66 Å²	66	34.2 Å²	34.2	55%	0.545	19%	0.187	S	C	.	.	S	Bend	trans	-61.9	-36.3	169.4	0	0	0	0	0	111.8	Y1686 G1687	A1683-Y1686 PolarHBondContact O-N 3.36Å; A1683-G1687 PolarHBondContact O-N 2.83Å
1684	V	56.3	Low	72.7	Confident	62 Å²	62	37.4 Å²	37.4	38%	0.376	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.5	136.5	-171.7	-174.5	0	0	0	0	110.8	S1682 Y1820	S1682-V1684 VanDerWaalsContact C-N 3.26Å; S1682-V1684 WeakPolarHBondContact CB-O 3.27Å; S1682-V1684 PolarHBondContact O-N 3.21Å; S1682-V1684 PolarHBondContact OG-N 2.8Å; S1682-V1684 PolarHBondContact OG-O 3.32Å; V1684-Y1820 HydrophobicContact CG1-CE1 4.31Å
1685	P	49.8	Very low	72.7	Confident	81 Å²	81	35.1 Å²	35.1	53%	0.526	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	cis	-81.2	123.6	-11.5	32.4	-31.5	0	0	0	111.2
1686	Y	58.7	Low	72.4	Confident	157 Å²	157	32.5 Å²	32.5	62%	0.616	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	58.1	169.1	-50.5	-75.5	0	0	0	115.9	Y1641 A1683 A1688	Y1641-Y1686 WeakPolarHBondContact CE2-O 3.29Å; Y1641-Y1686 VanDerWaalsContact CZ-O 3.31Å; Y1641-Y1686 PolarHBondContact OH-O 2.94Å; A1683-Y1686 PolarHBondContact O-N 3.36Å; Y1686-A1688 PolarHBondContact O-N 2.94Å
1687	G	63.9	Low	71.9	Confident	4 Å²	4	35.5 Å²	35.5	4%	0.041	20%	0.201	C	C	.	.	S	Bend	trans	64.9	36.1	165.3	0	0	0	0	0	115	L1638 S1682 A1683	L1638-G1687 WeakPolarHBondContact CD2-O 3.27Å; S1682-G1687 CarbonylContact O-C 3.49Å; S1682-G1687 WeakPolarHBondContact O-CA 3.45Å; S1682-G1687 PolarHBondContact O-N 3.36Å; A1683-G1687 PolarHBondContact O-N 2.83Å
1688	A	74.5	Confident	72	Confident	3 Å²	3	33.9 Å²	33.9	3%	0.025	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	133.6	179	0	0	0	0	0	111.4	C1681 S1682 Y1686 L1700	C1681-A1688 WeakPolarHBondContact CA-O 3.3Å; S1682-A1688 PolarHBondContact N-O 3.21Å; S1682-A1688 PolarHBondContact O-N 2.9Å; Y1686-A1688 PolarHBondContact O-N 2.94Å; A1688-L1700 HydrophobicContact CB-CD2 4.03Å; A1688-L1700 HydrophobicContact CB-CG 4.22Å
1689	V	79.8	Confident	71.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	134.7	174.9	-179.7	0	0	0	0	109.1	L1638 A1645 L1651 F1653 M1679 I1701	L1638-V1689 HydrophobicContact CD1-CG2 3.81Å; L1638-V1689 HydrophobicContact CD2-CG2 4.42Å; A1645-V1689 HydrophobicContact CB-CG2 4.01Å; L1651-V1689 HydrophobicContact CD1-CG1 4.23Å; L1651-V1689 HydrophobicContact CD2-CG1 4.16Å; F1653-V1689 HydrophobicContact CE1-CG2 3.66Å; F1653-V1689 HydrophobicContact CZ-CB 4.49Å; F1653-V1689 HydrophobicContact CZ-CG2 3.84Å; M1679-V1689 HydrophobicContact CG-CG1 3.68Å; M1679-V1689 HydrophobicContact SD-CG1 3.81Å; V1689-I1701 HydrophobicContact CB-CB 4.37Å; V1689-I1701 PolarHBondContact N-O 3.37Å; V1689-I1701 WeakPolarHBondContact O-CB 3.42Å; V1689-I1701 PolarHBondContact O-N 2.87Å
1690	I	82	Confident	71.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	124.7	176.3	-56.5	-176.3	0	0	0	107.9	M1679 N1680 V1698 H1699 L1700 L1813 T1815 L1822 L1836	M1679-I1690 CarbonylContact C-O 3.54Å; M1679-I1690 VanDerWaalsContact CA-O 3.31Å; M1679-I1690 WeakPolarHBondContact CA-O 3.3Å; N1680-I1690 PolarHBondContact N-O 2.82Å; N1680-I1690 PolarHBondContact O-N 3.22Å; N1680-I1690 VanDerWaalsContact O-O 3.12Å; I1690-V1698 HydrophobicContact CG2-CG1 3.32Å; I1690-H1699 WeakPolarHBondContact CA-O 3.2Å; I1690-L1700 HydrophobicContact CD1-CD1 4.18Å; I1690-L1700 HydrophobicContact CG1-CD1 4.23Å; I1690-L1700 HydrophobicContact CG1-CG 4.37Å; I1690-L1813 HydrophobicContact CG2-CD1 4.38Å; I1690-T1815 HydrophobicContact CD1-CG2 3.7Å; I1690-L1822 HydrophobicContact CD1-CD1 4.11Å; I1690-L1822 HydrophobicContact CG2-CD1 3.98Å; I1690-L1822 HydrophobicContact CG2-CD2 4.07Å; I1690-L1836 HydrophobicContact CD1-CD1 3.89Å; I1690-L1836 HydrophobicContact CD1-CD2 4.24Å
1691	C	83.3	Confident	71	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	144.3	178.8	62.2	0	0	0	0	112.5	L1676 A1678 M1679 H1699 I1701	L1676-C1691 HydrophobicContact CD1-CB 4.12Å; L1676-C1691 HydrophobicContact CD2-CB 4.19Å; A1678-C1691 VanDerWaalsContact O-CA 3.24Å; A1678-C1691 WeakPolarHBondContact O-CA 3.3Å; A1678-C1691 WeakPolarHBondContact O-CB 3.29Å; M1679-C1691 HydrophobicContact CB-CB 4.4Å; C1691-H1699 PolarHBondContact N-O 3.21Å; C1691-H1699 PolarHBondContact O-N 2.96Å; C1691-I1701 WeakPolarHBondContact SG-CD1 3.4Å
1692	S	78.8	Confident	70.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	148.9	176.6	54.3	0	0	0	0	111.7	L1676 T1677 A1678 F1697	L1676-S1692 CarbonylContact C-O 3.56Å; L1676-S1692 WeakPolarHBondContact CA-O 3.16Å; T1677-S1692 PolarHBondContact N-O 3.05Å; T1677-S1692 PolarHBondContact OG1-OG 2.88Å; A1678-S1692 WeakPolarHBondContact CB-OG 3.07Å; A1678-S1692 PolarHBondContact N-OG 2.99Å; A1678-S1692 PolarHBondContact O-N 2.98Å; A1678-S1692 VanDerWaalsContact O-N 3.12Å; S1692-F1697 CarbonylContact C-O 3.52Å; S1692-F1697 VanDerWaalsContact CA-O 3.26Å; S1692-F1697 WeakPolarHBondContact CA-O 3.37Å
1693	D	76.2	Confident	71	Confident	19 Å²	19	36.8 Å²	36.8	10%	0.102	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	170.4	165.4	92	-29.8	0	0	0	112.1	S1695 G1696 F1697	D1693-S1695 VanDerWaalsContact CG-N 3.26Å; D1693-S1695 PolarHBondContact O-N 2.97Å; D1693-S1695 VanDerWaalsContact O-N 3.13Å; D1693-S1695 VanDerWaalsContact OD1-CA 3.31Å; D1693-S1695 WeakPolarHBondContact OD1-CA 3.32Å; D1693-S1695 WeakPolarHBondContact OD1-CB 3.35Å; D1693-S1695 PolarHBondContact OD1-N 3.25Å; D1693-S1695 WeakPolarHBondContact OD2-CB 3.35Å; D1693-S1695 PolarHBondContact OD2-N 3.34Å; D1693-S1695 PolarHBondContact OD2-OG 3.21Å; D1693-G1696 PolarHBondContact O-N 3.39Å; D1693-G1696 PolarHBondContact OD1-N 3.07Å; D1693-F1697 PolarHBondContact N-O 3.2Å; D1693-F1697 WeakPolarHBondContact OD1-CB 3.37Å; D1693-F1697 PolarHBondContact OD1-N 2.8Å
1694	Q	70.8	Confident	71.2	Confident	105 Å²	105	39.8 Å²	39.8	49%	0.491	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-5.5	174.2	64.9	177.9	11.9	0	0	115	N1675 T1677 L1809	N1675-Q1694 HydrophobicContact CB-CG 4.05Å; N1675-Q1694 PolarHBondContact ND2-NE2 3.18Å; N1675-Q1694 PolarHBondContact O-N 3.24Å; T1677-Q1694 HydrophobicContact CG2-CB 4.09Å; Q1694-L1809 HydrophobicContact CB-CD2 4.35Å; Q1694-L1809 VanDerWaalsContact O-CD2 3.25Å; Q1694-L1809 WeakPolarHBondContact O-CD2 3.25Å
1695	S	63	Low	71.7	Confident	67 Å²	67	38.9 Å²	38.9	47%	0.469	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-1.9	-175.9	-30.4	0	0	0	0	113.2	D1693	D1693-S1695 VanDerWaalsContact CG-N 3.26Å; D1693-S1695 PolarHBondContact O-N 2.97Å; D1693-S1695 VanDerWaalsContact O-N 3.13Å; D1693-S1695 VanDerWaalsContact OD1-CA 3.31Å; D1693-S1695 WeakPolarHBondContact OD1-CA 3.32Å; D1693-S1695 WeakPolarHBondContact OD1-CB 3.35Å; D1693-S1695 PolarHBondContact OD1-N 3.25Å; D1693-S1695 WeakPolarHBondContact OD2-CB 3.35Å; D1693-S1695 PolarHBondContact OD2-N 3.34Å; D1693-S1695 PolarHBondContact OD2-OG 3.21Å
1696	G	65.2	Low	71.6	Confident	8 Å²	8	41.4 Å²	41.4	8%	0.082	21%	0.214	C	C	.	.	S	Bend	trans	83.7	18.1	-176.4	0	0	0	0	0	114.4	D1693 F1716	D1693-G1696 PolarHBondContact O-N 3.39Å; D1693-G1696 PolarHBondContact OD1-N 3.07Å; G1696-F1716 PolarHBondContact O-N 2.96Å
1697	F	69.3	Low	70.8	Confident	66 Å²	66	39.5 Å²	39.5	29%	0.289	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	136.6	161.3	-66.1	-84.8	0	0	0	109.7	S1692 D1693 L1714 R1715	S1692-F1697 CarbonylContact C-O 3.52Å; S1692-F1697 VanDerWaalsContact CA-O 3.26Å; S1692-F1697 WeakPolarHBondContact CA-O 3.37Å; D1693-F1697 PolarHBondContact N-O 3.2Å; D1693-F1697 WeakPolarHBondContact OD1-CB 3.37Å; D1693-F1697 PolarHBondContact OD1-N 2.8Å; F1697-L1714 CarbonylContact C-O 3.47Å; F1697-L1714 WeakPolarHBondContact CA-O 3.47Å; F1697-R1715 HydrophobicContact CD1-CB 3.75Å; F1697-R1715 HydrophobicContact CD1-CG 3.92Å; F1697-R1715 HydrophobicContact CE1-CB 3.66Å; F1697-R1715 HydrophobicContact CE1-CG 3.66Å; F1697-R1715 HydrophobicContact CG-CG 4.46Å; F1697-R1715 HydrophobicContact CZ-CB 4.46Å; F1697-R1715 HydrophobicContact CZ-CG 3.98Å
1698	V	76.8	Confident	69.8	Low	5 Å²	5	42.6 Å²	42.6	3%	0.03	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	139.7	159.2	176.9	0	0	0	0	108.3	I1690 S1713 L1714 F1716 L1810 L1813 L1822	I1690-V1698 HydrophobicContact CG2-CG1 3.32Å; V1698-S1713 CarbonylContact O-C 3.18Å; V1698-S1713 WeakPolarHBondContact O-CA 3.04Å; V1698-S1713 PolarHBondContact O-OG 3.08Å; V1698-L1714 PolarHBondContact N-O 3.34Å; V1698-L1714 PolarHBondContact O-N 3.03Å; V1698-F1716 HydrophobicContact CB-CE2 3.95Å; V1698-F1716 HydrophobicContact CG2-CD2 4.12Å; V1698-F1716 HydrophobicContact CG2-CE2 3.56Å; V1698-F1716 HydrophobicContact CG2-CZ 4.48Å; V1698-L1810 HydrophobicContact CG2-CD1 3.85Å; V1698-L1813 HydrophobicContact CG2-CD2 4Å; V1698-L1822 HydrophobicContact CG1-CD2 3.99Å
1699	H	74.7	Confident	68	Low	14 Å²	14	45.5 Å²	45.5	7%	0.065	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.6	172.4	-48.7	-69.9	0	0	0	109.1	W1673 I1690 C1691 I1701 S1713	W1673-H1699 AromaticContact CD1-CD2 3.63Å; W1673-H1699 AromaticContact CD1-CE1 3.92Å; W1673-H1699 AromaticContact CD1-CG 3.61Å; W1673-H1699 AromaticContact CD1-ND1 3.79Å; W1673-H1699 AromaticContact CD1-NE2 3.82Å; W1673-H1699 AromaticContact NE1-CG 3.72Å; W1673-H1699 AromaticContact NE1-ND1 3.8Å; I1690-H1699 WeakPolarHBondContact CA-O 3.2Å; C1691-H1699 PolarHBondContact N-O 3.21Å; C1691-H1699 PolarHBondContact O-N 2.96Å; H1699-I1701 HydrophobicContact CB-CD1 4.35Å; H1699-I1701 HydrophobicContact CB-CG1 4.25Å; H1699-S1713 PolarHBondContact CE1-OG 3.3Å; H1699-S1713 PolarHBondContact ND1-OG 3.15Å
1700	L	77.5	Confident	66.3	Low	55 Å²	55	54.7 Å²	54.7	29%	0.288	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	132.2	166.1	-170.6	142.8	0	0	0	109	A1688 I1690 T1711 G1712 L1836	A1688-L1700 HydrophobicContact CB-CD2 4.03Å; A1688-L1700 HydrophobicContact CB-CG 4.22Å; I1690-L1700 HydrophobicContact CD1-CD1 4.18Å; I1690-L1700 HydrophobicContact CG1-CD1 4.23Å; I1690-L1700 HydrophobicContact CG1-CG 4.37Å; L1700-T1711 WeakPolarHBondContact O-CB 3.41Å; L1700-T1711 PolarHBondContact O-OG1 3Å; L1700-G1712 PolarHBondContact N-O 3.02Å; L1700-L1836 HydrophobicContact CD1-CD2 4.22Å
1701	I	76.3	Confident	64.7	Low	1 Å²	1	57 Å²	57	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	111.8	-166.4	-58.9	174.5	0	0	0	109.8	L1651 W1673 V1689 C1691 H1699	L1651-I1701 HydrophobicContact CD2-CD1 3.66Å; L1651-I1701 HydrophobicContact CD2-CG2 4.25Å; W1673-I1701 HydrophobicContact CD2-CD1 3.82Å; W1673-I1701 HydrophobicContact CD2-CG1 4.46Å; W1673-I1701 HydrophobicContact CE3-CD1 3.6Å; W1673-I1701 HydrophobicContact CE3-CG1 4.34Å; W1673-I1701 HydrophobicContact CH2-CB 4.3Å; W1673-I1701 HydrophobicContact CH2-CD1 3.93Å; W1673-I1701 HydrophobicContact CH2-CG1 3.74Å; W1673-I1701 HydrophobicContact CH2-CG2 3.74Å; W1673-I1701 HydrophobicContact CZ2-CD1 4.09Å; W1673-I1701 HydrophobicContact CZ2-CG1 3.82Å; W1673-I1701 HydrophobicContact CZ3-CD1 3.67Å; W1673-I1701 HydrophobicContact CZ3-CG1 4Å; W1673-I1701 HydrophobicContact CZ3-CG2 3.79Å; V1689-I1701 HydrophobicContact CB-CB 4.37Å; V1689-I1701 PolarHBondContact N-O 3.37Å; V1689-I1701 WeakPolarHBondContact O-CB 3.42Å; V1689-I1701 PolarHBondContact O-N 2.87Å; C1691-I1701 WeakPolarHBondContact SG-CD1 3.4Å; H1699-I1701 HydrophobicContact CB-CD1 4.35Å; H1699-I1701 HydrophobicContact CB-CG1 4.25Å
1702	D	75.3	Confident	63.3	Low	45 Å²	45	59.6 Å²	59.6	24%	0.241	35%	0.349	C	S	.	.			trans	-76.8	121.6	164.3	-172	-33.4	0	0	0	109.1	R1704 A1705	D1702-R1704 PolarHBondContact O-N 3.31Å; D1702-R1704 WeakPolarHBondContact OD1-CA 3.39Å; D1702-R1704 WeakPolarHBondContact OD1-CB 3.19Å; D1702-R1704 VanDerWaalsContact OD1-CG 3.3Å; D1702-R1704 WeakPolarHBondContact OD1-CG 3.19Å; D1702-R1704 IonicContact OD1-CZ 3.96Å; D1702-R1704 PolarHBondContact OD1-N 3.48Å; D1702-R1704 IonicContact OD1-NE 2.77Å; D1702-R1704 PolarHBondContact OD1-NE 3.43Å; D1702-R1704 IonicContact OD1-NH2 3.6Å; D1702-R1704 IonicContact OD2-CZ 3.47Å; D1702-R1704 VanDerWaalsContact OD2-CZ 3.28Å; D1702-R1704 IonicContact OD2-NE 3.91Å; D1702-R1704 PolarHBondContact OD2-NE 2.86Å; D1702-R1704 IonicContact OD2-NH2 2.85Å; D1702-R1704 PolarHBondContact OD2-NH2 2.87Å; D1702-A1705 HydrophobicContact CB-CB 4.4Å; D1702-A1705 PolarHBondContact O-N 3.19Å
1703	P	73.6	Confident	62.3	Low	14 Å²	14	62.1 Å²	62.1	9%	0.091	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-27.6	177.6	23	-32.3	0	0	0	113.4	Y1641 F1653 K1663	Y1641-P1703 HydrophobicContact CD1-CG 4.5Å; Y1641-P1703 HydrophobicContact CD2-CG 3.46Å; Y1641-P1703 VanDerWaalsContact CD2-CG 3.46Å; Y1641-P1703 HydrophobicContact CE1-CG 4.34Å; Y1641-P1703 HydrophobicContact CE2-CG 3.24Å; Y1641-P1703 HydrophobicContact CG-CG 4.11Å; F1653-P1703 HydrophobicContact CD1-CB 4.18Å; F1653-P1703 HydrophobicContact CE1-CB 3.67Å; F1653-P1703 HydrophobicContact CZ-CB 3.91Å; K1663-P1703 PolarHBondContact NZ-O 2.92Å
1704	R	70	Confident	61.4	Low	130 Å²	130	63.8 Å²	63.8	49%	0.491	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.5	179.5	-55.5	172.9	-72.3	-164.7	1.8	113.4	Y1641 D1702 V1706	Y1641-R1704 HydrophobicContact CD1-CG 4.46Å; Y1641-R1704 HydrophobicContact CE1-CG 3.65Å; Y1641-R1704 PolarHBondContact OH-NE 3.33Å; D1702-R1704 PolarHBondContact O-N 3.31Å; D1702-R1704 WeakPolarHBondContact OD1-CA 3.39Å; D1702-R1704 WeakPolarHBondContact OD1-CB 3.19Å; D1702-R1704 VanDerWaalsContact OD1-CG 3.3Å; D1702-R1704 WeakPolarHBondContact OD1-CG 3.19Å; D1702-R1704 IonicContact OD1-CZ 3.96Å; D1702-R1704 PolarHBondContact OD1-N 3.48Å; D1702-R1704 IonicContact OD1-NE 2.77Å; D1702-R1704 PolarHBondContact OD1-NE 3.43Å; D1702-R1704 IonicContact OD1-NH2 3.6Å; D1702-R1704 IonicContact OD2-CZ 3.47Å; D1702-R1704 VanDerWaalsContact OD2-CZ 3.28Å; D1702-R1704 IonicContact OD2-NE 3.91Å; D1702-R1704 PolarHBondContact OD2-NE 2.86Å; D1702-R1704 IonicContact OD2-NH2 2.85Å; D1702-R1704 PolarHBondContact OD2-NH2 2.87Å; R1704-V1706 WeakPolarHBondContact O-CG2 3.33Å; R1704-V1706 PolarHBondContact O-N 2.81Å; R1704-V1706 VanDerWaalsContact O-N 3.11Å
1705	A	65.7	Low	60.8	Low	42 Å²	42	65.9 Å²	65.9	35%	0.347	38%	0.379	S	S	.	.			trans	-64.2	113.3	-174.6	0	0	0	0	0	111.3	K1663 D1702	K1663-A1705 PolarHBondContact NZ-O 3.47Å; D1702-A1705 HydrophobicContact CB-CB 4.4Å; D1702-A1705 PolarHBondContact O-N 3.19Å
1706	V	48	Very low	60.1	Low	135 Å²	135	63.7 Å²	63.7	82%	0.818	36%	0.361	S	S	*	.			trans	-79.4	-26.4	-167.8	-175.7	0	0	0	0	113.2	R1704	R1704-V1706 WeakPolarHBondContact O-CG2 3.33Å; R1704-V1706 PolarHBondContact O-N 2.81Å; R1704-V1706 VanDerWaalsContact O-N 3.11Å
1707	C	42.4	Very low	58.9	Low	116 Å²	116	69 Å²	69	78%	0.784	38%	0.383	S	S	*	.	S	Bend	trans	-131.7	150.8	-176.8	-62.4	0	0	0	0	112.7	G1709	C1707-G1709 PolarHBondContact O-N 2.82Å
1708	S	41.9	Very low	57.5	Low	69 Å²	69	67 Å²	67	48%	0.483	38%	0.378	S	S	.	.			trans	-81	107.7	-177.8	50.4	0	0	0	0	112.2	N1670	N1670-S1708 PolarHBondContact ND2-OG 3.07Å
1709	G	38.2	Very low	55.5	Low	64 Å²	64	69.8 Å²	69.8	66%	0.66	41%	0.408	S	S	*	.	S	Bend	trans	-162.7	104.3	172.5	0	0	0	0	0	112	C1707 T1711	C1707-G1709 PolarHBondContact O-N 2.82Å; G1709-T1711 PolarHBondContact O-N 2.78Å
1710	R	43	Very low	53.3	Low	194 Å²	194	74.3 Å²	74.3	73%	0.732	45%	0.447	S	S	*	.			trans	42.6	62.1	173	-64	-177.4	175.5	-175.5	-3.8	115.6	T1767	R1710-T1767 PolarHBondContact NH1-O 3.36Å; R1710-T1767 PolarHBondContact NH1-OG1 3Å
1711	T	48.6	Very low	50.9	Low	47 Å²	47	79 Å²	79	29%	0.288	47%	0.472	S	S	.	.			trans	-70.5	147	150.2	67.1	0	0	0	0	108.8	L1700 G1709 S1713	L1700-T1711 WeakPolarHBondContact O-CB 3.41Å; L1700-T1711 PolarHBondContact O-OG1 3Å; G1709-T1711 PolarHBondContact O-N 2.78Å; T1711-S1713 PolarHBondContact O-N 2.92Å; T1711-S1713 VanDerWaalsContact O-N 3.16Å
1712	G	53.8	Low	48.7	Very low	56 Å²	56	85.4 Å²	85.4	58%	0.577	51%	0.506	S	S	*	.			trans	-58	119.3	-175.5	0	0	0	0	0	111.5	L1700	L1700-G1712 PolarHBondContact N-O 3.02Å
1713	S	57.1	Low	46.2	Very low	53 Å²	53	87.4 Å²	87.4	37%	0.371	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.8	175	-168.6	0	0	0	0	110.3	V1698 H1699 T1711	V1698-S1713 CarbonylContact O-C 3.18Å; V1698-S1713 WeakPolarHBondContact O-CA 3.04Å; V1698-S1713 PolarHBondContact O-OG 3.08Å; H1699-S1713 PolarHBondContact CE1-OG 3.3Å; H1699-S1713 PolarHBondContact ND1-OG 3.15Å; T1711-S1713 PolarHBondContact O-N 2.92Å; T1711-S1713 VanDerWaalsContact O-N 3.16Å
1714	L	58.3	Low	43.9	Very low	54 Å²	54	91.4 Å²	91.4	28%	0.283	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.4	126.7	-174	-66.1	163.1	0	0	0	108.5	F1697 V1698 F1716 L1834	F1697-L1714 CarbonylContact C-O 3.47Å; F1697-L1714 WeakPolarHBondContact CA-O 3.47Å; V1698-L1714 PolarHBondContact N-O 3.34Å; V1698-L1714 PolarHBondContact O-N 3.03Å; L1714-F1716 HydrophobicContact CB-CE2 3.92Å; L1714-F1716 HydrophobicContact CB-CZ 4.2Å; L1714-L1834 HydrophobicContact CD1-CD1 3.83Å; L1714-L1834 HydrophobicContact CD1-CD2 3.6Å; L1714-L1834 HydrophobicContact CD1-CG 4.38Å; L1714-L1834 HydrophobicContact CD2-CD1 4.4Å
1715	R	57.9	Low	41.7	Very low	149 Å²	149	93.6 Å²	93.6	56%	0.562	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.1	122.8	-178.6	-167.4	-173.1	-170.8	-161.4	2.7	110	F1697 H1717	F1697-R1715 HydrophobicContact CD1-CB 3.75Å; F1697-R1715 HydrophobicContact CD1-CG 3.92Å; F1697-R1715 HydrophobicContact CE1-CB 3.66Å; F1697-R1715 HydrophobicContact CE1-CG 3.66Å; F1697-R1715 HydrophobicContact CG-CG 4.46Å; F1697-R1715 HydrophobicContact CZ-CB 4.46Å; F1697-R1715 HydrophobicContact CZ-CG 3.98Å; R1715-H1717 PolarHBondContact NE-NE2 3.48Å; R1715-H1717 PolarHBondContact NH1-NE2 3.38Å
1716	F	47.5	Very low	39.7	Very low	21 Å²	21	98.8 Å²	98.8	9%	0.092	59%	0.592	C	S	.	*			trans	-99	135.2	-177.4	-63.2	-94.4	0	0	0	111.4	G1696 V1698 L1714 F1826 L1834 V1841	G1696-F1716 PolarHBondContact O-N 2.96Å; V1698-F1716 HydrophobicContact CB-CE2 3.95Å; V1698-F1716 HydrophobicContact CG2-CD2 4.12Å; V1698-F1716 HydrophobicContact CG2-CE2 3.56Å; V1698-F1716 HydrophobicContact CG2-CZ 4.48Å; L1714-F1716 HydrophobicContact CB-CE2 3.92Å; L1714-F1716 HydrophobicContact CB-CZ 4.2Å; F1716-F1826 HydrophobicContact CB-CZ 3.92Å; F1716-F1826 HydrophobicContact CG-CZ 4.46Å; F1716-L1834 HydrophobicContact CE1-CB 4.23Å; F1716-L1834 HydrophobicContact CE1-CD1 3.91Å; F1716-L1834 HydrophobicContact CZ-CB 4.38Å; F1716-L1834 HydrophobicContact CZ-CD1 3.85Å; F1716-V1841 HydrophobicContact CD1-CG2 4.16Å; F1716-V1841 HydrophobicContact CE1-CG2 4.03Å
1717	H	41.7	Very low	38.7	Very low	118 Å²	118	99.1 Å²	99.1	55%	0.546	59%	0.588	S	S	.	*			trans	-129.9	119.1	173.3	-73	-69.1	0	0	0	108.8	R1715	R1715-H1717 PolarHBondContact NE-NE2 3.48Å; R1715-H1717 PolarHBondContact NH1-NE2 3.38Å
1718	S	39.8	Very low	37.8	Very low	25 Å²	25	99.7 Å²	99.7	18%	0.175	58%	0.583	C	S	.	*			trans	-98.9	104.5	-176.9	61.9	0	0	0	0	112.1	A1807	S1718-A1807 WeakPolarHBondContact OG-CB 3.01Å
1719	G	34.1	Very low	37	Very low	64 Å²	64	105.9 Å²	105.9	66%	0.66	60%	0.601	S	S	*	*	S	Bend	trans	147.9	101.4	167.8	0	0	0	0	0	115.2	N1721	G1719-N1721 VanDerWaalsContact C-N 3.33Å; G1719-N1721 PolarHBondContact O-N 2.95Å
1720	A	29.1	Very low	36.4	Very low	108 Å²	108	111.1 Å²	111.1	89%	0.893	61%	0.609	S	S	*	*	S	Bend	trans	37.5	39.5	150	0	0	0	0	0	120
1721	N	25.8	Very low	35.5	Very low	154 Å²	154	113.1 Å²	113.1	82%	0.824	62%	0.616	S	S	*	*			trans	-163.3	92.7	156.3	-107.1	-31.5	0	0	0	111.6	G1719	G1719-N1721 VanDerWaalsContact C-N 3.33Å; G1719-N1721 PolarHBondContact O-N 2.95Å
1722	L	29.9	Very low	34.3	Very low	136 Å²	136	116 Å²	116	71%	0.712	64%	0.638	S	S	*	*			trans	-135.4	94.3	162.1	-79.3	178.4	0	0	0	108.7	S1724	L1722-S1724 PolarHBondContact O-N 3.3Å
1723	A	24.6	Very low	32.8	Very low	86 Å²	86	121.8 Å²	121.8	71%	0.711	65%	0.648	S	S	*	*			trans	-70.5	122.2	165.6	0	0	0	0	0	109.2	F1725	A1723-F1725 PolarHBondContact O-N 3.13Å
1724	S	23.6	Very low	31.2	Very low	99 Å²	99	127.6 Å²	127.6	69%	0.692	67%	0.667	S	S	*	*			trans	34.9	83.4	153.9	62.6	0	0	0	0	117.4	L1722 L1726	L1722-S1724 PolarHBondContact O-N 3.3Å; S1724-L1726 PolarHBondContact O-N 3.02Å
1725	F	25.6	Very low	29.4	Very low	176 Å²	176	133.1 Å²	133.1	77%	0.772	69%	0.691	S	S	*	*			trans	-78.6	74	152.5	-98.9	-81	0	0	0	109.4	A1723 L1727	A1723-F1725 PolarHBondContact O-N 3.13Å; F1725-L1727 PolarHBondContact O-N 3.2Å; F1725-L1727 VanDerWaalsContact O-N 3.12Å
1726	L	22.8	Very low	27.7	Very low	151 Å²	151	132 Å²	132	79%	0.791	70%	0.701	S	S	*	*			trans	-76.8	94	179.6	-146.8	171	0	0	0	108.5	S1724	S1724-L1726 PolarHBondContact O-N 3.02Å
1727	L	26.1	Very low	26.6	Very low	142 Å²	142	137.1 Å²	137.1	74%	0.743	74%	0.736	S	S	*	*			trans	-91.9	122.5	175.9	-115.2	165.7	0	0	0	109.4	F1725	F1725-L1727 PolarHBondContact O-N 3.2Å; F1725-L1727 VanDerWaalsContact O-N 3.12Å
1728	N	25.1	Very low	25.9	Very low	128 Å²	128	139.2 Å²	139.2	68%	0.684	75%	0.75	S	S	*	*			trans	-68.8	144.2	-161.7	-164.6	9	0	0	0	113.2
1729	K	24.2	Very low	25.2	Very low	198 Å²	198	142.5 Å²	142.5	86%	0.861	77%	0.773	S	S	*	*			trans	-140.6	52.5	-178.5	-156.7	-177	-175.2	-176.9	0	112.5
1730	E	25.9	Very low	24.8	Very low	175 Å²	175	147.6 Å²	147.6	82%	0.818	78%	0.779	S	S	*	*			trans	-85.7	167	165.6	-72	-150.1	127.6	0	0	112.8
1731	R	23.8	Very low	24.7	Very low	235 Å²	235	146.7 Å²	146.7	89%	0.887	77%	0.767	S	S	*	*			trans	-100.1	141.9	-159.4	-72.2	171.7	160.9	166	-7.9	114
1732	S	22.8	Very low	24.7	Very low	107 Å²	107	146.4 Å²	146.4	75%	0.748	76%	0.764	S	S	*	*			trans	69.7	160.4	134.3	74.7	0	0	0	0	121.7
1733	K	23.3	Very low	24.6	Very low	179 Å²	179	148.3 Å²	148.3	78%	0.778	77%	0.766	S	S	*	*			trans	80.5	100.5	166	-61	-163	174.9	-174.3	0	119.7
1734	F	22.3	Very low	24.9	Very low	175 Å²	175	151.3 Å²	151.3	77%	0.768	77%	0.765	S	S	*	*				72.1	127.1	124.9	-80.1	-82.9	0	0	0	122.5
1735	E	21.2	Very low	25	Very low	170 Å²	170	152 Å²	152	79%	0.794	77%	0.765	S	S	*	*			trans	86	151.4	139.2	-92.8	159.3	-138.7	0	0	122.4
1736	T	22.8	Very low	24.9	Very low	126 Å²	126	147.5 Å²	147.5	77%	0.773	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-98.6	151.9	-163.3	40.7	0	0	0	0	111.8
1737	P	24.6	Very low	25.2	Very low	128 Å²	128	150.3 Å²	150.3	83%	0.831	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-79.3	143	-169.9	31.5	-35.9	0	0	0	112.9
1738	I	25.9	Very low	25.1	Very low	161 Å²	161	150 Å²	150	83%	0.826	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-92.1	135.5	164	-66	179.4	0	0	0	109.5
1739	S	24.8	Very low	25.2	Very low	95 Å²	95	150.1 Å²	150.1	66%	0.664	76%	0.762	S	S	*	*			trans	-45	160.2	172.7	53.1	0	0	0	0	115
1740	E	27.3	Very low	25.1	Very low	170 Å²	170	150 Å²	150	79%	0.794	76%	0.761	S	S	*	*			cis	-154.1	140	48.3	-79.2	-172.7	145.7	0	0	112
1741	S	26.2	Very low	25	Very low	90 Å²	90	147.2 Å²	147.2	63%	0.629	76%	0.761	S	S	*	*				73.2	118.2	89.4	116.6	0	0	0	0	114.6
1742	I	26.8	Very low	25	Very low	148 Å²	148	141.7 Å²	141.7	76%	0.759	76%	0.757	S	S	*	*			cis	109.5	118.2	30.8	-76.9	160.5	0	0	0	111.1
1743	K	26.8	Very low	25	Very low	175 Å²	175	142.2 Å²	142.2	76%	0.761	76%	0.761	S	S	*	*			trans	148.4	146	154.5	-86.2	152.7	-164.3	165.8	0	111
1744	H	30.1	Very low	25.2	Very low	150 Å²	150	138.8 Å²	138.8	69%	0.694	76%	0.757	S	S	*	*			cis	-144.4	129.1	6	-99.4	-63	0	0	0	108.3
1745	T	25.7	Very low	25.1	Very low	113 Å²	113	137.3 Å²	137.3	69%	0.693	76%	0.756	S	S	*	*				52.3	136.3	92.7	65.4	0	0	0	0	116.2
1746	S	24.3	Very low	25.1	Very low	81 Å²	81	137.5 Å²	137.5	57%	0.566	76%	0.755	S	S	*	*			cis	178.5	167.8	5.2	42.4	0	0	0	0	113.2
1747	Y	28.3	Very low	25.2	Very low	211 Å²	211	141.3 Å²	141.3	83%	0.827	76%	0.756	S	S	*	*			trans	74.2	145.9	155.6	-63.8	-49.8	0	0	0	119.8
1748	N	24.1	Very low	25.2	Very low	134 Å²	134	141.1 Å²	141.1	72%	0.717	75%	0.748	S	S	*	*			cis	-167.7	178	-20.3	-155.3	-8.7	0	0	0	111.5
1749	T	27.3	Very low	25	Very low	131 Å²	131	141.7 Å²	141.7	80%	0.804	75%	0.747	S	S	*	*			trans	90.1	166.9	168.1	76.6	0	0	0	0	119.2
1750	K	23.5	Very low	25	Very low	196 Å²	196	142.3 Å²	142.3	85%	0.852	75%	0.752	S	S	*	*			trans	-127.8	142.8	-151.8	-51.5	177.4	176.9	-171.3	0	114.7
1751	S	23.7	Very low	25	Very low	116 Å²	116	140.2 Å²	140.2	81%	0.811	75%	0.751	S	S	*	*				173.2	130.6	124.5	59.5	0	0	0	0	115.4
1752	C	22.4	Very low	25	Very low	119 Å²	119	143.6 Å²	143.6	80%	0.804	76%	0.759	S	S	*	*			trans	32.1	112.7	150.7	-59.5	0	0	0	0	123.6
1753	S	23.1	Very low	24.9	Very low	118 Å²	118	144.2 Å²	144.2	83%	0.825	76%	0.764	S	S	*	*			trans	67.3	166.8	140.3	83.6	0	0	0	0	119
1754	P	27.4	Very low	24.8	Very low	108 Å²	108	143 Å²	143	70%	0.701	76%	0.764	S	S	*	*				-130.6	178.7	-88.2	35.1	-16.6	0	0	0	116.3
1755	L	20.9	Very low	24.5	Very low	144 Å²	144	140.4 Å²	140.4	75%	0.754	76%	0.763	S	S	*	*			trans	107.2	120.7	171.8	-79.4	83.2	0	0	0	117.4
1756	F	21.7	Very low	24.5	Very low	174 Å²	174	143 Å²	143	76%	0.763	77%	0.77	S	S	*	*			trans	38.5	117.5	150.5	-66.7	-100.9	0	0	0	121
1757	Y	23.9	Very low	24.4	Very low	206 Å²	206	143.3 Å²	143.3	81%	0.808	77%	0.769	S	S	*	*				-173.1	160	93.5	-115.3	-86.7	0	0	0	114
1758	N	24.2	Very low	24.3	Very low	124 Å²	124	140.2 Å²	140.2	66%	0.663	77%	0.767	S	S	*	*			trans	53.2	106.7	162.2	-75.6	-9.4	0	0	0	123.3
1759	Q	23.4	Very low	24.3	Very low	172 Å²	172	142 Å²	142	80%	0.804	78%	0.775	S	S	*	*				36.3	131.3	116.2	-67.6	-179.9	-35	0	0	122.1
1760	S	24.8	Very low	24.1	Very low	108 Å²	108	143.7 Å²	143.7	76%	0.755	78%	0.775	S	S	*	*			trans	69	132.7	153.6	67.8	0	0	0	0	118
1761	T	26.8	Very low	24.2	Very low	127 Å²	127	141.3 Å²	141.3	78%	0.779	77%	0.769	S	S	*	*			cis	-159.5	164	-2.2	0.5	0	0	0	0	111.2
1762	M	26	Very low	24.3	Very low	161 Å²	161	142.5 Å²	142.5	79%	0.793	77%	0.766	S	S	*	*			trans	69.2	65.6	164.7	-66.1	-64.3	176.8	0	0	118.4
1763	D	23.8	Very low	24.4	Very low	161 Å²	161	145 Å²	145	86%	0.861	77%	0.77	S	S	*	*			trans	-86.9	124.1	141.8	-97.1	-42.7	0	0	0	109	S1765	D1763-S1765 PolarHBondContact O-N 3.04Å
1764	I	24.5	Very low	24.5	Very low	149 Å²	149	144.4 Å²	144.4	76%	0.764	76%	0.761	S	S	*	*			trans	-97.2	88.1	175.2	-58	178.5	0	0	0	109.1
1765	S	25.3	Very low	24.5	Very low	96 Å²	96	146.1 Å²	146.1	67%	0.671	77%	0.765	S	S	*	*			trans	-141.9	109.6	164.2	65.5	0	0	0	0	109.9	D1763 T1767	D1763-S1765 PolarHBondContact O-N 3.04Å; S1765-T1767 PolarHBondContact O-N 3.29Å
1766	I	24.7	Very low	24.7	Very low	167 Å²	167	147.1 Å²	147.1	86%	0.856	77%	0.766	S	S	*	*			trans	-78.3	96.9	-170.4	-59.1	175.2	0	0	0	110.2
1767	T	23.4	Very low	24.8	Very low	88 Å²	88	146.6 Å²	146.6	54%	0.54	76%	0.763	S	S	.	*			trans	-165.3	80.4	150.4	21	0	0	0	0	109.5	R1710 S1765	R1710-T1767 PolarHBondContact NH1-O 3.36Å; R1710-T1767 PolarHBondContact NH1-OG1 3Å; S1765-T1767 PolarHBondContact O-N 3.29Å
1768	N	25.4	Very low	24.9	Very low	145 Å²	145	144.4 Å²	144.4	78%	0.775	76%	0.761	S	S	*	*			trans	166.1	108.2	142	-85.4	-4.4	0	0	0	111.5
1769	I	24.4	Very low	25.4	Very low	172 Å²	172	142.3 Å²	142.3	88%	0.882	75%	0.753	S	S	*	*			trans	-133.4	89.5	159.8	-59.3	-178	0	0	0	108.7
1770	M	23.5	Very low	25.5	Very low	166 Å²	166	144.7 Å²	144.7	82%	0.818	76%	0.757	S	S	*	*			trans	175.5	125.7	155.7	-100	170.6	79	0	0	106.5
1771	M	25.2	Very low	25.5	Very low	147 Å²	147	146.4 Å²	146.4	72%	0.724	75%	0.753	S	S	*	*			cis	-141.9	158.7	-8.3	-75.3	-167.2	-83.6	0	0	109.6
1772	N	24.8	Very low	25.3	Very low	141 Å²	141	147 Å²	147	75%	0.754	75%	0.75	S	S	*	*				179.7	106.1	116.1	-94.3	-22.3	0	0	0	112.7
1773	I	25.5	Very low	25.2	Very low	171 Å²	171	143.3 Å²	143.3	88%	0.877	74%	0.74	S	S	*	*			trans	-132.5	112	138	-61.2	-175.8	0	0	0	107.7
1774	T	25.4	Very low	25.2	Very low	105 Å²	105	143.2 Å²	143.2	64%	0.644	74%	0.736	S	S	*	*			trans	-135.5	143.2	158	57.3	0	0	0	0	105.2
1775	N	26.4	Very low	25.2	Very low	145 Å²	145	141.5 Å²	141.5	78%	0.775	73%	0.729	S	S	*	*			cis	-136.9	-179.8	1.3	-69.2	-76.8	0	0	0	108.5
1776	Q	25.5	Very low	25.2	Very low	165 Å²	165	141.5 Å²	141.5	77%	0.771	73%	0.729	S	S	*	*				-163.8	123.1	117.9	-106	-170.3	17.1	0	0	113.5
1777	F	24.7	Very low	25.2	Very low	162 Å²	162	141.6 Å²	141.6	71%	0.711	72%	0.724	S	S	*	*			trans	55.9	148.3	157.4	-58	-70.8	0	0	0	121.7
1778	Q	25	Very low	25.3	Very low	161 Å²	161	143.3 Å²	143.3	75%	0.752	73%	0.734	S	S	*	*			cis	159.9	-176.1	-31.8	-102.5	-163.8	-9.3	0	0	108.2
1779	P	34.7	Very low	25.2	Very low	79 Å²	79	143.8 Å²	143.8	51%	0.513	74%	0.737	S	S	.	*				-136.4	-178.3	-60.6	41.2	-24.6	0	0	0	112.8
1780	Y	25.7	Very low	25.2	Very low	222 Å²	222	141.9 Å²	141.9	87%	0.871	73%	0.732	S	S	*	*				-153.4	110.5	127.4	-90.5	-67.6	0	0	0	107
1781	H	24.6	Very low	25.2	Very low	145 Å²	145	142 Å²	142	67%	0.671	74%	0.736	S	S	*	*				62.6	129.9	110	-91.6	-116.2	0	0	0	115.8
1782	L	23.4	Very low	25.2	Very low	138 Å²	138	140.2 Å²	140.2	72%	0.723	74%	0.739	S	S	*	*			cis	-168.5	179	-14.8	-139.4	66.3	0	0	0	105.6
1783	S	24	Very low	25.1	Very low	85 Å²	85	141 Å²	141	59%	0.594	74%	0.743	S	S	*	*			cis	-163.2	142.7	6.4	53.9	0	0	0	0	112.7
1784	M	23.2	Very low	25	Very low	158 Å²	158	138.1 Å²	138.1	78%	0.778	74%	0.738	S	S	*	*			trans	65.5	146.7	141	-69.1	-174.5	167.9	0	0	119.7
1785	N	24.5	Very low	24.9	Very low	114 Å²	114	138.4 Å²	138.4	61%	0.61	74%	0.744	S	S	*	*			cis	-157.8	160.8	-0.6	-110.6	-19.3	0	0	0	108.1
1786	S	25.6	Very low	24.7	Very low	96 Å²	96	139.7 Å²	139.7	67%	0.671	75%	0.749	S	S	*	*			cis	-162.2	139	11.7	47.7	0	0	0	0	113.9
1787	F	25.2	Very low	24.6	Very low	169 Å²	169	136.8 Å²	136.8	74%	0.741	75%	0.747	S	S	*	*			trans	43.6	138	130.1	-66.9	-89.8	0	0	0	122.1
1788	T	25.1	Very low	24.5	Very low	124 Å²	124	134.3 Å²	134.3	76%	0.761	75%	0.75	S	S	*	*			cis	-166.6	167.6	-8	-0.3	0	0	0	0	113.4
1789	N	22.5	Very low	24.4	Very low	155 Å²	155	134.5 Å²	134.5	83%	0.829	76%	0.755	S	S	*	*			trans	-59.2	150.5	163.7	-67.9	-35.5	0	0	0	114.9
1790	V	25.8	Very low	23.8	Very low	131 Å²	131	138.4 Å²	138.4	79%	0.794	77%	0.771	S	S	*	*			trans	-149.8	139.2	134	176.3	0	0	0	0	109.9
1791	N	22.8	Very low	23.6	Very low	168 Å²	168	136.2 Å²	136.2	90%	0.898	77%	0.774	S	S	*	*			trans	-99	120.2	167.6	-80.4	-30.5	0	0	0	111.2
1792	S	24.7	Very low	23.6	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	78%	0.775	S	S	*	*			trans	-171.8	157.3	154	50.3	0	0	0	0	112.4
1793	N	23	Very low	23.6	Very low	158 Å²	158	134.3 Å²	134.3	85%	0.845	78%	0.781	S	S	*	*			trans	-81.7	166	-176.4	-77	-35	0	0	0	114.5
1794	S	23.7	Very low	23.7	Very low	109 Å²	109	136.4 Å²	136.4	76%	0.762	79%	0.791	S	S	*	*			trans	75.1	100.4	168.3	62.4	0	0	0	0	119
1795	S	22.8	Very low	23.9	Very low	111 Å²	111	136.8 Å²	136.8	78%	0.776	80%	0.796	S	S	*	*			trans	38.7	107.4	137.3	59.8	0	0	0	0	120.3
1796	I	23.2	Very low	24.5	Very low	172 Å²	172	136.8 Å²	136.8	88%	0.882	79%	0.793	S	S	*	*			trans	-142.6	144.2	135.6	-103.6	157.4	0	0	0	108.5
1797	S	21.9	Very low	25.3	Very low	105 Å²	105	135.7 Å²	135.7	73%	0.734	79%	0.791	S	S	*	*			trans	-95.1	160.4	177.2	52.7	0	0	0	0	112.2
1798	S	23	Very low	26.7	Very low	110 Å²	110	128.7 Å²	128.7	77%	0.769	77%	0.766	S	S	*	*			trans	88.6	158.9	177.2	82.4	0	0	0	0	116.6
1799	L	23.2	Very low	28.5	Very low	165 Å²	165	127.4 Å²	127.4	86%	0.864	75%	0.754	S	S	*	*			trans	68	49.1	179.8	-69.8	166.4	0	0	0	117.9
1800	L	22.2	Very low	30.9	Very low	161 Å²	161	120.1 Å²	120.1	84%	0.843	72%	0.715	S	S	*	*			trans	-147.2	84	134.2	-116.6	173.1	0	0	0	110.8	A1802	L1800-A1802 PolarHBondContact O-N 3.27Å; L1800-A1802 VanDerWaalsContact O-N 3.09Å
1801	N	22.1	Very low	33.2	Very low	176 Å²	176	117.3 Å²	117.3	94%	0.941	70%	0.696	S	S	*	*			trans	-78.6	85.9	174.2	-87.5	-6.2	0	0	0	110.3
1802	A	23.6	Very low	35.9	Very low	82 Å²	82	109.8 Å²	109.8	68%	0.678	66%	0.656	S	S	*	*			trans	-139.9	119.9	164.1	0	0	0	0	0	108.9	L1800 T1804	L1800-A1802 PolarHBondContact O-N 3.27Å; L1800-A1802 VanDerWaalsContact O-N 3.09Å; A1802-T1804 PolarHBondContact O-N 3.2Å
1803	N	22.9	Very low	38.7	Very low	160 Å²	160	104.9 Å²	104.9	86%	0.856	62%	0.621	S	S	*	*			trans	-62.8	126.9	-165.7	-61	-40.5	0	0	0	113.8
1804	T	26.7	Very low	41.6	Very low	130 Å²	130	97.5 Å²	97.5	80%	0.798	58%	0.582	S	S	*	*				178.1	94.1	122.4	26.5	0	0	0	0	113.8	A1802 M1806	A1802-T1804 PolarHBondContact O-N 3.2Å; T1804-M1806 PolarHBondContact O-N 3.06Å
1805	N	27.8	Very low	44.3	Very low	165 Å²	165	92.9 Å²	92.9	88%	0.882	55%	0.549	S	S	*	.			trans	-90	87.8	164.1	-81.6	-16.9	0	0	0	110.2
1806	M	36.8	Very low	47	Very low	114 Å²	114	87.7 Å²	87.7	56%	0.562	51%	0.512	S	S	*	.			trans	-147	76.1	176.9	-78.5	-63.9	152.5	0	0	113.9	T1804 T1828	T1804-M1806 PolarHBondContact O-N 3.06Å; M1806-T1828 HydrophobicContact SD-CG2 4.09Å
1807	A	43.4	Very low	49.2	Very low	74 Å²	74	87.3 Å²	87.3	61%	0.612	50%	0.5	S	S	*	.			trans	-134.2	124.2	161.4	0	0	0	0	0	108.8	S1718	S1718-A1807 WeakPolarHBondContact OG-CB 3.01Å
1808	G	53.4	Low	51.4	Low	22 Å²	22	85.3 Å²	85.3	23%	0.227	48%	0.481	C	S	.	.			trans	-88.6	176.9	-173.6	0	0	0	0	0	113.9	T1827 T1828	G1808-T1827 WeakPolarHBondContact CA-OG1 3.36Å; G1808-T1828 PolarHBondContact N-OG1 2.73Å
1809	L	62.1	Low	53.5	Low	96 Å²	96	80.2 Å²	80.2	50%	0.503	45%	0.446	S	S	.	.			trans	-71.2	146.4	164	-71.4	166.9	0	0	0	109.1	Q1694 N1811 F1826 T1827	Q1694-L1809 HydrophobicContact CB-CD2 4.35Å; Q1694-L1809 VanDerWaalsContact O-CD2 3.25Å; Q1694-L1809 WeakPolarHBondContact O-CD2 3.25Å; L1809-N1811 PolarHBondContact O-N 3.24Å; L1809-F1826 CarbonylContact O-C 3.58Å; L1809-F1826 VanDerWaalsContact O-CA 3.32Å; L1809-F1826 WeakPolarHBondContact O-CA 3.31Å; L1809-T1827 HydrophobicContact CB-CG2 4.07Å; L1809-T1827 PolarHBondContact N-OG1 2.8Å; L1809-T1827 PolarHBondContact O-N 3.49Å
1810	L	73	Confident	55.9	Low	2 Å²	2	77 Å²	77	1%	0.01	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	114.5	173.3	-154.4	168.9	0	0	0	108.3	T1677 V1698 C1812 L1813 C1824 F1826	T1677-L1810 WeakPolarHBondContact CB-O 3.37Å; T1677-L1810 PolarHBondContact OG1-O 2.82Å; V1698-L1810 HydrophobicContact CG2-CD1 3.85Å; L1810-C1812 VanDerWaalsContact CD2-O 3.29Å; L1810-C1812 WeakPolarHBondContact CD2-O 3.37Å; L1810-L1813 HydrophobicContact CD1-CD2 4.22Å; L1810-L1813 HydrophobicContact CD2-CD2 3.63Å; L1810-L1813 HydrophobicContact CD2-CG 3.76Å; L1810-C1824 HydrophobicContact CD1-CB 3.9Å; L1810-C1824 HydrophobicContact CD2-CB 4.2Å; L1810-C1824 HydrophobicContact CG-CB 4.12Å; L1810-F1826 HydrophobicContact CB-CD1 4.18Å; L1810-F1826 HydrophobicContact CB-CE1 3.96Å; L1810-F1826 HydrophobicContact CD1-CE1 4.15Å; L1810-F1826 HydrophobicContact CD1-CZ 4.03Å; L1810-F1826 HydrophobicContact CG-CD1 4.34Å; L1810-F1826 HydrophobicContact CG-CE1 3.94Å; L1810-F1826 HydrophobicContact CG-CZ 4.09Å
1811	N	76	Confident	58.5	Low	73 Å²	73	71.1 Å²	71.1	39%	0.39	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-36.3	-167.4	-169.1	55.4	0	0	0	113	L1809 G1825 T1827 V1852	L1809-N1811 PolarHBondContact O-N 3.24Å; N1811-G1825 PolarHBondContact N-O 3.04Å; N1811-T1827 HydrophobicContact CB-CG2 4.06Å; N1811-V1852 PolarHBondContact ND2-O 3.47Å
1812	C	78.7	Confident	61.3	Low	9 Å²	9	62.8 Å²	62.8	6%	0.061	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	148.6	-178.7	50.1	0	0	0	0	111.7	L1810 G1825	L1810-C1812 VanDerWaalsContact CD2-O 3.29Å; L1810-C1812 WeakPolarHBondContact CD2-O 3.37Å; C1812-G1825 PolarHBondContact N-O 2.87Å; C1812-G1825 PolarHBondContact O-N 2.75Å
1813	L	84.1	Confident	64.2	Low	9 Å²	9	58.9 Å²	58.9	5%	0.047	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.9	-177.4	-75	172.5	0	0	0	109.4	A1678 N1680 I1690 V1698 L1810 L1822 C1824	A1678-L1813 HydrophobicContact CB-CB 4.37Å; A1678-L1813 HydrophobicContact CB-CD1 4.02Å; A1678-L1813 HydrophobicContact CB-CG 3.99Å; N1680-L1813 HydrophobicContact CB-CB 4.37Å; N1680-L1813 PolarHBondContact ND2-O 2.89Å; I1690-L1813 HydrophobicContact CG2-CD1 4.38Å; V1698-L1813 HydrophobicContact CG2-CD2 4Å; L1810-L1813 HydrophobicContact CD1-CD2 4.22Å; L1810-L1813 HydrophobicContact CD2-CD2 3.63Å; L1810-L1813 HydrophobicContact CD2-CG 3.76Å; L1813-L1822 HydrophobicContact CD2-CD1 4.29Å; L1813-C1824 HydrophobicContact CD2-CB 4.12Å; L1813-C1824 WeakPolarHBondContact CD2-SG 3.39Å
1814	T	82.2	Confident	66.9	Low	3 Å²	3	51.3 Å²	51.3	2%	0.018	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	144.8	177.5	-153.7	0	0	0	0	113	L1822 L1823 I1855 F1863	T1814-L1822 CarbonylContact O-C 3.31Å; T1814-L1822 WeakPolarHBondContact O-CA 3.31Å; T1814-L1823 HydrophobicContact CG2-CB 3.82Å; T1814-L1823 PolarHBondContact N-O 2.87Å; T1814-L1823 PolarHBondContact O-N 2.9Å; T1814-I1855 WeakPolarHBondContact CB-O 3.16Å; T1814-I1855 HydrophobicContact CG2-CB 3.55Å; T1814-I1855 HydrophobicContact CG2-CG2 3.5Å; T1814-I1855 WeakPolarHBondContact CG2-O 3.4Å; T1814-I1855 PolarHBondContact OG1-O 3.07Å; T1814-F1863 HydrophobicContact CG2-CD1 3.53Å; T1814-F1863 HydrophobicContact CG2-CE1 3.69Å
1815	T	81	Confident	69.5	Low	11 Å²	11	45.1 Å²	45.1	7%	0.067	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	148.2	-179	47.5	0	0	0	0	111.3	I1690 Y1821 L1822 L1836	I1690-T1815 HydrophobicContact CD1-CG2 3.7Å; T1815-Y1821 CarbonylContact C-O 3.57Å; T1815-Y1821 WeakPolarHBondContact CA-O 3.3Å; T1815-L1822 HydrophobicContact CG2-CD1 3.9Å; T1815-L1836 HydrophobicContact CG2-CD1 4.36Å
1816	S	78.9	Confident	71.9	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.014	19%	0.194	C	C	.	.			trans	-60.1	153.3	167.1	59.4	0	0	0	0	109.9	N1818 G1819 Y1820 Y1821	S1816-N1818 PolarHBondContact O-N 2.85Å; S1816-N1818 VanDerWaalsContact O-N 3.11Å; S1816-G1819 PolarHBondContact O-N 3.34Å; S1816-Y1820 PolarHBondContact OG-N 2.82Å; S1816-Y1821 PolarHBondContact N-O 2.82Å; S1816-Y1821 PolarHBondContact OG-N 3.27Å; S1816-Y1821 VanDerWaalsContact OG-N 3.08Å
1817	R	69.6	Low	73.7	Confident	165 Å²	165	35 Å²	35	62%	0.623	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-29.3	177.1	-161.4	176.3	-165.1	157.3	5.5	112.1	G1819 L1859	R1817-G1819 VanDerWaalsContact C-N 3.31Å; R1817-L1859 VanDerWaalsContact NH1-CD2 3.26Å
1818	N	69.1	Low	75	Confident	62 Å²	62	32.1 Å²	32.1	33%	0.332	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-6.7	-179	-46.6	-14.3	0	0	0	112.5	S1816 Y1820 D1861	S1816-N1818 PolarHBondContact O-N 2.85Å; S1816-N1818 VanDerWaalsContact O-N 3.11Å; N1818-Y1820 VanDerWaalsContact C-N 3.28Å; N1818-Y1820 HydrophobicContact CB-CD2 3.86Å; N1818-Y1820 HydrophobicContact CB-CE2 4.07Å; N1818-Y1820 PolarHBondContact O-N 2.85Å; N1818-D1861 VanDerWaalsContact ND2-CG 3.31Å; N1818-D1861 PolarHBondContact ND2-OD1 2.86Å; N1818-D1861 PolarHBondContact ND2-OD2 3.16Å
1819	G	67.6	Low	76	Confident	3 Å²	3	31.1 Å²	31.1	3%	0.031	15%	0.148	C	C	.	.	S	Bend	trans	75.8	2.5	177.1	0	0	0	0	0	116.2	S1682 S1816 R1817 L1836	S1682-G1819 VanDerWaalsContact OG-CA 3.22Å; S1682-G1819 WeakPolarHBondContact OG-CA 3.45Å; S1682-G1819 PolarHBondContact OG-O 2.83Å; S1816-G1819 PolarHBondContact O-N 3.34Å; R1817-G1819 VanDerWaalsContact C-N 3.31Å; G1819-L1836 WeakPolarHBondContact O-CD1 3.32Å
1820	Y	73.8	Confident	76.6	Confident	97 Å²	97	27.3 Å²	27.3	38%	0.38	13%	0.128	S	C	.	.	S	Bend	trans	-91.1	-24.5	-175.6	-55.4	-44.5	0	0	0	114.8	V1684 S1816 N1818 L1836 R1837	V1684-Y1820 HydrophobicContact CG1-CE1 4.31Å; S1816-Y1820 PolarHBondContact OG-N 2.82Å; N1818-Y1820 VanDerWaalsContact C-N 3.28Å; N1818-Y1820 HydrophobicContact CB-CD2 3.86Å; N1818-Y1820 HydrophobicContact CB-CE2 4.07Å; N1818-Y1820 PolarHBondContact O-N 2.85Å; Y1820-L1836 PolarHBondContact O-N 3.25Å; Y1820-R1837 HydrophobicContact CD1-CG 3.91Å; Y1820-R1837 HydrophobicContact CG-CG 4.48Å
1821	Y	76.6	Confident	77	Confident	39 Å²	39	27.2 Å²	27.2	15%	0.153	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	138.1	-176.4	-53.9	-50.1	0	0	0	111	T1815 S1816 L1834 D1835 I1842 P1876 T1877	T1815-Y1821 CarbonylContact C-O 3.57Å; T1815-Y1821 WeakPolarHBondContact CA-O 3.3Å; S1816-Y1821 PolarHBondContact N-O 2.82Å; S1816-Y1821 PolarHBondContact OG-N 3.27Å; S1816-Y1821 VanDerWaalsContact OG-N 3.08Å; Y1821-L1834 WeakPolarHBondContact CA-O 3.4Å; Y1821-D1835 HydrophobicContact CD1-CB 4.44Å; Y1821-D1835 HydrophobicContact CE1-CB 4.49Å; Y1821-I1842 HydrophobicContact CD1-CD1 3.58Å; Y1821-I1842 HydrophobicContact CE1-CD1 3.76Å; Y1821-P1876 HydrophobicContact CD2-CG 4.32Å; Y1821-T1877 HydrophobicContact CE2-CG2 3.84Å
1822	L	80.7	Confident	77	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.005	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.2	173.4	178.3	71.9	0	0	0	109.6	I1690 V1698 L1813 T1814 T1815 A1833 L1834 L1836	I1690-L1822 HydrophobicContact CD1-CD1 4.11Å; I1690-L1822 HydrophobicContact CG2-CD1 3.98Å; I1690-L1822 HydrophobicContact CG2-CD2 4.07Å; V1698-L1822 HydrophobicContact CG1-CD2 3.99Å; L1813-L1822 HydrophobicContact CD2-CD1 4.29Å; T1814-L1822 CarbonylContact O-C 3.31Å; T1814-L1822 WeakPolarHBondContact O-CA 3.31Å; T1815-L1822 HydrophobicContact CG2-CD1 3.9Å; L1822-A1833 CarbonylContact O-C 3.3Å; L1822-A1833 WeakPolarHBondContact O-CA 3.25Å; L1822-L1834 HydrophobicContact CB-CD2 4.48Å; L1822-L1834 PolarHBondContact N-O 2.84Å; L1822-L1834 PolarHBondContact O-N 3.46Å; L1822-L1836 HydrophobicContact CB-CD1 4.1Å; L1822-L1836 HydrophobicContact CB-CD2 3.98Å; L1822-L1836 HydrophobicContact CB-CG 3.95Å; L1822-L1836 HydrophobicContact CD2-CD2 4.25Å
1823	L	83.5	Confident	77.1	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	135.1	168.6	-87.4	68.8	0	0	0	110.3	T1814 I1831 T1832 A1833 I1855 F1863 I1874 P1876	T1814-L1823 HydrophobicContact CG2-CB 3.82Å; T1814-L1823 PolarHBondContact N-O 2.87Å; T1814-L1823 PolarHBondContact O-N 2.9Å; L1823-I1831 HydrophobicContact CB-CG2 4.47Å; L1823-I1831 HydrophobicContact CD2-CG2 4.07Å; L1823-I1831 HydrophobicContact CG-CG2 4.29Å; L1823-T1832 WeakPolarHBondContact CA-O 3.44Å; L1823-A1833 HydrophobicContact CD1-CB 3.72Å; L1823-A1833 HydrophobicContact CG-CB 4.08Å; L1823-I1855 HydrophobicContact CB-CD1 4.26Å; L1823-I1855 HydrophobicContact CD2-CG2 4.28Å; L1823-F1863 HydrophobicContact CD1-CD1 4.45Å; L1823-F1863 HydrophobicContact CD1-CD2 4.04Å; L1823-F1863 HydrophobicContact CD1-CE1 4.15Å; L1823-F1863 HydrophobicContact CD1-CE2 3.75Å; L1823-F1863 HydrophobicContact CD1-CG 4.37Å; L1823-F1863 HydrophobicContact CD1-CZ 3.76Å; L1823-F1863 HydrophobicContact CD2-CB 3.94Å; L1823-F1863 HydrophobicContact CD2-CD1 4.13Å; L1823-F1863 HydrophobicContact CD2-CD2 3.96Å; L1823-F1863 HydrophobicContact CD2-CG 3.74Å; L1823-I1874 HydrophobicContact CD2-CD1 4.29Å; L1823-P1876 HydrophobicContact CD1-CB 4.45Å; L1823-P1876 HydrophobicContact CD1-CG 4.4Å
1824	C	80.4	Confident	76.7	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123.5	177.2	-54.5	0	0	0	0	109.8	L1810 L1813 F1826 I1831 T1832	L1810-C1824 HydrophobicContact CD1-CB 3.9Å; L1810-C1824 HydrophobicContact CD2-CB 4.2Å; L1810-C1824 HydrophobicContact CG-CB 4.12Å; L1813-C1824 HydrophobicContact CD2-CB 4.12Å; L1813-C1824 WeakPolarHBondContact CD2-SG 3.39Å; C1824-F1826 HydrophobicContact CB-CE2 3.97Å; C1824-F1826 HydrophobicContact CB-CZ 4.36Å; C1824-I1831 VanDerWaalsContact O-CA 3.32Å; C1824-I1831 WeakPolarHBondContact O-CA 3.42Å; C1824-T1832 PolarHBondContact N-O 3.1Å; C1824-T1832 PolarHBondContact O-N 2.98Å
1825	G	80	Confident	76.4	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130.4	176.6	0	0	0	0	0	112.4	N1811 C1812	N1811-G1825 PolarHBondContact N-O 3.04Å; C1812-G1825 PolarHBondContact N-O 2.87Å; C1812-G1825 PolarHBondContact O-N 2.75Å
1826	F	78.9	Confident	75.9	Confident	9 Å²	9	25.1 Å²	25.1	4%	0.039	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	153	-177	-65.5	-92.9	0	0	0	112.7	F1716 L1809 L1810 C1824 T1828 G1829 I1830 T1832 V1852	F1716-F1826 HydrophobicContact CB-CZ 3.92Å; F1716-F1826 HydrophobicContact CG-CZ 4.46Å; L1809-F1826 CarbonylContact O-C 3.58Å; L1809-F1826 VanDerWaalsContact O-CA 3.32Å; L1809-F1826 WeakPolarHBondContact O-CA 3.31Å; L1810-F1826 HydrophobicContact CB-CD1 4.18Å; L1810-F1826 HydrophobicContact CB-CE1 3.96Å; L1810-F1826 HydrophobicContact CD1-CE1 4.15Å; L1810-F1826 HydrophobicContact CD1-CZ 4.03Å; L1810-F1826 HydrophobicContact CG-CD1 4.34Å; L1810-F1826 HydrophobicContact CG-CE1 3.94Å; L1810-F1826 HydrophobicContact CG-CZ 4.09Å; C1824-F1826 HydrophobicContact CB-CE2 3.97Å; C1824-F1826 HydrophobicContact CB-CZ 4.36Å; F1826-T1828 PolarHBondContact O-N 2.97Å; F1826-G1829 PolarHBondContact O-N 3.44Å; F1826-I1830 HydrophobicContact CB-CB 4.44Å; F1826-I1830 HydrophobicContact CD2-CG2 4.45Å; F1826-I1830 PolarHBondContact N-O 3.42Å; F1826-T1832 HydrophobicContact CE2-CG2 3.88Å; F1826-V1852 PolarHBondContact O-N 3.1Å
1827	T	74.8	Confident	75.3	Confident	57 Å²	57	32.2 Å²	32.2	35%	0.35	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-8.3	177.4	60.7	0	0	0	0	114.5	G1808 L1809 N1811 S1851	G1808-T1827 WeakPolarHBondContact CA-OG1 3.36Å; L1809-T1827 HydrophobicContact CB-CG2 4.07Å; L1809-T1827 PolarHBondContact N-OG1 2.8Å; L1809-T1827 PolarHBondContact O-N 3.49Å; N1811-T1827 HydrophobicContact CB-CG2 4.06Å; T1827-S1851 WeakPolarHBondContact O-CA 3.48Å; T1827-S1851 WeakPolarHBondContact O-CB 3.49Å
1828	T	70.4	Confident	74.9	Confident	15 Å²	15	29.9 Å²	29.9	9%	0.092	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	2.3	172.3	41.5	0	0	0	0	114.6	M1806 G1808 F1826 I1830 R1846	M1806-T1828 HydrophobicContact SD-CG2 4.09Å; G1808-T1828 PolarHBondContact N-OG1 2.73Å; F1826-T1828 PolarHBondContact O-N 2.97Å; T1828-I1830 VanDerWaalsContact C-N 3.31Å; T1828-R1846 PolarHBondContact O-NE 2.93Å; T1828-R1846 PolarHBondContact O-NH2 3.5Å
1829	G	74.7	Confident	74.5	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	79.2	15.1	-176.7	0	0	0	0	0	114.3	F1826 E1847 Y1848 D1850	F1826-G1829 PolarHBondContact O-N 3.44Å; G1829-E1847 PolarHBondContact O-N 2.97Å; G1829-Y1848 WeakPolarHBondContact CA-O 3.35Å; G1829-Y1848 PolarHBondContact O-N 3.48Å; G1829-D1850 WeakPolarHBondContact CA-O 3.39Å; G1829-D1850 PolarHBondContact N-O 2.86Å
1830	I	74.1	Confident	74	Confident	16 Å²	16	32.9 Å²	32.9	8%	0.082	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	141.1	176.8	-62.1	176.3	0	0	0	108.9	F1826 T1828 T1832 I1844 W1845 R1846	F1826-I1830 HydrophobicContact CB-CB 4.44Å; F1826-I1830 HydrophobicContact CD2-CG2 4.45Å; F1826-I1830 PolarHBondContact N-O 3.42Å; T1828-I1830 VanDerWaalsContact C-N 3.31Å; I1830-T1832 HydrophobicContact CG2-CG2 4.25Å; I1830-I1844 HydrophobicContact CG2-CG2 3.8Å; I1830-W1845 CarbonylContact C-O 3.54Å; I1830-W1845 VanDerWaalsContact CA-O 3.32Å; I1830-W1845 WeakPolarHBondContact CA-O 3.38Å; I1830-W1845 WeakPolarHBondContact CG2-O 3.44Å; I1830-R1846 HydrophobicContact CG1-CB 4.17Å; I1830-R1846 HydrophobicContact CG1-CG 3.9Å
1831	I	82.3	Confident	73.6	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.5	173.8	-61.6	173.7	0	0	0	108.1	L1823 C1824 W1845 V1852 I1855 S1865 I1874	L1823-I1831 HydrophobicContact CB-CG2 4.47Å; L1823-I1831 HydrophobicContact CD2-CG2 4.07Å; L1823-I1831 HydrophobicContact CG-CG2 4.29Å; C1824-I1831 VanDerWaalsContact O-CA 3.32Å; C1824-I1831 WeakPolarHBondContact O-CA 3.42Å; I1831-W1845 HydrophobicContact CB-CE3 4.32Å; I1831-W1845 HydrophobicContact CG2-CE3 4.07Å; I1831-W1845 HydrophobicContact CG2-CZ3 4.33Å; I1831-W1845 PolarHBondContact N-O 2.96Å; I1831-W1845 PolarHBondContact O-N 3.17Å; I1831-V1852 HydrophobicContact CD1-CG1 3.99Å; I1831-V1852 HydrophobicContact CD1-CG2 4.01Å; I1831-V1852 HydrophobicContact CG1-CG1 4.17Å; I1831-V1852 HydrophobicContact CG1-CG2 3.58Å; I1831-I1855 HydrophobicContact CD1-CD1 4.3Å; I1831-I1855 HydrophobicContact CG1-CD1 4.32Å; I1831-I1855 HydrophobicContact CG2-CD1 4.02Å; I1831-S1865 WeakPolarHBondContact CD1-OG 3.31Å; I1831-I1874 HydrophobicContact CB-CD1 4.49Å; I1831-I1874 HydrophobicContact CD1-CD1 3.46Å; I1831-I1874 VanDerWaalsContact CD1-CD1 3.46Å; I1831-I1874 HydrophobicContact CG2-CD1 4.05Å
1832	T	76.4	Confident	73.3	Confident	4 Å²	4	32.2 Å²	32.2	3%	0.025	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	126.4	177.2	64.2	0	0	0	0	111.1	L1823 C1824 F1826 I1830 H1843 I1844	L1823-T1832 WeakPolarHBondContact CA-O 3.44Å; C1824-T1832 PolarHBondContact N-O 3.1Å; C1824-T1832 PolarHBondContact O-N 2.98Å; F1826-T1832 HydrophobicContact CE2-CG2 3.88Å; I1830-T1832 HydrophobicContact CG2-CG2 4.25Å; T1832-H1843 WeakPolarHBondContact CA-O 3.42Å; T1832-I1844 HydrophobicContact CG2-CB 4.35Å; T1832-I1844 HydrophobicContact CG2-CD1 4.33Å; T1832-I1844 HydrophobicContact CG2-CG1 3.9Å; T1832-I1844 HydrophobicContact CG2-CG2 4.08Å
1833	A	81	Confident	72.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	139.5	170.1	0	0	0	0	0	111.1	L1822 L1823 V1841 I1842 H1843 W1845 P1876	L1822-A1833 CarbonylContact O-C 3.3Å; L1822-A1833 WeakPolarHBondContact O-CA 3.25Å; L1823-A1833 HydrophobicContact CD1-CB 3.72Å; L1823-A1833 HydrophobicContact CG-CB 4.08Å; A1833-V1841 CarbonylContact O-C 3.59Å; A1833-V1841 WeakPolarHBondContact O-CA 3.45Å; A1833-I1842 PolarHBondContact O-N 3.5Å; A1833-H1843 PolarHBondContact N-O 3.46Å; A1833-H1843 PolarHBondContact O-N 2.9Å; A1833-W1845 HydrophobicContact CB-CH2 3.49Å; A1833-W1845 VanDerWaalsContact CB-CH2 3.49Å; A1833-W1845 HydrophobicContact CB-CZ3 3.52Å; A1833-P1876 HydrophobicContact CB-CB 3.9Å
1834	L	74.9	Confident	72.3	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	138.8	177.1	172	134.7	0	0	0	110.6	L1714 F1716 Y1821 L1822 L1836 Q1840 V1841	L1714-L1834 HydrophobicContact CD1-CD1 3.83Å; L1714-L1834 HydrophobicContact CD1-CD2 3.6Å; L1714-L1834 HydrophobicContact CD1-CG 4.38Å; L1714-L1834 HydrophobicContact CD2-CD1 4.4Å; F1716-L1834 HydrophobicContact CE1-CB 4.23Å; F1716-L1834 HydrophobicContact CE1-CD1 3.91Å; F1716-L1834 HydrophobicContact CZ-CB 4.38Å; F1716-L1834 HydrophobicContact CZ-CD1 3.85Å; Y1821-L1834 WeakPolarHBondContact CA-O 3.4Å; L1822-L1834 HydrophobicContact CB-CD2 4.48Å; L1822-L1834 PolarHBondContact N-O 2.84Å; L1822-L1834 PolarHBondContact O-N 3.46Å; L1834-L1836 HydrophobicContact CD2-CD2 3.84Å; L1834-L1836 HydrophobicContact CD2-CG 4.28Å; L1834-Q1840 VanDerWaalsContact CA-O 3.29Å; L1834-Q1840 WeakPolarHBondContact CA-O 3.48Å; L1834-Q1840 WeakPolarHBondContact CG-O 3.47Å; L1834-V1841 HydrophobicContact CD1-CG2 4.23Å
1835	D	76.7	Confident	71.7	Confident	15 Å²	15	41.2 Å²	41.2	8%	0.08	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	116.9	168.7	-168.2	-39.8	0	0	0	109.4	Y1821 R1837 M1838 G1839 Q1840 I1842	Y1821-D1835 HydrophobicContact CD1-CB 4.44Å; Y1821-D1835 HydrophobicContact CE1-CB 4.49Å; D1835-R1837 PolarHBondContact O-N 2.66Å; D1835-R1837 WeakPolarHBondContact OD1-CA 3.27Å; D1835-R1837 WeakPolarHBondContact OD1-CB 3.21Å; D1835-R1837 VanDerWaalsContact OD1-CG 3.32Å; D1835-R1837 WeakPolarHBondContact OD1-CG 3.11Å; D1835-R1837 IonicContact OD1-CZ 3.06Å; D1835-R1837 PolarHBondContact OD1-N 3.4Å; D1835-R1837 IonicContact OD1-NE 3.03Å; D1835-R1837 PolarHBondContact OD1-NE 2.73Å; D1835-R1837 IonicContact OD2-CZ 2.95Å; D1835-R1837 IonicContact OD2-NE 3.1Å; D1835-R1837 PolarHBondContact OD2-NE 2.73Å; D1835-R1837 VanDerWaalsContact OD2-NE 3.17Å; D1835-R1837 IonicContact OD2-NH2 3.59Å; D1835-R1837 PolarHBondContact OD2-NH2 3.35Å; D1835-M1838 HydrophobicContact CB-CB 4.2Å; D1835-M1838 HydrophobicContact CB-CG 4.42Å; D1835-M1838 PolarHBondContact O-N 2.89Å; D1835-M1838 PolarHBondContact OD1-N 2.92Å; D1835-G1839 WeakPolarHBondContact O-CA 3.14Å; D1835-G1839 PolarHBondContact O-N 3.39Å; D1835-Q1840 PolarHBondContact N-O 2.68Å; D1835-I1842 HydrophobicContact CB-CD1 4.01Å; D1835-I1842 HydrophobicContact CB-CG1 4.12Å
1836	L	70.1	Confident	71.4	Confident	41 Å²	41	47.4 Å²	47.4	22%	0.215	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.9	-179.8	-71.9	169.8	0	0	0	113.1	I1690 L1700 T1815 G1819 Y1820 L1822 L1834	I1690-L1836 HydrophobicContact CD1-CD1 3.89Å; I1690-L1836 HydrophobicContact CD1-CD2 4.24Å; L1700-L1836 HydrophobicContact CD1-CD2 4.22Å; T1815-L1836 HydrophobicContact CG2-CD1 4.36Å; G1819-L1836 WeakPolarHBondContact O-CD1 3.32Å; Y1820-L1836 PolarHBondContact O-N 3.25Å; L1822-L1836 HydrophobicContact CB-CD1 4.1Å; L1822-L1836 HydrophobicContact CB-CD2 3.98Å; L1822-L1836 HydrophobicContact CB-CG 3.95Å; L1822-L1836 HydrophobicContact CD2-CD2 4.25Å; L1834-L1836 HydrophobicContact CD2-CD2 3.84Å; L1834-L1836 HydrophobicContact CD2-CG 4.28Å
1837	R	66.2	Low	70.7	Confident	150 Å²	150	49 Å²	49	57%	0.566	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-37.6	175.2	-49.1	169.6	-68.1	-177.2	1.8	111.3	Y1820 D1835	Y1820-R1837 HydrophobicContact CD1-CG 3.91Å; Y1820-R1837 HydrophobicContact CG-CG 4.48Å; D1835-R1837 PolarHBondContact O-N 2.66Å; D1835-R1837 WeakPolarHBondContact OD1-CA 3.27Å; D1835-R1837 WeakPolarHBondContact OD1-CB 3.21Å; D1835-R1837 VanDerWaalsContact OD1-CG 3.32Å; D1835-R1837 WeakPolarHBondContact OD1-CG 3.11Å; D1835-R1837 IonicContact OD1-CZ 3.06Å; D1835-R1837 PolarHBondContact OD1-N 3.4Å; D1835-R1837 IonicContact OD1-NE 3.03Å; D1835-R1837 PolarHBondContact OD1-NE 2.73Å; D1835-R1837 IonicContact OD2-CZ 2.95Å; D1835-R1837 IonicContact OD2-NE 3.1Å; D1835-R1837 PolarHBondContact OD2-NE 2.73Å; D1835-R1837 VanDerWaalsContact OD2-NE 3.17Å; D1835-R1837 IonicContact OD2-NH2 3.59Å; D1835-R1837 PolarHBondContact OD2-NH2 3.35Å
1838	M	61.7	Low	70.7	Confident	116 Å²	116	46.7 Å²	46.7	57%	0.571	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-20	-175.2	-60.6	-61.5	-67.2	0	0	113.7	D1835 Q1840	D1835-M1838 HydrophobicContact CB-CB 4.2Å; D1835-M1838 HydrophobicContact CB-CG 4.42Å; D1835-M1838 PolarHBondContact O-N 2.89Å; D1835-M1838 PolarHBondContact OD1-N 2.92Å; M1838-Q1840 HydrophobicContact CB-CB 4.23Å; M1838-Q1840 HydrophobicContact CB-CG 4.25Å; M1838-Q1840 PolarHBondContact O-N 3.04Å
1839	G	59.2	Low	70.6	Confident	35 Å²	35	52.9 Å²	52.9	36%	0.361	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	16	-172.2	0	0	0	0	0	113.9	D1835	D1835-G1839 WeakPolarHBondContact O-CA 3.14Å; D1835-G1839 PolarHBondContact O-N 3.39Å
1840	Q	57.6	Low	70.6	Confident	93 Å²	93	56.6 Å²	56.6	44%	0.435	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	139.5	-173.8	-71	179.9	-18.5	0	0	111.6	L1834 D1835 M1838 I1842	L1834-Q1840 VanDerWaalsContact CA-O 3.29Å; L1834-Q1840 WeakPolarHBondContact CA-O 3.48Å; L1834-Q1840 WeakPolarHBondContact CG-O 3.47Å; D1835-Q1840 PolarHBondContact N-O 2.68Å; M1838-Q1840 HydrophobicContact CB-CB 4.23Å; M1838-Q1840 HydrophobicContact CB-CG 4.25Å; M1838-Q1840 PolarHBondContact O-N 3.04Å; Q1840-I1842 PolarHBondContact O-N 2.96Å
1841	V	64.7	Low	70.7	Confident	64 Å²	64	57.7 Å²	57.7	39%	0.388	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	117.7	171	179.2	0	0	0	0	108.4	F1716 A1833 L1834 I1844	F1716-V1841 HydrophobicContact CD1-CG2 4.16Å; F1716-V1841 HydrophobicContact CE1-CG2 4.03Å; A1833-V1841 CarbonylContact O-C 3.59Å; A1833-V1841 WeakPolarHBondContact O-CA 3.45Å; L1834-V1841 HydrophobicContact CD1-CG2 4.23Å; V1841-I1844 HydrophobicContact CG1-CD1 4.22Å; V1841-I1844 HydrophobicContact CG1-CG1 3.73Å
1842	I	71.7	Confident	70.4	Confident	59 Å²	59	57.7 Å²	57.7	30%	0.303	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-48.2	179.2	-48.3	171	0	0	0	109.4	Y1821 A1833 D1835 Q1840	Y1821-I1842 HydrophobicContact CD1-CD1 3.58Å; Y1821-I1842 HydrophobicContact CE1-CD1 3.76Å; A1833-I1842 PolarHBondContact O-N 3.5Å; D1835-I1842 HydrophobicContact CB-CD1 4.01Å; D1835-I1842 HydrophobicContact CB-CG1 4.12Å; Q1840-I1842 PolarHBondContact O-N 2.96Å
1843	H	70.9	Confident	70.4	Confident	52 Å²	52	60.3 Å²	60.3	24%	0.241	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	151.8	-174.6	-101.8	-80.4	0	0	0	112.1	T1832 A1833 W1845 S1879	T1832-H1843 WeakPolarHBondContact CA-O 3.42Å; A1833-H1843 PolarHBondContact N-O 3.46Å; A1833-H1843 PolarHBondContact O-N 2.9Å; H1843-W1845 HydrophobicContact CB-CD2 4.18Å; H1843-W1845 HydrophobicContact CB-CE3 4.34Å; H1843-W1845 HydrophobicContact CB-CH2 3.5Å; H1843-W1845 HydrophobicContact CB-CZ2 3.28Å; H1843-W1845 HydrophobicContact CB-CZ3 4.04Å; H1843-W1845 AromaticContact CG-CE2 3.99Å; H1843-W1845 AromaticContact CG-CZ2 3.75Å; H1843-W1845 AromaticContact ND1-NE1 3.93Å; H1843-S1879 WeakPolarHBondContact NE2-CA 3.18Å; H1843-S1879 WeakPolarHBondContact NE2-CB 3.32Å
1844	I	72	Confident	70.3	Confident	85 Å²	85	63.9 Å²	63.9	44%	0.436	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	119.7	170.5	-56.3	-173.9	0	0	0	107.4	I1830 T1832 V1841	I1830-I1844 HydrophobicContact CG2-CG2 3.8Å; T1832-I1844 HydrophobicContact CG2-CB 4.35Å; T1832-I1844 HydrophobicContact CG2-CD1 4.33Å; T1832-I1844 HydrophobicContact CG2-CG1 3.9Å; T1832-I1844 HydrophobicContact CG2-CG2 4.08Å; V1841-I1844 HydrophobicContact CG1-CD1 4.22Å; V1841-I1844 HydrophobicContact CG1-CG1 3.73Å
1845	W	66.9	Low	70.7	Confident	53 Å²	53	63.9 Å²	63.9	20%	0.201	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	152.1	174.9	-52.2	-87.9	0	0	0	110.5	I1830 I1831 A1833 H1843 E1847 I1874 P1876	I1830-W1845 CarbonylContact C-O 3.54Å; I1830-W1845 VanDerWaalsContact CA-O 3.32Å; I1830-W1845 WeakPolarHBondContact CA-O 3.38Å; I1830-W1845 WeakPolarHBondContact CG2-O 3.44Å; I1831-W1845 HydrophobicContact CB-CE3 4.32Å; I1831-W1845 HydrophobicContact CG2-CE3 4.07Å; I1831-W1845 HydrophobicContact CG2-CZ3 4.33Å; I1831-W1845 PolarHBondContact N-O 2.96Å; I1831-W1845 PolarHBondContact O-N 3.17Å; A1833-W1845 HydrophobicContact CB-CH2 3.49Å; A1833-W1845 VanDerWaalsContact CB-CH2 3.49Å; A1833-W1845 HydrophobicContact CB-CZ3 3.52Å; H1843-W1845 HydrophobicContact CB-CD2 4.18Å; H1843-W1845 HydrophobicContact CB-CE3 4.34Å; H1843-W1845 HydrophobicContact CB-CH2 3.5Å; H1843-W1845 HydrophobicContact CB-CZ2 3.28Å; H1843-W1845 HydrophobicContact CB-CZ3 4.04Å; H1843-W1845 AromaticContact CG-CE2 3.99Å; H1843-W1845 AromaticContact CG-CZ2 3.75Å; H1843-W1845 AromaticContact ND1-NE1 3.93Å; W1845-E1847 HydrophobicContact CB-CG 3.79Å; W1845-I1874 HydrophobicContact CD2-CG2 4.09Å; W1845-I1874 HydrophobicContact CE3-CG2 4.04Å; W1845-I1874 HydrophobicContact CH2-CG2 3.84Å; W1845-I1874 HydrophobicContact CZ2-CG2 3.87Å; W1845-I1874 HydrophobicContact CZ3-CG2 3.92Å; W1845-P1876 HydrophobicContact CH2-CB 3.91Å
1846	R	74.4	Confident	70.9	Confident	129 Å²	129	67.5 Å²	67.5	49%	0.487	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	81.2	164.8	-169.7	174.4	-169.6	171	5	109.5	T1828 I1830 Y1848	T1828-R1846 PolarHBondContact O-NE 2.93Å; T1828-R1846 PolarHBondContact O-NH2 3.5Å; I1830-R1846 HydrophobicContact CG1-CB 4.17Å; I1830-R1846 HydrophobicContact CG1-CG 3.9Å; R1846-Y1848 WeakPolarHBondContact CG-O 3.45Å
1847	E	64.4	Low	71.1	Confident	44 Å²	44	68.2 Å²	68.2	21%	0.206	34%	0.342	C	S	.	.			trans	-79.2	-26.1	-174.9	-52.9	-161.1	154.7	0	0	112.4	G1829 W1845 S1872 I1874	G1829-E1847 PolarHBondContact O-N 2.97Å; W1845-E1847 HydrophobicContact CB-CG 3.79Å; E1847-S1872 VanDerWaalsContact OE2-CB 3.26Å; E1847-S1872 WeakPolarHBondContact OE2-CB 3.46Å; E1847-S1872 PolarHBondContact OE2-OG 2.86Å; E1847-I1874 WeakPolarHBondContact OE1-CG1 3.23Å; E1847-I1874 VanDerWaalsContact OE2-CD1 3.27Å; E1847-I1874 WeakPolarHBondContact OE2-CD1 3.1Å; E1847-I1874 WeakPolarHBondContact OE2-CG1 3.46Å
1848	Y	73.7	Confident	71.6	Confident	7 Å²	7	64.3 Å²	64.3	3%	0.027	33%	0.33	C	S	.	.			trans	-121.2	152.7	-178.7	-57.7	-38.9	0	0	0	112.7	G1829 R1846 D1850 V1852 S1865 N1867 N1870 S1872	G1829-Y1848 WeakPolarHBondContact CA-O 3.35Å; G1829-Y1848 PolarHBondContact O-N 3.48Å; R1846-Y1848 WeakPolarHBondContact CG-O 3.45Å; Y1848-D1850 WeakPolarHBondContact CB-O 3.25Å; Y1848-V1852 HydrophobicContact CD2-CG2 4.2Å; Y1848-S1865 WeakPolarHBondContact CE2-OG 3.42Å; Y1848-S1865 PolarHBondContact OH-O 3Å; Y1848-S1865 PolarHBondContact OH-OG 2.79Å; Y1848-N1867 WeakPolarHBondContact CB-ND2 3.41Å; Y1848-N1867 HydrophobicContact CD1-CB 4.36Å; Y1848-N1867 HydrophobicContact CD2-CB 3.63Å; Y1848-N1867 HydrophobicContact CE1-CB 4.34Å; Y1848-N1867 HydrophobicContact CE2-CB 3.58Å; Y1848-N1867 HydrophobicContact CG-CB 4.03Å; Y1848-N1870 HydrophobicContact CD1-CB 4.28Å; Y1848-N1870 HydrophobicContact CE1-CB 3.69Å; Y1848-N1870 VanDerWaalsContact CE1-ND2 3.31Å; Y1848-N1870 WeakPolarHBondContact CE1-ND2 3.25Å; Y1848-S1872 PolarHBondContact OH-N 2.77Å; Y1848-S1872 VanDerWaalsContact OH-N 3.15Å; Y1848-S1872 PolarHBondContact OH-OG 2.82Å
1849	Q	68.3	Low	71.5	Confident	145 Å²	145	63 Å²	63	68%	0.678	33%	0.325	S	S	*	.	S	Bend	trans	-84.2	-36.8	169.4	-65.3	-174.8	-25.8	0	0	110.9
1850	D	74.4	Confident	71.5	Confident	78 Å²	78	64 Å²	64	42%	0.417	32%	0.322	S	S	.	.	S	Bend	trans	-96.6	177.1	174.1	-52.2	-57.6	0	0	0	111.9	G1829 Y1848	G1829-D1850 WeakPolarHBondContact CA-O 3.39Å; G1829-D1850 PolarHBondContact N-O 2.86Å; Y1848-D1850 WeakPolarHBondContact CB-O 3.25Å
1851	S	77	Confident	71.9	Confident	39 Å²	39	61.8 Å²	61.8	27%	0.273	31%	0.313	S	S	.	.			trans	-60	139.7	-174.3	51.9	0	0	0	0	115.5	T1827 V1853 N1867	T1827-S1851 WeakPolarHBondContact O-CA 3.48Å; T1827-S1851 WeakPolarHBondContact O-CB 3.49Å; S1851-V1853 PolarHBondContact O-N 2.6Å; S1851-N1867 VanDerWaalsContact O-CG 3.25Å; S1851-N1867 PolarHBondContact O-OD1 3.05Å
1852	V	75.5	Confident	72.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.299	C	S	.	.			trans	-70.2	123.6	165.1	-165.8	0	0	0	0	108.6	N1811 F1826 I1831 Y1848 I1855	N1811-V1852 PolarHBondContact ND2-O 3.47Å; F1826-V1852 PolarHBondContact O-N 3.1Å; I1831-V1852 HydrophobicContact CD1-CG1 3.99Å; I1831-V1852 HydrophobicContact CD1-CG2 4.01Å; I1831-V1852 HydrophobicContact CG1-CG1 4.17Å; I1831-V1852 HydrophobicContact CG1-CG2 3.58Å; Y1848-V1852 HydrophobicContact CD2-CG2 4.2Å; V1852-I1855 HydrophobicContact CG1-CD1 4.16Å; V1852-I1855 HydrophobicContact CG1-CG1 3.85Å
1853	V	77.6	Confident	72.5	Confident	59 Å²	59	56.4 Å²	56.4	36%	0.358	29%	0.285	S	S	.	.			trans	-91	-45.9	-176.1	175.5	0	0	0	0	111.1	S1851 C1866	S1851-V1853 PolarHBondContact O-N 2.6Å; V1853-C1866 PolarHBondContact N-O 2.91Å
1854	D	78.8	Confident	73.1	Confident	75 Å²	75	55.7 Å²	55.7	40%	0.401	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	159.5	-178.2	-161.8	6.4	0	0	0	111.2	S1865 C1866	D1854-S1865 WeakPolarHBondContact O-CA 3.19Å; D1854-C1866 HydrophobicContact CB-CB 4.48Å; D1854-C1866 PolarHBondContact N-O 3.22Å; D1854-C1866 PolarHBondContact O-N 2.82Å
1855	I	83.9	Confident	73.6	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	121.8	173.5	-39.7	176.5	0	0	0	110	T1814 L1823 I1831 V1852 F1863 I1864	T1814-I1855 WeakPolarHBondContact CB-O 3.16Å; T1814-I1855 HydrophobicContact CG2-CB 3.55Å; T1814-I1855 HydrophobicContact CG2-CG2 3.5Å; T1814-I1855 WeakPolarHBondContact CG2-O 3.4Å; T1814-I1855 PolarHBondContact OG1-O 3.07Å; L1823-I1855 HydrophobicContact CB-CD1 4.26Å; L1823-I1855 HydrophobicContact CD2-CG2 4.28Å; I1831-I1855 HydrophobicContact CD1-CD1 4.3Å; I1831-I1855 HydrophobicContact CG1-CD1 4.32Å; I1831-I1855 HydrophobicContact CG2-CD1 4.02Å; V1852-I1855 HydrophobicContact CG1-CD1 4.16Å; V1852-I1855 HydrophobicContact CG1-CG1 3.85Å; I1855-F1863 HydrophobicContact CG2-CB 4.08Å; I1855-F1863 HydrophobicContact CG2-CD1 4.42Å; I1855-I1864 CarbonylContact C-O 3.6Å; I1855-I1864 WeakPolarHBondContact CA-O 3.49Å
1856	I	79.9	Confident	74.3	Confident	92 Å²	92	51.4 Å²	51.4	47%	0.472	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.8	-173.4	-58	175.8	0	0	0	109.3	F1863 I1864	I1856-F1863 CarbonylContact O-C 3.59Å; I1856-F1863 WeakPolarHBondContact O-CA 3.22Å; I1856-I1864 PolarHBondContact N-O 2.74Å; I1856-I1864 PolarHBondContact O-N 3.37Å
1857	P	75.3	Confident	74.6	Confident	55 Å²	55	45.6 Å²	45.6	36%	0.357	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	137.4	175.8	31	-33	0	0	0	110.8	F1863	P1857-F1863 HydrophobicContact CB-CD1 4.06Å; P1857-F1863 HydrophobicContact CB-CE1 4Å
1858	H	75.1	Confident	75	Confident	69 Å²	69	50 Å²	50	32%	0.319	27%	0.271	S	S	.	.			trans	-90.3	168	177.8	-166.7	-115.8	0	0	0	111.6	L1860 G1862	H1858-L1860 PolarHBondContact O-N 2.94Å; H1858-G1862 VanDerWaalsContact CB-O 3.29Å; H1858-G1862 WeakPolarHBondContact CB-O 3.28Å; H1858-G1862 PolarHBondContact N-O 3.09Å
1859	L	60.8	Low	75	Confident	87 Å²	87	56.3 Å²	56.3	46%	0.455	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-13.8	177.9	-95.8	141.9	0	0	0	114.5	R1817	R1817-L1859 VanDerWaalsContact NH1-CD2 3.26Å
1860	L	59.7	Low	75.1	Confident	57 Å²	57	50.8 Å²	50.8	30%	0.298	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	40.6	-167.9	-47.7	176.8	0	0	0	111.2	H1858 G1862 Y1890	H1858-L1860 PolarHBondContact O-N 2.94Å; L1860-G1862 PolarHBondContact O-N 3.23Å; L1860-Y1890 HydrophobicContact CD2-CD1 4.21Å
1861	D	64.9	Low	75.5	Confident	46 Å²	46	51 Å²	51	25%	0.246	27%	0.271	C	S	.	.	S	Bend	trans	52.9	-6.2	-175.5	-92.1	-18	0	0	0	118.9	N1818	N1818-D1861 VanDerWaalsContact ND2-CG 3.31Å; N1818-D1861 PolarHBondContact ND2-OD1 2.86Å; N1818-D1861 PolarHBondContact ND2-OD2 3.16Å
1862	G	69.5	Low	75.5	Confident	10 Å²	10	50.1 Å²	50.1	10%	0.103	27%	0.265	C	S	.	.			trans	-74.2	177.8	163.9	0	0	0	0	0	113.7	H1858 L1860 I1874	H1858-G1862 VanDerWaalsContact CB-O 3.29Å; H1858-G1862 WeakPolarHBondContact CB-O 3.28Å; H1858-G1862 PolarHBondContact N-O 3.09Å; L1860-G1862 PolarHBondContact O-N 3.23Å; G1862-I1874 CarbonylContact C-O 3.46Å; G1862-I1874 VanDerWaalsContact CA-O 3.3Å; G1862-I1874 WeakPolarHBondContact CA-O 3.48Å
1863	F	80.5	Confident	75.8	Confident	1 Å²	1	57.1 Å²	57.1	0%	0.004	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	149.7	-179.1	-64.8	-100.7	0	0	0	109.9	T1814 L1823 I1855 I1856 P1857 F1873 I1874 P1876	T1814-F1863 HydrophobicContact CG2-CD1 3.53Å; T1814-F1863 HydrophobicContact CG2-CE1 3.69Å; L1823-F1863 HydrophobicContact CD1-CD1 4.45Å; L1823-F1863 HydrophobicContact CD1-CD2 4.04Å; L1823-F1863 HydrophobicContact CD1-CE1 4.15Å; L1823-F1863 HydrophobicContact CD1-CE2 3.75Å; L1823-F1863 HydrophobicContact CD1-CG 4.37Å; L1823-F1863 HydrophobicContact CD1-CZ 3.76Å; L1823-F1863 HydrophobicContact CD2-CB 3.94Å; L1823-F1863 HydrophobicContact CD2-CD1 4.13Å; L1823-F1863 HydrophobicContact CD2-CD2 3.96Å; L1823-F1863 HydrophobicContact CD2-CG 3.74Å; I1855-F1863 HydrophobicContact CG2-CB 4.08Å; I1855-F1863 HydrophobicContact CG2-CD1 4.42Å; I1856-F1863 CarbonylContact O-C 3.59Å; I1856-F1863 WeakPolarHBondContact O-CA 3.22Å; P1857-F1863 HydrophobicContact CB-CD1 4.06Å; P1857-F1863 HydrophobicContact CB-CE1 4Å; F1863-F1873 CarbonylContact O-C 3.52Å; F1863-F1873 WeakPolarHBondContact O-CA 3.38Å; F1863-I1874 HydrophobicContact CB-CB 4.48Å; F1863-I1874 PolarHBondContact N-O 2.93Å; F1863-I1874 PolarHBondContact O-N 3.03Å; F1863-P1876 HydrophobicContact CD2-CG 4.12Å; F1863-P1876 HydrophobicContact CE2-CG 3.72Å
1864	I	83	Confident	75.6	Confident	36 Å²	36	54.6 Å²	54.6	19%	0.185	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	117	173.1	-64.2	171.6	0	0	0	107.5	I1855 I1856 L1871 S1872 F1873	I1855-I1864 CarbonylContact C-O 3.6Å; I1855-I1864 WeakPolarHBondContact CA-O 3.49Å; I1856-I1864 PolarHBondContact N-O 2.74Å; I1856-I1864 PolarHBondContact O-N 3.37Å; I1864-L1871 HydrophobicContact CG2-CD1 3.78Å; I1864-L1871 HydrophobicContact CG2-CD2 3.72Å; I1864-L1871 HydrophobicContact CG2-CG 3.6Å; I1864-S1872 CarbonylContact C-O 3.56Å; I1864-S1872 VanDerWaalsContact CA-O 3.3Å; I1864-S1872 WeakPolarHBondContact CA-O 3.3Å; I1864-F1873 HydrophobicContact CD1-CD1 4.37Å; I1864-F1873 HydrophobicContact CD1-CE1 3.64Å; I1864-F1873 HydrophobicContact CD1-CZ 3.96Å; I1864-F1873 HydrophobicContact CG1-CD1 3.73Å; I1864-F1873 HydrophobicContact CG1-CE1 3.5Å; I1864-F1873 VanDerWaalsContact CG1-CE1 3.5Å; I1864-F1873 HydrophobicContact CG1-CG 4.43Å; I1864-F1873 HydrophobicContact CG1-CZ 4.02Å
1865	S	82.9	Confident	75.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	147.3	170.4	98.4	0	0	0	0	111	I1831 Y1848 D1854 L1871 S1872	I1831-S1865 WeakPolarHBondContact CD1-OG 3.31Å; Y1848-S1865 WeakPolarHBondContact CE2-OG 3.42Å; Y1848-S1865 PolarHBondContact OH-O 3Å; Y1848-S1865 PolarHBondContact OH-OG 2.79Å; D1854-S1865 WeakPolarHBondContact O-CA 3.19Å; S1865-L1871 WeakPolarHBondContact O-CA 3.2Å; S1865-S1872 PolarHBondContact N-O 3.04Å; S1865-S1872 PolarHBondContact O-N 3.17Å; S1865-S1872 PolarHBondContact OG-OG 3.18Å
1866	C	81.3	Confident	74.3	Confident	48 Å²	48	53.6 Å²	53.6	32%	0.324	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	146.7	-176.9	-168.8	0	0	0	0	111.6	V1853 D1854	V1853-C1866 PolarHBondContact N-O 2.91Å; D1854-C1866 HydrophobicContact CB-CB 4.48Å; D1854-C1866 PolarHBondContact N-O 3.22Å; D1854-C1866 PolarHBondContact O-N 2.82Å
1867	N	79.9	Confident	73.5	Confident	7 Å²	7	52.7 Å²	52.7	4%	0.037	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	159.4	172.3	-179.5	-6.1	0	0	0	107.4	Y1848 S1851 R1869 N1870	Y1848-N1867 WeakPolarHBondContact CB-ND2 3.41Å; Y1848-N1867 HydrophobicContact CD1-CB 4.36Å; Y1848-N1867 HydrophobicContact CD2-CB 3.63Å; Y1848-N1867 HydrophobicContact CE1-CB 4.34Å; Y1848-N1867 HydrophobicContact CE2-CB 3.58Å; Y1848-N1867 HydrophobicContact CG-CB 4.03Å; S1851-N1867 VanDerWaalsContact O-CG 3.25Å; S1851-N1867 PolarHBondContact O-OD1 3.05Å; N1867-R1869 PolarHBondContact O-N 3.25Å; N1867-N1870 HydrophobicContact CB-CB 4.36Å; N1867-N1870 PolarHBondContact N-O 3.05Å; N1867-N1870 PolarHBondContact O-N 3.44Å
1868	D	72.4	Confident	72.4	Confident	136 Å²	136	56 Å²	56	73%	0.727	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	-16.9	-173.3	-78.7	-6.7	0	0	0	116.1
1869	R	74	Confident	70.6	Confident	141 Å²	141	55.7 Å²	55.7	53%	0.532	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.1	6.9	-179.1	-48.2	174.8	-178.6	142.9	0.4	114.3	N1867 I1912	N1867-R1869 PolarHBondContact O-N 3.25Å; R1869-I1912 HydrophobicContact CB-CB 4.36Å; R1869-I1912 HydrophobicContact CB-CD1 4.24Å; R1869-I1912 HydrophobicContact CB-CG1 4.03Å; R1869-I1912 HydrophobicContact CB-CG2 3.44Å; R1869-I1912 VanDerWaalsContact CB-CG2 3.44Å; R1869-I1912 HydrophobicContact CG-CG2 4.32Å
1870	N	71.9	Confident	69.1	Low	28 Å²	28	61 Å²	61	15%	0.15	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	155.4	-170.6	-135.5	22.4	0	0	0	113.3	Y1848 N1867 I1912	Y1848-N1870 HydrophobicContact CD1-CB 4.28Å; Y1848-N1870 HydrophobicContact CE1-CB 3.69Å; Y1848-N1870 VanDerWaalsContact CE1-ND2 3.31Å; Y1848-N1870 WeakPolarHBondContact CE1-ND2 3.25Å; N1867-N1870 HydrophobicContact CB-CB 4.36Å; N1867-N1870 PolarHBondContact N-O 3.05Å; N1867-N1870 PolarHBondContact O-N 3.44Å; N1870-I1912 HydrophobicContact CB-CD1 4.42Å; N1870-I1912 HydrophobicContact CB-CG1 3.54Å; N1870-I1912 PolarHBondContact ND2-N 3.39Å; N1870-I1912 VanDerWaalsContact OD1-CA 3.23Å; N1870-I1912 WeakPolarHBondContact OD1-CA 3.24Å; N1870-I1912 PolarHBondContact OD1-N 3.12Å
1871	L	81.9	Confident	67.4	Low	83 Å²	83	63 Å²	63	44%	0.435	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	138.2	171.8	-173.8	151	0	0	0	108.5	I1864 S1865 F1873	I1864-L1871 HydrophobicContact CG2-CD1 3.78Å; I1864-L1871 HydrophobicContact CG2-CD2 3.72Å; I1864-L1871 HydrophobicContact CG2-CG 3.6Å; S1865-L1871 WeakPolarHBondContact O-CA 3.2Å; L1871-F1873 HydrophobicContact CD2-CD2 3.91Å; L1871-F1873 HydrophobicContact CD2-CE2 3.45Å; L1871-F1873 VanDerWaalsContact CD2-CE2 3.45Å; L1871-F1873 HydrophobicContact CD2-CZ 4.17Å
1872	S	77.9	Confident	65.7	Low	21 Å²	21	67.7 Å²	67.7	15%	0.147	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.4	178.6	68.1	0	0	0	0	111	E1847 Y1848 I1864 S1865	E1847-S1872 VanDerWaalsContact OE2-CB 3.26Å; E1847-S1872 WeakPolarHBondContact OE2-CB 3.46Å; E1847-S1872 PolarHBondContact OE2-OG 2.86Å; Y1848-S1872 PolarHBondContact OH-N 2.77Å; Y1848-S1872 VanDerWaalsContact OH-N 3.15Å; Y1848-S1872 PolarHBondContact OH-OG 2.82Å; I1864-S1872 CarbonylContact C-O 3.56Å; I1864-S1872 VanDerWaalsContact CA-O 3.3Å; I1864-S1872 WeakPolarHBondContact CA-O 3.3Å; S1865-S1872 PolarHBondContact N-O 3.04Å; S1865-S1872 PolarHBondContact O-N 3.17Å; S1865-S1872 PolarHBondContact OG-OG 3.18Å
1873	F	80.3	Confident	63.6	Low	146 Å²	146	76 Å²	76	64%	0.64	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.6	172.8	-72.8	-101.4	0	0	0	109.1	F1863 I1864 L1871	F1863-F1873 CarbonylContact O-C 3.52Å; F1863-F1873 WeakPolarHBondContact O-CA 3.38Å; I1864-F1873 HydrophobicContact CD1-CD1 4.37Å; I1864-F1873 HydrophobicContact CD1-CE1 3.64Å; I1864-F1873 HydrophobicContact CD1-CZ 3.96Å; I1864-F1873 HydrophobicContact CG1-CD1 3.73Å; I1864-F1873 HydrophobicContact CG1-CE1 3.5Å; I1864-F1873 VanDerWaalsContact CG1-CE1 3.5Å; I1864-F1873 HydrophobicContact CG1-CG 4.43Å; I1864-F1873 HydrophobicContact CG1-CZ 4.02Å; L1871-F1873 HydrophobicContact CD2-CD2 3.91Å; L1871-F1873 HydrophobicContact CD2-CE2 3.45Å; L1871-F1873 VanDerWaalsContact CD2-CE2 3.45Å; L1871-F1873 HydrophobicContact CD2-CZ 4.17Å
1874	I	73.2	Confident	60.8	Low	6 Å²	6	82.7 Å²	82.7	3%	0.031	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.9	-175.6	-39.1	-174.8	0	0	0	108.1	L1823 I1831 W1845 E1847 G1862 F1863	L1823-I1874 HydrophobicContact CD2-CD1 4.29Å; I1831-I1874 HydrophobicContact CB-CD1 4.49Å; I1831-I1874 HydrophobicContact CD1-CD1 3.46Å; I1831-I1874 VanDerWaalsContact CD1-CD1 3.46Å; I1831-I1874 HydrophobicContact CG2-CD1 4.05Å; W1845-I1874 HydrophobicContact CD2-CG2 4.09Å; W1845-I1874 HydrophobicContact CE3-CG2 4.04Å; W1845-I1874 HydrophobicContact CH2-CG2 3.84Å; W1845-I1874 HydrophobicContact CZ2-CG2 3.87Å; W1845-I1874 HydrophobicContact CZ3-CG2 3.92Å; E1847-I1874 WeakPolarHBondContact OE1-CG1 3.23Å; E1847-I1874 VanDerWaalsContact OE2-CD1 3.27Å; E1847-I1874 WeakPolarHBondContact OE2-CD1 3.1Å; E1847-I1874 WeakPolarHBondContact OE2-CG1 3.46Å; G1862-I1874 CarbonylContact C-O 3.46Å; G1862-I1874 VanDerWaalsContact CA-O 3.3Å; G1862-I1874 WeakPolarHBondContact CA-O 3.48Å; F1863-I1874 HydrophobicContact CB-CB 4.48Å; F1863-I1874 PolarHBondContact N-O 2.93Å; F1863-I1874 PolarHBondContact O-N 3.03Å
1875	N	74.7	Confident	58	Low	56 Å²	56	84.8 Å²	84.8	30%	0.299	45%	0.449	S	S	.	.			trans	-118.3	107.6	169	-168.9	-1.8	0	0	0	110	T1877 I1878	N1875-T1877 PolarHBondContact O-N 3.01Å; N1875-T1877 PolarHBondContact OD1-N 3.05Å; N1875-T1877 PolarHBondContact OD1-OG1 3.37Å; N1875-I1878 HydrophobicContact CB-CD1 3.87Å; N1875-I1878 HydrophobicContact CB-CG1 4.04Å; N1875-I1878 PolarHBondContact O-N 2.97Å
1876	P	62.2	Low	55.2	Low	1 Å²	1	92.5 Å²	92.5	1%	0.006	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-13.3	-173.5	30.3	-37.7	0	0	0	114.2	Y1821 L1823 A1833 W1845 F1863 I1878	Y1821-P1876 HydrophobicContact CD2-CG 4.32Å; L1823-P1876 HydrophobicContact CD1-CB 4.45Å; L1823-P1876 HydrophobicContact CD1-CG 4.4Å; A1833-P1876 HydrophobicContact CB-CB 3.9Å; W1845-P1876 HydrophobicContact CH2-CB 3.91Å; F1863-P1876 HydrophobicContact CD2-CG 4.12Å; F1863-P1876 HydrophobicContact CE2-CG 3.72Å; P1876-I1878 VanDerWaalsContact C-N 3.35Å
1877	T	62.3	Low	52.5	Low	72 Å²	72	95.1 Å²	95.1	44%	0.442	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-8.7	179.6	59.2	0	0	0	0	113.6	Y1821 N1875 S1879	Y1821-T1877 HydrophobicContact CE2-CG2 3.84Å; N1875-T1877 PolarHBondContact O-N 3.01Å; N1875-T1877 PolarHBondContact OD1-N 3.05Å; N1875-T1877 PolarHBondContact OD1-OG1 3.37Å; T1877-S1879 PolarHBondContact O-N 3.34Å
1878	I	52.8	Low	49.9	Very low	124 Å²	124	100.2 Å²	100.2	64%	0.636	54%	0.539	S	S	*	.			trans	-91.6	71.8	-179.7	-49.1	-178.3	0	0	0	110.1	N1875 P1876	N1875-I1878 HydrophobicContact CB-CD1 3.87Å; N1875-I1878 HydrophobicContact CB-CG1 4.04Å; N1875-I1878 PolarHBondContact O-N 2.97Å; P1876-I1878 VanDerWaalsContact C-N 3.35Å
1879	S	37.5	Very low	47.5	Very low	64 Å²	64	98.7 Å²	98.7	45%	0.448	54%	0.54	S	S	.	.			trans	-94.1	141.7	169.7	57.1	0	0	0	0	111.3	H1843 T1877 S1881	H1843-S1879 WeakPolarHBondContact NE2-CA 3.18Å; H1843-S1879 WeakPolarHBondContact NE2-CB 3.32Å; T1877-S1879 PolarHBondContact O-N 3.34Å; S1879-S1881 PolarHBondContact O-N 2.95Å
1880	Q	28.1	Very low	45.2	Very low	199 Å²	199	100.1 Å²	100.1	93%	0.93	55%	0.546	S	S	*	.	S	Bend	trans	-75.2	93.5	-166.5	-64.2	178.8	-58.9	0	0	114.5
1881	S	25	Very low	42.9	Very low	98 Å²	98	103 Å²	103	69%	0.685	57%	0.568	S	S	*	*	S	Bend	trans	-147.8	131.7	156.8	53.7	0	0	0	0	109.1	S1879	S1879-S1881 PolarHBondContact O-N 2.95Å
1882	N	28	Very low	40.1	Very low	145 Å²	145	105.7 Å²	105.7	78%	0.775	58%	0.579	S	S	*	*			trans	58	120.6	-169.4	-67.5	2	0	0	0	116
1883	Q	25	Very low	37.6	Very low	183 Å²	183	108.2 Å²	108.2	86%	0.855	59%	0.59	S	S	*	*	S	Bend	trans	-80.4	160.1	153.6	-64.4	171.8	-50.7	0	0	107.5
1884	N	23.6	Very low	34.9	Very low	143 Å²	143	106.6 Å²	106.6	77%	0.765	59%	0.585	S	S	*	*	S	Bend	trans	78.5	161.4	-170	-49.6	-13.8	0	0	0	113.9	L1886	N1884-L1886 PolarHBondContact O-N 3.29Å
1885	S	23	Very low	32.6	Very low	80 Å²	80	110.2 Å²	110.2	56%	0.559	60%	0.601	S	S	*	*	S	Bend	trans	52.5	42.1	174.9	65.8	0	0	0	0	119.9
1886	L	24.4	Very low	30.2	Very low	161 Å²	161	112.9 Å²	112.9	84%	0.843	61%	0.611	S	S	*	*			trans	-154.3	67.6	155.7	-119.4	166.4	0	0	0	115.6	N1884	N1884-L1886 PolarHBondContact O-N 3.29Å
1887	S	23.7	Very low	28.3	Very low	104 Å²	104	117.5 Å²	117.5	73%	0.727	64%	0.635	S	S	*	*			trans	-102.4	129.3	160.1	56.6	0	0	0	0	111.4
1888	T	25.2	Very low	26.4	Very low	113 Å²	113	121.3 Å²	121.3	69%	0.693	64%	0.642	S	S	*	*			trans	59.6	98	165	54.1	0	0	0	0	119
1889	S	22.2	Very low	25	Very low	105 Å²	105	119.4 Å²	119.4	73%	0.734	63%	0.633	S	S	*	*	S	Bend	trans	-148	42.8	141.2	58.3	0	0	0	0	113.7
1890	Y	25.8	Very low	24.4	Very low	171 Å²	171	120.4 Å²	120.4	67%	0.671	64%	0.638	S	S	*	*			trans	-149.5	96.7	156.7	-105.5	-65.9	0	0	0	111.6	L1860	L1860-Y1890 HydrophobicContact CD2-CD1 4.21Å
1891	S	23.6	Very low	24.3	Very low	88 Å²	88	114.4 Å²	114.4	62%	0.615	61%	0.612	S	S	*	*			trans	-166.7	83.5	162.6	57.9	0	0	0	0	109.8
1892	E	23.6	Very low	24.4	Very low	140 Å²	140	118.1 Å²	118.1	65%	0.654	62%	0.616	S	S	*	*			trans	-133.1	147.5	159.5	-75.4	-155.4	177.8	0	0	108.9	H1895	E1892-H1895 IonicContact OE2-CE1 3.97Å; E1892-H1895 IonicContact OE2-ND1 3.07Å; E1892-H1895 PolarHBondContact OE2-ND1 2.82Å
1893	L	24.5	Very low	24.4	Very low	74 Å²	74	113.6 Å²	113.6	39%	0.387	60%	0.595	S	S	.	*	S	Bend	trans	64	80.1	-161.8	-64	128.7	0	0	0	111.2	H1895	L1893-H1895 VanDerWaalsContact CD2-CD2 3.5Å; L1893-H1895 WeakPolarHBondContact CD2-CD2 3.47Å; L1893-H1895 VanDerWaalsContact CD2-NE2 3.3Å; L1893-H1895 WeakPolarHBondContact CD2-NE2 3.36Å; L1893-H1895 VanDerWaalsContact CG-NE2 3.31Å; L1893-H1895 WeakPolarHBondContact CG-NE2 3.46Å
1894	E	23.7	Very low	24.3	Very low	112 Å²	112	108.8 Å²	108.8	52%	0.523	58%	0.578	S	S	.	*	S	Bend	cis	-70.4	134.1	17.1	-66.4	-169.3	97.6	0	0	115	N1511 H1513	N1511-E1894 HydrophobicContact CB-CB 4.3Å; N1511-E1894 HydrophobicContact CB-CG 4.02Å; N1511-E1894 WeakPolarHBondContact CB-OE1 3.26Å; N1511-E1894 WeakPolarHBondContact ND2-CB 3.32Å; H1513-E1894 IonicContact CE1-OE1 3.79Å; H1513-E1894 PolarHBondContact CE1-OE1 2.96Å; H1513-E1894 IonicContact CE1-OE2 2.88Å; H1513-E1894 PolarHBondContact CE1-OE2 3.39Å; H1513-E1894 IonicContact ND1-OE1 3.55Å
1895	H	25.6	Very low	24.4	Very low	82 Å²	82	107.2 Å²	107.2	38%	0.38	57%	0.568	S	S	.	*			trans	-86	-169.9	176.2	-64.6	-71.5	0	0	0	111	N1511 E1892 L1893	N1511-H1895 VanDerWaalsContact CG-N 3.33Å; N1511-H1895 PolarHBondContact ND2-N 2.71Å; N1511-H1895 PolarHBondContact ND2-O 3.22Å; N1511-H1895 WeakPolarHBondContact OD1-CB 3.4Å; N1511-H1895 PolarHBondContact OD1-N 2.86Å; E1892-H1895 IonicContact OE2-CE1 3.97Å; E1892-H1895 IonicContact OE2-ND1 3.07Å; E1892-H1895 PolarHBondContact OE2-ND1 2.82Å; L1893-H1895 VanDerWaalsContact CD2-CD2 3.5Å; L1893-H1895 WeakPolarHBondContact CD2-CD2 3.47Å; L1893-H1895 VanDerWaalsContact CD2-NE2 3.3Å; L1893-H1895 WeakPolarHBondContact CD2-NE2 3.36Å; L1893-H1895 VanDerWaalsContact CG-NE2 3.31Å; L1893-H1895 WeakPolarHBondContact CG-NE2 3.46Å
1896	F	25.5	Very low	24.3	Very low	112 Å²	112	109.1 Å²	109.1	49%	0.491	58%	0.582	S	S	.	*			trans	81.6	89.9	178.5	-72.2	-93.7	0	0	0	115.5	D1509	D1509-F1896 HydrophobicContact CB-CD1 4.07Å; D1509-F1896 HydrophobicContact CB-CD2 4.41Å; D1509-F1896 HydrophobicContact CB-CE1 3.53Å; D1509-F1896 HydrophobicContact CB-CE2 3.92Å; D1509-F1896 HydrophobicContact CB-CG 4.49Å; D1509-F1896 HydrophobicContact CB-CZ 3.45Å; D1509-F1896 VanDerWaalsContact CB-CZ 3.45Å; D1509-F1896 WeakPolarHBondContact O-CD1 3.29Å; D1509-F1896 WeakPolarHBondContact O-CD2 3.36Å; D1509-F1896 WeakPolarHBondContact O-CG 3.27Å
1897	N	20.7	Very low	24.3	Very low	97 Å²	97	108.5 Å²	108.5	52%	0.519	58%	0.578	S	S	.	*			trans	52.6	105.5	140.4	-64.9	-53.1	0	0	0	119.5	K1148	K1148-N1897 PolarHBondContact NZ-OD1 2.81Å
1898	Y	22	Very low	24.3	Very low	152 Å²	152	112.5 Å²	112.5	60%	0.596	58%	0.583	S	S	*	*			trans	73.3	131.5	131.5	-86.7	-89.6	0	0	0	120.8	K1148 L1150	K1148-Y1898 HydrophobicContact CD-CD2 3.94Å; K1148-Y1898 HydrophobicContact CD-CE2 3.54Å; L1150-Y1898 HydrophobicContact CD1-CD1 4.11Å; L1150-Y1898 HydrophobicContact CD1-CE1 4.24Å; L1150-Y1898 HydrophobicContact CD2-CD1 3.39Å; L1150-Y1898 HydrophobicContact CD2-CD2 4.39Å; L1150-Y1898 HydrophobicContact CD2-CE1 3.87Å; L1150-Y1898 HydrophobicContact CD2-CG 3.67Å; L1150-Y1898 HydrophobicContact CG-CD1 4.41Å
1899	L	23.9	Very low	24.3	Very low	85 Å²	85	112.5 Å²	112.5	45%	0.445	59%	0.585	S	S	.	*			trans	70.5	148.3	169	-93.7	61	0	0	0	117.1	L1150 F1168	L1150-L1899 HydrophobicContact CB-CD2 4.24Å; L1150-L1899 HydrophobicContact CD1-CD1 3.78Å; F1168-L1899 HydrophobicContact CE2-CD2 4.32Å; F1168-L1899 HydrophobicContact CZ-CD2 4.35Å
1900	P	24.7	Very low	24.4	Very low	84 Å²	84	115.8 Å²	115.8	55%	0.545	59%	0.586	S	S	.	*			trans	-126.6	-165	-154.2	42.2	-24.3	0	0	0	112.8
1901	N	25.7	Very low	24.3	Very low	74 Å²	74	110.4 Å²	110.4	40%	0.396	57%	0.573	S	S	.	*			trans	60.5	92.8	165.1	-61.8	-17.9	0	0	0	114.4
1902	K	27.4	Very low	24.4	Very low	175 Å²	175	108.3 Å²	108.3	76%	0.761	55%	0.554	S	S	*	*				56.4	126.9	82.3	-67.3	-175.3	173.3	-179.7	0	112	I1267	I1267-K1902 VanDerWaalsContact CG2-O 3.29Å; I1267-K1902 WeakPolarHBondContact CG2-O 2.99Å
1903	P	27.7	Very low	24.5	Very low	50 Å²	50	111.5 Å²	111.5	33%	0.325	56%	0.561	S	S	.	*				-117	161.5	85.5	-8.3	31.9	0	0	0	111	I1267	I1267-P1903 HydrophobicContact CB-CG 4.32Å; I1267-P1903 HydrophobicContact CG2-CG 3.77Å; I1267-P1903 WeakPolarHBondContact O-CG 2.78Å
1904	T	23.4	Very low	24.5	Very low	83 Å²	83	113.8 Å²	113.8	51%	0.509	57%	0.572	S	S	.	*				-167.3	167	77.5	23.3	0	0	0	0	112.8	D1271	D1271-T1904 WeakPolarHBondContact OD1-CG2 3.19Å
1905	I	25.1	Very low	24.6	Very low	109 Å²	109	113.8 Å²	113.8	56%	0.559	58%	0.582	S	S	*	*			trans	64.1	111.4	152	-68.2	158.8	0	0	0	117.8	L1907	I1905-L1907 HydrophobicContact CG2-CD1 4.1Å; I1905-L1907 HydrophobicContact CG2-CG 3.77Å
1906	S	22.3	Very low	24.5	Very low	121 Å²	121	115.6 Å²	115.6	85%	0.846	60%	0.603	S	S	*	*			trans	-73.9	117.6	156.5	48.4	0	0	0	0	110.5
1907	L	24.4	Very low	24.5	Very low	147 Å²	147	116.6 Å²	116.6	77%	0.77	62%	0.619	S	S	*	*			trans	-105	102	176.8	-102.1	163.8	0	0	0	112.3	I1905	I1905-L1907 HydrophobicContact CG2-CD1 4.1Å; I1905-L1907 HydrophobicContact CG2-CG 3.77Å
1908	K	22.7	Very low	24.7	Very low	188 Å²	188	120.1 Å²	120.1	82%	0.817	64%	0.637	S	S	*	*			trans	-61.2	137.2	157.5	-67.3	170.9	-179.1	168.1	0	108.2	K1910	K1908-K1910 PolarHBondContact O-N 2.71Å
1909	P	25	Very low	24.9	Very low	113 Å²	113	122.3 Å²	122.3	73%	0.734	65%	0.652	S	S	*	*	S	Bend	trans	-72.3	98.9	-171.6	27.7	-35.1	0	0	0	112.5
1910	K	24.2	Very low	24.9	Very low	175 Å²	175	126.3 Å²	126.3	76%	0.761	67%	0.674	S	S	*	*			trans	-144.6	101.8	161.9	-78.5	-163.1	177.6	-178.8	0	112.5	K1908	K1908-K1910 PolarHBondContact O-N 2.71Å
1911	S	24.3	Very low	25	Very low	57 Å²	57	129.7 Å²	129.7	40%	0.399	69%	0.686	S	S	.	*			trans	39.9	113.9	136.4	63.5	0	0	0	0	120.5
1912	I	25.2	Very low	25.1	Very low	44 Å²	44	132 Å²	132	23%	0.226	70%	0.703	C	S	.	*				70.7	93.3	123.3	-65.8	166	0	0	0	116.6	R1869 N1870	R1869-I1912 HydrophobicContact CB-CB 4.36Å; R1869-I1912 HydrophobicContact CB-CD1 4.24Å; R1869-I1912 HydrophobicContact CB-CG1 4.03Å; R1869-I1912 HydrophobicContact CB-CG2 3.44Å; R1869-I1912 VanDerWaalsContact CB-CG2 3.44Å; R1869-I1912 HydrophobicContact CG-CG2 4.32Å; N1870-I1912 HydrophobicContact CB-CD1 4.42Å; N1870-I1912 HydrophobicContact CB-CG1 3.54Å; N1870-I1912 PolarHBondContact ND2-N 3.39Å; N1870-I1912 VanDerWaalsContact OD1-CA 3.23Å; N1870-I1912 WeakPolarHBondContact OD1-CA 3.24Å; N1870-I1912 PolarHBondContact OD1-N 3.12Å
1913	R	25.6	Very low	25.1	Very low	208 Å²	208	128.9 Å²	128.9	79%	0.785	70%	0.702	S	S	*	*				-172.9	138.8	104.5	-102.8	168.4	-168.6	167.5	5	114
1914	I	25.6	Very low	24.9	Very low	122 Å²	122	133.9 Å²	133.9	63%	0.626	73%	0.725	S	S	*	*			trans	-73.3	143	163.8	-68	172.2	0	0	0	108.9
1915	P	25.1	Very low	25.1	Very low	112 Å²	112	136.9 Å²	136.9	73%	0.727	74%	0.744	S	S	*	*			trans	-71.7	151.8	-168.7	27.6	-36.8	0	0	0	114.9
1916	S	23.5	Very low	25.1	Very low	119 Å²	119	140.6 Å²	140.6	83%	0.832	76%	0.756	S	S	*	*			trans	-106.5	77.8	-173.6	58.8	0	0	0	0	113.2
1917	T	26	Very low	25.3	Very low	134 Å²	134	146 Å²	146	82%	0.822	76%	0.759	S	S	*	*			trans	-130.9	24.8	175.8	43.7	0	0	0	0	114
1918	L	25.2	Very low	25.5	Very low	171 Å²	171	146.5 Å²	146.5	90%	0.895	76%	0.758	S	S	*	*	S	Bend	trans	-143.8	37.8	177.4	-123.7	175.4	0	0	0	115.7
1919	Q	26.6	Very low	25.6	Very low	197 Å²	197	144.8 Å²	144.8	92%	0.921	75%	0.753	S	S	*	*			trans	-154.7	100.7	162.2	-118.8	172.3	23.3	0	0	112.1
1920	N	23	Very low	25.6	Very low	170 Å²	170	146.7 Å²	146.7	91%	0.909	76%	0.757	S	S	*	*			trans	-125.2	92.3	172.2	-113.9	-18.9	0	0	0	108.8
1921	I	26.7	Very low	26.2	Very low	155 Å²	155	143.6 Å²	143.6	80%	0.795	76%	0.755	S	S	*	*			trans	-157.9	135.9	166.8	-106.9	154.1	0	0	0	109.3
1922	T	28	Very low	26.2	Very low	122 Å²	122	147.8 Å²	147.8	75%	0.748	77%	0.771	S	S	*	*			trans	59.8	91.1	170.4	47.9	0	0	0	0	120.9
1923	C	26.5	Very low	26.2	Very low	110 Å²	110	154.6 Å²	154.6	74%	0.743	80%	0.799	S	S	*	*				68.8	106.6	118.2	-61.8	0	0	0	0	123.1
1924	L	23.9	Very low	26.2	Very low	154 Å²	154	149 Å²	149	81%	0.806	79%	0.791	S	S	*	*				54.7	112.9	119.3	-69.3	162.2	0	0	0	120.7
1925	T	29.2	Very low	26.3	Very low	146 Å²	146	145.6 Å²	145.6	90%	0.896	78%	0.781	S	S	*	*				-164.6	161.1	98.6	15.7	0	0	0	0	112.2
1926	K	23.9	Very low	26.5	Very low	188 Å²	188	146.7 Å²	146.7	82%	0.817	78%	0.781	S	S	*	*			trans	-89.4	154.7	-179.2	-61.1	176.6	175.7	-178.7	0	111.7
1927	Y	27.1	Very low	26.5	Very low	234 Å²	234	146.5 Å²	146.5	92%	0.918	78%	0.779	S	S	*	*				-169.5	152.6	113.5	-110	-77.5	0	0	0	110.7
1928	Q	27.6	Very low	26.7	Very low	158 Å²	158	145.7 Å²	145.7	74%	0.738	77%	0.769	S	S	*	*			trans	-105.6	144.1	-177.1	-78.5	177.5	-95.1	0	0	113.2
1929	E	26.1	Very low	27.1	Very low	152 Å²	152	141.1 Å²	141.1	71%	0.71	75%	0.75	S	S	*	*			trans	44.3	113.3	142.6	-64.4	150.3	-117.4	0	0	119.9
1930	N	25.2	Very low	27	Very low	153 Å²	153	139.8 Å²	139.8	82%	0.818	75%	0.748	S	S	*	*				56.1	156	65.8	-75.7	-12.3	0	0	0	115.8
1931	P	36.4	Very low	27.3	Very low	110 Å²	110	135.8 Å²	135.8	71%	0.714	73%	0.733	S	S	*	*			cis	-136.3	-118.2	-30.8	37.9	-18.4	0	0	0	111.8
1932	I	24.9	Very low	27.2	Very low	145 Å²	145	138.9 Å²	138.9	74%	0.744	74%	0.737	S	S	*	*			trans	78.2	131.1	169.5	-65.2	173.6	0	0	0	115.5
1933	F	24.5	Very low	27.5	Very low	186 Å²	186	137.6 Å²	137.6	82%	0.816	73%	0.731	S	S	*	*			cis	-164.3	-148.4	-21.9	-131.4	-36	0	0	0	106.3
1934	C	25.3	Very low	27.4	Very low	92 Å²	92	140.1 Å²	140.1	62%	0.622	74%	0.736	S	S	*	*			cis	-165.4	-174.9	-3.7	-124.4	0	0	0	0	105.5
1935	A	26.7	Very low	27.8	Very low	49 Å²	49	137.9 Å²	137.9	41%	0.405	73%	0.731	S	S	.	*			cis	-165	152.1	-11.4	0	0	0	0	0	108.9	L1938	A1935-L1938 HydrophobicContact CB-CB 4.05Å; A1935-L1938 HydrophobicContact CB-CD1 3.9Å; A1935-L1938 HydrophobicContact CB-CD2 4.19Å; A1935-L1938 HydrophobicContact CB-CG 4.27Å
1936	N	29.3	Very low	27.6	Very low	136 Å²	136	136 Å²	136	73%	0.727	72%	0.723	S	S	*	*	S	Bend	trans	164.4	131.2	130	-84.2	-10.1	0	0	0	111.5
1937	S	23.9	Very low	27.9	Very low	115 Å²	115	133 Å²	133	80%	0.804	72%	0.721	S	S	*	*	S	Bend	cis	-125.4	125.9	6.6	53.9	0	0	0	0	112.7
1938	L	30.6	Very low	28.1	Very low	116 Å²	116	126.9 Å²	126.9	61%	0.607	71%	0.712	S	S	*	*			cis	61.6	165	-5	-75.2	141.3	0	0	0	116	A1935	A1935-L1938 HydrophobicContact CB-CB 4.05Å; A1935-L1938 HydrophobicContact CB-CD1 3.9Å; A1935-L1938 HydrophobicContact CB-CD2 4.19Å; A1935-L1938 HydrophobicContact CB-CG 4.27Å
1939	P	33.3	Very low	28	Very low	75 Å²	75	130.1 Å²	130.1	49%	0.487	72%	0.718	S	S	.	*			cis	-134.4	147.4	-22.8	32	-14.4	0	0	0	115
1940	L	25.4	Very low	28	Very low	170 Å²	170	131.7 Å²	131.7	89%	0.89	72%	0.723	S	S	*	*			trans	-166	140.5	150.7	-91	125.8	0	0	0	107.5
1941	S	28.5	Very low	28.4	Very low	85 Å²	85	129 Å²	129	59%	0.594	71%	0.713	S	S	*	*			cis	-166.2	129.3	-17.8	46.8	0	0	0	0	111.3
1942	Y	24.8	Very low	27.9	Very low	220 Å²	220	130.4 Å²	130.4	86%	0.863	71%	0.713	S	S	*	*			trans	35.2	159.7	132.4	-68	-81.2	0	0	0	122.8
1943	P	33.8	Very low	28	Very low	96 Å²	96	133.5 Å²	133.5	62%	0.623	72%	0.722	S	S	*	*				-149.8	-162.9	-54.4	42.9	-22.6	0	0	0	114.9
1944	L	25.3	Very low	28	Very low	162 Å²	162	127.3 Å²	127.3	85%	0.848	71%	0.71	S	S	*	*			trans	74.8	167.4	153	-78.4	170.4	0	0	0	117.3
1945	P	32.6	Very low	27.9	Very low	108 Å²	108	129.3 Å²	129.3	70%	0.701	73%	0.726	S	S	*	*				-113.8	173.8	-128.3	43.2	-40.3	0	0	0	118.1
1946	S	25.3	Very low	27.8	Very low	105 Å²	105	130.3 Å²	130.3	73%	0.734	74%	0.741	S	S	*	*			trans	84.4	126.3	159.6	69.5	0	0	0	0	120
1947	T	29.9	Very low	27.5	Very low	127 Å²	127	129.9 Å²	129.9	78%	0.779	75%	0.749	S	S	*	*			trans	62.2	112.7	153.7	47.9	0	0	0	0	122.4
1948	S	30	Very low	27.6	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	75%	0.749	S	S	*	*			trans	77.2	114.1	135.6	60.8	0	0	0	0	124.6
1949	R	27.3	Very low	27.6	Very low	225 Å²	225	126.6 Å²	126.6	85%	0.849	76%	0.761	S	S	*	*			trans	76.2	136.6	131.9	-72	-175	173.9	-179.3	-2.3	123.3
1950	F	24.8	Very low	27.2	Very low	186 Å²	186	126.6 Å²	126.6	82%	0.816	77%	0.774	S	S	*	*			trans	78.5	160.1	149.1	-82.9	-46.4	0	0	0	119.5
1951	P	33.8	Very low	28	Very low	96 Å²	96	122 Å²	122	62%	0.623	77%	0.768	S	S	*	*				-140.2	-167.5	-126	48.8	-31.2	0	0	0	117.2
1952	I	26.2	Very low	28.1	Very low	139 Å²	139	123.8 Å²	123.8	71%	0.713	78%	0.775	S	S	*	*			trans	62	111.5	161.3	-56.1	164.8	0	0	0	117.9
1953	F	26.9	Very low	28.3	Very low	210 Å²	210	119.7 Å²	119.7	92%	0.921	77%	0.769	S	S	*	*				-174.7	177	115.4	-109.9	-74.5	0	0	0	109.7
1954	G	24.4	Very low	28	Very low	56 Å²	56	121.7 Å²	121.7	58%	0.577	77%	0.774	S	S	*	*			trans	-164	-163.3	-177.3	0	0	0	0	0	115.6
1955	S	24.1	Very low	28.1	Very low	135 Å²	135	119.8 Å²	119.8	94%	0.944	77%	0.769	S	S	*	*			trans	72.8	163.3	-174.7	82.6	0	0	0	0	116.6
1956	G	23.7	Very low	27.9	Very low	70 Å²	70	119.9 Å²	119.9	72%	0.722	77%	0.768	S	S	*	*			trans	114	63.1	154.4	0	0	0	0	0	120.5
1957	S	23.6	Very low	28.1	Very low	127 Å²	127	120.4 Å²	120.4	89%	0.888	77%	0.766	S	S	*	*			trans	15.8	115.2	139.5	173.7	0	0	0	0	121.5
1958	G	26.3	Very low	27.9	Very low	79 Å²	79	121.8 Å²	121.8	81%	0.814	77%	0.769	S	S	*	*			trans	78.5	163.7	150.4	0	0	0	0	0	117.3
1959	G	29.3	Very low	28.7	Very low	83 Å²	83	122.9 Å²	122.9	86%	0.856	77%	0.774	S	S	*	*			cis	175	159.3	-6	0	0	0	0	0	111.5
1960	G	26.2	Very low	28.7	Very low	75 Å²	75	118.5 Å²	118.5	77%	0.773	77%	0.767	S	S	*	*			trans	103.5	172	178.1	0	0	0	0	0	115.1
1961	G	42	Very low	28.8	Very low	74 Å²	74	118 Å²	118	76%	0.763	77%	0.765	S	S	*	*			cis	66	72.8	1.9	0	0	0	0	0	112.7
1962	T	29.3	Very low	28.4	Very low	121 Å²	121	118.1 Å²	118.1	74%	0.742	77%	0.768	S	S	*	*			cis	-151.5	142.2	24.5	52.2	0	0	0	0	115
1963	N	29.8	Very low	28.4	Very low	134 Å²	134	117.3 Å²	117.3	72%	0.717	77%	0.77	S	S	*	*			trans	71	123.6	140	-60.5	-2.8	0	0	0	122.4
1964	N	27.3	Very low	28.3	Very low	138 Å²	138	112.8 Å²	112.8	74%	0.738	76%	0.764	S	S	*	*			trans	78.6	119.8	135.1	-60.2	-3.6	0	0	0	119.8
1965	V	27.7	Very low	28.3	Very low	123 Å²	123	115 Å²	115	75%	0.745	77%	0.77	S	S	*	*				98.5	132.5	92.8	159.6	0	0	0	0	112.9
1966	T	28	Very low	28.4	Very low	109 Å²	109	113.2 Å²	113.2	67%	0.669	76%	0.758	S	S	*	*			cis	-164.6	171.3	-8.2	30.3	0	0	0	0	112.3
1967	T	29.5	Very low	28.6	Very low	116 Å²	116	117.2 Å²	117.2	71%	0.712	76%	0.761	S	S	*	*			trans	74.2	116.3	143.6	41.7	0	0	0	0	123.7
1968	N	26.1	Very low	29	Very low	157 Å²	157	118.1 Å²	118.1	84%	0.84	76%	0.755	S	S	*	*			trans	42.8	143.5	136.3	-60.5	12.1	0	0	0	124
1969	P	46.3	Very low	29.4	Very low	128 Å²	128	120.4 Å²	120.4	83%	0.831	75%	0.748	S	S	*	*			trans	-114	165.9	-176.1	42.9	-35.2	0	0	0	116.8
1970	D	26.8	Very low	29.7	Very low	132 Å²	132	123.7 Å²	123.7	71%	0.706	74%	0.742	S	S	*	*			trans	-169.4	145.6	152.5	-144.3	-3.3	0	0	0	115.1
1971	K	28.4	Very low	30.2	Very low	176 Å²	176	125.5 Å²	125.5	77%	0.765	74%	0.737	S	S	*	*			trans	64.3	-178.7	157.2	-74.3	166.6	-172.2	72.4	0	122.4
1972	S	24.6	Very low	30.1	Very low	99 Å²	99	127.5 Å²	127.5	69%	0.692	74%	0.735	S	S	*	*			trans	-148.2	169.9	-143.3	64.3	0	0	0	0	118.9
1973	T	25.5	Very low	30.5	Very low	122 Å²	122	127.2 Å²	127.2	75%	0.748	73%	0.733	S	S	*	*			trans	77.1	125.5	150	38.5	0	0	0	0	124
1974	S	24.9	Very low	30.4	Very low	115 Å²	115	124.7 Å²	124.7	80%	0.804	72%	0.723	S	S	*	*			trans	66.3	148.8	151.1	38.6	0	0	0	0	121.1
1975	S	25.8	Very low	30.4	Very low	101 Å²	101	123.4 Å²	123.4	71%	0.706	72%	0.722	S	S	*	*			cis	-166.5	160.7	-3.4	49	0	0	0	0	114.8
1976	S	26	Very low	30.6	Very low	99 Å²	99	120.5 Å²	120.5	69%	0.692	70%	0.702	S	S	*	*			trans	67.1	161.9	144.1	54.6	0	0	0	0	122.6
1977	I	26.6	Very low	31	Very low	153 Å²	153	120 Å²	120	79%	0.785	70%	0.703	S	S	*	*			cis	-169.9	151	-25.5	-90.9	157.2	0	0	0	106
1978	I	32.2	Very low	31.4	Very low	146 Å²	146	119.5 Å²	119.5	75%	0.749	70%	0.704	S	S	*	*			trans	161.9	124.1	140.2	-85.1	172.7	0	0	0	113.6
1979	N	34.6	Very low	31.6	Very low	127 Å²	127	116 Å²	116	68%	0.679	70%	0.697	S	S	*	*			trans	54.1	148.9	155.6	-63.3	22.3	0	0	0	121.4
1980	E	35.5	Very low	31	Very low	153 Å²	153	116.1 Å²	116.1	72%	0.715	70%	0.695	S	S	*	*			cis	-154.5	169.7	4.4	-133.5	161.7	-104.2	0	0	114.2
1981	T	38.2	Very low	31.5	Very low	112 Å²	112	115.5 Å²	115.5	69%	0.687	70%	0.697	S	S	*	*			trans	70.7	105.3	159.8	50	0	0	0	0	123.7
1982	T	39.8	Very low	31.7	Very low	117 Å²	117	113.3 Å²	113.3	72%	0.718	70%	0.698	S	S	*	*				68.1	117.1	127	59.6	0	0	0	0	124.6
1983	T	36.1	Very low	31.8	Very low	114 Å²	114	113.1 Å²	113.1	70%	0.699	70%	0.696	S	S	*	*			trans	64	105.2	130.8	60.8	0	0	0	0	122.2
1984	T	28.6	Very low	32.3	Very low	81 Å²	81	114.4 Å²	114.4	50%	0.497	69%	0.694	S	S	.	*				40.5	109.8	123.1	63.7	0	0	0	0	117.6	Y1996	T1984-Y1996 HydrophobicContact CG2-CD2 3.47Å; T1984-Y1996 VanDerWaalsContact CG2-CD2 3.47Å; T1984-Y1996 HydrophobicContact CG2-CE2 3.89Å
1985	P	26.4	Very low	32.4	Very low	112 Å²	112	111.7 Å²	111.7	73%	0.727	67%	0.673	S	S	*	*				-134.4	-169.7	74	19.1	4.3	0	0	0	116.2	P1995 Y1996	P1985-P1995 CarbonylContact C-O 3.56Å; P1985-P1995 VanDerWaalsContact C-O 3.28Å; P1985-Y1996 VanDerWaalsContact CA-O 3.32Å; P1985-Y1996 WeakPolarHBondContact CA-O 3.31Å; P1985-Y1996 WeakPolarHBondContact CB-O 3.45Å
1986	L	32.8	Very low	32.5	Very low	61 Å²	61	113.2 Å²	113.2	32%	0.319	67%	0.665	S	S	.	*			trans	-86.3	156.7	-159.8	-139.8	153.7	0	0	0	115.8	Q1994 P1995 Y1996	L1986-Q1994 HydrophobicContact CD1-CB 4.12Å; L1986-Q1994 HydrophobicContact CD1-CG 4.46Å; L1986-Q1994 HydrophobicContact CD2-CB 4.21Å; L1986-Q1994 HydrophobicContact CD2-CG 4.18Å; L1986-Q1994 HydrophobicContact CG-CB 4.04Å; L1986-P1995 HydrophobicContact CD1-CB 4.49Å; L1986-P1995 PolarHBondContact N-O 3Å; L1986-Y1996 WeakPolarHBondContact CB-O 3.4Å; L1986-Y1996 PolarHBondContact N-O 2.81Å
1987	S	36.3	Very low	32.5	Very low	100 Å²	100	116.5 Å²	116.5	70%	0.699	66%	0.663	S	S	*	*			trans	78.4	143.2	167.8	81.7	0	0	0	0	116.9
1988	S	37.1	Very low	32.5	Very low	105 Å²	105	115.4 Å²	115.4	73%	0.734	66%	0.659	S	S	*	*			cis	-155.2	134.2	-18.8	53.5	0	0	0	0	111.5
1989	A	30.7	Very low	32.3	Very low	82 Å²	82	114.6 Å²	114.6	68%	0.678	66%	0.656	S	S	*	*			trans	63.1	164.2	179.1	0	0	0	0	0	116.1
1990	T	33.4	Very low	32.1	Very low	131 Å²	131	115.4 Å²	115.4	80%	0.804	66%	0.66	S	S	*	*	S	Bend	cis	-48.3	129.2	-2.7	41.1	0	0	0	0	113
1991	T	38.6	Very low	32	Very low	120 Å²	120	113.1 Å²	113.1	74%	0.736	66%	0.661	S	S	*	*	S	Bend	trans	46.4	98.6	168.4	55	0	0	0	0	116.5
1992	V	31.9	Very low	31.6	Very low	130 Å²	130	109.3 Å²	109.3	79%	0.788	65%	0.645	S	S	*	*			trans	69.2	-173	161.4	-169.7	0	0	0	0	112.9
1993	S	26.4	Very low	30.9	Very low	94 Å²	94	107.8 Å²	107.8	66%	0.657	64%	0.635	S	S	*	*			trans	82.4	135.2	168.2	66.6	0	0	0	0	121.1
1994	Q	36.8	Very low	30.5	Very low	150 Å²	150	106.1 Å²	106.1	70%	0.701	62%	0.621	S	S	*	*			trans	-108.4	-168.8	171	-52.7	176.1	-42.9	0	0	108.8	L1986	L1986-Q1994 HydrophobicContact CD1-CB 4.12Å; L1986-Q1994 HydrophobicContact CD1-CG 4.46Å; L1986-Q1994 HydrophobicContact CD2-CB 4.21Å; L1986-Q1994 HydrophobicContact CD2-CG 4.18Å; L1986-Q1994 HydrophobicContact CG-CB 4.04Å
1995	P	27.7	Very low	30.4	Very low	57 Å²	57	107.7 Å²	107.7	37%	0.37	63%	0.626	S	S	.	*			cis	-114.9	-175.8	-10.7	38	-21.3	0	0	0	112.8	P1985 L1986	P1985-P1995 CarbonylContact C-O 3.56Å; P1985-P1995 VanDerWaalsContact C-O 3.28Å; L1986-P1995 HydrophobicContact CD1-CB 4.49Å; L1986-P1995 PolarHBondContact N-O 3Å
1996	Y	26.8	Very low	30.4	Very low	134 Å²	134	105.6 Å²	105.6	53%	0.525	62%	0.618	S	S	.	*			cis	-133.2	148.4	10.5	-83.3	-100.1	0	0	0	108.6	T1984 P1985 L1986	T1984-Y1996 HydrophobicContact CG2-CD2 3.47Å; T1984-Y1996 VanDerWaalsContact CG2-CD2 3.47Å; T1984-Y1996 HydrophobicContact CG2-CE2 3.89Å; P1985-Y1996 VanDerWaalsContact CA-O 3.32Å; P1985-Y1996 WeakPolarHBondContact CA-O 3.31Å; P1985-Y1996 WeakPolarHBondContact CB-O 3.45Å; L1986-Y1996 WeakPolarHBondContact CB-O 3.4Å; L1986-Y1996 PolarHBondContact N-O 2.81Å
1997	Y	27.3	Very low	30	Very low	168 Å²	168	108.1 Å²	108.1	66%	0.659	64%	0.636	S	S	*	*				57.7	92.2	80.2	-61.2	-68.9	0	0	0	118.7
1998	N	26.1	Very low	29.5	Very low	129 Å²	129	111 Å²	111	69%	0.69	63%	0.633	S	S	*	*				82.8	140.3	115.2	-72.3	25	0	0	0	126.2
1999	N	28.3	Very low	28.9	Very low	129 Å²	129	109.9 Å²	109.9	69%	0.69	63%	0.625	S	S	*	*			trans	62.8	111.3	139.6	-60.9	13.8	0	0	0	121.8
2000	N	28.8	Very low	29.3	Very low	144 Å²	144	113.7 Å²	113.7	77%	0.77	62%	0.623	S	S	*	*				-179	151.9	108.7	-90.2	-26.9	0	0	0	111.9
2001	S	34.9	Very low	28.9	Very low	105 Å²	105	113.4 Å²	113.4	73%	0.734	62%	0.623	S	S	*	*			trans	48.6	126.3	162.3	57	0	0	0	0	119.8
2002	G	28.6	Very low	28.2	Very low	33 Å²	33	116.5 Å²	116.5	34%	0.34	63%	0.627	S	S	.	*			cis	123.9	139.5	-2.7	0	0	0	0	0	113.7	I2020	G2002-I2020 CarbonylContact C-O 3.24Å; G2002-I2020 VanDerWaalsContact CA-O 3.27Å; G2002-I2020 WeakPolarHBondContact CA-O 2.98Å; G2002-I2020 PolarHBondContact N-O 3.5Å
2003	T	26.2	Very low	27.9	Very low	84 Å²	84	116.1 Å²	116.1	52%	0.515	62%	0.62	S	S	.	*			trans	67	137.5	150.4	60.8	0	0	0	0	118.9	N2019 I2020	T2003-N2019 CarbonylContact C-O 3.49Å; T2003-I2020 PolarHBondContact N-O 3.17Å; T2003-I2020 VanDerWaalsContact N-O 3.17Å
2004	I	26.3	Very low	27.9	Very low	80 Å²	80	117.8 Å²	117.8	41%	0.41	62%	0.622	S	S	.	*			cis	-166.2	165.3	5.2	-123.4	165.4	0	0	0	114.1	N961 I962	N961-I2004 WeakPolarHBondContact O-CD1 3.48Å; I962-I2004 HydrophobicContact CB-CD1 3.84Å
2005	L	27.3	Very low	27.6	Very low	114 Å²	114	118.7 Å²	118.7	60%	0.597	62%	0.624	S	S	*	*			trans	52.5	107.4	161.6	-77.5	168.5	0	0	0	122.4	I962	I962-L2005 WeakPolarHBondContact O-CD1 3.48Å
2006	A	25.7	Very low	27.8	Very low	68 Å²	68	122.3 Å²	122.3	56%	0.562	64%	0.64	S	S	*	*				43.6	126.7	110.6	0	0	0	0	0	123.4
2007	T	24.9	Very low	28.1	Very low	114 Å²	114	122.1 Å²	122.1	70%	0.699	65%	0.646	S	S	*	*			trans	67.8	156.8	141.5	63.2	0	0	0	0	118.4
2008	Y	25.8	Very low	28.3	Very low	160 Å²	160	120.4 Å²	120.4	63%	0.627	65%	0.649	S	S	*	*			cis	-131.1	-177.5	16.4	-107.3	-76	0	0	0	114	Y2010	Y2008-Y2010 AromaticContact CD1-CE2 3.9Å; Y2008-Y2010 HydrophobicContact CD1-CE2 3.9Å; Y2008-Y2010 HydrophobicContact CG-CE2 4.19Å
2009	S	25.1	Very low	28.4	Very low	81 Å²	81	118.5 Å²	118.5	57%	0.566	64%	0.638	S	S	*	*			trans	-81.5	-145	179.9	55.9	0	0	0	0	113
2010	Y	38.4	Very low	28.4	Very low	162 Å²	162	117 Å²	117	64%	0.635	63%	0.63	S	S	*	*	S	Bend	trans	75.1	141.2	174.8	-39.8	-68.8	0	0	0	116.2	Y2008 F2012	Y2008-Y2010 AromaticContact CD1-CE2 3.9Å; Y2008-Y2010 HydrophobicContact CD1-CE2 3.9Å; Y2008-Y2010 HydrophobicContact CG-CE2 4.19Å; Y2010-F2012 PolarHBondContact O-N 2.83Å
2011	P	25.8	Very low	28.2	Very low	126 Å²	126	114.9 Å²	114.9	82%	0.818	62%	0.618	S	S	*	*	S	Bend	trans	-77.6	66	169.4	34.5	-35.2	0	0	0	110.7
2012	F	22.7	Very low	27.8	Very low	185 Å²	185	116.1 Å²	116.1	81%	0.811	61%	0.612	S	S	*	*			trans	-138.5	80.6	153.2	-99.7	-65.7	0	0	0	112.5	Y2010	Y2010-F2012 PolarHBondContact O-N 2.83Å
2013	N	25.4	Very low	27.6	Very low	121 Å²	121	118.7 Å²	118.7	65%	0.647	62%	0.619	S	S	*	*			trans	63.2	122.5	139.7	-70	-15.5	0	0	0	120.8
2014	N	27.2	Very low	27.5	Very low	130 Å²	130	121.6 Å²	121.6	70%	0.695	62%	0.624	S	S	*	*			trans	78.7	107.2	136.7	-64.7	-30.2	0	0	0	120.1
2015	K	31.1	Very low	27.5	Very low	169 Å²	169	127.8 Å²	127.8	74%	0.735	64%	0.644	S	S	*	*				82.2	132.9	122.5	-71.1	-173.9	176.4	-167.6	0	120.2
2016	D	32.1	Very low	27.4	Very low	132 Å²	132	126.1 Å²	126.1	71%	0.706	64%	0.638	S	S	*	*			trans	67.9	143.6	145.5	-51.6	-17.1	0	0	0	117.2
2017	I	33.1	Very low	27.4	Very low	130 Å²	130	130.4 Å²	130.4	67%	0.667	65%	0.651	S	S	*	*			cis	-169.1	138.5	-21.3	-117.3	158.6	0	0	0	108.7
2018	N	30.9	Very low	27.3	Very low	133 Å²	133	128.1 Å²	128.1	71%	0.711	65%	0.65	S	S	*	*			trans	61.1	157	160.3	-65.6	7.1	0	0	0	119.4
2019	N	28.1	Very low	27.3	Very low	88 Å²	88	132 Å²	132	47%	0.471	66%	0.663	S	S	.	*			cis	-156.6	143.4	2.3	-114.3	11.6	0	0	0	111	T2003	T2003-N2019 CarbonylContact C-O 3.49Å
2020	I	27.8	Very low	27.3	Very low	99 Å²	99	136.2 Å²	136.2	51%	0.508	68%	0.678	S	S	.	*				67.1	127.4	97.1	-61.8	-175.4	0	0	0	115	G2002 T2003	G2002-I2020 CarbonylContact C-O 3.24Å; G2002-I2020 VanDerWaalsContact CA-O 3.27Å; G2002-I2020 WeakPolarHBondContact CA-O 2.98Å; G2002-I2020 PolarHBondContact N-O 3.5Å; T2003-I2020 PolarHBondContact N-O 3.17Å; T2003-I2020 VanDerWaalsContact N-O 3.17Å
2021	N	24.5	Very low	26.5	Very low	99 Å²	99	132.8 Å²	132.8	53%	0.529	68%	0.678	S	S	.	*			cis	-146.8	153.5	30.5	-108.3	-27.5	0	0	0	110.1
2022	E	26.7	Very low	26.5	Very low	130 Å²	130	132.2 Å²	132.2	61%	0.607	68%	0.677	S	S	*	*				70.4	128	67.8	-75.8	-163.1	-157.8	0	0	116.2	Q958	Q958-E2022 PolarHBondContact NE2-O 3.07Å; Q958-E2022 PolarHBondContact OE1-O 3.01Å; Q958-E2022 VanDerWaalsContact OE1-O 3.07Å
2023	N	24.9	Very low	26.6	Very low	88 Å²	88	133.5 Å²	133.5	47%	0.471	68%	0.678	S	S	.	*			cis	-153.2	150.7	11.8	-95	-52.8	0	0	0	114	Q958	Q958-N2023 VanDerWaalsContact CD-N 3.3Å
2024	F	23.5	Very low	26.7	Very low	145 Å²	145	135.4 Å²	135.4	64%	0.636	68%	0.681	S	S	*	*			trans	-164.8	172.1	135.8	-113.1	-62.2	0	0	0	113	Y956	Y956-F2024 HydrophobicContact CD1-CB 4.16Å; Y956-F2024 HydrophobicContact CE1-CB 3.98Å; Y956-F2024 HydrophobicContact CE2-CB 4.45Å; Y956-F2024 VanDerWaalsContact OH-C 3.27Å; Y956-F2024 PolarHBondContact OH-O 2.81Å; Y956-F2024 VanDerWaalsContact OH-O 3.11Å
2025	Y	25.5	Very low	26.7	Very low	209 Å²	209	137.4 Å²	137.4	82%	0.82	69%	0.69	S	S	*	*			trans	-150.6	75.3	-148.5	-140.7	-91.3	0	0	0	117.9	Y956	Y956-Y2025 VanDerWaalsContact OH-CA 3.3Å; Y956-Y2025 WeakPolarHBondContact OH-CA 3.35Å; Y956-Y2025 PolarHBondContact OH-N 3.4Å; Y956-Y2025 VanDerWaalsContact OH-N 3.1Å
2026	T	25.2	Very low	26.3	Very low	79 Å²	79	141.4 Å²	141.4	49%	0.485	70%	0.701	S	S	.	*			trans	-142.2	147.4	163.4	74.5	0	0	0	0	110.6	L955 Y956	L955-T2026 HydrophobicContact CD2-CG2 4.49Å; Y956-T2026 HydrophobicContact CE2-CG2 4.08Å; Y956-T2026 VanDerWaalsContact CE2-N 3.33Å; Y956-T2026 VanDerWaalsContact CE2-OG1 3.24Å; Y956-T2026 WeakPolarHBondContact CE2-OG1 3.09Å; Y956-T2026 PolarHBondContact OH-N 2.85Å; Y956-T2026 PolarHBondContact OH-O 3.5Å
2027	L	26.1	Very low	25.9	Very low	159 Å²	159	138.8 Å²	138.8	83%	0.832	71%	0.705	S	S	*	*			cis	-144.4	107.9	6.1	-141.3	165.4	0	0	0	109.2
2028	G	24	Very low	25.5	Very low	65 Å²	65	138 Å²	138	67%	0.67	71%	0.711	S	S	*	*			trans	-100.9	160.4	173.3	0	0	0	0	0	112.1
2029	R	25.7	Very low	25.2	Very low	241 Å²	241	138.4 Å²	138.4	91%	0.909	72%	0.718	S	S	*	*			trans	70.9	84.2	176.4	-62.2	-175.8	172.6	171.6	-0.6	116.7	S2031	R2029-S2031 PolarHBondContact O-N 3.39Å
2030	I	24.3	Very low	24.9	Very low	170 Å²	170	140 Å²	140	87%	0.872	74%	0.736	S	S	*	*				-34.1	127.2	126.9	-62.8	161.7	0	0	0	109.7
2031	S	22.8	Very low	24.7	Very low	90 Å²	90	141 Å²	141	63%	0.629	75%	0.747	S	S	*	*			trans	-93.2	143.1	170.4	77.7	0	0	0	0	110.5	R2029 Y2033	R2029-S2031 PolarHBondContact O-N 3.39Å; S2031-Y2033 VanDerWaalsContact C-N 3.29Å; S2031-Y2033 PolarHBondContact O-N 2.74Å
2032	S	24.8	Very low	24.7	Very low	114 Å²	114	143.3 Å²	143.3	80%	0.797	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	54.3	-163.8	62.7	0	0	0	0	114.2
2033	Y	25.9	Very low	24.5	Very low	213 Å²	213	145.2 Å²	145.2	84%	0.835	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130	-9.8	174.5	-83	-76.2	0	0	0	115.4	S2031 L2035	S2031-Y2033 VanDerWaalsContact C-N 3.29Å; S2031-Y2033 PolarHBondContact O-N 2.74Å; Y2033-L2035 VanDerWaalsContact C-N 3.27Å; Y2033-L2035 PolarHBondContact O-N 3.45Å
2034	F	27.4	Very low	24.5	Very low	161 Å²	161	145.3 Å²	145.3	71%	0.706	78%	0.779	S	S	*	*	S	Bend	trans	-79.3	5.7	-174.6	-128.3	-90.8	0	0	0	116
2035	L	25.5	Very low	24.6	Very low	171 Å²	171	146.6 Å²	146.6	90%	0.895	79%	0.792	S	S	*	*			trans	-130.1	72.3	-178	-82	172.6	0	0	0	112.6	Y2033	Y2033-L2035 VanDerWaalsContact C-N 3.27Å; Y2033-L2035 PolarHBondContact O-N 3.45Å
2036	R	24.3	Very low	24.5	Very low	253 Å²	253	141.8 Å²	141.8	96%	0.955	79%	0.789	S	S	*	*			trans	-153.9	62.3	163	-124.4	175.7	-170.3	-168.8	2.2	113.2
2037	G	23.6	Very low	24.7	Very low	77 Å²	77	146.5 Å²	146.5	79%	0.794	81%	0.805	S	S	*	*	S	Bend	trans	-128	-14.7	-173.3	0	0	0	0	0	118
2038	S	23.8	Very low	24.9	Very low	114 Å²	114	145 Å²	145	80%	0.797	80%	0.798	S	S	*	*			trans	-164.5	65.3	-172.4	47.1	0	0	0	0	115.2
2039	V	24.4	Very low	25	Very low	142 Å²	142	148.8 Å²	148.8	86%	0.861	80%	0.803	S	S	*	*			trans	-130.9	89.1	164.1	-174.3	0	0	0	0	110.4
2040	S	22.7	Very low	25	Very low	120 Å²	120	144 Å²	144	84%	0.839	79%	0.794	S	S	*	*			trans	-138.8	38	167.7	65.7	0	0	0	0	111.4
2041	V	23.6	Very low	24.9	Very low	122 Å²	122	142.5 Å²	142.5	74%	0.739	79%	0.788	S	S	*	*			trans	-129.4	157	164.8	-177.4	0	0	0	0	106.1
2042	I	24.9	Very low	25	Very low	146 Å²	146	144.7 Å²	144.7	75%	0.749	79%	0.792	S	S	*	*			trans	68.4	77	-169.8	-42.8	178.2	0	0	0	112.4
2043	N	22.5	Very low	24.9	Very low	171 Å²	171	147 Å²	147	91%	0.914	79%	0.794	S	S	*	*			trans	-123.2	66.8	140.2	-165.9	12.6	0	0	0	108.8
2044	S	24.5	Very low	24.8	Very low	90 Å²	90	139.7 Å²	139.7	63%	0.629	78%	0.782	S	S	*	*	S	Bend	trans	-141.8	86.1	178.9	58.7	0	0	0	0	109.9
2045	L	25.9	Very low	24.8	Very low	171 Å²	171	137.1 Å²	137.1	90%	0.895	79%	0.785	S	S	*	*			trans	48.4	102.9	156.8	-68.4	160.8	0	0	0	117.9
2046	S	23.7	Very low	24.8	Very low	109 Å²	109	135.9 Å²	135.9	76%	0.762	78%	0.779	S	S	*	*			trans	-61.2	138.6	143.9	52.9	0	0	0	0	111
2047	E	29.3	Very low	25.1	Very low	178 Å²	178	130.7 Å²	130.7	83%	0.832	78%	0.775	S	S	*	*			trans	-161.3	116.6	130.6	-112.1	-179.4	-156.6	0	0	113.6
2048	N	29.7	Very low	25.3	Very low	128 Å²	128	130.5 Å²	130.5	68%	0.684	77%	0.773	S	S	*	*			trans	49.9	93.2	140.4	-60.1	-25.9	0	0	0	122.8
2049	N	25.1	Very low	25.4	Very low	144 Å²	144	129.3 Å²	129.3	77%	0.77	77%	0.77	S	S	*	*				66	144.1	101.8	-89.1	-25.6	0	0	0	124.6
2050	L	25.8	Very low	25.5	Very low	139 Å²	139	130.5 Å²	130.5	73%	0.728	77%	0.771	S	S	*	*			trans	84.1	95.3	148.7	-94.3	96.8	0	0	0	122.5
2051	L	22.8	Very low	25.6	Very low	139 Å²	139	129.4 Å²	129.4	73%	0.728	76%	0.764	S	S	*	*				61.9	112	106.1	-94.9	175.5	0	0	0	121.5
2052	L	24.2	Very low	25.6	Very low	136 Å²	136	130.7 Å²	130.7	71%	0.712	77%	0.766	S	S	*	*				160.5	120.1	105.2	-85	152	0	0	0	115.9
2053	I	22.7	Very low	25.5	Very low	164 Å²	164	131.8 Å²	131.8	84%	0.841	77%	0.772	S	S	*	*			trans	53.9	134.1	134.7	-64.9	176.3	0	0	0	122.1
2054	G	24.7	Very low	25.6	Very low	58 Å²	58	135.5 Å²	135.5	60%	0.598	78%	0.775	S	S	*	*			trans	162.3	87.4	136.6	0	0	0	0	0	120.3
2055	S	27.1	Very low	25.7	Very low	108 Å²	108	137.8 Å²	137.8	76%	0.755	78%	0.782	S	S	*	*			trans	58.4	145	148.3	56.9	0	0	0	0	121
2056	D	26.5	Very low	25.7	Very low	145 Å²	145	136 Å²	136	78%	0.775	78%	0.776	S	S	*	*			cis	-162.9	176.2	-10.9	-112.4	-37.8	0	0	0	112.8
2057	T	29.4	Very low	25.8	Very low	143 Å²	143	137.5 Å²	137.5	88%	0.877	78%	0.777	S	S	*	*	S	Bend	trans	76.9	106.6	177.1	69.3	0	0	0	0	116.2
2058	G	28.1	Very low	25.6	Very low	73 Å²	73	135.1 Å²	135.1	75%	0.753	77%	0.774	S	S	*	*			cis	-172.4	136.9	-9.4	0	0	0	0	0	115.4
2059	A	26.4	Very low	25.3	Very low	89 Å²	89	135.6 Å²	135.6	74%	0.736	78%	0.779	S	S	*	*			trans	48.4	113.7	161.9	0	0	0	0	0	118.8
2060	L	25	Very low	25.3	Very low	167 Å²	167	135 Å²	135	87%	0.874	78%	0.78	S	S	*	*				60.1	139	59.3	-71.3	95.6	0	0	0	114.4
2061	S	25.1	Very low	25.3	Very low	98 Å²	98	134.7 Å²	134.7	69%	0.685	78%	0.784	S	S	*	*			cis	-137.2	137.2	29.7	59.7	0	0	0	0	118.2
2062	L	23.9	Very low	25.5	Very low	149 Å²	149	134.4 Å²	134.4	78%	0.78	79%	0.788	S	S	*	*	S	Bend	trans	66.7	102.7	147.1	-73.5	160.6	0	0	0	119.6
2063	L	23.3	Very low	25.6	Very low	169 Å²	169	134.3 Å²	134.3	89%	0.885	79%	0.794	S	S	*	*			trans	65.2	77	152.1	-64	168.7	0	0	0	116.8
2064	Y	25	Very low	25.9	Very low	248 Å²	248	131.5 Å²	131.5	97%	0.973	79%	0.79	S	S	*	*				-115.3	0	129.7	-117.5	-59.5	0	0	0	108.3	D979	D979-Y2064 PolarHBondContact OD2-OH 3.42Å

Retrieved 2,064 of 2,064 residues in 1627.5 ms (Link to these results)

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