A0A3Q0KSL9_SCHMA Loading...

Putative tgf beta receptor associated protein-1

AlphaFold DB , UniProt , Accession A0A3Q0KSL9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,058 aa.

						>A0A3Q0KSL9_SCHMA|A0A3Q0KSL9
MMNDYVNNIEPENTKYSLFQSHSRSCTAMETEVEITAMCSFSDFLFIGTSKGLVSQLIIQELYDDKTSFCFSNVLSRRIFTKPISRLETSSKKTTVSIFSDENLILCNAEKLEIINFIPSFKGVSSFQLCSFDDEKEKLCIGFKSGLIQLHHIFVSTCMLVFETKLTEVSLSLCISPQFLCVASDSSYISINLRTNATTELLRSVKEPVRNYIAYFTQNEFIVSGPGSLGIIVDANGVSHRAPLQLSSNIVEVFVWKNYFFTITDEFFTIHNILTQSQIQTINLQKPSVACFSADAHLLYFTETSDFNTDTASIRNIQVLGPERWDLIARRFILTGCLKQAFHVQQQERNRLTQVMQLQVEKFKHEQQLFDRRRQRVLGLLGFYHFEKGELDKAASYFEQSTIDIREILFRYSDLLPKGCYFMPNWFYKLHQTNPEPSHDNNNGDTQISGINLTSDLCILRAAEDSDNDDHDLTISSSWLLRYQEFLFNFLRKHHKSKFVEKHLHFVETALVKLYVRLQQAGIQPYLYELIIDTTSSSDSRSGESGLTKSTSNSDQSLVDLISSLIHIDVEDLTVYLENNNAYHALALIYRWQGNLSGALEIWRKLVYNELNDSSFPGVEFYISILLDLSAHDPTDSQKQSPYKGVAIHSSSDVNYEFSVYAELVWNHFMQALRTNHEIIAEQLMLRFPIPSSYINSSCELSIISDSTTETSLESSLAPSQILSPNHIIQSLISSYPNMTMTYLKHLCYSLPNCHPENHNLLGKLYLNTLLMKLKSTDNLFDDDMKKRIRELRTEFCQLIRYSLLISHKTLLDRLHNESVAVQKKLAYEIAILEGKANNHMKALKYLIEDINDYKAALYYCLTFSRQQPIHYSARKNDTNVQCNTIAVNSLDNCHYWDQFEFMEGDSNNQSIFSLLFTTFVEICLDRLLINEENSNDDIKKMILNLLNNPDLKFNYSKLLFRLPSTWDILEIKPFLHNALRSTLHEWSELQLEYGLTKYNAKLSVVDLPKKSNCLLIEDDTLCSICHQSIYVYGPSDSFAWLIPKNQVVHTHCLSSNQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.9	Very low	45.8	Very low	208 Å²	208	100.9 Å²	100.9	100%	1.025	51%	0.509	S	S	*	.				0	-56.3	0	-64.4	-61.4	-96.5	0	0	112.1
2	M	32.9	Very low	47.8	Very low	143 Å²	143	99.9 Å²	99.9	70%	0.704	50%	0.501	S	S	*	.			trans	-91.4	-19.9	-179.9	-80.9	-166.9	173.3	0	0	116.1	D4	M2-D4 VanDerWaalsContact C-N 3.32Å; M2-D4 PolarHBondContact O-N 2.99Å
3	N	31.4	Very low	49.6	Very low	151 Å²	151	97.7 Å²	97.7	81%	0.807	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-13	-179.6	-77.8	-4.5	0	0	0	114	Y5	N3-Y5 VanDerWaalsContact C-N 3.35Å
4	D	35.3	Very low	51.4	Low	114 Å²	114	92.3 Å²	92.3	61%	0.61	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	1.2	-172.3	-56	-51.3	0	0	0	113.3	M2 V6	M2-D4 VanDerWaalsContact C-N 3.32Å; M2-D4 PolarHBondContact O-N 2.99Å; D4-V6 VanDerWaalsContact C-N 3.31Å; D4-V6 PolarHBondContact O-N 3.49Å
5	Y	37.8	Very low	53.5	Low	129 Å²	129	93.4 Å²	93.4	51%	0.506	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-17.1	-163.2	-139.2	-94.1	0	0	0	115.2	N3 N13	N3-Y5 VanDerWaalsContact C-N 3.35Å; Y5-N13 HydrophobicContact CE1-CB 4.05Å; Y5-N13 PolarHBondContact OH-OD1 3.3Å
6	V	43.7	Very low	55.6	Low	52 Å²	52	87.7 Å²	87.7	32%	0.315	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.1	0.5	-170.3	-163	0	0	0	0	116.9	D4 N8 I9	D4-V6 VanDerWaalsContact C-N 3.31Å; D4-V6 PolarHBondContact O-N 3.49Å; V6-N8 PolarHBondContact O-N 3.22Å; V6-I9 HydrophobicContact CG1-CG1 4.15Å
7	N	46.4	Very low	57.4	Low	139 Å²	139	83.9 Å²	83.9	74%	0.743	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-14.9	155.1	-83.6	3.2	0	0	0	111
8	N	52.8	Low	59	Low	71 Å²	71	83.5 Å²	83.5	38%	0.38	42%	0.421	S	S	.	.	S	Bend	trans	-121	86.9	174.2	-72.7	-30.1	0	0	0	109.5	V6 E10 K257	V6-N8 PolarHBondContact O-N 3.22Å; N8-E10 HydrophobicContact CB-CG 4.05Å; N8-E10 PolarHBondContact O-N 2.93Å; N8-K257 PolarHBondContact OD1-NZ 2.94Å
9	I	59.4	Low	60.4	Low	48 Å²	48	79.5 Å²	79.5	25%	0.246	40%	0.4	C	S	.	.			trans	-63.3	87.4	162.4	-62.2	166.2	0	0	0	106.6	V6 T14 W256 P322	V6-I9 HydrophobicContact CG1-CG1 4.15Å; I9-T14 HydrophobicContact CG2-CG2 4.12Å; I9-W256 WeakPolarHBondContact O-CH2 3.39Å; I9-W256 WeakPolarHBondContact O-CZ3 3.46Å; I9-P322 HydrophobicContact CG2-CB 4.2Å; I9-P322 HydrophobicContact CG2-CG 4.18Å
10	E	68.6	Low	61.3	Low	54 Å²	54	81.5 Å²	81.5	25%	0.252	41%	0.408	S	S	.	.			trans	-88	134.1	175.7	-74.5	-170.5	-157.1	0	0	109.1	N8 E12 N13 T14 Y259	N8-E10 HydrophobicContact CB-CG 4.05Å; N8-E10 PolarHBondContact O-N 2.93Å; E10-E12 PolarHBondContact O-N 2.64Å; E10-E12 VanDerWaalsContact O-N 3.11Å; E10-N13 PolarHBondContact O-N 2.92Å; E10-T14 PolarHBondContact O-N 3.09Å; E10-T14 PolarHBondContact O-OG1 3.13Å; E10-T14 VanDerWaalsContact O-OG1 3.11Å; E10-Y259 HydrophobicContact CB-CE2 4.22Å; E10-Y259 WeakPolarHBondContact CB-OH 3.38Å; E10-Y259 HydrophobicContact CG-CE2 4.08Å; E10-Y259 PolarHBondContact OE2-OH 3.06Å
11	P	67.4	Low	61.9	Low	1 Å²	1	80.2 Å²	80.2	1%	0.006	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-21.8	176.8	-28	35.6	0	0	0	114.3	N13 Y16 W256 Y259 F261 I270 I279	P11-N13 VanDerWaalsContact C-N 3.28Å; P11-N13 PolarHBondContact O-N 3.44Å; P11-Y16 HydrophobicContact CB-CE2 3.88Å; P11-Y16 HydrophobicContact CG-CE2 4.06Å; P11-W256 HydrophobicContact CG-CZ3 4.4Å; P11-Y259 HydrophobicContact CB-CD1 4.05Å; P11-Y259 HydrophobicContact CB-CE1 4.2Å; P11-Y259 HydrophobicContact CB-CG 4.38Å; P11-Y259 VanDerWaalsContact CD-CD2 3.49Å; P11-Y259 HydrophobicContact CG-CD1 3.88Å; P11-Y259 HydrophobicContact CG-CD2 3.9Å; P11-Y259 HydrophobicContact CG-CE1 4.22Å; P11-Y259 HydrophobicContact CG-CE2 4.25Å; P11-Y259 HydrophobicContact CG-CG 3.7Å; P11-F261 HydrophobicContact CG-CE1 4.4Å; P11-F261 HydrophobicContact CG-CZ 3.79Å; P11-I270 HydrophobicContact CB-CD1 4.32Å; P11-I270 HydrophobicContact CB-CG2 3.91Å; P11-I270 HydrophobicContact CG-CG2 4.41Å; P11-I279 HydrophobicContact CB-CD1 4.28Å
12	E	69.7	Low	64	Low	89 Å²	89	71.1 Å²	71.1	42%	0.416	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-31.2	172.2	-67.8	-171.9	157.6	0	0	113.1	E10 Y259 N272 I279	E10-E12 PolarHBondContact O-N 2.64Å; E10-E12 VanDerWaalsContact O-N 3.11Å; E12-Y259 HydrophobicContact CG-CE1 3.85Å; E12-N272 PolarHBondContact OE1-ND2 3.04Å; E12-I279 HydrophobicContact CG-CD1 3.76Å; E12-I279 HydrophobicContact CG-CG1 4.42Å
13	N	71	Confident	65.6	Low	71 Å²	71	69.6 Å²	69.6	38%	0.38	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-11	-175.2	-62.8	-33	0	0	0	112.4	Y5 E10 P11	Y5-N13 HydrophobicContact CE1-CB 4.05Å; Y5-N13 PolarHBondContact OH-OD1 3.3Å; E10-N13 PolarHBondContact O-N 2.92Å; P11-N13 VanDerWaalsContact C-N 3.28Å; P11-N13 PolarHBondContact O-N 3.44Å
14	T	74.7	Confident	67.1	Low	22 Å²	22	71.4 Å²	71.4	14%	0.135	36%	0.361	C	S	.	.	S	Bend	trans	-130.8	128.2	-173.2	51.9	0	0	0	0	111.2	I9 E10 Y16 P322	I9-T14 HydrophobicContact CG2-CG2 4.12Å; E10-T14 PolarHBondContact O-N 3.09Å; E10-T14 PolarHBondContact O-OG1 3.13Å; E10-T14 VanDerWaalsContact O-OG1 3.11Å; T14-Y16 PolarHBondContact O-N 3.2Å; T14-P322 HydrophobicContact CG2-CB 4.49Å
15	K	82.8	Confident	68.2	Low	109 Å²	109	67.5 Å²	67.5	47%	0.474	34%	0.342	S	S	.	.			trans	-75	127.9	173.1	-173.5	176.5	172	-161.4	0	108.5	E323	K15-E323 HydrophobicContact CB-CG 4.46Å; K15-E323 WeakPolarHBondContact CD-OE1 3.12Å; K15-E323 IonicContact NZ-OE1 2.86Å; K15-E323 WeakPolarHBondContact O-CG 3.39Å; K15-E323 PolarHBondContact O-N 3.18Å
16	Y	87.2	Confident	69	Low	2 Å²	2	65.9 Å²	65.9	1%	0.008	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	141.4	171.6	-82.6	-119.4	0	0	0	109.4	P11 T14 F261 F268 I270 Q280 I282 L320 G321 P322	P11-Y16 HydrophobicContact CB-CE2 3.88Å; P11-Y16 HydrophobicContact CG-CE2 4.06Å; T14-Y16 PolarHBondContact O-N 3.2Å; Y16-F261 HydrophobicContact CE1-CE1 4.12Å; Y16-F268 HydrophobicContact CD1-CE1 4.38Å; Y16-F268 HydrophobicContact CD1-CZ 4.34Å; Y16-I270 HydrophobicContact CD1-CD1 4.05Å; Y16-I270 HydrophobicContact CD2-CD1 3.64Å; Y16-I270 HydrophobicContact CE1-CD1 4.49Å; Y16-I270 HydrophobicContact CE2-CD1 4.13Å; Y16-I270 HydrophobicContact CG-CD1 3.62Å; Y16-Q280 PolarHBondContact O-NE2 3.17Å; Y16-I282 WeakPolarHBondContact O-CD1 3.23Å; Y16-L320 HydrophobicContact CD1-CD2 3.58Å; Y16-L320 HydrophobicContact CG-CD2 4.19Å; Y16-G321 CarbonylContact C-O 3.37Å; Y16-G321 VanDerWaalsContact CA-O 3.31Å; Y16-G321 WeakPolarHBondContact CA-O 3.45Å; Y16-P322 HydrophobicContact CE2-CB 4.2Å
17	S	86.2	Confident	69.4	Low	24 Å²	24	65 Å²	65	17%	0.168	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	154.4	-179.5	63.6	0	0	0	0	111.2	G321 E323	S17-G321 PolarHBondContact N-O 3.49Å; S17-G321 PolarHBondContact O-N 3.43Å; S17-E323 WeakPolarHBondContact OG-CG 3.39Å
18	L	86.4	Confident	69.5	Low	76 Å²	76	62.9 Å²	62.9	40%	0.398	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	125.4	172.3	-168.5	68.3	0	0	0	110.2	F301 Q318	L18-F301 HydrophobicContact CD1-CE1 3.8Å; L18-F301 HydrophobicContact CD1-CZ 3.64Å; L18-Q318 HydrophobicContact CD1-CB 3.98Å
19	F	85.9	Confident	69.4	Low	8 Å²	8	60.8 Å²	60.8	4%	0.035	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	141.8	175.1	-63.8	-73.7	0	0	0	111	T67 F69 L298 V319 P322	F19-T67 WeakPolarHBondContact CD1-OG1 3.49Å; F19-T67 WeakPolarHBondContact CE1-OG1 3.33Å; F19-F69 HydrophobicContact CB-CD2 3.68Å; F19-F69 HydrophobicContact CB-CE2 3.74Å; F19-F69 HydrophobicContact CD1-CE2 4.1Å; F19-F69 HydrophobicContact CD2-CD2 4.29Å; F19-F69 AromaticContact CD2-CE2 3.54Å; F19-F69 HydrophobicContact CD2-CE2 3.54Å; F19-F69 HydrophobicContact CD2-CZ 4.45Å; F19-F69 HydrophobicContact CE2-CE2 4.08Å; F19-F69 HydrophobicContact CG-CD2 4.03Å; F19-F69 AromaticContact CG-CE2 3.53Å; F19-F69 HydrophobicContact CG-CE2 3.53Å; F19-L298 HydrophobicContact CE2-CD2 4.38Å; F19-V319 HydrophobicContact CB-CB 4.28Å; F19-V319 HydrophobicContact CD2-CG1 4.26Å; F19-V319 PolarHBondContact N-O 3.07Å; F19-P322 WeakPolarHBondContact CZ-O 3.33Å
20	Q	77.9	Confident	69.1	Low	119 Å²	119	64.2 Å²	64.2	56%	0.556	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	141.6	177.9	-67.8	-175.8	-34.9	0	0	110.8	S68 F69	Q20-S68 WeakPolarHBondContact O-CA 3.19Å; Q20-S68 WeakPolarHBondContact O-CB 3.28Å; Q20-F69 PolarHBondContact O-N 3.26Å
21	S	74.1	Confident	68.3	Low	54 Å²	54	65 Å²	65	38%	0.378	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	135.9	169	54.4	0	0	0	0	109.9
22	H	73.2	Confident	67.7	Low	18 Å²	18	71.5 Å²	71.5	8%	0.083	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-78.7	144.5	-178.1	-165.5	72.6	0	0	0	111.2	R24 S25 D64 S68 F69 C70	H22-R24 VanDerWaalsContact C-N 3.28Å; H22-R24 PolarHBondContact CD2-N 2.82Å; H22-R24 PolarHBondContact O-N 3.01Å; H22-S25 VanDerWaalsContact O-CB 3.32Å; H22-S25 WeakPolarHBondContact O-CB 3.1Å; H22-S25 PolarHBondContact O-N 3.44Å; H22-S25 VanDerWaalsContact O-N 3.08Å; H22-S25 PolarHBondContact O-OG 3.43Å; H22-D64 IonicContact CE1-OD2 2.6Å; H22-D64 PolarHBondContact CE1-OD2 2.91Å; H22-S68 PolarHBondContact ND1-OG 3.25Å; H22-F69 WeakPolarHBondContact CB-O 3.34Å; H22-F69 PolarHBondContact N-O 3.37Å; H22-C70 HydrophobicContact CB-CB 4.12Å
23	S	66.5	Low	67.8	Low	111 Å²	111	68 Å²	68	78%	0.776	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-28.1	-175.7	60.4	0	0	0	0	113.9	S25	S23-S25 PolarHBondContact O-N 3.43Å
24	R	61.8	Low	68.2	Low	189 Å²	189	70.1 Å²	70.1	71%	0.713	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	6.2	175.5	-54.1	177.4	175	178.9	0.2	114.1	H22 C26	H22-R24 VanDerWaalsContact C-N 3.28Å; H22-R24 PolarHBondContact CD2-N 2.82Å; H22-R24 PolarHBondContact O-N 3.01Å; R24-C26 PolarHBondContact O-N 3.22Å
25	S	59.5	Low	68.7	Low	32 Å²	32	69.9 Å²	69.9	22%	0.224	38%	0.378	C	S	.	.			trans	-54.7	107.7	172.3	44.8	0	0	0	0	109.1	H22 S23 F71	H22-S25 VanDerWaalsContact O-CB 3.32Å; H22-S25 WeakPolarHBondContact O-CB 3.1Å; H22-S25 PolarHBondContact O-N 3.44Å; H22-S25 VanDerWaalsContact O-N 3.08Å; H22-S25 PolarHBondContact O-OG 3.43Å; S23-S25 PolarHBondContact O-N 3.43Å; S25-F71 WeakPolarHBondContact CA-O 3.32Å
26	C	53.7	Low	69	Low	95 Å²	95	66.4 Å²	66.4	64%	0.642	37%	0.366	S	S	*	.	B	Isolated β-bridge	trans	-109.6	93.5	-173	-153.9	0	0	0	0	107	R24 F71 N73	R24-C26 PolarHBondContact O-N 3.22Å; C26-F71 PolarHBondContact N-O 3.37Å; C26-N73 PolarHBondContact O-N 3.43Å
27	T	52.8	Low	69.1	Low	32 Å²	32	66.6 Å²	66.6	20%	0.196	37%	0.367	C	S	.	.			trans	-111.1	101.7	176.8	57.3	0	0	0	0	108.4	M29 I314	T27-M29 PolarHBondContact O-N 3.5Å; T27-I314 HydrophobicContact CG2-CB 3.98Å; T27-I314 HydrophobicContact CG2-CD1 4.03Å; T27-I314 HydrophobicContact CG2-CG1 4.48Å; T27-I314 HydrophobicContact CG2-CG2 4Å
28	A	47.4	Very low	69.3	Low	96 Å²	96	65.9 Å²	65.9	79%	0.793	36%	0.361	S	S	*	.			trans	-73.4	56.6	170.2	0	0	0	0	0	110.7
29	M	52.2	Low	69.6	Low	27 Å²	27	62.5 Å²	62.5	13%	0.133	34%	0.344	C	S	.	.	S	Bend	trans	-110.8	145.9	172.6	-67.9	-168	63.7	0	0	109.3	T27 T31 T49 L53 S55 I314	T27-M29 PolarHBondContact O-N 3.5Å; M29-T31 PolarHBondContact O-N 3.22Å; M29-T49 HydrophobicContact CE-CG2 3.6Å; M29-L53 HydrophobicContact CE-CD2 3.21Å; M29-L53 HydrophobicContact SD-CD2 4.5Å; M29-S55 VanDerWaalsContact CE-OG 3.32Å; M29-S55 WeakPolarHBondContact CE-OG 3.14Å; M29-S55 PolarHBondContact SD-OG 3.25Å; M29-I314 HydrophobicContact CB-CD1 3.77Å; M29-I314 HydrophobicContact CE-CD1 4.39Å; M29-I314 HydrophobicContact CG-CD1 3.77Å; M29-I314 HydrophobicContact SD-CD1 3.28Å; M29-I314 WeakPolarHBondContact SD-CD1 3.43Å
30	E	51.4	Low	69.8	Low	120 Å²	120	62.7 Å²	62.7	56%	0.561	35%	0.347	S	S	*	.			trans	-51.7	126.1	171.3	-70.1	175	-176.8	0	0	109.1	E32 V33 K51	E30-E32 PolarHBondContact O-N 3.24Å; E30-V33 HydrophobicContact CB-CG2 3.74Å; E30-V33 PolarHBondContact O-N 3.49Å; E30-K51 IonicContact OE2-NZ 2.66Å; E30-K51 PolarHBondContact OE2-NZ 3.12Å
31	T	53.1	Low	70.2	Confident	70 Å²	70	58.5 Å²	58.5	43%	0.429	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	4.3	-171.7	46.3	0	0	0	0	115	M29 A312	M29-T31 PolarHBondContact O-N 3.22Å; T31-A312 CarbonylContact C-O 3.51Å; T31-A312 CarbonylContact O-C 3.59Å; T31-A312 VanDerWaalsContact O-CA 3.22Å; T31-A312 WeakPolarHBondContact O-CA 3.34Å; T31-A312 WeakPolarHBondContact O-CB 3.39Å; T31-A312 PolarHBondContact O-N 2.87Å
32	E	54.5	Low	70.6	Confident	138 Å²	138	58 Å²	58	65%	0.645	32%	0.324	S	S	*	.	B	Isolated β-bridge	trans	-121.4	19.8	-173.9	-65	-178.9	176.4	0	0	112.7	E30	E30-E32 PolarHBondContact O-N 3.24Å
33	V	70.7	Confident	71.1	Confident	15 Å²	15	60.2 Å²	60.2	9%	0.091	34%	0.336	C	S	.	.			trans	-111.9	110.4	-171.7	-171.6	0	0	0	0	111.1	E30 T49 K51	E30-V33 HydrophobicContact CB-CG2 3.74Å; E30-V33 PolarHBondContact O-N 3.49Å; V33-T49 HydrophobicContact CB-CG2 4.48Å; V33-T49 HydrophobicContact CG1-CG2 3.46Å; V33-T49 VanDerWaalsContact CG1-CG2 3.46Å; V33-K51 HydrophobicContact CG1-CB 4.43Å; V33-K51 HydrophobicContact CG1-CG 4.22Å; V33-K51 HydrophobicContact CG2-CD 3.77Å; V33-K51 HydrophobicContact CG2-CG 4.34Å
34	E	79.7	Confident	72.1	Confident	116 Å²	116	57.4 Å²	57.4	54%	0.542	31%	0.31	S	S	.	.			trans	-64.1	134.4	174	-171.9	-179.1	-176.6	0	0	111.5	T49 S50	E34-T49 WeakPolarHBondContact O-CA 3.38Å; E34-S50 PolarHBondContact O-N 3.38Å
35	I	85.9	Confident	73.4	Confident	16 Å²	16	48.4 Å²	48.4	8%	0.082	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	120.6	172.2	-64.6	173.6	0	0	0	108.2	M38 I47 T302 I314 I317	I35-M38 HydrophobicContact CG2-CG 3.83Å; I35-M38 HydrophobicContact CG2-SD 4.15Å; I35-I47 HydrophobicContact CB-CG2 4.05Å; I35-I47 HydrophobicContact CD1-CD1 4.21Å; I35-I47 HydrophobicContact CD1-CG2 3.76Å; I35-I47 HydrophobicContact CG1-CG2 3.58Å; I35-I47 HydrophobicContact CG2-CG2 3.44Å; I35-I47 VanDerWaalsContact CG2-CG2 3.44Å; I35-T302 HydrophobicContact CB-CG2 4.05Å; I35-T302 HydrophobicContact CD1-CG2 3.67Å; I35-T302 HydrophobicContact CG1-CG2 4.44Å; I35-T302 HydrophobicContact CG2-CG2 3.94Å; I35-I314 HydrophobicContact CD1-CG2 4.44Å; I35-I317 HydrophobicContact CD1-CD1 4.32Å; I35-I317 HydrophobicContact CD1-CG1 4.15Å
36	T	88.2	Confident	74.9	Confident	37 Å²	37	46.9 Å²	46.9	23%	0.227	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-17.2	-174.3	54.3	0	0	0	0	113.2	G48 T49 I84	T36-G48 PolarHBondContact N-O 3.25Å; T36-G48 PolarHBondContact OG1-O 3.23Å; T36-T49 VanDerWaalsContact OG1-C 3.29Å; T36-I84 VanDerWaalsContact CB-O 3.28Å; T36-I84 WeakPolarHBondContact CB-O 3.3Å; T36-I84 PolarHBondContact OG1-O 3.1Å
37	A	89.5	Confident	76.7	Confident	5 Å²	5	42.4 Å²	42.4	4%	0.041	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	150.7	177.8	0	0	0	0	0	111.5	G48 I84 L87	A37-G48 PolarHBondContact N-O 3.04Å; A37-G48 PolarHBondContact O-N 2.99Å; A37-I84 HydrophobicContact CB-CG2 3.96Å; A37-L87 HydrophobicContact CB-CB 4.23Å; A37-L87 HydrophobicContact CB-CD1 4.22Å; A37-L87 HydrophobicContact CB-CG 3.87Å
38	M	91.2	Very high	78.5	Confident	9 Å²	9	40.9 Å²	40.9	4%	0.044	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	145.1	177.5	-65.9	176.7	66.4	0	0	111	I35 L45 F46 I47 V289 C291 T302 I317	I35-M38 HydrophobicContact CG2-CG 3.83Å; I35-M38 HydrophobicContact CG2-SD 4.15Å; M38-L45 HydrophobicContact CE-CD1 3.82Å; M38-L45 HydrophobicContact CE-CD2 3.76Å; M38-L45 HydrophobicContact CE-CG 4.14Å; M38-F46 WeakPolarHBondContact CA-O 3.46Å; M38-I47 HydrophobicContact CE-CD1 4.43Å; M38-I47 HydrophobicContact CG-CG1 4.41Å; M38-V289 HydrophobicContact CB-CG1 4.02Å; M38-V289 HydrophobicContact CG-CG1 3.75Å; M38-V289 HydrophobicContact SD-CB 4.49Å; M38-V289 HydrophobicContact SD-CG1 4.13Å; M38-C291 HydrophobicContact CB-CB 3.91Å; M38-T302 HydrophobicContact SD-CG2 3.69Å; M38-I317 HydrophobicContact CE-CG2 4.38Å
39	C	91.5	Very high	80.4	Confident	5 Å²	5	36.3 Å²	36.3	3%	0.034	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	157.9	166.3	69.1	0	0	0	0	110.8	F46 L87 T89 C291	C39-F46 PolarHBondContact N-O 2.97Å; C39-F46 PolarHBondContact O-N 2.92Å; C39-L87 HydrophobicContact CB-CB 3.98Å; C39-T89 HydrophobicContact CB-CG2 4.16Å; C39-T89 WeakPolarHBondContact SG-CG2 3.45Å; C39-C291 VanDerWaalsContact C-SG 3.56Å; C39-C291 WeakPolarHBondContact CA-SG 3.47Å
40	S	90.2	Very high	82.1	Confident	13 Å²	13	36.9 Å²	36.9	9%	0.091	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	145.2	-178.1	66.9	0	0	0	0	111.5	F44 T89 C291 F292 S293	S40-F44 WeakPolarHBondContact CA-O 3.43Å; S40-T89 PolarHBondContact O-OG1 3.24Å; S40-C291 PolarHBondContact N-SG 3.28Å; S40-C291 PolarHBondContact OG-SG 3.12Å; S40-F292 PolarHBondContact OG-O 3.33Å; S40-S293 VanDerWaalsContact OG-CA 3.26Å; S40-S293 WeakPolarHBondContact OG-CA 3.44Å; S40-S293 WeakPolarHBondContact OG-CB 3.19Å
41	F	86.9	Confident	83.7	Confident	30 Å²	30	34.7 Å²	34.7	13%	0.132	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	119.6	173.6	173.5	-101.1	0	0	0	108.8	D43 F44 F46 T89 S90 K93 T94 A109	F41-D43 PolarHBondContact O-N 2.86Å; F41-F44 PolarHBondContact N-O 2.76Å; F41-F44 WeakPolarHBondContact O-CB 3.47Å; F41-F44 PolarHBondContact O-N 2.95Å; F41-F46 HydrophobicContact CB-CE2 4.1Å; F41-T89 HydrophobicContact CB-CG2 3.85Å; F41-S90 WeakPolarHBondContact CD2-O 3.3Å; F41-K93 WeakPolarHBondContact CE2-O 3.28Å; F41-K93 WeakPolarHBondContact CZ-O 3.22Å; F41-T94 HydrophobicContact CE1-CG2 3.79Å; F41-T94 HydrophobicContact CZ-CG2 3.96Å; F41-A109 HydrophobicContact CD1-CB 4.12Å
42	S	82.6	Confident	85.3	Confident	45 Å²	45	31.3 Å²	31.3	32%	0.315	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	-128.4	-173.2	-163.4	0	0	0	0	111.1	F44	S42-F44 VanDerWaalsContact C-N 3.28Å; S42-F44 PolarHBondContact O-N 2.84Å
43	D	83	Confident	87	Confident	64 Å²	64	26.6 Å²	26.6	34%	0.342	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	2.5	177.6	-49.1	-40.6	0	0	0	113.9	F41 I59 K362	F41-D43 PolarHBondContact O-N 2.86Å; D43-I59 PolarHBondContact O-N 3.41Å; D43-I59 VanDerWaalsContact O-N 3.09Å; D43-K362 IonicContact OD1-NZ 2.81Å; D43-K362 PolarHBondContact OD1-NZ 3.29Å; D43-K362 WeakPolarHBondContact OD2-CE 3.3Å; D43-K362 IonicContact OD2-NZ 3.36Å; D43-K362 PolarHBondContact OD2-NZ 3.1Å
44	F	88.4	Confident	88	Confident	52 Å²	52	25.9 Å²	25.9	23%	0.228	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	136.3	-179.3	-61.9	-64.3	0	0	0	111.9	S40 F41 S42 F46 Q56 L57 I58 V74	S40-F44 WeakPolarHBondContact CA-O 3.43Å; F41-F44 PolarHBondContact N-O 2.76Å; F41-F44 WeakPolarHBondContact O-CB 3.47Å; F41-F44 PolarHBondContact O-N 2.95Å; S42-F44 VanDerWaalsContact C-N 3.28Å; S42-F44 PolarHBondContact O-N 2.84Å; F44-F46 HydrophobicContact CB-CE2 3.83Å; F44-F46 HydrophobicContact CB-CZ 3.99Å; F44-Q56 HydrophobicContact CB-CG 4.28Å; F44-Q56 HydrophobicContact CD1-CG 3.78Å; F44-Q56 VanDerWaalsContact CD1-NE2 3.26Å; F44-Q56 HydrophobicContact CE1-CG 4.4Å; F44-Q56 VanDerWaalsContact CE1-NE2 3.28Å; F44-Q56 HydrophobicContact CG-CG 4.15Å; F44-L57 CarbonylContact C-O 3.57Å; F44-L57 VanDerWaalsContact CA-O 3.3Å; F44-L57 WeakPolarHBondContact CA-O 3.44Å; F44-I58 HydrophobicContact CD1-CB 4.25Å; F44-I58 HydrophobicContact CE1-CB 4.18Å; F44-I58 HydrophobicContact CE1-CD1 4.35Å; F44-I58 HydrophobicContact CE1-CG1 4.33Å; F44-V74 HydrophobicContact CE1-CG2 4.42Å
45	L	89.8	Confident	88.4	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	120.3	169.5	-179.6	67.1	0	0	0	108.6	M38 I47 L57 I59 F71 Y300 I317	M38-L45 HydrophobicContact CE-CD1 3.82Å; M38-L45 HydrophobicContact CE-CD2 3.76Å; M38-L45 HydrophobicContact CE-CG 4.14Å; L45-I47 HydrophobicContact CD2-CD1 4.19Å; L45-I47 HydrophobicContact CD2-CG1 4.48Å; L45-I47 HydrophobicContact CG-CD1 4.39Å; L45-I47 HydrophobicContact CG-CG1 4.15Å; L45-L57 HydrophobicContact CB-CB 4.38Å; L45-L57 PolarHBondContact N-O 3.46Å; L45-L57 PolarHBondContact O-N 2.88Å; L45-I59 HydrophobicContact CB-CD1 3.62Å; L45-I59 HydrophobicContact CB-CG1 4.05Å; L45-I59 HydrophobicContact CD2-CD1 4.44Å; L45-F71 HydrophobicContact CD2-CD1 4.33Å; L45-F71 HydrophobicContact CD2-CE1 4.04Å; L45-Y300 HydrophobicContact CD1-CD2 3.83Å; L45-Y300 HydrophobicContact CD1-CE2 4.44Å; L45-Y300 HydrophobicContact CD1-CG 4.08Å; L45-Y300 HydrophobicContact CD2-CD1 4.3Å; L45-Y300 HydrophobicContact CD2-CG 4.17Å; L45-I317 HydrophobicContact CD2-CD1 4.39Å; L45-I317 HydrophobicContact CD2-CG2 4.5Å
46	F	91.1	Very high	88.6	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	136.1	175.3	-59.7	-88.1	0	0	0	109.9	M38 C39 F41 F44 V54 S55 Q56 L87 T89 V96 A109 L112	M38-F46 WeakPolarHBondContact CA-O 3.46Å; C39-F46 PolarHBondContact N-O 2.97Å; C39-F46 PolarHBondContact O-N 2.92Å; F41-F46 HydrophobicContact CB-CE2 4.1Å; F44-F46 HydrophobicContact CB-CE2 3.83Å; F44-F46 HydrophobicContact CB-CZ 3.99Å; F46-V54 HydrophobicContact CD1-CG1 4.49Å; F46-S55 CarbonylContact C-O 3.5Å; F46-S55 VanDerWaalsContact CA-O 3.29Å; F46-S55 WeakPolarHBondContact CA-O 3.48Å; F46-Q56 HydrophobicContact CD1-CB 3.96Å; F46-Q56 HydrophobicContact CD1-CG 4.18Å; F46-Q56 HydrophobicContact CE1-CB 3.72Å; F46-Q56 HydrophobicContact CE1-CG 3.56Å; F46-Q56 HydrophobicContact CZ-CG 3.99Å; F46-L87 HydrophobicContact CB-CD1 4.38Å; F46-T89 HydrophobicContact CD2-CG2 4.17Å; F46-T89 HydrophobicContact CE2-CG2 4.41Å; F46-V96 HydrophobicContact CD1-CG2 4.35Å; F46-V96 HydrophobicContact CD2-CG2 4.13Å; F46-V96 HydrophobicContact CE1-CG2 4.17Å; F46-V96 HydrophobicContact CE2-CG2 3.97Å; F46-V96 HydrophobicContact CG-CG2 4.33Å; F46-V96 HydrophobicContact CZ-CG2 4Å; F46-A109 WeakPolarHBondContact CE1-O 3.47Å; F46-A109 HydrophobicContact CE2-CB 4.26Å; F46-A109 HydrophobicContact CZ-CB 3.8Å; F46-A109 WeakPolarHBondContact CZ-O 3.37Å; F46-L112 HydrophobicContact CD1-CD1 4.03Å; F46-L112 HydrophobicContact CE1-CD1 4.05Å
47	I	89.9	Confident	88.6	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	126.8	-175.6	-56.5	-166.9	0	0	0	108.8	I35 M38 L45 V54 S55 L57 I317	I35-I47 HydrophobicContact CB-CG2 4.05Å; I35-I47 HydrophobicContact CD1-CD1 4.21Å; I35-I47 HydrophobicContact CD1-CG2 3.76Å; I35-I47 HydrophobicContact CG1-CG2 3.58Å; I35-I47 HydrophobicContact CG2-CG2 3.44Å; I35-I47 VanDerWaalsContact CG2-CG2 3.44Å; M38-I47 HydrophobicContact CE-CD1 4.43Å; M38-I47 HydrophobicContact CG-CG1 4.41Å; L45-I47 HydrophobicContact CD2-CD1 4.19Å; L45-I47 HydrophobicContact CD2-CG1 4.48Å; L45-I47 HydrophobicContact CG-CD1 4.39Å; L45-I47 HydrophobicContact CG-CG1 4.15Å; I47-V54 CarbonylContact O-C 3.55Å; I47-V54 VanDerWaalsContact O-CA 3.27Å; I47-V54 WeakPolarHBondContact O-CA 3.38Å; I47-S55 PolarHBondContact N-O 3.4Å; I47-S55 PolarHBondContact O-N 3.38Å; I47-L57 HydrophobicContact CD1-CD1 3.38Å; I47-L57 HydrophobicContact CD1-CG 4.2Å; I47-L57 HydrophobicContact CG1-CD1 4.18Å; I47-I317 HydrophobicContact CD1-CD1 3.24Å; I47-I317 HydrophobicContact CD1-CG1 4.37Å
48	G	90.6	Very high	88.5	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	143.3	174.2	0	0	0	0	0	110.4	T36 A37 L87	T36-G48 PolarHBondContact N-O 3.25Å; T36-G48 PolarHBondContact OG1-O 3.23Å; A37-G48 PolarHBondContact N-O 3.04Å; A37-G48 PolarHBondContact O-N 2.99Å; G48-L87 VanDerWaalsContact N-CD1 3.28Å
49	T	88.7	Confident	88.3	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	162.6	-174.8	56.5	0	0	0	0	113.4	M29 V33 E34 T36 K51 G52 L53 I84	M29-T49 HydrophobicContact CE-CG2 3.6Å; V33-T49 HydrophobicContact CB-CG2 4.48Å; V33-T49 HydrophobicContact CG1-CG2 3.46Å; V33-T49 VanDerWaalsContact CG1-CG2 3.46Å; E34-T49 WeakPolarHBondContact O-CA 3.38Å; T36-T49 VanDerWaalsContact OG1-C 3.29Å; T49-K51 PolarHBondContact O-N 2.97Å; T49-G52 PolarHBondContact O-N 2.65Å; T49-L53 HydrophobicContact CG2-CD2 4.25Å; T49-L53 PolarHBondContact N-O 3.28Å; T49-L53 WeakPolarHBondContact OG1-CA 3.02Å; T49-L53 WeakPolarHBondContact OG1-CB 3.37Å; T49-L53 PolarHBondContact OG1-N 3.36Å; T49-L53 PolarHBondContact OG1-O 3.23Å; T49-I84 PolarHBondContact O-N 3.12Å; T49-I84 VanDerWaalsContact O-N 3.13Å
50	S	87.1	Confident	88	Confident	40 Å²	40	24.1 Å²	24.1	28%	0.28	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-22.8	173.8	62.9	0	0	0	0	113.9	E34 P83	E34-S50 PolarHBondContact O-N 3.38Å; S50-P83 VanDerWaalsContact O-CA 3.25Å; S50-P83 WeakPolarHBondContact O-CA 3.22Å; S50-P83 WeakPolarHBondContact O-CB 3.26Å
51	K	85.5	Confident	87.9	Confident	73 Å²	73	24.5 Å²	24.5	32%	0.317	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	11.7	176.2	-62.2	-171.5	-175.6	173.7	0	114.2	E30 V33 T49 L53 R78	E30-K51 IonicContact OE2-NZ 2.66Å; E30-K51 PolarHBondContact OE2-NZ 3.12Å; V33-K51 HydrophobicContact CG1-CB 4.43Å; V33-K51 HydrophobicContact CG1-CG 4.22Å; V33-K51 HydrophobicContact CG2-CD 3.77Å; V33-K51 HydrophobicContact CG2-CG 4.34Å; T49-K51 PolarHBondContact O-N 2.97Å; K51-L53 VanDerWaalsContact C-N 3.3Å; K51-L53 PolarHBondContact O-N 2.79Å; K51-R78 PolarHBondContact O-NE 2.84Å
52	G	87.2	Confident	87.8	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	73.8	18	176.6	0	0	0	0	0	115.4	T49 I79 F80 K82 I84	T49-G52 PolarHBondContact O-N 2.65Å; G52-I79 PolarHBondContact O-N 3.37Å; G52-I79 VanDerWaalsContact O-N 3.14Å; G52-F80 CarbonylContact C-O 3.56Å; G52-F80 WeakPolarHBondContact CA-O 3.13Å; G52-F80 PolarHBondContact O-N 3.44Å; G52-F80 VanDerWaalsContact O-O 3.09Å; G52-K82 WeakPolarHBondContact CA-O 3.3Å; G52-K82 PolarHBondContact N-O 3.23Å; G52-I84 VanDerWaalsContact C-CD1 3.46Å
53	L	89.6	Confident	87.7	Confident	38 Å²	38	23.1 Å²	23.1	20%	0.199	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	130.4	178.9	173.5	137.6	0	0	0	110.5	M29 T49 K51 S55 S76 I84	M29-L53 HydrophobicContact CE-CD2 3.21Å; M29-L53 HydrophobicContact SD-CD2 4.5Å; T49-L53 HydrophobicContact CG2-CD2 4.25Å; T49-L53 PolarHBondContact N-O 3.28Å; T49-L53 WeakPolarHBondContact OG1-CA 3.02Å; T49-L53 WeakPolarHBondContact OG1-CB 3.37Å; T49-L53 PolarHBondContact OG1-N 3.36Å; T49-L53 PolarHBondContact OG1-O 3.23Å; K51-L53 VanDerWaalsContact C-N 3.3Å; K51-L53 PolarHBondContact O-N 2.79Å; L53-S55 WeakPolarHBondContact CD2-OG 3.4Å; L53-S76 WeakPolarHBondContact CD1-OG 3.44Å; L53-S76 WeakPolarHBondContact CD2-OG 3.45Å; L53-S76 WeakPolarHBondContact CG-OG 3.42Å; L53-I84 VanDerWaalsContact C-CD1 3.48Å; L53-I84 VanDerWaalsContact O-CD1 3.24Å; L53-I84 WeakPolarHBondContact O-CD1 3.46Å
54	V	90.8	Very high	87.2	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	127.9	172.4	-177.2	0	0	0	0	108.7	F46 I47 S76 R77 I79 I84 L87 I98 L112	F46-V54 HydrophobicContact CD1-CG1 4.49Å; I47-V54 CarbonylContact O-C 3.55Å; I47-V54 VanDerWaalsContact O-CA 3.27Å; I47-V54 WeakPolarHBondContact O-CA 3.38Å; V54-S76 WeakPolarHBondContact O-CA 3.46Å; V54-R77 PolarHBondContact N-O 3.41Å; V54-R77 PolarHBondContact O-N 3.33Å; V54-I79 HydrophobicContact CB-CD1 4.04Å; V54-I79 HydrophobicContact CG2-CD1 3.92Å; V54-I84 HydrophobicContact CB-CD1 4.48Å; V54-I84 HydrophobicContact CG2-CD1 3.39Å; V54-I84 HydrophobicContact CG2-CG1 4.34Å; V54-L87 HydrophobicContact CG2-CD2 4.33Å; V54-I98 HydrophobicContact CG2-CD1 3.98Å; V54-I98 HydrophobicContact CG2-CG1 4.4Å; V54-I98 HydrophobicContact CG2-CG2 4.03Å; V54-L112 HydrophobicContact CB-CD1 4.44Å; V54-L112 HydrophobicContact CB-CD2 4.19Å; V54-L112 HydrophobicContact CG1-CD1 3.8Å; V54-L112 HydrophobicContact CG1-CD2 4.17Å; V54-L112 VanDerWaalsContact O-CD2 3.3Å; V54-L112 WeakPolarHBondContact O-CD2 3.45Å
55	S	88.7	Confident	86.3	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.7	175.4	-73.4	0	0	0	0	110.4	M29 F46 I47 L53 N73 L75 S76	M29-S55 VanDerWaalsContact CE-OG 3.32Å; M29-S55 WeakPolarHBondContact CE-OG 3.14Å; M29-S55 PolarHBondContact SD-OG 3.25Å; F46-S55 CarbonylContact C-O 3.5Å; F46-S55 VanDerWaalsContact CA-O 3.29Å; F46-S55 WeakPolarHBondContact CA-O 3.48Å; I47-S55 PolarHBondContact N-O 3.4Å; I47-S55 PolarHBondContact O-N 3.38Å; L53-S55 WeakPolarHBondContact CD2-OG 3.4Å; S55-N73 PolarHBondContact OG-ND2 2.85Å; S55-L75 CarbonylContact C-O 3.56Å; S55-L75 WeakPolarHBondContact CA-O 3.28Å; S55-S76 WeakPolarHBondContact OG-CB 3.23Å; S55-S76 PolarHBondContact OG-OG 2.91Å
56	Q	89.9	Confident	85.7	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.009	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	117.9	171.6	-179.7	-177.3	2.5	0	0	108.6	F44 F46 V74 L75 A109 E110	F44-Q56 HydrophobicContact CB-CG 4.28Å; F44-Q56 HydrophobicContact CD1-CG 3.78Å; F44-Q56 VanDerWaalsContact CD1-NE2 3.26Å; F44-Q56 HydrophobicContact CE1-CG 4.4Å; F44-Q56 VanDerWaalsContact CE1-NE2 3.28Å; F44-Q56 HydrophobicContact CG-CG 4.15Å; F46-Q56 HydrophobicContact CD1-CB 3.96Å; F46-Q56 HydrophobicContact CD1-CG 4.18Å; F46-Q56 HydrophobicContact CE1-CB 3.72Å; F46-Q56 HydrophobicContact CE1-CG 3.56Å; F46-Q56 HydrophobicContact CZ-CG 3.99Å; Q56-V74 PolarHBondContact O-N 3Å; Q56-L75 HydrophobicContact CB-CB 4.35Å; Q56-L75 PolarHBondContact N-O 2.87Å; Q56-L75 PolarHBondContact O-N 3.17Å; Q56-A109 PolarHBondContact NE2-O 2.95Å; Q56-A109 PolarHBondContact OE1-O 3.05Å; Q56-E110 PolarHBondContact OE1-O 2.74Å
57	L	88.2	Confident	85.4	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	138.2	176.4	-52.7	-173.8	0	0	0	109.4	F44 L45 I47 F71 S72 N73 I317	F44-L57 CarbonylContact C-O 3.57Å; F44-L57 VanDerWaalsContact CA-O 3.3Å; F44-L57 WeakPolarHBondContact CA-O 3.44Å; L45-L57 HydrophobicContact CB-CB 4.38Å; L45-L57 PolarHBondContact N-O 3.46Å; L45-L57 PolarHBondContact O-N 2.88Å; I47-L57 HydrophobicContact CD1-CD1 3.38Å; I47-L57 HydrophobicContact CD1-CG 4.2Å; I47-L57 HydrophobicContact CG1-CD1 4.18Å; L57-F71 HydrophobicContact CD1-CB 4.24Å; L57-S72 CarbonylContact C-O 3.56Å; L57-S72 VanDerWaalsContact CA-O 3.31Å; L57-S72 WeakPolarHBondContact CA-O 3.45Å; L57-N73 HydrophobicContact CD2-CB 3.79Å; L57-I317 HydrophobicContact CD1-CD1 4.02Å
58	I	88.1	Confident	85.2	Confident	44 Å²	44	32.4 Å²	32.4	23%	0.226	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	135.6	166.1	-168.9	169.4	0	0	0	109	F44 S72 V74	F44-I58 HydrophobicContact CD1-CB 4.25Å; F44-I58 HydrophobicContact CE1-CB 4.18Å; F44-I58 HydrophobicContact CE1-CD1 4.35Å; F44-I58 HydrophobicContact CE1-CG1 4.33Å; I58-S72 WeakPolarHBondContact CG2-OG 3.3Å; I58-S72 PolarHBondContact N-O 3.24Å; I58-S72 PolarHBondContact O-N 3.49Å; I58-V74 HydrophobicContact CB-CG2 3.76Å; I58-V74 HydrophobicContact CG2-CG2 3.64Å
59	I	86.2	Confident	85	Confident	21 Å²	21	32.6 Å²	32.6	11%	0.108	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	124.7	-178	-58.3	155.2	0	0	0	108.3	D43 L45 F69 F71 Y300	D43-I59 PolarHBondContact O-N 3.41Å; D43-I59 VanDerWaalsContact O-N 3.09Å; L45-I59 HydrophobicContact CB-CD1 3.62Å; L45-I59 HydrophobicContact CB-CG1 4.05Å; L45-I59 HydrophobicContact CD2-CD1 4.44Å; I59-F69 HydrophobicContact CG2-CD1 3.81Å; I59-F71 HydrophobicContact CG1-CD1 3.98Å; I59-F71 HydrophobicContact CG1-CE1 4.01Å; I59-F71 HydrophobicContact CG2-CE1 4.43Å; I59-Y300 HydrophobicContact CD1-CE1 3.76Å; I59-Y300 HydrophobicContact CD1-CE2 4Å; I59-Y300 VanDerWaalsContact CD1-CZ 3.41Å; I59-Y300 VanDerWaalsContact CD1-OH 3.27Å; I59-Y300 WeakPolarHBondContact CD1-OH 3.4Å; I59-Y300 HydrophobicContact CG1-CE1 4.49Å; I59-Y300 HydrophobicContact CG2-CE1 4.45Å
60	Q	84.8	Confident	84.9	Confident	85 Å²	85	33 Å²	33	40%	0.397	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.1	175.4	-68.1	-176.9	-12.6	0	0	110	C70	Q60-C70 PolarHBondContact N-O 2.9Å; Q60-C70 PolarHBondContact O-N 2.89Å
61	E	88	Confident	84.9	Confident	20 Å²	20	31.3 Å²	31.3	9%	0.093	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	126.3	170.9	-174.6	168.8	179.6	0	0	109.5	F69 R324 H365 L369 R373	E61-F69 HydrophobicContact CB-CD1 4.12Å; E61-F69 HydrophobicContact CB-CE1 3.72Å; E61-F69 HydrophobicContact CB-CZ 4.39Å; E61-F69 HydrophobicContact CG-CE1 3.93Å; E61-F69 HydrophobicContact CG-CZ 4.1Å; E61-R324 IonicContact OE1-CZ 2.79Å; E61-R324 IonicContact OE1-NE 3.86Å; E61-R324 PolarHBondContact OE1-NE 2.86Å; E61-R324 IonicContact OE1-NH2 3.8Å; E61-R324 IonicContact OE2-CZ 2.63Å; E61-R324 IonicContact OE2-NE 3.37Å; E61-R324 PolarHBondContact OE2-NE 2.82Å; E61-R324 IonicContact OE2-NH2 3.49Å; E61-R324 PolarHBondContact OE2-NH2 2.99Å; E61-H365 PolarHBondContact O-CE1 3.28Å; E61-H365 VanDerWaalsContact O-CE1 3.31Å; E61-H365 PolarHBondContact O-NE2 3.23Å; E61-L369 HydrophobicContact CB-CD1 4.17Å; E61-L369 HydrophobicContact CG-CD1 4.14Å; E61-R373 IonicContact OE1-CZ 3.71Å; E61-R373 IonicContact OE1-NH1 2.72Å; E61-R373 IonicContact OE1-NH2 2.7Å; E61-R373 PolarHBondContact OE1-NH2 3.29Å
62	L	85.2	Confident	84.9	Confident	36 Å²	36	29.5 Å²	29.5	19%	0.188	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	150.8	177	-62	179.3	0	0	0	109.8	S68 C70	L62-S68 PolarHBondContact N-O 3.47Å; L62-S68 PolarHBondContact O-N 3.18Å; L62-S68 VanDerWaalsContact O-O 3.04Å; L62-C70 HydrophobicContact CD1-CB 3.58Å; L62-C70 HydrophobicContact CG-CB 4.17Å
63	Y	81.6	Confident	84.7	Confident	10 Å²	10	31.5 Å²	31.5	4%	0.039	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	113.5	-179.9	177.2	-93.9	0	0	0	110.5	T67 R372 R373 R376	Y63-T67 HydrophobicContact CD2-CG2 3.82Å; Y63-T67 HydrophobicContact CE2-CG2 4.46Å; Y63-R372 HydrophobicContact CD1-CB 3.56Å; Y63-R372 HydrophobicContact CD1-CG 4.4Å; Y63-R372 HydrophobicContact CE1-CB 3.78Å; Y63-R372 WeakPolarHBondContact O-CD 3.09Å; Y63-R372 PolarHBondContact O-NH1 3.01Å; Y63-R373 HydrophobicContact CD1-CG 4.49Å; Y63-R373 HydrophobicContact CD2-CG 4.45Å; Y63-R373 HydrophobicContact CG-CG 4.46Å; Y63-R376 WeakPolarHBondContact OH-CD 3.47Å; Y63-R376 PolarHBondContact OH-NE 3.42Å; Y63-R376 PolarHBondContact OH-NH1 2.84Å
64	D	72.7	Confident	84.6	Confident	89 Å²	89	33.1 Å²	33.1	48%	0.476	17%	0.174	S	C	.	.	S	Bend	trans	-109.9	-87	168.1	-62.2	-38.6	0	0	0	108.2	H22 R372	H22-D64 IonicContact CE1-OD2 2.6Å; H22-D64 PolarHBondContact CE1-OD2 2.91Å; D64-R372 IonicContact OD1-NH1 3.91Å; D64-R372 PolarHBondContact OD1-NH1 3.44Å
65	D	69.4	Low	84.5	Confident	99 Å²	99	36.5 Å²	36.5	53%	0.529	19%	0.192	S	C	.	.	S	Bend	trans	-102.1	-26.9	170.7	-70	-49.3	0	0	0	113.2	R376 N425	D65-R376 PolarHBondContact O-NH1 2.72Å; D65-N425 PolarHBondContact OD1-ND2 3.45Å
66	K	77.1	Confident	84.4	Confident	99 Å²	99	39.1 Å²	39.1	43%	0.43	21%	0.21	S	C	.	.	S	Bend	trans	-131.7	151.2	177.1	-66	-177.8	-178.2	177.6	0	108.4	S68	K66-S68 PolarHBondContact O-N 3.43Å
67	T	84.1	Confident	84.4	Confident	16 Å²	16	43.8 Å²	43.8	10%	0.098	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	121.8	173.2	47.9	0	0	0	0	108.8	F19 Y63 R324 R373	F19-T67 WeakPolarHBondContact CD1-OG1 3.49Å; F19-T67 WeakPolarHBondContact CE1-OG1 3.33Å; Y63-T67 HydrophobicContact CD2-CG2 3.82Å; Y63-T67 HydrophobicContact CE2-CG2 4.46Å; T67-R324 HydrophobicContact CG2-CB 4.42Å; T67-R324 HydrophobicContact CG2-CG 3.94Å; T67-R373 VanDerWaalsContact CG2-NH2 3.28Å
68	S	86.2	Confident	84.4	Confident	9 Å²	9	50.7 Å²	50.7	6%	0.063	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	155.6	-179.8	57.6	0	0	0	0	110	Q20 H22 L62 K66	Q20-S68 WeakPolarHBondContact O-CA 3.19Å; Q20-S68 WeakPolarHBondContact O-CB 3.28Å; H22-S68 PolarHBondContact ND1-OG 3.25Å; L62-S68 PolarHBondContact N-O 3.47Å; L62-S68 PolarHBondContact O-N 3.18Å; L62-S68 VanDerWaalsContact O-O 3.04Å; K66-S68 PolarHBondContact O-N 3.43Å
69	F	86.9	Confident	84.4	Confident	3 Å²	3	50 Å²	50	1%	0.013	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.6	178.6	-71.1	-87.8	0	0	0	110.3	F19 Q20 H22 I59 E61 F71 L298 V319	F19-F69 HydrophobicContact CB-CD2 3.68Å; F19-F69 HydrophobicContact CB-CE2 3.74Å; F19-F69 HydrophobicContact CD1-CE2 4.1Å; F19-F69 HydrophobicContact CD2-CD2 4.29Å; F19-F69 AromaticContact CD2-CE2 3.54Å; F19-F69 HydrophobicContact CD2-CE2 3.54Å; F19-F69 HydrophobicContact CD2-CZ 4.45Å; F19-F69 HydrophobicContact CE2-CE2 4.08Å; F19-F69 HydrophobicContact CG-CD2 4.03Å; F19-F69 AromaticContact CG-CE2 3.53Å; F19-F69 HydrophobicContact CG-CE2 3.53Å; Q20-F69 PolarHBondContact O-N 3.26Å; H22-F69 WeakPolarHBondContact CB-O 3.34Å; H22-F69 PolarHBondContact N-O 3.37Å; I59-F69 HydrophobicContact CG2-CD1 3.81Å; E61-F69 HydrophobicContact CB-CD1 4.12Å; E61-F69 HydrophobicContact CB-CE1 3.72Å; E61-F69 HydrophobicContact CB-CZ 4.39Å; E61-F69 HydrophobicContact CG-CE1 3.93Å; E61-F69 HydrophobicContact CG-CZ 4.1Å; F69-F71 HydrophobicContact CB-CE2 4.47Å; F69-F71 HydrophobicContact CB-CZ 4.37Å; F69-L298 HydrophobicContact CD1-CD1 4.37Å; F69-L298 HydrophobicContact CE1-CD1 3.54Å; F69-L298 HydrophobicContact CZ-CD1 3.7Å; F69-L298 HydrophobicContact CZ-CD2 4.14Å; F69-V319 HydrophobicContact CB-CG2 3.8Å; F69-V319 HydrophobicContact CD2-CB 3.79Å; F69-V319 HydrophobicContact CD2-CG1 3.78Å; F69-V319 HydrophobicContact CD2-CG2 3.94Å; F69-V319 HydrophobicContact CE2-CB 4.28Å; F69-V319 HydrophobicContact CE2-CG1 3.84Å; F69-V319 HydrophobicContact CG-CB 4.26Å; F69-V319 HydrophobicContact CG-CG1 4.21Å; F69-V319 HydrophobicContact CG-CG2 3.92Å; F69-V319 HydrophobicContact CZ-CG1 4.3Å
70	C	86.6	Confident	84.6	Confident	10 Å²	10	50.2 Å²	50.2	7%	0.068	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	130.3	174.8	-174.2	0	0	0	0	109.3	H22 Q60 L62	H22-C70 HydrophobicContact CB-CB 4.12Å; Q60-C70 PolarHBondContact N-O 2.9Å; Q60-C70 PolarHBondContact O-N 2.89Å; L62-C70 HydrophobicContact CD1-CB 3.58Å; L62-C70 HydrophobicContact CG-CB 4.17Å
71	F	85.8	Confident	84.8	Confident	3 Å²	3	52.2 Å²	52.2	1%	0.013	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	122.8	174.8	-54.5	-83.4	0	0	0	108.7	S25 C26 L45 L57 I59 F69 Y300 I317 V319	S25-F71 WeakPolarHBondContact CA-O 3.32Å; C26-F71 PolarHBondContact N-O 3.37Å; L45-F71 HydrophobicContact CD2-CD1 4.33Å; L45-F71 HydrophobicContact CD2-CE1 4.04Å; L57-F71 HydrophobicContact CD1-CB 4.24Å; I59-F71 HydrophobicContact CG1-CD1 3.98Å; I59-F71 HydrophobicContact CG1-CE1 4.01Å; I59-F71 HydrophobicContact CG2-CE1 4.43Å; F69-F71 HydrophobicContact CB-CE2 4.47Å; F69-F71 HydrophobicContact CB-CZ 4.37Å; F71-Y300 HydrophobicContact CE1-CD1 4.33Å; F71-Y300 HydrophobicContact CE1-CE1 4.44Å; F71-I317 HydrophobicContact CE1-CG2 3.99Å; F71-I317 HydrophobicContact CE2-CB 4.16Å; F71-I317 HydrophobicContact CE2-CG2 4.02Å; F71-I317 HydrophobicContact CZ-CB 4.17Å; F71-I317 HydrophobicContact CZ-CG2 3.52Å; F71-V319 HydrophobicContact CE1-CG2 4.31Å; F71-V319 HydrophobicContact CE2-CG2 4.24Å; F71-V319 HydrophobicContact CZ-CG2 3.45Å; F71-V319 VanDerWaalsContact CZ-CG2 3.45Å
72	S	85.2	Confident	85	Confident	35 Å²	35	56 Å²	56	25%	0.245	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	130.9	172.8	43.4	0	0	0	0	110.2	L57 I58 V74	L57-S72 CarbonylContact C-O 3.56Å; L57-S72 VanDerWaalsContact CA-O 3.31Å; L57-S72 WeakPolarHBondContact CA-O 3.45Å; I58-S72 WeakPolarHBondContact CG2-OG 3.3Å; I58-S72 PolarHBondContact N-O 3.24Å; I58-S72 PolarHBondContact O-N 3.49Å; S72-V74 PolarHBondContact O-N 2.74Å
73	N	83.8	Confident	85.2	Confident	42 Å²	42	57.7 Å²	57.7	23%	0.225	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	122.8	176.4	-169.6	-72.2	0	0	0	109.6	C26 S55 L57	C26-N73 PolarHBondContact O-N 3.43Å; S55-N73 PolarHBondContact OG-ND2 2.85Å; L57-N73 HydrophobicContact CD2-CB 3.79Å
74	V	87.1	Confident	85.7	Confident	72 Å²	72	57.2 Å²	57.2	44%	0.436	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-52.2	178.4	-173.9	0	0	0	0	109.7	F44 Q56 I58 S72	F44-V74 HydrophobicContact CE1-CG2 4.42Å; Q56-V74 PolarHBondContact O-N 3Å; I58-V74 HydrophobicContact CB-CG2 3.76Å; I58-V74 HydrophobicContact CG2-CG2 3.64Å; S72-V74 PolarHBondContact O-N 2.74Å
75	L	88.6	Confident	86.6	Confident	72 Å²	72	56 Å²	56	38%	0.377	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	147.1	-179.7	-69.2	175	0	0	0	110	S55 Q56	S55-L75 CarbonylContact C-O 3.56Å; S55-L75 WeakPolarHBondContact CA-O 3.28Å; Q56-L75 HydrophobicContact CB-CB 4.35Å; Q56-L75 PolarHBondContact N-O 2.87Å; Q56-L75 PolarHBondContact O-N 3.17Å
76	S	88	Confident	87.6	Confident	54 Å²	54	56.1 Å²	56.1	38%	0.378	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	134.2	172.1	-167.4	0	0	0	0	110	L53 V54 S55	L53-S76 WeakPolarHBondContact CD1-OG 3.44Å; L53-S76 WeakPolarHBondContact CD2-OG 3.45Å; L53-S76 WeakPolarHBondContact CG-OG 3.42Å; V54-S76 WeakPolarHBondContact O-CA 3.46Å; S55-S76 WeakPolarHBondContact OG-CB 3.23Å; S55-S76 PolarHBondContact OG-OG 2.91Å
77	R	88.6	Confident	88.4	Confident	101 Å²	101	51.8 Å²	51.8	38%	0.381	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	133.5	-177.8	-168.9	176.2	-68.6	-161.2	2.9	110.7	V54 I79 L112 E113	V54-R77 PolarHBondContact N-O 3.41Å; V54-R77 PolarHBondContact O-N 3.33Å; R77-I79 HydrophobicContact CB-CG1 4.45Å; R77-I79 HydrophobicContact CG-CG1 4.27Å; R77-I79 PolarHBondContact O-N 3.04Å; R77-L112 HydrophobicContact CB-CD2 3.72Å; R77-L112 HydrophobicContact CB-CG 4.36Å; R77-L112 VanDerWaalsContact CD-O 3.31Å; R77-L112 WeakPolarHBondContact CD-O 3.42Å; R77-L112 VanDerWaalsContact CZ-O 3.3Å; R77-L112 PolarHBondContact NE-O 3.44Å; R77-L112 PolarHBondContact NH1-O 3.11Å; R77-E113 VanDerWaalsContact NH1-CG 3.29Å; R77-E113 IonicContact NH2-OE1 3.24Å
78	R	89.1	Confident	88.7	Confident	144 Å²	144	52.1 Å²	52.1	54%	0.543	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	113.6	168.1	-175.5	171.1	-83.3	153.8	3.6	109.2	K51 F80	K51-R78 PolarHBondContact O-NE 2.84Å; R78-F80 WeakPolarHBondContact CG-O 3.09Å
79	I	88.2	Confident	88.8	Confident	29 Å²	29	53 Å²	53	15%	0.149	28%	0.275	C	S	.	.			trans	-102.4	-40.5	-177.3	-66.2	173.6	0	0	0	109.7	G52 V54 R77 I98 L112	G52-I79 PolarHBondContact O-N 3.37Å; G52-I79 VanDerWaalsContact O-N 3.14Å; V54-I79 HydrophobicContact CB-CD1 4.04Å; V54-I79 HydrophobicContact CG2-CD1 3.92Å; R77-I79 HydrophobicContact CB-CG1 4.45Å; R77-I79 HydrophobicContact CG-CG1 4.27Å; R77-I79 PolarHBondContact O-N 3.04Å; I79-I98 HydrophobicContact CD1-CD1 3.22Å; I79-I98 HydrophobicContact CG1-CD1 4.46Å; I79-I98 HydrophobicContact CG2-CD1 4.3Å; I79-L112 HydrophobicContact CD1-CG 4.26Å
80	F	90.3	Very high	88.5	Confident	27 Å²	27	53 Å²	53	12%	0.118	28%	0.275	C	S	.	.			trans	-119.8	163	173.7	-68.5	-71.4	0	0	0	110.9	G52 R78 I98 S100 N103 I105	G52-F80 CarbonylContact C-O 3.56Å; G52-F80 WeakPolarHBondContact CA-O 3.13Å; G52-F80 PolarHBondContact O-N 3.44Å; G52-F80 VanDerWaalsContact O-O 3.09Å; R78-F80 WeakPolarHBondContact CG-O 3.09Å; F80-I98 HydrophobicContact CD2-CG2 3.96Å; F80-I98 HydrophobicContact CE2-CB 4.32Å; F80-I98 HydrophobicContact CE2-CG2 3.76Å; F80-S100 VanDerWaalsContact CD2-CB 3.44Å; F80-N103 HydrophobicContact CE1-CB 3.73Å; F80-N103 HydrophobicContact CZ-CB 3.99Å; F80-I105 HydrophobicContact CE1-CD1 3.58Å; F80-I105 HydrophobicContact CE1-CG1 4.25Å; F80-I105 HydrophobicContact CE2-CD1 4.25Å; F80-I105 HydrophobicContact CE2-CG1 4.49Å; F80-I105 HydrophobicContact CZ-CB 4.11Å; F80-I105 HydrophobicContact CZ-CD1 3.38Å; F80-I105 HydrophobicContact CZ-CG1 3.65Å
81	T	87.7	Confident	87.8	Confident	127 Å²	127	55.9 Å²	55.9	78%	0.779	30%	0.295	S	S	*	.	S	Bend	trans	-91.3	-16.3	169.8	50.6	0	0	0	0	112.3
82	K	92.1	Very high	87.2	Confident	100 Å²	100	60.5 Å²	60.5	44%	0.435	32%	0.315	S	S	.	.	S	Bend	trans	-100.8	160.7	-178.8	-72.9	-175.8	178.7	178.7	0	110.5	G52 S100 D101	G52-K82 WeakPolarHBondContact CA-O 3.3Å; G52-K82 PolarHBondContact N-O 3.23Å; K82-S100 WeakPolarHBondContact CB-OG 3Å; K82-S100 PolarHBondContact O-OG 3.3Å; K82-D101 HydrophobicContact CB-CB 4.35Å; K82-D101 HydrophobicContact CD-CB 3.56Å; K82-D101 WeakPolarHBondContact CD-OD2 3.33Å; K82-D101 WeakPolarHBondContact CE-OD2 3.26Å; K82-D101 IonicContact NZ-OD2 3.89Å; K82-D101 PolarHBondContact NZ-OD2 3.43Å
83	P	90.7	Very high	86.6	Confident	71 Å²	71	60.4 Å²	60.4	46%	0.461	31%	0.31	S	S	.	.			trans	-57.3	140	179.9	23.6	-36.2	0	0	0	111.7	S50 S85 S100	S50-P83 VanDerWaalsContact O-CA 3.25Å; S50-P83 WeakPolarHBondContact O-CA 3.22Å; S50-P83 WeakPolarHBondContact O-CB 3.26Å; P83-S85 PolarHBondContact O-N 2.68Å; P83-S100 WeakPolarHBondContact O-CB 3.47Å; P83-S100 PolarHBondContact O-OG 3.43Å
84	I	92.1	Very high	86.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.313	C	S	.	.			trans	-79.1	114.6	173.7	-67.8	147.4	0	0	0	107.8	T36 A37 T49 G52 L53 V54 L87 I98	T36-I84 VanDerWaalsContact CB-O 3.28Å; T36-I84 WeakPolarHBondContact CB-O 3.3Å; T36-I84 PolarHBondContact OG1-O 3.1Å; A37-I84 HydrophobicContact CB-CG2 3.96Å; T49-I84 PolarHBondContact O-N 3.12Å; T49-I84 VanDerWaalsContact O-N 3.13Å; G52-I84 VanDerWaalsContact C-CD1 3.46Å; L53-I84 VanDerWaalsContact C-CD1 3.48Å; L53-I84 VanDerWaalsContact O-CD1 3.24Å; L53-I84 WeakPolarHBondContact O-CD1 3.46Å; V54-I84 HydrophobicContact CB-CD1 4.48Å; V54-I84 HydrophobicContact CG2-CD1 3.39Å; V54-I84 HydrophobicContact CG2-CG1 4.34Å; I84-L87 HydrophobicContact CG2-CD1 4.45Å; I84-L87 HydrophobicContact CG2-CD2 3.78Å; I84-L87 HydrophobicContact CG2-CG 3.77Å; I84-I98 HydrophobicContact CG1-CG2 4.21Å; I84-I98 HydrophobicContact CG2-CG2 4.2Å
85	S	90.7	Very high	86.4	Confident	64 Å²	64	57.6 Å²	57.6	45%	0.448	30%	0.295	S	S	.	.			trans	-87.9	-28.6	-175.4	47.8	0	0	0	0	112.8	P83 F99	P83-S85 PolarHBondContact O-N 2.68Å; S85-F99 PolarHBondContact N-O 3.39Å; S85-F99 WeakPolarHBondContact OG-CD1 3.38Å; S85-F99 WeakPolarHBondContact OG-CE1 3.31Å; S85-F99 PolarHBondContact OG-O 2.74Å; S85-F99 VanDerWaalsContact OG-O 3.12Å
86	R	91.1	Very high	86.5	Confident	100 Å²	100	54.1 Å²	54.1	38%	0.377	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	142.6	178.8	-162.2	174.6	177.3	106.4	0.8	111.3	E88 F99 F127	R86-E88 HydrophobicContact CG-CG 4.44Å; R86-E88 IonicContact CZ-OE1 2.53Å; R86-E88 VanDerWaalsContact CZ-OE1 3.24Å; R86-E88 IonicContact NE-OE1 2.89Å; R86-E88 PolarHBondContact NE-OE1 3.33Å; R86-E88 IonicContact NH2-OE1 2.6Å; R86-E88 PolarHBondContact NH2-OE1 2.74Å; R86-F99 HydrophobicContact CB-CB 4.33Å; R86-F99 HydrophobicContact CB-CD1 4.23Å; R86-F99 PolarHBondContact N-O 2.8Å; R86-F99 PolarHBondContact O-N 3.3Å; R86-F127 HydrophobicContact CB-CE1 4.01Å; R86-F127 HydrophobicContact CB-CZ 4.21Å; R86-F127 HydrophobicContact CG-CE1 4.21Å; R86-F127 HydrophobicContact CG-CZ 4.16Å
87	L	93.1	Very high	86.7	Confident	9 Å²	9	51.6 Å²	51.6	5%	0.047	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.1	173.1	-71.6	179.5	0	0	0	108.7	A37 C39 F46 G48 V54 I84 V96 S97 I98	A37-L87 HydrophobicContact CB-CB 4.23Å; A37-L87 HydrophobicContact CB-CD1 4.22Å; A37-L87 HydrophobicContact CB-CG 3.87Å; C39-L87 HydrophobicContact CB-CB 3.98Å; F46-L87 HydrophobicContact CB-CD1 4.38Å; G48-L87 VanDerWaalsContact N-CD1 3.28Å; V54-L87 HydrophobicContact CG2-CD2 4.33Å; I84-L87 HydrophobicContact CG2-CD1 4.45Å; I84-L87 HydrophobicContact CG2-CD2 3.78Å; I84-L87 HydrophobicContact CG2-CG 3.77Å; L87-V96 HydrophobicContact CD2-CG1 4.48Å; L87-S97 WeakPolarHBondContact CA-O 3.33Å; L87-I98 HydrophobicContact CD2-CB 3.98Å; L87-I98 HydrophobicContact CD2-CG1 3.63Å; L87-I98 HydrophobicContact CD2-CG2 3.81Å
88	E	90.1	Very high	87	Confident	23 Å²	23	46.8 Å²	46.8	11%	0.107	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	143.4	172.8	-63.7	-169.6	171.7	0	0	110.7	R86 V96 S97 F127 Q128 L129	R86-E88 HydrophobicContact CG-CG 4.44Å; R86-E88 IonicContact CZ-OE1 2.53Å; R86-E88 VanDerWaalsContact CZ-OE1 3.24Å; R86-E88 IonicContact NE-OE1 2.89Å; R86-E88 PolarHBondContact NE-OE1 3.33Å; R86-E88 IonicContact NH2-OE1 2.6Å; R86-E88 PolarHBondContact NH2-OE1 2.74Å; E88-V96 CarbonylContact O-C 3.58Å; E88-S97 PolarHBondContact N-O 3.46Å; E88-S97 PolarHBondContact O-N 3.43Å; E88-F127 HydrophobicContact CB-CE2 4.03Å; E88-F127 HydrophobicContact CG-CE2 3.96Å; E88-F127 HydrophobicContact CG-CZ 4.14Å; E88-Q128 VanDerWaalsContact OE2-CA 3.24Å; E88-Q128 WeakPolarHBondContact OE2-CA 3.41Å; E88-L129 HydrophobicContact CB-CB 4.43Å; E88-L129 PolarHBondContact OE2-N 3.06Å
89	T	89.2	Confident	87.2	Confident	28 Å²	28	41.2 Å²	41.2	17%	0.172	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	153.5	175.8	41.2	0	0	0	0	109.3	C39 S40 F41 F46 V96	C39-T89 HydrophobicContact CB-CG2 4.16Å; C39-T89 WeakPolarHBondContact SG-CG2 3.45Å; S40-T89 PolarHBondContact O-OG1 3.24Å; F41-T89 HydrophobicContact CB-CG2 3.85Å; F46-T89 HydrophobicContact CD2-CG2 4.17Å; F46-T89 HydrophobicContact CE2-CG2 4.41Å; T89-V96 HydrophobicContact CG2-CB 4.49Å; T89-V96 HydrophobicContact CG2-CG1 4.45Å; T89-V96 HydrophobicContact CG2-CG2 3.85Å
90	S	81	Confident	87.5	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.014	21%	0.214	C	C	.	.			trans	-82.6	153.3	162.4	83.6	0	0	0	0	110	F41 K92 K93 T95 E137	F41-S90 WeakPolarHBondContact CD2-O 3.3Å; S90-K92 VanDerWaalsContact C-N 3.33Å; S90-K93 PolarHBondContact OG-N 2.76Å; S90-K93 PolarHBondContact OG-O 2.7Å; S90-T95 PolarHBondContact N-O 3.49Å; S90-E137 WeakPolarHBondContact CB-OE1 3.42Å; S90-E137 PolarHBondContact OG-OE1 3.47Å
91	S	72.4	Confident	87.5	Confident	71 Å²	71	42.3 Å²	42.3	50%	0.497	23%	0.228	S	C	.	.	S	Bend	trans	-74	-22.7	178.7	50.1	0	0	0	0	113.6
92	K	73.2	Confident	87.7	Confident	99 Å²	99	39.4 Å²	39.4	43%	0.43	21%	0.206	S	C	.	.	S	Bend	trans	-117.6	-20.9	-167.9	-66.2	-175.6	177.2	-176.8	0	114.8	S90 F132 D134	S90-K92 VanDerWaalsContact C-N 3.33Å; K92-F132 PolarHBondContact NZ-O 3.35Å; K92-D134 WeakPolarHBondContact CD-OD1 3.13Å; K92-D134 WeakPolarHBondContact CE-OD1 3.46Å; K92-D134 IonicContact NZ-OD1 2.81Å; K92-D134 PolarHBondContact NZ-OD1 3.33Å
93	K	72	Confident	87.8	Confident	33 Å²	33	37 Å²	37	14%	0.143	20%	0.197	C	C	.	.	S	Bend	trans	-125.2	165.5	178.9	-41.9	-173	-178.4	172.2	0	111.7	F41 S90 T95 E135 E137 I153	F41-K93 WeakPolarHBondContact CE2-O 3.28Å; F41-K93 WeakPolarHBondContact CZ-O 3.22Å; S90-K93 PolarHBondContact OG-N 2.76Å; S90-K93 PolarHBondContact OG-O 2.7Å; K93-T95 PolarHBondContact O-N 3.4Å; K93-E135 PolarHBondContact NZ-O 2.91Å; K93-E137 VanDerWaalsContact CB-OE1 3.25Å; K93-E137 WeakPolarHBondContact CB-OE1 3.35Å; K93-E137 HydrophobicContact CD-CG 3.76Å; K93-E137 HydrophobicContact CG-CG 4.02Å; K93-I153 PolarHBondContact NZ-O 2.75Å; K93-I153 VanDerWaalsContact NZ-O 3.1Å
94	T	79.7	Confident	87.9	Confident	44 Å²	44	33.6 Å²	33.6	27%	0.27	18%	0.176	S	C	.	.	S	Bend	trans	-80.8	47.8	-177.5	52.7	0	0	0	0	112.1	F41 N108 A109 E110	F41-T94 HydrophobicContact CE1-CG2 3.79Å; F41-T94 HydrophobicContact CZ-CG2 3.96Å; T94-N108 CarbonylContact O-C 3.58Å; T94-N108 VanDerWaalsContact O-CA 3.31Å; T94-N108 WeakPolarHBondContact O-CA 3.29Å; T94-A109 PolarHBondContact O-N 3.26Å; T94-E110 HydrophobicContact CG2-CG 3.87Å
95	T	87.2	Confident	88	Confident	11 Å²	11	34.8 Å²	34.8	7%	0.067	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.6	176.5	73.2	0	0	0	0	112	S90 K93 C107 I115 E137	S90-T95 PolarHBondContact N-O 3.49Å; K93-T95 PolarHBondContact O-N 3.4Å; T95-C107 WeakPolarHBondContact CA-O 3.3Å; T95-I115 HydrophobicContact CG2-CD1 3.86Å; T95-E137 WeakPolarHBondContact CG2-OE2 3.48Å; T95-E137 VanDerWaalsContact OG1-CD 3.28Å; T95-E137 PolarHBondContact OG1-OE1 3.08Å; T95-E137 PolarHBondContact OG1-OE2 2.9Å
96	V	90.5	Very high	88	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	119.6	176.8	-176.1	0	0	0	0	108.2	F46 L87 E88 T89 I98 L106 C107 A109	F46-V96 HydrophobicContact CD1-CG2 4.35Å; F46-V96 HydrophobicContact CD2-CG2 4.13Å; F46-V96 HydrophobicContact CE1-CG2 4.17Å; F46-V96 HydrophobicContact CE2-CG2 3.97Å; F46-V96 HydrophobicContact CG-CG2 4.33Å; F46-V96 HydrophobicContact CZ-CG2 4Å; L87-V96 HydrophobicContact CD2-CG1 4.48Å; E88-V96 CarbonylContact O-C 3.58Å; T89-V96 HydrophobicContact CG2-CB 4.49Å; T89-V96 HydrophobicContact CG2-CG1 4.45Å; T89-V96 HydrophobicContact CG2-CG2 3.85Å; V96-I98 HydrophobicContact CG1-CG1 4.04Å; V96-L106 CarbonylContact O-C 3.53Å; V96-L106 WeakPolarHBondContact O-CA 3.14Å; V96-C107 PolarHBondContact N-O 3.23Å; V96-C107 PolarHBondContact O-N 2.89Å; V96-A109 HydrophobicContact CG2-CB 3.67Å
97	S	91.6	Very high	88	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.5	174	-63.8	0	0	0	0	110	L87 E88 L129	L87-S97 WeakPolarHBondContact CA-O 3.33Å; E88-S97 PolarHBondContact N-O 3.46Å; E88-S97 PolarHBondContact O-N 3.43Å; S97-L129 WeakPolarHBondContact OG-CD2 3.3Å
98	I	94.3	Very high	87.8	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	120.2	-174.3	-52.4	165.4	0	0	0	108.4	V54 I79 F80 I84 L87 V96 I105 C107	V54-I98 HydrophobicContact CG2-CD1 3.98Å; V54-I98 HydrophobicContact CG2-CG1 4.4Å; V54-I98 HydrophobicContact CG2-CG2 4.03Å; I79-I98 HydrophobicContact CD1-CD1 3.22Å; I79-I98 HydrophobicContact CG1-CD1 4.46Å; I79-I98 HydrophobicContact CG2-CD1 4.3Å; F80-I98 HydrophobicContact CD2-CG2 3.96Å; F80-I98 HydrophobicContact CE2-CB 4.32Å; F80-I98 HydrophobicContact CE2-CG2 3.76Å; I84-I98 HydrophobicContact CG1-CG2 4.21Å; I84-I98 HydrophobicContact CG2-CG2 4.2Å; L87-I98 HydrophobicContact CD2-CB 3.98Å; L87-I98 HydrophobicContact CD2-CG1 3.63Å; L87-I98 HydrophobicContact CD2-CG2 3.81Å; V96-I98 HydrophobicContact CG1-CG1 4.04Å; I98-I105 PolarHBondContact N-O 2.72Å; I98-I105 PolarHBondContact O-N 3.42Å; I98-C107 HydrophobicContact CD1-CB 4.05Å; I98-C107 VanDerWaalsContact CD1-SG 3.6Å
99	F	94.6	Very high	87.6	Confident	27 Å²	27	27.7 Å²	27.7	12%	0.118	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.3	-178.3	179	-116.8	0	0	0	111.3	S85 R86 N103 L104 V124 F127	S85-F99 PolarHBondContact N-O 3.39Å; S85-F99 WeakPolarHBondContact OG-CD1 3.38Å; S85-F99 WeakPolarHBondContact OG-CE1 3.31Å; S85-F99 PolarHBondContact OG-O 2.74Å; S85-F99 VanDerWaalsContact OG-O 3.12Å; R86-F99 HydrophobicContact CB-CB 4.33Å; R86-F99 HydrophobicContact CB-CD1 4.23Å; R86-F99 PolarHBondContact N-O 2.8Å; R86-F99 PolarHBondContact O-N 3.3Å; F99-N103 WeakPolarHBondContact CA-O 3.35Å; F99-N103 WeakPolarHBondContact CD2-O 3.25Å; F99-L104 HydrophobicContact CB-CD1 4.19Å; F99-L104 HydrophobicContact CD2-CB 4.39Å; F99-V124 HydrophobicContact CD2-CG1 4.39Å; F99-V124 HydrophobicContact CE2-CB 3.96Å; F99-V124 HydrophobicContact CE2-CG1 3.97Å; F99-F127 HydrophobicContact CB-CD1 4.02Å; F99-F127 HydrophobicContact CB-CE1 3.23Å; F99-F127 HydrophobicContact CB-CZ 3.82Å; F99-F127 HydrophobicContact CD1-CD1 4.49Å; F99-F127 HydrophobicContact CD1-CE1 4.05Å; F99-F127 HydrophobicContact CD2-CD1 4.35Å; F99-F127 HydrophobicContact CD2-CE1 4.36Å; F99-F127 HydrophobicContact CG-CD1 4.06Å; F99-F127 AromaticContact CG-CE1 3.66Å; F99-F127 HydrophobicContact CG-CE1 3.66Å
100	S	94	Very high	87.4	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.007	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	123.4	175.4	-176.1	0	0	0	0	109.4	F80 K82 P83 E102 N103	F80-S100 VanDerWaalsContact CD2-CB 3.44Å; K82-S100 WeakPolarHBondContact CB-OG 3Å; K82-S100 PolarHBondContact O-OG 3.3Å; P83-S100 WeakPolarHBondContact O-CB 3.47Å; P83-S100 PolarHBondContact O-OG 3.43Å; S100-E102 PolarHBondContact O-N 3.3Å; S100-N103 PolarHBondContact N-O 2.68Å; S100-N103 WeakPolarHBondContact O-CB 3.27Å; S100-N103 PolarHBondContact O-N 2.75Å
101	D	90.8	Very high	87.7	Confident	78 Å²	78	37.3 Å²	37.3	42%	0.417	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	41.5	66.1	173.1	-165.1	41.6	0	0	0	114.2	K82 N103	K82-D101 HydrophobicContact CB-CB 4.35Å; K82-D101 HydrophobicContact CD-CB 3.56Å; K82-D101 WeakPolarHBondContact CD-OD2 3.33Å; K82-D101 WeakPolarHBondContact CE-OD2 3.26Å; K82-D101 IonicContact NZ-OD2 3.89Å; K82-D101 PolarHBondContact NZ-OD2 3.43Å; D101-N103 PolarHBondContact O-N 2.87Å; D101-N103 VanDerWaalsContact O-N 3.11Å; D101-N103 PolarHBondContact O-ND2 2.92Å
102	E	91.2	Very high	88.4	Confident	66 Å²	66	34 Å²	34	31%	0.308	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	1.5	179.8	-48.4	179.1	-165.9	0	0	116.5	S100 K122 G123 V124 K144	S100-E102 PolarHBondContact O-N 3.3Å; E102-K122 CarbonylContact O-C 3.6Å; E102-G123 PolarHBondContact O-N 2.88Å; E102-V124 WeakPolarHBondContact CA-O 3.14Å; E102-V124 PolarHBondContact O-N 3.41Å; E102-K144 HydrophobicContact CG-CD 4.36Å; E102-K144 VanDerWaalsContact OE1-CE 3.29Å; E102-K144 WeakPolarHBondContact OE1-CE 3.2Å; E102-K144 IonicContact OE1-NZ 3.78Å; E102-K144 PolarHBondContact OE1-NZ 2.79Å
103	N	94.2	Very high	89.2	Confident	49 Å²	49	33.5 Å²	33.5	26%	0.262	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129	177.7	-57.9	-72.6	0	0	0	110.3	F80 F99 S100 D101 F121 K122	F80-N103 HydrophobicContact CE1-CB 3.73Å; F80-N103 HydrophobicContact CZ-CB 3.99Å; F99-N103 WeakPolarHBondContact CA-O 3.35Å; F99-N103 WeakPolarHBondContact CD2-O 3.25Å; S100-N103 PolarHBondContact N-O 2.68Å; S100-N103 WeakPolarHBondContact O-CB 3.27Å; S100-N103 PolarHBondContact O-N 2.75Å; D101-N103 PolarHBondContact O-N 2.87Å; D101-N103 VanDerWaalsContact O-N 3.11Å; D101-N103 PolarHBondContact O-ND2 2.92Å; N103-F121 WeakPolarHBondContact CA-O 3.19Å; N103-K122 WeakPolarHBondContact OD1-CG 3.32Å
104	L	93.6	Very high	90	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	125.7	175.3	178.4	68.8	0	0	0	109.5	F99 L106 F121 V124 F127 L139 I141	F99-L104 HydrophobicContact CB-CD1 4.19Å; F99-L104 HydrophobicContact CD2-CB 4.39Å; L104-L106 HydrophobicContact CG-CD1 4.44Å; L104-F121 HydrophobicContact CB-CB 4.3Å; L104-F121 HydrophobicContact CD2-CD2 4.3Å; L104-F121 PolarHBondContact N-O 3.01Å; L104-F121 PolarHBondContact O-N 2.95Å; L104-F121 VanDerWaalsContact O-N 3.09Å; L104-V124 HydrophobicContact CB-CG2 4.08Å; L104-F127 HydrophobicContact CD1-CD1 3.99Å; L104-F127 HydrophobicContact CD1-CD2 3.79Å; L104-F127 HydrophobicContact CD1-CE1 4.07Å; L104-F127 HydrophobicContact CD1-CE2 3.85Å; L104-F127 HydrophobicContact CD1-CG 3.86Å; L104-F127 HydrophobicContact CD1-CZ 3.99Å; L104-F127 HydrophobicContact CD2-CB 3.91Å; L104-F127 HydrophobicContact CD2-CD2 4.2Å; L104-F127 HydrophobicContact CD2-CG 3.99Å; L104-L139 HydrophobicContact CD2-CD1 4.26Å; L104-L139 HydrophobicContact CD2-CD2 4.34Å; L104-I141 HydrophobicContact CD2-CD1 3.94Å; L104-I141 HydrophobicContact CD2-CG1 4.07Å
105	I	92.7	Very high	90.4	Very high	26 Å²	26	35 Å²	35	13%	0.133	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	141.8	176.6	-65.1	175.9	0	0	0	108.9	F80 I98 I114	F80-I105 HydrophobicContact CE1-CD1 3.58Å; F80-I105 HydrophobicContact CE1-CG1 4.25Å; F80-I105 HydrophobicContact CE2-CD1 4.25Å; F80-I105 HydrophobicContact CE2-CG1 4.49Å; F80-I105 HydrophobicContact CZ-CB 4.11Å; F80-I105 HydrophobicContact CZ-CD1 3.38Å; F80-I105 HydrophobicContact CZ-CG1 3.65Å; I98-I105 PolarHBondContact N-O 2.72Å; I98-I105 PolarHBondContact O-N 3.42Å; I105-I114 HydrophobicContact CG2-CB 4.36Å; I105-I114 HydrophobicContact CG2-CD1 4.19Å; I105-I114 HydrophobicContact CG2-CG1 3.89Å; I105-I114 HydrophobicContact CG2-CG2 3.75Å
106	L	92.3	Very high	90.3	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.026	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.3	173.9	-72.7	91.4	0	0	0	110.5	V96 L104 I115 I118 L139 I153	V96-L106 CarbonylContact O-C 3.53Å; V96-L106 WeakPolarHBondContact O-CA 3.14Å; L104-L106 HydrophobicContact CG-CD1 4.44Å; L106-I115 PolarHBondContact O-N 3.4Å; L106-I118 HydrophobicContact CB-CD1 4.08Å; L106-I118 HydrophobicContact CB-CG2 4.48Å; L106-I118 HydrophobicContact CD1-CG2 3.93Å; L106-I118 HydrophobicContact CD2-CD1 4.15Å; L106-L139 HydrophobicContact CD1-CD2 3.67Å; L106-L139 HydrophobicContact CD2-CD2 4.19Å; L106-I153 HydrophobicContact CD2-CD1 3.63Å
107	C	91.1	Very high	90.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	155.3	178.5	-68.3	0	0	0	0	111	T95 V96 I98 E113	T95-C107 WeakPolarHBondContact CA-O 3.3Å; V96-C107 PolarHBondContact N-O 3.23Å; V96-C107 PolarHBondContact O-N 2.89Å; I98-C107 HydrophobicContact CD1-CB 4.05Å; I98-C107 VanDerWaalsContact CD1-SG 3.6Å; C107-E113 CarbonylContact C-O 3.25Å; C107-E113 WeakPolarHBondContact CA-O 3.37Å; C107-E113 WeakPolarHBondContact CB-O 3.33Å
108	N	89.1	Confident	90	Very high	42 Å²	42	46.2 Å²	46.2	23%	0.225	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	126.7	167.8	-177.2	-30	0	0	0	109.2	T94 E110 L112 E113 I115	T94-N108 CarbonylContact O-C 3.58Å; T94-N108 VanDerWaalsContact O-CA 3.31Å; T94-N108 WeakPolarHBondContact O-CA 3.29Å; N108-E110 VanDerWaalsContact C-N 3.32Å; N108-E110 PolarHBondContact O-N 2.8Å; N108-E110 PolarHBondContact OD1-N 3.39Å; N108-L112 WeakPolarHBondContact O-CA 3.23Å; N108-L112 PolarHBondContact O-N 3.38Å; N108-E113 PolarHBondContact N-O 2.94Å; N108-I115 HydrophobicContact CB-CG1 4.4Å
109	A	85.9	Confident	89.7	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-37.4	-179.7	0	0	0	0	0	113.1	F41 F46 Q56 T94 V96	F41-A109 HydrophobicContact CD1-CB 4.12Å; F46-A109 WeakPolarHBondContact CE1-O 3.47Å; F46-A109 HydrophobicContact CE2-CB 4.26Å; F46-A109 HydrophobicContact CZ-CB 3.8Å; F46-A109 WeakPolarHBondContact CZ-O 3.37Å; Q56-A109 PolarHBondContact NE2-O 2.95Å; Q56-A109 PolarHBondContact OE1-O 3.05Å; T94-A109 PolarHBondContact O-N 3.26Å; V96-A109 HydrophobicContact CG2-CB 3.67Å
110	E	85.3	Confident	89.4	Confident	114 Å²	114	52.2 Å²	52.2	53%	0.533	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-39.2	-174.4	-65.4	-179.4	170.5	0	0	112.9	Q56 T94 N108	Q56-E110 PolarHBondContact OE1-O 2.74Å; T94-E110 HydrophobicContact CG2-CG 3.87Å; N108-E110 VanDerWaalsContact C-N 3.32Å; N108-E110 PolarHBondContact O-N 2.8Å; N108-E110 PolarHBondContact OD1-N 3.39Å
111	K	86.1	Confident	89.3	Confident	117 Å²	117	53 Å²	53	51%	0.509	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-10.5	-174.3	-63.7	-173.2	-179.9	-178.5	0	114	E113	K111-E113 HydrophobicContact CB-CB 4.31Å; K111-E113 HydrophobicContact CB-CG 4.05Å; K111-E113 PolarHBondContact O-N 2.88Å
112	L	87.3	Confident	89.4	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	38.5	-172.3	-153.4	68.4	0	0	0	112.7	F46 V54 R77 I79 N108	F46-L112 HydrophobicContact CD1-CD1 4.03Å; F46-L112 HydrophobicContact CE1-CD1 4.05Å; V54-L112 HydrophobicContact CB-CD1 4.44Å; V54-L112 HydrophobicContact CB-CD2 4.19Å; V54-L112 HydrophobicContact CG1-CD1 3.8Å; V54-L112 HydrophobicContact CG1-CD2 4.17Å; V54-L112 VanDerWaalsContact O-CD2 3.3Å; V54-L112 WeakPolarHBondContact O-CD2 3.45Å; R77-L112 HydrophobicContact CB-CD2 3.72Å; R77-L112 HydrophobicContact CB-CG 4.36Å; R77-L112 VanDerWaalsContact CD-O 3.31Å; R77-L112 WeakPolarHBondContact CD-O 3.42Å; R77-L112 VanDerWaalsContact CZ-O 3.3Å; R77-L112 PolarHBondContact NE-O 3.44Å; R77-L112 PolarHBondContact NH1-O 3.11Å; I79-L112 HydrophobicContact CD1-CG 4.26Å; N108-L112 WeakPolarHBondContact O-CA 3.23Å; N108-L112 PolarHBondContact O-N 3.38Å
113	E	89.3	Confident	89.4	Confident	90 Å²	90	54.4 Å²	54.4	42%	0.421	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	139.9	-179.6	-77.9	176.9	173.7	0	0	111.5	R77 C107 N108 K111 I115	R77-E113 VanDerWaalsContact NH1-CG 3.29Å; R77-E113 IonicContact NH2-OE1 3.24Å; C107-E113 CarbonylContact C-O 3.25Å; C107-E113 WeakPolarHBondContact CA-O 3.37Å; C107-E113 WeakPolarHBondContact CB-O 3.33Å; N108-E113 PolarHBondContact N-O 2.94Å; K111-E113 HydrophobicContact CB-CB 4.31Å; K111-E113 HydrophobicContact CB-CG 4.05Å; K111-E113 PolarHBondContact O-N 2.88Å; E113-I115 PolarHBondContact O-N 3.4Å
114	I	88.5	Confident	89.4	Confident	83 Å²	83	52.1 Å²	52.1	43%	0.426	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	131.7	178.6	-59.6	174.1	0	0	0	109.7	I105 N116	I105-I114 HydrophobicContact CG2-CB 4.36Å; I105-I114 HydrophobicContact CG2-CD1 4.19Å; I105-I114 HydrophobicContact CG2-CG1 3.89Å; I105-I114 HydrophobicContact CG2-CG2 3.75Å; I114-N116 PolarHBondContact O-N 3.44Å
115	I	88.7	Confident	89.3	Confident	24 Å²	24	53.4 Å²	53.4	12%	0.123	28%	0.278	C	S	.	.			trans	-82.8	98.5	179.1	-56.7	175.3	0	0	0	109.1	T95 L106 N108 E113 F117 I118	T95-I115 HydrophobicContact CG2-CD1 3.86Å; L106-I115 PolarHBondContact O-N 3.4Å; N108-I115 HydrophobicContact CB-CG1 4.4Å; E113-I115 PolarHBondContact O-N 3.4Å; I115-F117 VanDerWaalsContact C-N 3.3Å; I115-F117 HydrophobicContact CG2-CD1 3.42Å; I115-F117 VanDerWaalsContact CG2-CD1 3.42Å; I115-F117 HydrophobicContact CG2-CD2 4.32Å; I115-F117 HydrophobicContact CG2-CE1 3.1Å; I115-F117 HydrophobicContact CG2-CE2 4.05Å; I115-F117 HydrophobicContact CG2-CG 4.03Å; I115-F117 HydrophobicContact CG2-CZ 3.44Å; I115-F117 VanDerWaalsContact CG2-CZ 3.44Å; I115-F117 PolarHBondContact O-N 3.1Å; I115-I118 HydrophobicContact CB-CD1 4.03Å; I115-I118 HydrophobicContact CB-CG1 4.26Å; I115-I118 HydrophobicContact CD1-CD1 4.09Å; I115-I118 HydrophobicContact CG2-CB 4.46Å; I115-I118 HydrophobicContact CG2-CD1 3.73Å; I115-I118 HydrophobicContact CG2-CG1 3.74Å; I115-I118 PolarHBondContact O-N 2.97Å; I115-I118 VanDerWaalsContact O-N 3.08Å
116	N	86.5	Confident	89.2	Confident	152 Å²	152	52.6 Å²	52.6	81%	0.813	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-24.8	-170.3	-66.3	-28	0	0	0	115.7	I114 I118	I114-N116 PolarHBondContact O-N 3.44Å; N116-I118 PolarHBondContact O-N 3.4Å
117	F	87.6	Confident	89.3	Confident	85 Å²	85	52.7 Å²	52.7	37%	0.373	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-13.1	177.7	69.4	-102.2	0	0	0	112.7	I115 I153 V155 C158	I115-F117 VanDerWaalsContact C-N 3.3Å; I115-F117 HydrophobicContact CG2-CD1 3.42Å; I115-F117 VanDerWaalsContact CG2-CD1 3.42Å; I115-F117 HydrophobicContact CG2-CD2 4.32Å; I115-F117 HydrophobicContact CG2-CE1 3.1Å; I115-F117 HydrophobicContact CG2-CE2 4.05Å; I115-F117 HydrophobicContact CG2-CG 4.03Å; I115-F117 HydrophobicContact CG2-CZ 3.44Å; I115-F117 VanDerWaalsContact CG2-CZ 3.44Å; I115-F117 PolarHBondContact O-N 3.1Å; F117-I153 HydrophobicContact CE2-CG2 4.47Å; F117-V155 WeakPolarHBondContact CZ-O 3.46Å; F117-C158 HydrophobicContact CD2-CB 4.41Å
118	I	87.5	Confident	89.3	Confident	11 Å²	11	54.3 Å²	54.3	6%	0.056	28%	0.282	C	S	.	.	S	Bend	trans	-94.5	124.4	176.1	-55.4	179.3	0	0	0	107.8	L106 I115 N116 F121 I153 C158	L106-I118 HydrophobicContact CB-CD1 4.08Å; L106-I118 HydrophobicContact CB-CG2 4.48Å; L106-I118 HydrophobicContact CD1-CG2 3.93Å; L106-I118 HydrophobicContact CD2-CD1 4.15Å; I115-I118 HydrophobicContact CB-CD1 4.03Å; I115-I118 HydrophobicContact CB-CG1 4.26Å; I115-I118 HydrophobicContact CD1-CD1 4.09Å; I115-I118 HydrophobicContact CG2-CB 4.46Å; I115-I118 HydrophobicContact CG2-CD1 3.73Å; I115-I118 HydrophobicContact CG2-CG1 3.74Å; I115-I118 PolarHBondContact O-N 2.97Å; I115-I118 VanDerWaalsContact O-N 3.08Å; N116-I118 PolarHBondContact O-N 3.4Å; I118-F121 HydrophobicContact CG2-CE2 4.2Å; I118-I153 HydrophobicContact CD1-CD1 4.28Å; I118-I153 HydrophobicContact CD1-CG1 4.46Å; I118-I153 HydrophobicContact CD1-CG2 3.8Å; I118-C158 HydrophobicContact CG1-CB 4.09Å; I118-C158 HydrophobicContact CG2-CB 4.47Å
119	P	87	Confident	89.4	Confident	71 Å²	71	52.9 Å²	52.9	46%	0.461	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-58	143.6	176.2	-23.4	33.4	0	0	0	111.9	F121	P119-F121 HydrophobicContact CB-CE1 4.28Å; P119-F121 HydrophobicContact CB-CZ 4.17Å; P119-F121 HydrophobicContact CG-CZ 4.46Å; P119-F121 VanDerWaalsContact O-CD2 3.22Å; P119-F121 WeakPolarHBondContact O-CD2 3.34Å; P119-F121 WeakPolarHBondContact O-CE2 3.43Å
120	S	89.1	Confident	89.4	Confident	81 Å²	81	54.4 Å²	54.4	57%	0.566	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-76.6	128.5	164.8	62.6	0	0	0	0	109.3
121	F	92	Very high	89.4	Confident	17 Å²	17	49.5 Å²	49.5	8%	0.075	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.5	-177.7	-56.2	-85.4	0	0	0	110.5	N103 L104 I118 P119 V124 L139 I141 F143 H151	N103-F121 WeakPolarHBondContact CA-O 3.19Å; L104-F121 HydrophobicContact CB-CB 4.3Å; L104-F121 HydrophobicContact CD2-CD2 4.3Å; L104-F121 PolarHBondContact N-O 3.01Å; L104-F121 PolarHBondContact O-N 2.95Å; L104-F121 VanDerWaalsContact O-N 3.09Å; I118-F121 HydrophobicContact CG2-CE2 4.2Å; P119-F121 HydrophobicContact CB-CE1 4.28Å; P119-F121 HydrophobicContact CB-CZ 4.17Å; P119-F121 HydrophobicContact CG-CZ 4.46Å; P119-F121 VanDerWaalsContact O-CD2 3.22Å; P119-F121 WeakPolarHBondContact O-CD2 3.34Å; P119-F121 WeakPolarHBondContact O-CE2 3.43Å; F121-V124 HydrophobicContact CB-CG2 3.68Å; F121-L139 HydrophobicContact CE2-CD2 4.03Å; F121-I141 HydrophobicContact CB-CD1 4.22Å; F121-I141 HydrophobicContact CD1-CD1 3.66Å; F121-I141 HydrophobicContact CD2-CD1 3.46Å; F121-I141 VanDerWaalsContact CD2-CD1 3.46Å; F121-I141 HydrophobicContact CE1-CD1 3.78Å; F121-I141 HydrophobicContact CE2-CD1 3.58Å; F121-I141 HydrophobicContact CG-CD1 3.5Å; F121-I141 VanDerWaalsContact CG-CD1 3.5Å; F121-I141 HydrophobicContact CZ-CD1 3.74Å; F121-F143 HydrophobicContact CB-CE1 4.49Å; F121-F143 HydrophobicContact CD1-CZ 4.23Å; F121-H151 AromaticContact CE1-CE1 3.5Å; F121-H151 AromaticContact CE1-NE2 3.56Å; F121-H151 AromaticContact CZ-CE1 3.82Å; F121-H151 AromaticContact CZ-NE2 3.78Å
122	K	92.1	Very high	89	Confident	152 Å²	152	46.1 Å²	46.1	66%	0.661	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	151	178.8	-59.5	-169.6	175.1	178.1	0	110.5	E102 N103 V124 F143	E102-K122 CarbonylContact O-C 3.6Å; N103-K122 WeakPolarHBondContact OD1-CG 3.32Å; K122-V124 VanDerWaalsContact C-N 3.31Å; K122-F143 WeakPolarHBondContact O-CD1 3.34Å; K122-F143 WeakPolarHBondContact O-CE1 3.39Å
123	G	91.4	Very high	88.4	Confident	22 Å²	22	49.9 Å²	49.9	23%	0.227	27%	0.268	C	S	.	.	S	Bend	trans	74.7	23.1	-178.4	0	0	0	0	0	113.2	E102 F143 K144	E102-G123 PolarHBondContact O-N 2.88Å; G123-F143 CarbonylContact O-C 3.56Å; G123-F143 VanDerWaalsContact O-CA 3.31Å; G123-F143 WeakPolarHBondContact O-CA 3.41Å; G123-K144 PolarHBondContact O-N 3.32Å
124	V	94.3	Very high	87.4	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	129.5	-179.7	178.2	0	0	0	0	109.5	F99 E102 L104 F121 K122 S126 F127 I141 G142 F143	F99-V124 HydrophobicContact CD2-CG1 4.39Å; F99-V124 HydrophobicContact CE2-CB 3.96Å; F99-V124 HydrophobicContact CE2-CG1 3.97Å; E102-V124 WeakPolarHBondContact CA-O 3.14Å; E102-V124 PolarHBondContact O-N 3.41Å; L104-V124 HydrophobicContact CB-CG2 4.08Å; F121-V124 HydrophobicContact CB-CG2 3.68Å; K122-V124 VanDerWaalsContact C-N 3.31Å; V124-S126 WeakPolarHBondContact CG1-O 3.38Å; V124-F127 HydrophobicContact CG1-CB 4.39Å; V124-I141 HydrophobicContact CB-CG2 4.2Å; V124-I141 HydrophobicContact CG1-CG2 3.67Å; V124-I141 HydrophobicContact CG2-CG2 3.6Å; V124-G142 CarbonylContact C-O 3.58Å; V124-G142 WeakPolarHBondContact CA-O 3.11Å; V124-F143 HydrophobicContact CG2-CD1 4.33Å; V124-F143 HydrophobicContact CG2-CE1 4.05Å
125	S	92.1	Very high	86.8	Confident	28 Å²	28	54.7 Å²	54.7	20%	0.196	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	-40.5	173.1	64.9	0	0	0	0	112	G142 S170	S125-G142 PolarHBondContact N-O 2.76Å; S125-G142 PolarHBondContact OG-O 3.16Å; S125-S170 PolarHBondContact OG-O 3.05Å; S125-S170 PolarHBondContact OG-OG 2.95Å
126	S	90.8	Very high	86.5	Confident	9 Å²	9	56.1 Å²	56.1	6%	0.063	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	155.6	179.5	58.7	0	0	0	0	110.5	V124 G142 S170 L171 L173	V124-S126 WeakPolarHBondContact CG1-O 3.38Å; S126-G142 PolarHBondContact N-O 2.69Å; S126-G142 PolarHBondContact O-N 3.26Å; S126-S170 PolarHBondContact OG-O 3Å; S126-S170 PolarHBondContact OG-OG 3.06Å; S126-S170 VanDerWaalsContact OG-OG 3.09Å; S126-L171 VanDerWaalsContact CB-O 3.31Å; S126-L171 WeakPolarHBondContact CB-O 3.31Å; S126-L173 WeakPolarHBondContact OG-CD1 3.18Å; S126-L173 WeakPolarHBondContact OG-CG 3.35Å
127	F	93.8	Very high	86.5	Confident	7 Å²	7	49 Å²	49	3%	0.031	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	161	175.9	74.4	-76.8	0	0	0	109.8	R86 E88 F99 L104 V124 L139 C140	R86-F127 HydrophobicContact CB-CE1 4.01Å; R86-F127 HydrophobicContact CB-CZ 4.21Å; R86-F127 HydrophobicContact CG-CE1 4.21Å; R86-F127 HydrophobicContact CG-CZ 4.16Å; E88-F127 HydrophobicContact CB-CE2 4.03Å; E88-F127 HydrophobicContact CG-CE2 3.96Å; E88-F127 HydrophobicContact CG-CZ 4.14Å; F99-F127 HydrophobicContact CB-CD1 4.02Å; F99-F127 HydrophobicContact CB-CE1 3.23Å; F99-F127 HydrophobicContact CB-CZ 3.82Å; F99-F127 HydrophobicContact CD1-CD1 4.49Å; F99-F127 HydrophobicContact CD1-CE1 4.05Å; F99-F127 HydrophobicContact CD2-CD1 4.35Å; F99-F127 HydrophobicContact CD2-CE1 4.36Å; F99-F127 HydrophobicContact CG-CD1 4.06Å; F99-F127 AromaticContact CG-CE1 3.66Å; F99-F127 HydrophobicContact CG-CE1 3.66Å; L104-F127 HydrophobicContact CD1-CD1 3.99Å; L104-F127 HydrophobicContact CD1-CD2 3.79Å; L104-F127 HydrophobicContact CD1-CE1 4.07Å; L104-F127 HydrophobicContact CD1-CE2 3.85Å; L104-F127 HydrophobicContact CD1-CG 3.86Å; L104-F127 HydrophobicContact CD1-CZ 3.99Å; L104-F127 HydrophobicContact CD2-CB 3.91Å; L104-F127 HydrophobicContact CD2-CD2 4.2Å; L104-F127 HydrophobicContact CD2-CG 3.99Å; V124-F127 HydrophobicContact CG1-CB 4.39Å; F127-L139 HydrophobicContact CD2-CD1 4.29Å; F127-C140 CarbonylContact C-O 3.54Å; F127-C140 WeakPolarHBondContact CA-O 3.04Å; F127-C140 WeakPolarHBondContact CB-O 3.43Å
128	Q	91.8	Very high	86.6	Confident	34 Å²	34	45.8 Å²	45.8	16%	0.159	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	135.5	167.5	-163.3	-168.3	27.2	0	0	110.5	E88 C140 L173 I175	E88-Q128 VanDerWaalsContact OE2-CA 3.24Å; E88-Q128 WeakPolarHBondContact OE2-CA 3.41Å; Q128-C140 PolarHBondContact N-O 3.47Å; Q128-C140 PolarHBondContact O-N 3.19Å; Q128-L173 HydrophobicContact CB-CB 4.45Å; Q128-L173 PolarHBondContact OE1-O 3.32Å; Q128-I175 HydrophobicContact CB-CD1 4.44Å
129	L	90	Very high	86.8	Confident	11 Å²	11	45.3 Å²	45.3	6%	0.058	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	125.9	171.9	-179.2	63.4	0	0	0	110.2	E88 S97 E137 L139 I153	E88-L129 HydrophobicContact CB-CB 4.43Å; E88-L129 PolarHBondContact OE2-N 3.06Å; S97-L129 WeakPolarHBondContact OG-CD2 3.3Å; L129-E137 HydrophobicContact CD1-CB 4.05Å; L129-L139 HydrophobicContact CB-CD1 4.31Å; L129-L139 HydrophobicContact CD1-CB 4.25Å; L129-L139 HydrophobicContact CD1-CD1 4.36Å; L129-I153 HydrophobicContact CD1-CD1 4.32Å
130	C	86.6	Confident	87.1	Confident	33 Å²	33	41.9 Å²	41.9	22%	0.223	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	149.4	177.7	-168.8	0	0	0	0	111.9	F132 K138	C130-F132 HydrophobicContact CB-CE2 4.2Å; C130-F132 HydrophobicContact CB-CZ 4.41Å; C130-F132 VanDerWaalsContact SG-CZ 3.54Å; C130-K138 PolarHBondContact N-O 3.14Å; C130-K138 PolarHBondContact O-N 2.95Å
131	S	85.1	Confident	87.3	Confident	10 Å²	10	38 Å²	38	7%	0.07	19%	0.194	C	C	.	.			trans	-123.4	114.5	174.4	-157.1	0	0	0	0	110.1	D133	S131-D133 PolarHBondContact OG-O 3.13Å; S131-D133 VanDerWaalsContact OG-O 3.06Å
132	F	78.3	Confident	87.4	Confident	47 Å²	47	37.2 Å²	37.2	21%	0.206	19%	0.191	C	C	.	.	S	Bend	trans	-96.3	-45.3	173.4	-61.7	-76.1	0	0	0	111.1	K92 C130 K138 I175 P177 Y215	K92-F132 PolarHBondContact NZ-O 3.35Å; C130-F132 HydrophobicContact CB-CE2 4.2Å; C130-F132 HydrophobicContact CB-CZ 4.41Å; C130-F132 VanDerWaalsContact SG-CZ 3.54Å; F132-K138 HydrophobicContact CD2-CD 4.12Å; F132-K138 HydrophobicContact CE2-CD 4.32Å; F132-I175 HydrophobicContact CE2-CB 4.47Å; F132-I175 HydrophobicContact CE2-CG2 3.87Å; F132-I175 HydrophobicContact CZ-CG2 4.43Å; F132-I175 WeakPolarHBondContact CZ-O 3.28Å; F132-P177 HydrophobicContact CD1-CG 3.97Å; F132-P177 HydrophobicContact CE1-CG 4.08Å; F132-P177 HydrophobicContact CG-CG 4.37Å; F132-Y215 HydrophobicContact CE1-CD1 4.47Å; F132-Y215 HydrophobicContact CE1-CE1 4.15Å
133	D	73.1	Confident	87.5	Confident	79 Å²	79	31.1 Å²	31.1	42%	0.422	16%	0.164	S	C	.	.	S	Bend	trans	-97.5	163.9	179.7	-57	-32	0	0	0	110.2	S131 K136	S131-D133 PolarHBondContact OG-O 3.13Å; S131-D133 VanDerWaalsContact OG-O 3.06Å; D133-K136 HydrophobicContact CB-CG 4.44Å; D133-K136 WeakPolarHBondContact OD2-CE 3.44Å; D133-K136 IonicContact OD2-NZ 3.15Å
134	D	69	Low	87.4	Confident	120 Å²	120	35.3 Å²	35.3	64%	0.642	18%	0.176	S	C	*	.	S	Bend	trans	-76.1	-28.2	176	-61.7	-28.2	0	0	0	111.8	K92	K92-D134 WeakPolarHBondContact CD-OD1 3.13Å; K92-D134 WeakPolarHBondContact CE-OD1 3.46Å; K92-D134 IonicContact NZ-OD1 2.81Å; K92-D134 PolarHBondContact NZ-OD1 3.33Å
135	E	75.4	Confident	87.2	Confident	154 Å²	154	39.1 Å²	39.1	72%	0.72	20%	0.203	S	C	*	.	S	Bend	trans	-82.1	-31.6	-172.1	-62.4	-158.1	154.2	0	0	114.3	K93	K93-E135 PolarHBondContact NZ-O 2.91Å
136	K	82.5	Confident	87	Confident	55 Å²	55	38 Å²	38	24%	0.239	20%	0.196	C	C	.	.			trans	-139	139.2	-169.2	66.2	-172.9	175.3	-165	0	112.9	D133 I153 F154	D133-K136 HydrophobicContact CB-CG 4.44Å; D133-K136 WeakPolarHBondContact OD2-CE 3.44Å; D133-K136 IonicContact OD2-NZ 3.15Å; K136-I153 WeakPolarHBondContact CA-O 3.32Å; K136-F154 HydrophobicContact CB-CD1 4.03Å; K136-F154 HydrophobicContact CB-CE1 3.74Å; K136-F154 HydrophobicContact CB-CZ 4.21Å; K136-F154 HydrophobicContact CD-CE1 4.42Å; K136-F154 HydrophobicContact CD-CZ 4.45Å
137	E	87.1	Confident	87.1	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	144.5	166.7	-57.1	162.2	133.3	0	0	108.8	S90 K93 T95 L129 H152 I153	S90-E137 WeakPolarHBondContact CB-OE1 3.42Å; S90-E137 PolarHBondContact OG-OE1 3.47Å; K93-E137 VanDerWaalsContact CB-OE1 3.25Å; K93-E137 WeakPolarHBondContact CB-OE1 3.35Å; K93-E137 HydrophobicContact CD-CG 3.76Å; K93-E137 HydrophobicContact CG-CG 4.02Å; T95-E137 WeakPolarHBondContact CG2-OE2 3.48Å; T95-E137 VanDerWaalsContact OG1-CD 3.28Å; T95-E137 PolarHBondContact OG1-OE1 3.08Å; T95-E137 PolarHBondContact OG1-OE2 2.9Å; L129-E137 HydrophobicContact CD1-CB 4.05Å; E137-H152 CarbonylContact O-C 3.54Å; E137-H152 WeakPolarHBondContact O-CA 3.26Å; E137-I153 HydrophobicContact CB-CB 4.23Å; E137-I153 PolarHBondContact N-O 2.87Å; E137-I153 PolarHBondContact O-N 3.39Å
138	K	89.5	Confident	87	Confident	19 Å²	19	39 Å²	39	8%	0.083	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	119.4	175.4	-66.6	-171.1	-178.2	176.9	0	108.5	C130 F132 L150 H151 I175 P177	C130-K138 PolarHBondContact N-O 3.14Å; C130-K138 PolarHBondContact O-N 2.95Å; F132-K138 HydrophobicContact CD2-CD 4.12Å; F132-K138 HydrophobicContact CE2-CD 4.32Å; K138-L150 HydrophobicContact CB-CD1 4.11Å; K138-H151 WeakPolarHBondContact CA-O 3.36Å; K138-I175 HydrophobicContact CB-CD1 4.26Å; K138-I175 HydrophobicContact CD-CG2 4.2Å; K138-P177 PolarHBondContact NZ-O 3.08Å
139	L	91.7	Very high	87.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	109.7	173	176.5	67.1	0	0	0	108.6	L104 L106 F121 F127 L129 I141 H151 I153	L104-L139 HydrophobicContact CD2-CD1 4.26Å; L104-L139 HydrophobicContact CD2-CD2 4.34Å; L106-L139 HydrophobicContact CD1-CD2 3.67Å; L106-L139 HydrophobicContact CD2-CD2 4.19Å; F121-L139 HydrophobicContact CE2-CD2 4.03Å; F127-L139 HydrophobicContact CD2-CD1 4.29Å; L129-L139 HydrophobicContact CB-CD1 4.31Å; L129-L139 HydrophobicContact CD1-CB 4.25Å; L129-L139 HydrophobicContact CD1-CD1 4.36Å; L139-I141 HydrophobicContact CD1-CG1 4.4Å; L139-I141 HydrophobicContact CD2-CD1 3.83Å; L139-I141 HydrophobicContact CD2-CG1 4.18Å; L139-I141 HydrophobicContact CG-CD1 4.09Å; L139-I141 HydrophobicContact CG-CG1 3.87Å; L139-H151 HydrophobicContact CB-CB 4.36Å; L139-H151 PolarHBondContact N-O 2.69Å; L139-H151 PolarHBondContact O-N 3.5Å; L139-I153 HydrophobicContact CB-CD1 3.73Å; L139-I153 HydrophobicContact CB-CG1 4.46Å; L139-I153 HydrophobicContact CD2-CD1 4.1Å
140	C	93	Very high	87.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	134.2	172.3	-168.1	0	0	0	0	109.6	F127 Q128 Q149 L150 I175 L180	F127-C140 CarbonylContact C-O 3.54Å; F127-C140 WeakPolarHBondContact CA-O 3.04Å; F127-C140 WeakPolarHBondContact CB-O 3.43Å; Q128-C140 PolarHBondContact N-O 3.47Å; Q128-C140 PolarHBondContact O-N 3.19Å; C140-Q149 CarbonylContact C-O 3.55Å; C140-Q149 WeakPolarHBondContact CA-O 3.49Å; C140-L150 HydrophobicContact CB-CD1 4.03Å; C140-I175 HydrophobicContact CB-CD1 3.31Å; C140-I175 HydrophobicContact CB-CG1 3.53Å; C140-L180 HydrophobicContact CB-CD1 4.39Å
141	I	94	Very high	87.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	127.2	-175.6	-51.2	177.3	0	0	0	107.9	L104 F121 V124 L139 F143 I148 Q149	L104-I141 HydrophobicContact CD2-CD1 3.94Å; L104-I141 HydrophobicContact CD2-CG1 4.07Å; F121-I141 HydrophobicContact CB-CD1 4.22Å; F121-I141 HydrophobicContact CD1-CD1 3.66Å; F121-I141 HydrophobicContact CD2-CD1 3.46Å; F121-I141 VanDerWaalsContact CD2-CD1 3.46Å; F121-I141 HydrophobicContact CE1-CD1 3.78Å; F121-I141 HydrophobicContact CE2-CD1 3.58Å; F121-I141 HydrophobicContact CG-CD1 3.5Å; F121-I141 VanDerWaalsContact CG-CD1 3.5Å; F121-I141 HydrophobicContact CZ-CD1 3.74Å; V124-I141 HydrophobicContact CB-CG2 4.2Å; V124-I141 HydrophobicContact CG1-CG2 3.67Å; V124-I141 HydrophobicContact CG2-CG2 3.6Å; L139-I141 HydrophobicContact CD1-CG1 4.4Å; L139-I141 HydrophobicContact CD2-CD1 3.83Å; L139-I141 HydrophobicContact CD2-CG1 4.18Å; L139-I141 HydrophobicContact CG-CD1 4.09Å; L139-I141 HydrophobicContact CG-CG1 3.87Å; I141-F143 HydrophobicContact CB-CE2 4.2Å; I141-F143 HydrophobicContact CB-CZ 4.42Å; I141-F143 HydrophobicContact CG2-CD2 4.33Å; I141-F143 HydrophobicContact CG2-CE1 4.21Å; I141-F143 HydrophobicContact CG2-CE2 3.84Å; I141-F143 HydrophobicContact CG2-CZ 3.78Å; I141-I148 CarbonylContact O-C 3.53Å; I141-I148 VanDerWaalsContact O-CA 3.31Å; I141-I148 WeakPolarHBondContact O-CA 3.38Å; I141-Q149 PolarHBondContact N-O 2.91Å; I141-Q149 PolarHBondContact O-N 3.01Å
142	G	93	Very high	87.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	135.5	168.3	0	0	0	0	0	109.9	V124 S125 S126 L147 S170	V124-G142 CarbonylContact C-O 3.58Å; V124-G142 WeakPolarHBondContact CA-O 3.11Å; S125-G142 PolarHBondContact N-O 2.76Å; S125-G142 PolarHBondContact OG-O 3.16Å; S126-G142 PolarHBondContact N-O 2.69Å; S126-G142 PolarHBondContact O-N 3.26Å; G142-L147 CarbonylContact C-O 3.55Å; G142-L147 WeakPolarHBondContact CA-O 3.5Å; G142-S170 WeakPolarHBondContact CA-OG 3.49Å
143	F	94.7	Very high	88.2	Confident	23 Å²	23	36 Å²	36	10%	0.101	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	154.5	179.9	-64.5	-90	0	0	0	111	F121 K122 G123 V124 I141 S145 G146 L147 Q149	F121-F143 HydrophobicContact CB-CE1 4.49Å; F121-F143 HydrophobicContact CD1-CZ 4.23Å; K122-F143 WeakPolarHBondContact O-CD1 3.34Å; K122-F143 WeakPolarHBondContact O-CE1 3.39Å; G123-F143 CarbonylContact O-C 3.56Å; G123-F143 VanDerWaalsContact O-CA 3.31Å; G123-F143 WeakPolarHBondContact O-CA 3.41Å; V124-F143 HydrophobicContact CG2-CD1 4.33Å; V124-F143 HydrophobicContact CG2-CE1 4.05Å; I141-F143 HydrophobicContact CB-CE2 4.2Å; I141-F143 HydrophobicContact CB-CZ 4.42Å; I141-F143 HydrophobicContact CG2-CD2 4.33Å; I141-F143 HydrophobicContact CG2-CE1 4.21Å; I141-F143 HydrophobicContact CG2-CE2 3.84Å; I141-F143 HydrophobicContact CG2-CZ 3.78Å; F143-S145 PolarHBondContact O-N 2.98Å; F143-G146 PolarHBondContact O-N 3.42Å; F143-L147 HydrophobicContact CB-CB 4.23Å; F143-L147 HydrophobicContact CD2-CB 4.07Å; F143-L147 HydrophobicContact CD2-CD2 4.1Å; F143-L147 HydrophobicContact CD2-CG 4.34Å; F143-L147 WeakPolarHBondContact CD2-O 3.4Å; F143-L147 HydrophobicContact CE2-CD2 4.39Å; F143-L147 PolarHBondContact N-O 2.86Å; F143-Q149 HydrophobicContact CE2-CB 4.04Å; F143-Q149 HydrophobicContact CE2-CG 3.8Å; F143-Q149 VanDerWaalsContact CE2-OE1 3.25Å
144	K	90.7	Very high	88.8	Confident	110 Å²	110	35.5 Å²	35.5	48%	0.478	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.3	173.9	-70.9	-167.7	171	-169.7	0	114.2	E102 G123 G146 V169	E102-K144 HydrophobicContact CG-CD 4.36Å; E102-K144 VanDerWaalsContact OE1-CE 3.29Å; E102-K144 WeakPolarHBondContact OE1-CE 3.2Å; E102-K144 IonicContact OE1-NZ 3.78Å; E102-K144 PolarHBondContact OE1-NZ 2.79Å; G123-K144 PolarHBondContact O-N 3.32Å; K144-G146 PolarHBondContact O-N 3Å; K144-V169 WeakPolarHBondContact O-CG2 3.4Å
145	S	89.8	Confident	89.4	Confident	82 Å²	82	35.9 Å²	35.9	57%	0.573	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-2.4	173	58.6	0	0	0	0	113.9	F143 L147	F143-S145 PolarHBondContact O-N 2.98Å; S145-L147 VanDerWaalsContact C-N 3.28Å; S145-L147 WeakPolarHBondContact OG-CB 3.42Å
146	G	86.9	Confident	89.8	Confident	4 Å²	4	32.6 Å²	32.6	4%	0.041	18%	0.177	C	C	.	.	S	Bend	trans	82.7	2.8	-172.4	0	0	0	0	0	113.5	F143 K144 L166	F143-G146 PolarHBondContact O-N 3.42Å; K144-G146 PolarHBondContact O-N 3Å; G146-L166 PolarHBondContact O-N 3.22Å
147	L	93.3	Very high	90	Very high	35 Å²	35	33 Å²	33	18%	0.183	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	140.4	177.5	-169.1	74.3	0	0	0	110.9	G142 F143 S145 Q149 E163 K165	G142-L147 CarbonylContact C-O 3.55Å; G142-L147 WeakPolarHBondContact CA-O 3.5Å; F143-L147 HydrophobicContact CB-CB 4.23Å; F143-L147 HydrophobicContact CD2-CB 4.07Å; F143-L147 HydrophobicContact CD2-CD2 4.1Å; F143-L147 HydrophobicContact CD2-CG 4.34Å; F143-L147 WeakPolarHBondContact CD2-O 3.4Å; F143-L147 HydrophobicContact CE2-CD2 4.39Å; F143-L147 PolarHBondContact N-O 2.86Å; S145-L147 VanDerWaalsContact C-N 3.28Å; S145-L147 WeakPolarHBondContact OG-CB 3.42Å; L147-Q149 HydrophobicContact CD2-CG 4.02Å; L147-Q149 HydrophobicContact CG-CG 4.28Å; L147-E163 HydrophobicContact CD1-CG 3.72Å; L147-E163 WeakPolarHBondContact CD1-OE1 3.48Å; L147-E163 VanDerWaalsContact CD2-OE1 3.31Å; L147-E163 WeakPolarHBondContact CD2-OE1 3.34Å; L147-E163 HydrophobicContact CG-CG 4.25Å; L147-K165 HydrophobicContact CD1-CB 4.42Å
148	I	92.2	Very high	90.1	Very high	1 Å²	1	34 Å²	34	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.3	171.1	-66.9	-177.9	0	0	0	108.6	I141 E163 T164 L166 L173 L180 V182 I191	I141-I148 CarbonylContact O-C 3.53Å; I141-I148 VanDerWaalsContact O-CA 3.31Å; I141-I148 WeakPolarHBondContact O-CA 3.38Å; I148-E163 CarbonylContact O-C 3.04Å; I148-E163 VanDerWaalsContact O-CA 3.29Å; I148-E163 WeakPolarHBondContact O-CA 3.47Å; I148-T164 HydrophobicContact CB-CG2 3.93Å; I148-T164 HydrophobicContact CG2-CG2 4.36Å; I148-T164 PolarHBondContact N-O 2.97Å; I148-T164 PolarHBondContact O-N 3.47Å; I148-L166 HydrophobicContact CD1-CD1 3.33Å; I148-L166 HydrophobicContact CD1-CG 3.91Å; I148-L166 HydrophobicContact CG1-CD1 4.31Å; I148-L173 HydrophobicContact CD1-CD2 4.04Å; I148-L180 HydrophobicContact CD1-CD2 4.46Å; I148-L180 HydrophobicContact CG2-CD2 3.61Å; I148-V182 HydrophobicContact CD1-CG1 4.05Å; I148-V182 HydrophobicContact CD1-CG2 3.68Å; I148-I191 HydrophobicContact CD1-CD1 4.27Å
149	Q	92.9	Very high	90.2	Very high	29 Å²	29	38.5 Å²	38.5	14%	0.136	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	135.9	177.9	-70.1	-177.6	-19.2	0	0	111	C140 I141 F143 L147 H151 L160 F162 E163	C140-Q149 CarbonylContact C-O 3.55Å; C140-Q149 WeakPolarHBondContact CA-O 3.49Å; I141-Q149 PolarHBondContact N-O 2.91Å; I141-Q149 PolarHBondContact O-N 3.01Å; F143-Q149 HydrophobicContact CE2-CB 4.04Å; F143-Q149 HydrophobicContact CE2-CG 3.8Å; F143-Q149 VanDerWaalsContact CE2-OE1 3.25Å; L147-Q149 HydrophobicContact CD2-CG 4.02Å; L147-Q149 HydrophobicContact CG-CG 4.28Å; Q149-H151 PolarHBondContact OE1-CE1 2.77Å; Q149-L160 HydrophobicContact CB-CD1 3.69Å; Q149-L160 HydrophobicContact CG-CD1 3.92Å; Q149-F162 CarbonylContact C-O 3.59Å; Q149-F162 WeakPolarHBondContact CA-O 3.4Å; Q149-E163 HydrophobicContact CG-CB 4.48Å; Q149-E163 HydrophobicContact CG-CG 4.07Å; Q149-E163 PolarHBondContact NE2-OE1 2.77Å
150	L	92.8	Very high	90.2	Very high	7 Å²	7	42.1 Å²	42.1	4%	0.037	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	116.9	173.1	-179.2	68.4	0	0	0	109.3	K138 C140 V161 F162 I175 L193	K138-L150 HydrophobicContact CB-CD1 4.11Å; C140-L150 HydrophobicContact CB-CD1 4.03Å; L150-V161 PolarHBondContact O-N 2.61Å; L150-F162 HydrophobicContact CB-CB 3.93Å; L150-F162 HydrophobicContact CB-CD1 4.36Å; L150-F162 HydrophobicContact CD2-CB 4.18Å; L150-F162 PolarHBondContact N-O 2.89Å; L150-F162 PolarHBondContact O-N 2.99Å; L150-I175 HydrophobicContact CD1-CD1 4.25Å; L150-L193 HydrophobicContact CD2-CD1 4.19Å; L150-L193 HydrophobicContact CD2-CD2 4.15Å
151	H	91.6	Very high	90	Very high	13 Å²	13	46 Å²	46	6%	0.06	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	138.9	176.6	-63.6	81.6	0	0	0	110.4	F121 K138 L139 Q149 M159	F121-H151 AromaticContact CE1-CE1 3.5Å; F121-H151 AromaticContact CE1-NE2 3.56Å; F121-H151 AromaticContact CZ-CE1 3.82Å; F121-H151 AromaticContact CZ-NE2 3.78Å; K138-H151 WeakPolarHBondContact CA-O 3.36Å; L139-H151 HydrophobicContact CB-CB 4.36Å; L139-H151 PolarHBondContact N-O 2.69Å; L139-H151 PolarHBondContact O-N 3.5Å; Q149-H151 PolarHBondContact OE1-CE1 2.77Å; H151-M159 CarbonylContact C-O 3.27Å; H151-M159 VanDerWaalsContact CA-O 3.29Å; H151-M159 WeakPolarHBondContact CA-O 3.44Å
152	H	90.8	Very high	89.9	Confident	23 Å²	23	47.3 Å²	47.3	11%	0.106	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	122.3	167.7	-72.7	-179.4	0	0	0	109.2	E137 F154 C158 M159 V161	E137-H152 CarbonylContact O-C 3.54Å; E137-H152 WeakPolarHBondContact O-CA 3.26Å; H152-F154 HydrophobicContact CB-CE2 3.89Å; H152-F154 HydrophobicContact CB-CZ 4.27Å; H152-C158 WeakPolarHBondContact O-CA 3.38Å; H152-M159 PolarHBondContact N-O 2.72Å; H152-M159 PolarHBondContact O-N 2.77Å; H152-V161 HydrophobicContact CB-CG2 3.94Å
153	I	88.5	Confident	89.8	Confident	1 Å²	1	52 Å²	52	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	114.1	179.7	-55.8	164.8	0	0	0	108.8	K93 L106 F117 I118 L129 K136 E137 L139	K93-I153 PolarHBondContact NZ-O 2.75Å; K93-I153 VanDerWaalsContact NZ-O 3.1Å; L106-I153 HydrophobicContact CD2-CD1 3.63Å; F117-I153 HydrophobicContact CE2-CG2 4.47Å; I118-I153 HydrophobicContact CD1-CD1 4.28Å; I118-I153 HydrophobicContact CD1-CG1 4.46Å; I118-I153 HydrophobicContact CD1-CG2 3.8Å; L129-I153 HydrophobicContact CD1-CD1 4.32Å; K136-I153 WeakPolarHBondContact CA-O 3.32Å; E137-I153 HydrophobicContact CB-CB 4.23Å; E137-I153 PolarHBondContact N-O 2.87Å; E137-I153 PolarHBondContact O-N 3.39Å; L139-I153 HydrophobicContact CB-CD1 3.73Å; L139-I153 HydrophobicContact CB-CG1 4.46Å; L139-I153 HydrophobicContact CD2-CD1 4.1Å
154	F	86.1	Confident	89.7	Confident	68 Å²	68	51.6 Å²	51.6	30%	0.298	28%	0.284	S	S	.	.			trans	-97.7	176.5	169.9	-57.9	-86.5	0	0	0	109.5	K136 H152 S156 T157	K136-F154 HydrophobicContact CB-CD1 4.03Å; K136-F154 HydrophobicContact CB-CE1 3.74Å; K136-F154 HydrophobicContact CB-CZ 4.21Å; K136-F154 HydrophobicContact CD-CE1 4.42Å; K136-F154 HydrophobicContact CD-CZ 4.45Å; H152-F154 HydrophobicContact CB-CE2 3.89Å; H152-F154 HydrophobicContact CB-CZ 4.27Å; F154-S156 PolarHBondContact O-N 2.73Å; F154-S156 VanDerWaalsContact O-N 3.15Å; F154-T157 PolarHBondContact N-O 3.16Å
155	V	81.7	Confident	89.7	Confident	128 Å²	128	53.9 Å²	53.9	78%	0.776	29%	0.294	S	S	*	.	S	Bend	trans	-55.2	-36	-175.9	179	0	0	0	0	112.9	F117	F117-V155 WeakPolarHBondContact CZ-O 3.46Å
156	S	82.4	Confident	89.5	Confident	85 Å²	85	51 Å²	51	59%	0.594	27%	0.272	S	S	*	.	S	Bend	trans	-131.5	3	-176	63.2	0	0	0	0	114.5	F154	F154-S156 PolarHBondContact O-N 2.73Å; F154-S156 VanDerWaalsContact O-N 3.15Å
157	T	87.2	Confident	89.4	Confident	65 Å²	65	57.6 Å²	57.6	40%	0.399	31%	0.311	S	S	.	.			trans	-140.9	148.1	-176.2	60	0	0	0	0	111.2	F154	F154-T157 PolarHBondContact N-O 3.16Å
158	C	89	Confident	89	Confident	22 Å²	22	59.3 Å²	59.3	15%	0.149	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	124.8	172.9	179.1	0	0	0	0	108	F117 I118 H152	F117-C158 HydrophobicContact CD2-CB 4.41Å; I118-C158 HydrophobicContact CG1-CB 4.09Å; I118-C158 HydrophobicContact CG2-CB 4.47Å; H152-C158 WeakPolarHBondContact O-CA 3.38Å
159	M	91.6	Very high	88.8	Confident	113 Å²	113	61.7 Å²	61.7	56%	0.557	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.9	-176.8	-62.1	-61.8	-64.7	0	0	110.3	H151 H152	H151-M159 CarbonylContact C-O 3.27Å; H151-M159 VanDerWaalsContact CA-O 3.29Å; H151-M159 WeakPolarHBondContact CA-O 3.44Å; H152-M159 PolarHBondContact N-O 2.72Å; H152-M159 PolarHBondContact O-N 2.77Å
160	L	91.7	Very high	88.6	Confident	76 Å²	76	60.4 Å²	60.4	40%	0.398	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	127.2	168.4	178	65.9	0	0	0	109.3	Q149 F162	Q149-L160 HydrophobicContact CB-CD1 3.69Å; Q149-L160 HydrophobicContact CG-CD1 3.92Å; L160-F162 WeakPolarHBondContact CD1-O 3.43Å
161	V	88.8	Confident	88.2	Confident	82 Å²	82	63.8 Å²	63.8	50%	0.497	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-31.6	-176	177.8	0	0	0	0	112.6	L150 H152	L150-V161 PolarHBondContact O-N 2.61Å; H152-V161 HydrophobicContact CB-CG2 3.94Å
162	F	92.1	Very high	88.1	Confident	26 Å²	26	64.1 Å²	64.1	11%	0.114	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	140.7	-179.8	172.8	-86.2	0	0	0	110.1	Q149 L150 L160 T164 I191 L193 N196	Q149-F162 CarbonylContact C-O 3.59Å; Q149-F162 WeakPolarHBondContact CA-O 3.4Å; L150-F162 HydrophobicContact CB-CB 3.93Å; L150-F162 HydrophobicContact CB-CD1 4.36Å; L150-F162 HydrophobicContact CD2-CB 4.18Å; L150-F162 PolarHBondContact N-O 2.89Å; L150-F162 PolarHBondContact O-N 2.99Å; L160-F162 WeakPolarHBondContact CD1-O 3.43Å; F162-T164 HydrophobicContact CE1-CG2 3.58Å; F162-T164 HydrophobicContact CZ-CG2 3.97Å; F162-I191 HydrophobicContact CE1-CG2 4.42Å; F162-I191 HydrophobicContact CZ-CG2 3.89Å; F162-L193 HydrophobicContact CD1-CD2 4.02Å; F162-L193 WeakPolarHBondContact CD2-O 3.4Å; F162-L193 HydrophobicContact CE1-CD2 4.04Å; F162-L193 HydrophobicContact CG-CD2 4.29Å; F162-L193 HydrophobicContact CZ-CD2 4.34Å; F162-N196 HydrophobicContact CE2-CB 4.18Å; F162-N196 HydrophobicContact CZ-CB 4.5Å; F162-N196 VanDerWaalsContact CZ-OD1 3.27Å; F162-N196 WeakPolarHBondContact CZ-OD1 3.45Å
163	E	92.3	Very high	88	Confident	99 Å²	99	63.3 Å²	63.3	46%	0.463	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	132.3	-179.8	-179	172.9	-165.6	0	0	108.7	L147 I148 Q149	L147-E163 HydrophobicContact CD1-CG 3.72Å; L147-E163 WeakPolarHBondContact CD1-OE1 3.48Å; L147-E163 VanDerWaalsContact CD2-OE1 3.31Å; L147-E163 WeakPolarHBondContact CD2-OE1 3.34Å; L147-E163 HydrophobicContact CG-CG 4.25Å; I148-E163 CarbonylContact O-C 3.04Å; I148-E163 VanDerWaalsContact O-CA 3.29Å; I148-E163 WeakPolarHBondContact O-CA 3.47Å; Q149-E163 HydrophobicContact CG-CB 4.48Å; Q149-E163 HydrophobicContact CG-CG 4.07Å; Q149-E163 PolarHBondContact NE2-OE1 2.77Å
164	T	91.5	Very high	88.1	Confident	14 Å²	14	63.2 Å²	63.2	9%	0.086	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	153.8	178.6	-165.5	0	0	0	0	110.3	I148 F162 I191 N196	I148-T164 HydrophobicContact CB-CG2 3.93Å; I148-T164 HydrophobicContact CG2-CG2 4.36Å; I148-T164 PolarHBondContact N-O 2.97Å; I148-T164 PolarHBondContact O-N 3.47Å; F162-T164 HydrophobicContact CE1-CG2 3.58Å; F162-T164 HydrophobicContact CZ-CG2 3.97Å; T164-I191 HydrophobicContact CG2-CD1 4Å; T164-N196 WeakPolarHBondContact CB-OD1 3.36Å; T164-N196 PolarHBondContact OG1-ND2 3.06Å; T164-N196 PolarHBondContact OG1-OD1 2.81Å
165	K	90	Very high	88.3	Confident	159 Å²	159	60 Å²	60	69%	0.691	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	121.7	-180	-173.3	174.7	-177.9	178	0	109.7	L147	L147-K165 HydrophobicContact CD1-CB 4.42Å
166	L	86.8	Confident	88.6	Confident	22 Å²	22	54 Å²	54	12%	0.115	29%	0.294	C	S	.	.			trans	-93.2	160.8	173.5	-65.7	-175.9	0	0	0	111.5	G146 I148 V182 I191	G146-L166 PolarHBondContact O-N 3.22Å; I148-L166 HydrophobicContact CD1-CD1 3.33Å; I148-L166 HydrophobicContact CD1-CG 3.91Å; I148-L166 HydrophobicContact CG1-CD1 4.31Å; L166-V182 HydrophobicContact CD1-CB 4.27Å; L166-V182 HydrophobicContact CD1-CG1 3.73Å; L166-V182 HydrophobicContact CD1-CG2 4.31Å; L166-I191 HydrophobicContact CD1-CD1 4.34Å; L166-I191 HydrophobicContact CD2-CD1 3.94Å; L166-I191 HydrophobicContact CG-CD1 4.44Å
167	T	84.5	Confident	88.7	Confident	141 Å²	141	52.3 Å²	52.3	87%	0.865	28%	0.281	S	S	*	.	S	Bend	trans	-73.8	-32.2	175.4	48.6	0	0	0	0	112.4
168	E	85.7	Confident	88.7	Confident	71 Å²	71	55 Å²	55	33%	0.332	29%	0.289	S	S	.	.	S	Bend	trans	-116.8	159.2	-178.7	-64.2	-172.9	177.9	0	0	110.9	S184 S186	E168-S184 VanDerWaalsContact OE2-CB 3.29Å; E168-S184 WeakPolarHBondContact OE2-CB 3.27Å; E168-S184 PolarHBondContact OE2-OG 2.58Å; E168-S186 PolarHBondContact OE1-OG 2.83Å; E168-S186 VanDerWaalsContact OE1-OG 3.07Å; E168-S186 WeakPolarHBondContact OE2-CB 3.46Å; E168-S186 PolarHBondContact OE2-N 3.05Å; E168-S186 PolarHBondContact OE2-OG 3.4Å
169	V	88.1	Confident	88.7	Confident	52 Å²	52	54.8 Å²	54.8	32%	0.315	29%	0.286	S	S	.	.			trans	-74.1	134.8	176.9	-179.5	0	0	0	0	109.2	K144 L171	K144-V169 WeakPolarHBondContact O-CG2 3.4Å; V169-L171 PolarHBondContact O-N 3.33Å
170	S	87.4	Confident	88.7	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.014	26%	0.26	C	S	.	.			trans	-76.4	122.8	175.6	54.8	0	0	0	0	110.9	S125 S126 G142	S125-S170 PolarHBondContact OG-O 3.05Å; S125-S170 PolarHBondContact OG-OG 2.95Å; S126-S170 PolarHBondContact OG-O 3Å; S126-S170 PolarHBondContact OG-OG 3.06Å; S126-S170 VanDerWaalsContact OG-OG 3.09Å; G142-S170 WeakPolarHBondContact CA-OG 3.49Å
171	L	85.7	Confident	88.6	Confident	78 Å²	78	45.9 Å²	45.9	41%	0.408	24%	0.241	S	C	.	.	S	Bend	trans	-84	-40.8	174.6	-65	176.8	0	0	0	112.4	S126 V169 A183 D185 N211	S126-L171 VanDerWaalsContact CB-O 3.31Å; S126-L171 WeakPolarHBondContact CB-O 3.31Å; V169-L171 PolarHBondContact O-N 3.33Å; L171-A183 PolarHBondContact N-O 3.2Å; L171-D185 WeakPolarHBondContact CD1-OD1 3.48Å; L171-N211 WeakPolarHBondContact CD1-ND2 3.4Å
172	S	87.5	Confident	88.6	Confident	20 Å²	20	42 Å²	42	14%	0.14	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	150.9	179.3	-174.2	0	0	0	0	109.9	A183	S172-A183 PolarHBondContact O-N 3.39Å
173	L	90.2	Very high	88.4	Confident	5 Å²	5	40.8 Å²	40.8	3%	0.026	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	139.1	-177.1	-65.6	168.9	0	0	0	109.4	S126 Q128 I148 L180 V182	S126-L173 WeakPolarHBondContact OG-CD1 3.18Å; S126-L173 WeakPolarHBondContact OG-CG 3.35Å; Q128-L173 HydrophobicContact CB-CB 4.45Å; Q128-L173 PolarHBondContact OE1-O 3.32Å; I148-L173 HydrophobicContact CD1-CD2 4.04Å; L173-L180 HydrophobicContact CD2-CD1 4.37Å; L173-V182 HydrophobicContact CD2-CB 4.15Å; L173-V182 HydrophobicContact CD2-CG1 3.83Å; L173-V182 HydrophobicContact CD2-CG2 3.68Å
174	C	90.3	Very high	88.2	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	112.3	173	-165.7	0	0	0	0	111.2	C181 I213 A214 Y215 F221	C174-C181 HydrophobicContact CB-CB 4.28Å; C174-C181 PolarHBondContact N-O 3.36Å; C174-C181 PolarHBondContact O-N 3.07Å; C174-I213 HydrophobicContact CB-CB 3.77Å; C174-I213 HydrophobicContact CB-CG2 3.25Å; C174-A214 VanDerWaalsContact SG-C 3.58Å; C174-Y215 VanDerWaalsContact SG-CB 3.55Å; C174-Y215 PolarHBondContact SG-N 3.26Å; C174-F221 HydrophobicContact CB-CD1 4.27Å; C174-F221 HydrophobicContact CB-CE1 4.37Å
175	I	89	Confident	87.6	Confident	1 Å²	1	41 Å²	41	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	136.1	-178.6	-53	166.1	0	0	0	108.8	Q128 F132 K138 C140 L150 L180	Q128-I175 HydrophobicContact CB-CD1 4.44Å; F132-I175 HydrophobicContact CE2-CB 4.47Å; F132-I175 HydrophobicContact CE2-CG2 3.87Å; F132-I175 HydrophobicContact CZ-CG2 4.43Å; F132-I175 WeakPolarHBondContact CZ-O 3.28Å; K138-I175 HydrophobicContact CB-CD1 4.26Å; K138-I175 HydrophobicContact CD-CG2 4.2Å; C140-I175 HydrophobicContact CB-CD1 3.31Å; C140-I175 HydrophobicContact CB-CG1 3.53Å; L150-I175 HydrophobicContact CD1-CD1 4.25Å; I175-L180 HydrophobicContact CG1-CD1 3.92Å
176	S	88	Confident	87.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.199	C	C	.	.			trans	-116.1	173.8	161.4	86.6	0	0	0	0	110.4	Q178 F179 Y215	S176-Q178 PolarHBondContact O-N 3.17Å; S176-F179 WeakPolarHBondContact CA-O 3.47Å; S176-F179 PolarHBondContact N-O 2.89Å; S176-F179 WeakPolarHBondContact OG-CA 3.07Å; S176-F179 WeakPolarHBondContact OG-CB 3.37Å; S176-F179 PolarHBondContact OG-N 3.38Å; S176-F179 PolarHBondContact OG-O 3.28Å; S176-F179 VanDerWaalsContact OG-O 3.05Å; S176-Y215 VanDerWaalsContact CB-CE2 3.48Å
177	P	84.8	Confident	87.2	Confident	50 Å²	50	35.1 Å²	35.1	33%	0.325	20%	0.197	S	C	.	.	S	Bend	trans	-55.2	-36.9	178.8	-28.6	36.8	0	0	0	114	F132 K138	F132-P177 HydrophobicContact CD1-CG 3.97Å; F132-P177 HydrophobicContact CE1-CG 4.08Å; F132-P177 HydrophobicContact CG-CG 4.37Å; K138-P177 PolarHBondContact NZ-O 3.08Å
178	Q	87.2	Confident	87.4	Confident	121 Å²	121	28.4 Å²	28.4	57%	0.565	16%	0.156	S	C	*	.	S	Bend	trans	-120.2	-17.7	-174.2	-64.2	-173.7	-0.9	0	0	114.5	S176 L193	S176-Q178 PolarHBondContact O-N 3.17Å; Q178-L193 WeakPolarHBondContact O-CB 3.37Å; Q178-L193 PolarHBondContact O-N 3.15Å
179	F	90.5	Very high	87.6	Confident	19 Å²	19	26.3 Å²	26.3	8%	0.083	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	160.2	-174.3	-60.5	-90	0	0	0	110.8	S176 I191 N192 N219 F221 A235	S176-F179 WeakPolarHBondContact CA-O 3.47Å; S176-F179 PolarHBondContact N-O 2.89Å; S176-F179 WeakPolarHBondContact OG-CA 3.07Å; S176-F179 WeakPolarHBondContact OG-CB 3.37Å; S176-F179 PolarHBondContact OG-N 3.38Å; S176-F179 PolarHBondContact OG-O 3.28Å; S176-F179 VanDerWaalsContact OG-O 3.05Å; F179-I191 CarbonylContact C-O 3.58Å; F179-I191 VanDerWaalsContact CA-O 3.28Å; F179-I191 WeakPolarHBondContact CA-O 3.44Å; F179-N192 HydrophobicContact CD1-CB 4.02Å; F179-N192 HydrophobicContact CE1-CB 3.91Å; F179-N192 VanDerWaalsContact CE1-ND2 3.3Å; F179-N192 WeakPolarHBondContact CE1-ND2 3.41Å; F179-N219 VanDerWaalsContact CE2-OD1 3.25Å; F179-N219 WeakPolarHBondContact CE2-OD1 3.5Å; F179-F221 HydrophobicContact CB-CE2 4.18Å; F179-F221 HydrophobicContact CB-CZ 4.08Å; F179-A235 HydrophobicContact CB-CB 4.23Å; F179-A235 HydrophobicContact CD1-CB 3.56Å; F179-A235 HydrophobicContact CD2-CB 3.7Å; F179-A235 HydrophobicContact CE1-CB 3.68Å; F179-A235 HydrophobicContact CE2-CB 3.86Å; F179-A235 HydrophobicContact CG-CB 3.56Å; F179-A235 HydrophobicContact CZ-CB 3.84Å
180	L	89.8	Confident	87.7	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.01	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	119.2	172	170.9	68.5	0	0	0	107.8	C140 I148 L173 I175 V182 S190 I191 L193	C140-L180 HydrophobicContact CB-CD1 4.39Å; I148-L180 HydrophobicContact CD1-CD2 4.46Å; I148-L180 HydrophobicContact CG2-CD2 3.61Å; L173-L180 HydrophobicContact CD2-CD1 4.37Å; I175-L180 HydrophobicContact CG1-CD1 3.92Å; L180-V182 HydrophobicContact CD2-CG2 4.09Å; L180-V182 HydrophobicContact CG-CG2 3.92Å; L180-S190 CarbonylContact O-C 3.56Å; L180-S190 WeakPolarHBondContact O-CA 3.38Å; L180-I191 HydrophobicContact CB-CB 4.34Å; L180-I191 HydrophobicContact CD2-CD1 4.4Å; L180-I191 PolarHBondContact N-O 2.82Å; L180-I191 PolarHBondContact O-N 3.4Å; L180-L193 HydrophobicContact CB-CD2 3.94Å
181	C	90	Very high	87.8	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	131.8	172.9	-173.2	0	0	0	0	109.6	C174 I189 I213 F221	C174-C181 HydrophobicContact CB-CB 4.28Å; C174-C181 PolarHBondContact N-O 3.36Å; C174-C181 PolarHBondContact O-N 3.07Å; C181-I189 CarbonylContact C-O 3.52Å; C181-I189 WeakPolarHBondContact CA-O 3.25Å; C181-I213 HydrophobicContact CB-CG2 4.01Å; C181-F221 HydrophobicContact CB-CB 4.46Å; C181-F221 HydrophobicContact CB-CD1 3.61Å; C181-F221 HydrophobicContact CB-CD2 3.95Å; C181-F221 HydrophobicContact CB-CE1 3.65Å; C181-F221 HydrophobicContact CB-CE2 3.99Å; C181-F221 HydrophobicContact CB-CG 3.74Å; C181-F221 HydrophobicContact CB-CZ 3.83Å
182	V	89.8	Confident	88	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	127	-175.4	-174.5	0	0	0	0	108.9	I148 L166 L173 L180 Y188 I189 I191	I148-V182 HydrophobicContact CD1-CG1 4.05Å; I148-V182 HydrophobicContact CD1-CG2 3.68Å; L166-V182 HydrophobicContact CD1-CB 4.27Å; L166-V182 HydrophobicContact CD1-CG1 3.73Å; L166-V182 HydrophobicContact CD1-CG2 4.31Å; L173-V182 HydrophobicContact CD2-CB 4.15Å; L173-V182 HydrophobicContact CD2-CG1 3.83Å; L173-V182 HydrophobicContact CD2-CG2 3.68Å; L180-V182 HydrophobicContact CD2-CG2 4.09Å; L180-V182 HydrophobicContact CG-CG2 3.92Å; V182-Y188 CarbonylContact O-C 3.41Å; V182-Y188 WeakPolarHBondContact O-CA 3.49Å; V182-I189 PolarHBondContact N-O 2.95Å; V182-I189 PolarHBondContact O-N 3.41Å; V182-I191 HydrophobicContact CG2-CD1 3.84Å; V182-I191 HydrophobicContact CG2-CG1 4.28Å
183	A	88.5	Confident	88	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	125.3	167.9	0	0	0	0	0	109.2	L171 S172 Y188 I213	L171-A183 PolarHBondContact N-O 3.2Å; S172-A183 PolarHBondContact O-N 3.39Å; A183-Y188 HydrophobicContact CB-CD1 3.65Å; A183-Y188 HydrophobicContact CB-CE1 3.4Å; A183-I213 HydrophobicContact CB-CD1 3.56Å; A183-I213 HydrophobicContact CB-CG1 4.06Å; A183-I213 VanDerWaalsContact N-CD1 3.29Å
184	S	86.5	Confident	87.9	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.021	16%	0.157	C	C	.	.			trans	-105.3	178.3	167.2	64.2	0	0	0	0	110.1	E168 S186 S187	E168-S184 VanDerWaalsContact OE2-CB 3.29Å; E168-S184 WeakPolarHBondContact OE2-CB 3.27Å; E168-S184 PolarHBondContact OE2-OG 2.58Å; S184-S186 PolarHBondContact O-N 3.48Å; S184-S187 PolarHBondContact N-O 3.05Å; S184-S187 PolarHBondContact OG-N 3.17Å; S184-S187 PolarHBondContact OG-O 3.32Å; S184-S187 PolarHBondContact OG-OG 3.43Å
185	D	80.3	Confident	87.8	Confident	114 Å²	114	35.7 Å²	35.7	61%	0.61	18%	0.18	S	C	*	.	S	Bend	trans	-63	-31.2	174.5	-71.4	-40.4	0	0	0	111.9	L171	L171-D185 WeakPolarHBondContact CD1-OD1 3.48Å
186	S	81.9	Confident	87.7	Confident	49 Å²	49	39 Å²	39	34%	0.343	20%	0.198	S	C	.	.	S	Bend	trans	-103	-28.7	-173.4	69	0	0	0	0	114.7	E168 S184 S204	E168-S186 PolarHBondContact OE1-OG 2.83Å; E168-S186 VanDerWaalsContact OE1-OG 3.07Å; E168-S186 WeakPolarHBondContact OE2-CB 3.46Å; E168-S186 PolarHBondContact OE2-N 3.05Å; E168-S186 PolarHBondContact OE2-OG 3.4Å; S184-S186 PolarHBondContact O-N 3.48Å; S186-S204 PolarHBondContact O-N 3Å
187	S	86.6	Confident	87.7	Confident	9 Å²	9	41.4 Å²	41.4	6%	0.063	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	159.3	-169.3	59.7	0	0	0	0	113.9	S184 L202	S184-S187 PolarHBondContact N-O 3.05Å; S184-S187 PolarHBondContact OG-N 3.17Å; S184-S187 PolarHBondContact OG-O 3.32Å; S184-S187 PolarHBondContact OG-OG 3.43Å; S187-L202 CarbonylContact C-O 3.51Å; S187-L202 VanDerWaalsContact CA-O 3.3Å; S187-L202 WeakPolarHBondContact CA-O 3.3Å
188	Y	88.1	Confident	87.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	127.5	166.7	-67.7	-91.9	0	0	0	109.1	V182 A183 L201 L202 N211 I213 V223	V182-Y188 CarbonylContact O-C 3.41Å; V182-Y188 WeakPolarHBondContact O-CA 3.49Å; A183-Y188 HydrophobicContact CB-CD1 3.65Å; A183-Y188 HydrophobicContact CB-CE1 3.4Å; Y188-L201 WeakPolarHBondContact O-CB 3.2Å; Y188-L201 PolarHBondContact O-N 2.74Å; Y188-L202 HydrophobicContact CD2-CB 4.38Å; Y188-L202 HydrophobicContact CD2-CD2 4.5Å; Y188-L202 PolarHBondContact N-O 3.48Å; Y188-L202 PolarHBondContact O-N 3.25Å; Y188-N211 WeakPolarHBondContact OH-CA 3.36Å; Y188-N211 VanDerWaalsContact OH-CB 3.3Å; Y188-N211 WeakPolarHBondContact OH-CB 3.48Å; Y188-N211 VanDerWaalsContact OH-CG 3.25Å; Y188-N211 PolarHBondContact OH-OD1 2.88Å; Y188-I213 HydrophobicContact CD1-CD1 4.14Å; Y188-I213 HydrophobicContact CD1-CG1 3.99Å; Y188-I213 HydrophobicContact CE1-CD1 4.22Å; Y188-I213 HydrophobicContact CE1-CG1 3.71Å; Y188-V223 HydrophobicContact CD1-CB 4.45Å; Y188-V223 HydrophobicContact CD1-CG1 3.47Å; Y188-V223 VanDerWaalsContact CD1-CG1 3.47Å; Y188-V223 HydrophobicContact CD1-CG2 4.18Å; Y188-V223 HydrophobicContact CD2-CG1 3.37Å; Y188-V223 HydrophobicContact CE1-CG1 3.51Å; Y188-V223 HydrophobicContact CE2-CG1 3.42Å; Y188-V223 VanDerWaalsContact CE2-CG1 3.42Å; Y188-V223 HydrophobicContact CG-CG1 3.39Å; Y188-V223 HydrophobicContact CG-CG2 4.45Å; Y188-V223 VanDerWaalsContact CZ-CG1 3.49Å
189	I	89.8	Confident	87.8	Confident	26 Å²	26	39.4 Å²	39.4	13%	0.133	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	135.5	-174.6	-56.2	172.2	0	0	0	108.8	C181 V182 I191 T198 T199	C181-I189 CarbonylContact C-O 3.52Å; C181-I189 WeakPolarHBondContact CA-O 3.25Å; V182-I189 PolarHBondContact N-O 2.95Å; V182-I189 PolarHBondContact O-N 3.41Å; I189-I191 HydrophobicContact CG2-CG1 4.42Å; I189-T198 HydrophobicContact CG2-CG2 4.49Å; I189-T199 CarbonylContact C-O 3.55Å; I189-T199 WeakPolarHBondContact CA-O 3.4Å
190	S	90.5	Very high	87.6	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.1	168.9	164	0	0	0	0	109.9	L180 T198 T199 A235	L180-S190 CarbonylContact O-C 3.56Å; L180-S190 WeakPolarHBondContact O-CA 3.38Å; S190-T198 CarbonylContact O-C 3.55Å; S190-T198 VanDerWaalsContact O-CA 3.3Å; S190-T198 WeakPolarHBondContact O-CA 3.27Å; S190-T199 WeakPolarHBondContact CB-OG1 3.37Å; S190-T199 PolarHBondContact N-O 2.7Å; S190-T199 PolarHBondContact O-N 3.04Å; S190-T199 PolarHBondContact O-OG1 3.45Å; S190-A235 VanDerWaalsContact CB-O 3.31Å; S190-A235 WeakPolarHBondContact CB-O 3.48Å; S190-A235 PolarHBondContact OG-O 2.91Å
191	I	89.5	Confident	87.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	122	179.1	-49.5	-176.4	0	0	0	107.9	I148 F162 T164 L166 F179 L180 V182 I189 L193 A197 T198	I148-I191 HydrophobicContact CD1-CD1 4.27Å; F162-I191 HydrophobicContact CE1-CG2 4.42Å; F162-I191 HydrophobicContact CZ-CG2 3.89Å; T164-I191 HydrophobicContact CG2-CD1 4Å; L166-I191 HydrophobicContact CD1-CD1 4.34Å; L166-I191 HydrophobicContact CD2-CD1 3.94Å; L166-I191 HydrophobicContact CG-CD1 4.44Å; F179-I191 CarbonylContact C-O 3.58Å; F179-I191 VanDerWaalsContact CA-O 3.28Å; F179-I191 WeakPolarHBondContact CA-O 3.44Å; L180-I191 HydrophobicContact CB-CB 4.34Å; L180-I191 HydrophobicContact CD2-CD1 4.4Å; L180-I191 PolarHBondContact N-O 2.82Å; L180-I191 PolarHBondContact O-N 3.4Å; V182-I191 HydrophobicContact CG2-CD1 3.84Å; V182-I191 HydrophobicContact CG2-CG1 4.28Å; I189-I191 HydrophobicContact CG2-CG1 4.42Å; I191-L193 PolarHBondContact O-N 2.71Å; I191-A197 WeakPolarHBondContact CA-O 3.46Å; I191-T198 HydrophobicContact CG1-CG2 4.17Å; I191-T198 HydrophobicContact CG2-CG2 4.49Å
192	N	89.6	Confident	87	Confident	26 Å²	26	45.5 Å²	45.5	14%	0.139	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	116.4	172.5	-172.2	-53	0	0	0	109.7	F179 R194 T195 N196 A197	F179-N192 HydrophobicContact CD1-CB 4.02Å; F179-N192 HydrophobicContact CE1-CB 3.91Å; F179-N192 VanDerWaalsContact CE1-ND2 3.3Å; F179-N192 WeakPolarHBondContact CE1-ND2 3.41Å; N192-R194 PolarHBondContact O-N 3.43Å; N192-R194 VanDerWaalsContact O-N 3.14Å; N192-R194 WeakPolarHBondContact OD1-CB 3.42Å; N192-R194 PolarHBondContact OD1-N 3.08Å; N192-T195 VanDerWaalsContact CB-OG1 3.26Å; N192-T195 WeakPolarHBondContact CB-OG1 3.36Å; N192-T195 VanDerWaalsContact CG-OG1 3.23Å; N192-T195 PolarHBondContact O-N 3.27Å; N192-T195 PolarHBondContact OD1-N 2.88Å; N192-T195 VanDerWaalsContact OD1-N 3.12Å; N192-T195 PolarHBondContact OD1-OG1 3.43Å; N192-N196 WeakPolarHBondContact O-CA 3.3Å; N192-N196 PolarHBondContact O-N 3.49Å; N192-A197 PolarHBondContact N-O 3.2Å
193	L	86.6	Confident	86.3	Confident	30 Å²	30	53.9 Å²	53.9	16%	0.157	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.5	-175.3	-64.1	174.8	0	0	0	113.4	L150 F162 Q178 L180 I191	L150-L193 HydrophobicContact CD2-CD1 4.19Å; L150-L193 HydrophobicContact CD2-CD2 4.15Å; F162-L193 HydrophobicContact CD1-CD2 4.02Å; F162-L193 WeakPolarHBondContact CD2-O 3.4Å; F162-L193 HydrophobicContact CE1-CD2 4.04Å; F162-L193 HydrophobicContact CG-CD2 4.29Å; F162-L193 HydrophobicContact CZ-CD2 4.34Å; Q178-L193 WeakPolarHBondContact O-CB 3.37Å; Q178-L193 PolarHBondContact O-N 3.15Å; L180-L193 HydrophobicContact CB-CD2 3.94Å; I191-L193 PolarHBondContact O-N 2.71Å
194	R	88.3	Confident	85.4	Confident	219 Å²	219	55.4 Å²	55.4	83%	0.826	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-42.4	179.5	-177.6	174.5	62.2	114.1	-0.5	112.7	N192	N192-R194 PolarHBondContact O-N 3.43Å; N192-R194 VanDerWaalsContact O-N 3.14Å; N192-R194 WeakPolarHBondContact OD1-CB 3.42Å; N192-R194 PolarHBondContact OD1-N 3.08Å
195	T	87.6	Confident	84.2	Confident	80 Å²	80	59 Å²	59	49%	0.491	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-9.7	-176.1	60.8	0	0	0	0	113.5	N192 A197	N192-T195 VanDerWaalsContact CB-OG1 3.26Å; N192-T195 WeakPolarHBondContact CB-OG1 3.36Å; N192-T195 VanDerWaalsContact CG-OG1 3.23Å; N192-T195 PolarHBondContact O-N 3.27Å; N192-T195 PolarHBondContact OD1-N 2.88Å; N192-T195 VanDerWaalsContact OD1-N 3.12Å; N192-T195 PolarHBondContact OD1-OG1 3.43Å; T195-A197 PolarHBondContact O-N 3.37Å; T195-A197 VanDerWaalsContact O-N 3.14Å; T195-A197 WeakPolarHBondContact OG1-CB 3.13Å; T195-A197 PolarHBondContact OG1-N 2.7Å
196	N	87	Confident	83.1	Confident	71 Å²	71	63.6 Å²	63.6	38%	0.38	32%	0.321	S	S	.	.			trans	53.8	22.8	-169.6	-161.7	27.3	0	0	0	113.3	F162 T164 N192	F162-N196 HydrophobicContact CE2-CB 4.18Å; F162-N196 HydrophobicContact CZ-CB 4.5Å; F162-N196 VanDerWaalsContact CZ-OD1 3.27Å; F162-N196 WeakPolarHBondContact CZ-OD1 3.45Å; T164-N196 WeakPolarHBondContact CB-OD1 3.36Å; T164-N196 PolarHBondContact OG1-ND2 3.06Å; T164-N196 PolarHBondContact OG1-OD1 2.81Å; N192-N196 WeakPolarHBondContact O-CA 3.3Å; N192-N196 PolarHBondContact O-N 3.49Å
197	A	88.7	Confident	82	Confident	49 Å²	49	65.8 Å²	65.8	41%	0.405	33%	0.326	S	S	.	.			trans	-78.8	134.7	176.1	0	0	0	0	0	109.9	I191 N192 T195	I191-A197 WeakPolarHBondContact CA-O 3.46Å; N192-A197 PolarHBondContact N-O 3.2Å; T195-A197 PolarHBondContact O-N 3.37Å; T195-A197 VanDerWaalsContact O-N 3.14Å; T195-A197 WeakPolarHBondContact OG1-CB 3.13Å; T195-A197 PolarHBondContact OG1-N 2.7Å
198	T	87.3	Confident	80.5	Confident	82 Å²	82	72 Å²	72	50%	0.503	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.6	179.8	57.2	0	0	0	0	110.5	I189 S190 I191	I189-T198 HydrophobicContact CG2-CG2 4.49Å; S190-T198 CarbonylContact O-C 3.55Å; S190-T198 VanDerWaalsContact O-CA 3.3Å; S190-T198 WeakPolarHBondContact O-CA 3.27Å; I191-T198 HydrophobicContact CG1-CG2 4.17Å; I191-T198 HydrophobicContact CG2-CG2 4.49Å
199	T	87.3	Confident	79.2	Confident	47 Å²	47	74.1 Å²	74.1	29%	0.288	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.8	176.6	45.3	0	0	0	0	109.9	I189 S190 L201 A235	I189-T199 CarbonylContact C-O 3.55Å; I189-T199 WeakPolarHBondContact CA-O 3.4Å; S190-T199 WeakPolarHBondContact CB-OG1 3.37Å; S190-T199 PolarHBondContact N-O 2.7Å; S190-T199 PolarHBondContact O-N 3.04Å; S190-T199 PolarHBondContact O-OG1 3.45Å; T199-L201 PolarHBondContact O-N 2.82Å; T199-A235 PolarHBondContact OG1-O 2.88Å
200	E	86.4	Confident	78.2	Confident	96 Å²	96	80 Å²	80	45%	0.449	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	119	174.4	-173.3	176.9	-164.3	0	0	108.9	R203	E200-R203 WeakPolarHBondContact OE1-CD 3.35Å; E200-R203 WeakPolarHBondContact OE1-CG 3.47Å; E200-R203 IonicContact OE1-CZ 3.63Å; E200-R203 IonicContact OE1-NE 3.88Å; E200-R203 PolarHBondContact OE1-NE 3.39Å; E200-R203 IonicContact OE1-NH2 3.62Å; E200-R203 IonicContact OE2-CZ 3.65Å; E200-R203 IonicContact OE2-NE 2.62Å; E200-R203 PolarHBondContact OE2-NE 2.96Å; E200-R203 IonicContact OE2-NH2 2.93Å; E200-R203 PolarHBondContact OE2-NH2 3.09Å
201	L	84.8	Confident	77.3	Confident	16 Å²	16	81.9 Å²	81.9	8%	0.084	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-49.7	-177.9	-57.8	-178.9	0	0	0	111.4	Y188 T199 V233 D234 G237	Y188-L201 WeakPolarHBondContact O-CB 3.2Å; Y188-L201 PolarHBondContact O-N 2.74Å; T199-L201 PolarHBondContact O-N 2.82Å; L201-V233 HydrophobicContact CB-CG1 4.29Å; L201-V233 HydrophobicContact CD2-CG1 4.22Å; L201-D234 VanDerWaalsContact CD2-O 3.32Å; L201-D234 WeakPolarHBondContact CD2-O 3.48Å; L201-G237 VanDerWaalsContact CD2-CA 3.44Å; L201-G237 VanDerWaalsContact CD2-N 3.27Å
202	L	81.9	Confident	76.9	Confident	37 Å²	37	83 Å²	83	19%	0.194	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	137.6	-174.4	-159.8	131.4	0	0	0	110.5	S187 Y188 I231	S187-L202 CarbonylContact C-O 3.51Å; S187-L202 VanDerWaalsContact CA-O 3.3Å; S187-L202 WeakPolarHBondContact CA-O 3.3Å; Y188-L202 HydrophobicContact CD2-CB 4.38Å; Y188-L202 HydrophobicContact CD2-CD2 4.5Å; Y188-L202 PolarHBondContact N-O 3.48Å; Y188-L202 PolarHBondContact O-N 3.25Å; L202-I231 HydrophobicContact CD1-CD1 3.42Å; L202-I231 VanDerWaalsContact CD1-CD1 3.42Å; L202-I231 HydrophobicContact CD1-CG2 4.35Å
203	R	75.6	Confident	76.7	Confident	178 Å²	178	82.7 Å²	82.7	67%	0.672	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	122.1	171.8	-74.9	-177.9	-175.9	165	9.2	109.7	E200	E200-R203 WeakPolarHBondContact OE1-CD 3.35Å; E200-R203 WeakPolarHBondContact OE1-CG 3.47Å; E200-R203 IonicContact OE1-CZ 3.63Å; E200-R203 IonicContact OE1-NE 3.88Å; E200-R203 PolarHBondContact OE1-NE 3.39Å; E200-R203 IonicContact OE1-NH2 3.62Å; E200-R203 IonicContact OE2-CZ 3.65Å; E200-R203 IonicContact OE2-NE 2.62Å; E200-R203 PolarHBondContact OE2-NE 2.96Å; E200-R203 IonicContact OE2-NH2 2.93Å; E200-R203 PolarHBondContact OE2-NH2 3.09Å
204	S	70	Confident	76.6	Confident	31 Å²	31	81.9 Å²	81.9	22%	0.217	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-69	131.7	176.6	-168	0	0	0	0	109.6	S186	S186-S204 PolarHBondContact O-N 3Å
205	V	59.7	Low	76.5	Confident	80 Å²	80	74.6 Å²	74.6	49%	0.485	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-85.6	136.7	168.5	-176.1	0	0	0	0	106.3	E207 P226	V205-E207 HydrophobicContact CG1-CG 4.29Å; V205-E207 PolarHBondContact O-N 3.4Å; V205-P226 HydrophobicContact CG2-CB 4.34Å
206	K	58.2	Low	76.3	Confident	209 Å²	209	71.7 Å²	71.7	91%	0.909	36%	0.363	S	S	*	.	S	Bend	trans	-63.3	21	-173.2	-64.2	-174.9	174.6	-176.1	0	115.7
207	E	59.2	Low	76	Confident	95 Å²	95	70.8 Å²	70.8	44%	0.444	36%	0.36	S	S	.	.	S	Bend	trans	-67.6	144.7	172.4	-71.3	170.2	-177	0	0	109.5	V205 V209 G227	V205-E207 HydrophobicContact CG1-CG 4.29Å; V205-E207 PolarHBondContact O-N 3.4Å; E207-V209 HydrophobicContact CB-CG2 4.2Å; E207-V209 PolarHBondContact O-N 2.91Å; E207-G227 PolarHBondContact OE2-N 3.32Å
208	P	55.2	Low	75.4	Confident	139 Å²	139	75.6 Å²	75.6	90%	0.903	37%	0.374	S	S	*	.			trans	-79.2	49.4	-176	36.2	-36.9	0	0	0	110.9
209	V	60.5	Low	75.1	Confident	46 Å²	46	74.9 Å²	74.9	28%	0.279	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-88.3	132.6	174	-172	0	0	0	0	107.8	E207 N211	E207-V209 HydrophobicContact CB-CG2 4.2Å; E207-V209 PolarHBondContact O-N 2.91Å; V209-N211 PolarHBondContact O-N 3.31Å; V209-N211 VanDerWaalsContact O-N 3.09Å
210	R	67.8	Low	75.1	Confident	148 Å²	148	73.9 Å²	73.9	56%	0.558	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-59.2	116.8	174.1	-174.3	178.2	-175.5	166.8	4.4	108.9	Y212 V251	R210-Y212 WeakPolarHBondContact O-CD1 3.36Å; R210-Y212 PolarHBondContact O-N 3.1Å; R210-V251 PolarHBondContact NH1-O 3.19Å
211	N	73.1	Confident	75.2	Confident	40 Å²	40	69.3 Å²	69.3	21%	0.214	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-66.1	123.2	175.7	-71.3	-22.3	0	0	0	109.9	L171 Y188 V209	L171-N211 WeakPolarHBondContact CD1-ND2 3.4Å; Y188-N211 WeakPolarHBondContact OH-CA 3.36Å; Y188-N211 VanDerWaalsContact OH-CB 3.3Å; Y188-N211 WeakPolarHBondContact OH-CB 3.48Å; Y188-N211 VanDerWaalsContact OH-CG 3.25Å; Y188-N211 PolarHBondContact OH-OD1 2.88Å; V209-N211 PolarHBondContact O-N 3.31Å; V209-N211 VanDerWaalsContact O-N 3.09Å
212	Y	80	Confident	75.4	Confident	25 Å²	25	68.7 Å²	68.7	10%	0.098	34%	0.335	C	S	.	.			trans	-126	149.3	171.1	59.7	-94.4	0	0	0	110.1	R210 S224 L246 I250 V253 F260	R210-Y212 WeakPolarHBondContact O-CD1 3.36Å; R210-Y212 PolarHBondContact O-N 3.1Å; Y212-S224 PolarHBondContact O-N 3.04Å; Y212-L246 WeakPolarHBondContact OH-CD1 3.42Å; Y212-I250 HydrophobicContact CE1-CD1 3.92Å; Y212-V253 HydrophobicContact CD1-CG2 4.1Å; Y212-V253 HydrophobicContact CD2-CB 4.37Å; Y212-V253 HydrophobicContact CD2-CG1 4.32Å; Y212-V253 HydrophobicContact CD2-CG2 3.99Å; Y212-V253 HydrophobicContact CE1-CG2 4.37Å; Y212-V253 HydrophobicContact CE2-CG2 4.26Å; Y212-V253 HydrophobicContact CG-CB 4.49Å; Y212-V253 HydrophobicContact CG-CG2 3.92Å; Y212-F260 HydrophobicContact CE2-CZ 4.1Å
213	I	85.3	Confident	75.6	Confident	18 Å²	18	66.9 Å²	66.9	9%	0.092	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	128.9	174	-46.2	172.1	0	0	0	107.1	C174 C181 A183 Y188 I222	C174-I213 HydrophobicContact CB-CB 3.77Å; C174-I213 HydrophobicContact CB-CG2 3.25Å; C181-I213 HydrophobicContact CB-CG2 4.01Å; A183-I213 HydrophobicContact CB-CD1 3.56Å; A183-I213 HydrophobicContact CB-CG1 4.06Å; A183-I213 VanDerWaalsContact N-CD1 3.29Å; Y188-I213 HydrophobicContact CD1-CD1 4.14Å; Y188-I213 HydrophobicContact CD1-CG1 3.99Å; Y188-I213 HydrophobicContact CE1-CD1 4.22Å; Y188-I213 HydrophobicContact CE1-CG1 3.71Å; I213-I222 WeakPolarHBondContact CA-O 3.27Å
214	A	84.9	Confident	76.1	Confident	14 Å²	14	58.8 Å²	58.8	12%	0.116	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	143.1	174.3	0	0	0	0	0	110.9	C174 F221 I222 V255	C174-A214 VanDerWaalsContact SG-C 3.58Å; A214-F221 CarbonylContact O-C 3.59Å; A214-F221 WeakPolarHBondContact O-CA 3.35Å; A214-I222 HydrophobicContact CB-CB 4.42Å; A214-I222 PolarHBondContact N-O 3.17Å; A214-I222 PolarHBondContact O-N 2.85Å; A214-V255 HydrophobicContact CB-CG2 3.49Å; A214-V255 VanDerWaalsContact CB-CG2 3.49Å
215	Y	86.8	Confident	76.7	Confident	65 Å²	65	57.5 Å²	57.5	26%	0.255	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	135.3	174.8	168.3	-99.5	0	0	0	109	F132 C174 S176 T217 Q218 F221	F132-Y215 HydrophobicContact CE1-CD1 4.47Å; F132-Y215 HydrophobicContact CE1-CE1 4.15Å; C174-Y215 VanDerWaalsContact SG-CB 3.55Å; C174-Y215 PolarHBondContact SG-N 3.26Å; S176-Y215 VanDerWaalsContact CB-CE2 3.48Å; Y215-T217 WeakPolarHBondContact CE2-O 3.07Å; Y215-Q218 WeakPolarHBondContact OH-CA 3.24Å; Y215-Q218 PolarHBondContact OH-N 3.02Å; Y215-F221 HydrophobicContact CD2-CE1 4.23Å
216	F	82.6	Confident	77.6	Confident	20 Å²	20	56.4 Å²	56.4	9%	0.088	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	-64.8	-179	178.7	-123.3	0	0	0	112.1	E220 I222 V255 K257 I273	F216-E220 HydrophobicContact CD1-CB 4.34Å; F216-E220 WeakPolarHBondContact CD1-OE2 3.36Å; F216-E220 PolarHBondContact N-O 3.46Å; F216-E220 VanDerWaalsContact N-O 3.08Å; F216-I222 HydrophobicContact CB-CD1 4.26Å; F216-I222 HydrophobicContact CB-CG1 4.1Å; F216-I222 HydrophobicContact CG-CD1 4.49Å; F216-V255 HydrophobicContact CD2-CG1 3.84Å; F216-K257 VanDerWaalsContact CE2-O 3.24Å; F216-K257 WeakPolarHBondContact CE2-O 3.4Å; F216-I273 HydrophobicContact CD2-CD1 3.6Å; F216-I273 HydrophobicContact CE1-CG2 3.85Å; F216-I273 HydrophobicContact CE2-CB 4.22Å; F216-I273 HydrophobicContact CE2-CD1 3.35Å; F216-I273 HydrophobicContact CE2-CG1 4.38Å; F216-I273 HydrophobicContact CE2-CG2 4.03Å; F216-I273 HydrophobicContact CG-CD1 4.47Å; F216-I273 HydrophobicContact CZ-CB 4.1Å; F216-I273 HydrophobicContact CZ-CD1 4.08Å; F216-I273 HydrophobicContact CZ-CG2 3.58Å
217	T	81	Confident	78.6	Confident	51 Å²	51	48.6 Å²	48.6	31%	0.313	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	176.3	-178.7	66.8	0	0	0	0	110.2	Y215 N219 E220	Y215-T217 WeakPolarHBondContact CE2-O 3.07Å; T217-N219 PolarHBondContact O-N 3.39Å; T217-E220 PolarHBondContact O-N 3.3Å; T217-E220 WeakPolarHBondContact OG1-CB 3.41Å; T217-E220 WeakPolarHBondContact OG1-CG 3.5Å; T217-E220 PolarHBondContact OG1-OE2 3.43Å
218	Q	75	Confident	79.7	Confident	150 Å²	150	45.1 Å²	45.1	70%	0.701	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.2	-33	-167.5	-84.2	179.3	-18.3	0	0	115.4	Y215	Y215-Q218 WeakPolarHBondContact OH-CA 3.24Å; Y215-Q218 PolarHBondContact OH-N 3.02Å
219	N	81.1	Confident	81.1	Confident	68 Å²	68	40.5 Å²	40.5	36%	0.364	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.9	11.7	177.4	-60.8	-29.8	0	0	0	114.2	F179 T217 D234 A235	F179-N219 VanDerWaalsContact CE2-OD1 3.25Å; F179-N219 WeakPolarHBondContact CE2-OD1 3.5Å; T217-N219 PolarHBondContact O-N 3.39Å; N219-D234 CarbonylContact O-C 3.59Å; N219-D234 VanDerWaalsContact O-C 3.31Å; N219-D234 WeakPolarHBondContact O-CA 3.43Å; N219-A235 HydrophobicContact CB-CB 4.35Å; N219-A235 PolarHBondContact O-N 3.1Å
220	E	88.6	Confident	82.3	Confident	25 Å²	25	38.3 Å²	38.3	12%	0.117	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	136.8	-176.5	-62.4	178	139.1	0	0	111.6	F216 T217 I232 V233	F216-E220 HydrophobicContact CD1-CB 4.34Å; F216-E220 WeakPolarHBondContact CD1-OE2 3.36Å; F216-E220 PolarHBondContact N-O 3.46Å; F216-E220 VanDerWaalsContact N-O 3.08Å; T217-E220 PolarHBondContact O-N 3.3Å; T217-E220 WeakPolarHBondContact OG1-CB 3.41Å; T217-E220 WeakPolarHBondContact OG1-CG 3.5Å; T217-E220 PolarHBondContact OG1-OE2 3.43Å; E220-I232 HydrophobicContact CB-CG2 4.25Å; E220-V233 WeakPolarHBondContact CA-O 3.41Å
221	F	88.2	Confident	83.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.8	176.8	-59.7	-81.5	0	0	0	110	C174 F179 C181 A214 Y215 V223 I232 V233 A235	C174-F221 HydrophobicContact CB-CD1 4.27Å; C174-F221 HydrophobicContact CB-CE1 4.37Å; F179-F221 HydrophobicContact CB-CE2 4.18Å; F179-F221 HydrophobicContact CB-CZ 4.08Å; C181-F221 HydrophobicContact CB-CB 4.46Å; C181-F221 HydrophobicContact CB-CD1 3.61Å; C181-F221 HydrophobicContact CB-CD2 3.95Å; C181-F221 HydrophobicContact CB-CE1 3.65Å; C181-F221 HydrophobicContact CB-CE2 3.99Å; C181-F221 HydrophobicContact CB-CG 3.74Å; C181-F221 HydrophobicContact CB-CZ 3.83Å; A214-F221 CarbonylContact O-C 3.59Å; A214-F221 WeakPolarHBondContact O-CA 3.35Å; Y215-F221 HydrophobicContact CD2-CE1 4.23Å; F221-V223 HydrophobicContact CB-CG2 4.43Å; F221-I232 CarbonylContact O-C 3.59Å; F221-I232 WeakPolarHBondContact O-CA 3.39Å; F221-V233 PolarHBondContact N-O 3.46Å; F221-V233 PolarHBondContact O-N 3.1Å; F221-A235 HydrophobicContact CE2-CB 4.41Å
222	I	87.7	Confident	83.9	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.015	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.5	171.1	-47.8	-173.5	0	0	0	107.7	I213 A214 F216 I231 I232 V255 F260 I273	I213-I222 WeakPolarHBondContact CA-O 3.27Å; A214-I222 HydrophobicContact CB-CB 4.42Å; A214-I222 PolarHBondContact N-O 3.17Å; A214-I222 PolarHBondContact O-N 2.85Å; F216-I222 HydrophobicContact CB-CD1 4.26Å; F216-I222 HydrophobicContact CB-CG1 4.1Å; F216-I222 HydrophobicContact CG-CD1 4.49Å; I222-I231 CarbonylContact C-O 3.54Å; I222-I231 WeakPolarHBondContact CA-O 3.35Å; I222-I232 HydrophobicContact CG1-CG1 4.16Å; I222-V255 HydrophobicContact CD1-CG2 3.83Å; I222-F260 HydrophobicContact CB-CE2 4.34Å; I222-F260 HydrophobicContact CD1-CD2 3.75Å; I222-F260 HydrophobicContact CD1-CE2 3.8Å; I222-F260 HydrophobicContact CG2-CE2 3.81Å; I222-F260 HydrophobicContact CG2-CZ 3.92Å; I222-I273 HydrophobicContact CD1-CD1 3.86Å
223	V	87.4	Confident	84.4	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	144	-171.3	173.8	0	0	0	0	109.3	Y188 F221 G225 I231	Y188-V223 HydrophobicContact CD1-CB 4.45Å; Y188-V223 HydrophobicContact CD1-CG1 3.47Å; Y188-V223 VanDerWaalsContact CD1-CG1 3.47Å; Y188-V223 HydrophobicContact CD1-CG2 4.18Å; Y188-V223 HydrophobicContact CD2-CG1 3.37Å; Y188-V223 HydrophobicContact CE1-CG1 3.51Å; Y188-V223 HydrophobicContact CE2-CG1 3.42Å; Y188-V223 VanDerWaalsContact CE2-CG1 3.42Å; Y188-V223 HydrophobicContact CG-CG1 3.39Å; Y188-V223 HydrophobicContact CG-CG2 4.45Å; Y188-V223 VanDerWaalsContact CZ-CG1 3.49Å; F221-V223 HydrophobicContact CB-CG2 4.43Å; V223-G225 PolarHBondContact O-N 3.34Å; V223-I231 PolarHBondContact N-O 3.11Å; V223-I231 PolarHBondContact O-N 3.08Å
224	S	85.8	Confident	84.5	Confident	7 Å²	7	29.8 Å²	29.8	5%	0.049	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	119	171.5	-169.6	0	0	0	0	110.9	Y212	Y212-S224 PolarHBondContact O-N 3.04Å
225	G	81.9	Confident	84.5	Confident	5 Å²	5	29.2 Å²	29.2	5%	0.052	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	171.4	172.6	0	0	0	0	0	113.4	V223 L229 I231	V223-G225 PolarHBondContact O-N 3.34Å; G225-L229 WeakPolarHBondContact CA-O 3.45Å; G225-L229 PolarHBondContact N-O 3.4Å; G225-I231 VanDerWaalsContact CA-CD1 3.49Å
226	P	79.5	Confident	84.4	Confident	56 Å²	56	31.4 Å²	31.4	36%	0.364	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	146.8	176.1	28.3	-34.8	0	0	0	111.1	V205 L229	V205-P226 HydrophobicContact CG2-CB 4.34Å; P226-L229 WeakPolarHBondContact O-CD1 3.2Å; P226-L229 WeakPolarHBondContact O-CG 3.43Å
227	G	79.1	Confident	84.4	Confident	46 Å²	46	31.8 Å²	31.8	47%	0.474	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	30.9	176.9	0	0	0	0	0	115.4	E207 L229	E207-G227 PolarHBondContact OE2-N 3.32Å; G227-L229 VanDerWaalsContact C-N 3.32Å; G227-L229 PolarHBondContact O-N 2.67Å
228	S	81.7	Confident	84.6	Confident	22 Å²	22	32.8 Å²	32.8	15%	0.154	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	37.8	-177.6	-47.1	0	0	0	0	113.4	L246	S228-L246 WeakPolarHBondContact O-CA 2.99Å; S228-L246 VanDerWaalsContact O-CB 3.24Å; S228-L246 WeakPolarHBondContact O-CB 3.31Å; S228-L246 PolarHBondContact O-N 2.81Å
229	L	85.1	Confident	85.1	Confident	41 Å²	41	28.1 Å²	28.1	22%	0.215	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	135.2	174.3	-69	177	0	0	0	110.6	G225 P226 G227 I231 P243 L244 Q245	G225-L229 WeakPolarHBondContact CA-O 3.45Å; G225-L229 PolarHBondContact N-O 3.4Å; P226-L229 WeakPolarHBondContact O-CD1 3.2Å; P226-L229 WeakPolarHBondContact O-CG 3.43Å; G227-L229 VanDerWaalsContact C-N 3.32Å; G227-L229 PolarHBondContact O-N 2.67Å; L229-I231 HydrophobicContact CB-CG1 4.45Å; L229-P243 HydrophobicContact CB-CB 4.12Å; L229-P243 HydrophobicContact CD1-CB 4.22Å; L229-P243 HydrophobicContact CD1-CG 4.21Å; L229-P243 HydrophobicContact CD2-CB 4.28Å; L229-P243 HydrophobicContact CG-CB 4.45Å; L229-L244 CarbonylContact C-O 3.59Å; L229-L244 WeakPolarHBondContact CA-O 3.42Å; L229-Q245 HydrophobicContact CD2-CB 4.47Å
230	G	85.6	Confident	85.1	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	109.2	167.1	0	0	0	0	0	110	P243 L244	G230-P243 WeakPolarHBondContact O-CA 3.42Å; G230-L244 PolarHBondContact N-O 2.79Å; G230-L244 PolarHBondContact O-N 3.46Å
231	I	87.4	Confident	84.9	Confident	22 Å²	22	33 Å²	33	11%	0.113	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	129.8	-177.5	-53.4	180	0	0	0	109.1	L202 I222 V223 G225 L229 V233 P243	L202-I231 HydrophobicContact CD1-CD1 3.42Å; L202-I231 VanDerWaalsContact CD1-CD1 3.42Å; L202-I231 HydrophobicContact CD1-CG2 4.35Å; I222-I231 CarbonylContact C-O 3.54Å; I222-I231 WeakPolarHBondContact CA-O 3.35Å; V223-I231 PolarHBondContact N-O 3.11Å; V223-I231 PolarHBondContact O-N 3.08Å; G225-I231 VanDerWaalsContact CA-CD1 3.49Å; L229-I231 HydrophobicContact CB-CG1 4.45Å; I231-V233 HydrophobicContact CB-CG2 4.34Å; I231-V233 HydrophobicContact CG2-CG2 3.52Å; I231-P243 HydrophobicContact CG1-CB 4.16Å
232	I	88.2	Confident	84.7	Confident	8 Å²	8	35.4 Å²	35.4	4%	0.041	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	110.4	179.2	-51.4	175.3	0	0	0	108.2	E220 F221 I222 S239 I273	E220-I232 HydrophobicContact CB-CG2 4.25Å; F221-I232 CarbonylContact O-C 3.59Å; F221-I232 WeakPolarHBondContact O-CA 3.39Å; I222-I232 HydrophobicContact CG1-CG1 4.16Å; I232-S239 WeakPolarHBondContact O-CA 3.18Å; I232-S239 PolarHBondContact O-OG 3.46Å; I232-I273 HydrophobicContact CD1-CG2 3.38Å
233	V	89.1	Confident	84.5	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	137.5	-172	-165.5	0	0	0	0	109.7	L201 E220 F221 I231 G237	L201-V233 HydrophobicContact CB-CG1 4.29Å; L201-V233 HydrophobicContact CD2-CG1 4.22Å; E220-V233 WeakPolarHBondContact CA-O 3.41Å; F221-V233 PolarHBondContact N-O 3.46Å; F221-V233 PolarHBondContact O-N 3.1Å; I231-V233 HydrophobicContact CB-CG2 4.34Å; I231-V233 HydrophobicContact CG2-CG2 3.52Å; V233-G237 VanDerWaalsContact CG1-CA 3.43Å
234	D	88.6	Confident	84.4	Confident	19 Å²	19	39 Å²	39	10%	0.102	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	168.8	170.5	78.5	8.2	0	0	0	112.2	L201 N219 N236 G237 V238 H240	L201-D234 VanDerWaalsContact CD2-O 3.32Å; L201-D234 WeakPolarHBondContact CD2-O 3.48Å; N219-D234 CarbonylContact O-C 3.59Å; N219-D234 VanDerWaalsContact O-C 3.31Å; N219-D234 WeakPolarHBondContact O-CA 3.43Å; D234-N236 PolarHBondContact O-N 3.31Å; D234-N236 VanDerWaalsContact OD1-CA 3.31Å; D234-N236 WeakPolarHBondContact OD1-CA 3.43Å; D234-N236 WeakPolarHBondContact OD1-CB 3.18Å; D234-N236 PolarHBondContact OD1-N 2.94Å; D234-G237 PolarHBondContact O-N 3.02Å; D234-G237 PolarHBondContact OD1-N 3.42Å; D234-V238 PolarHBondContact N-O 3.17Å; D234-V238 PolarHBondContact OD1-N 3.01Å; D234-H240 IonicContact OD2-CD2 2.74Å; D234-H240 IonicContact OD2-CE1 3.48Å; D234-H240 IonicContact OD2-NE2 3.87Å; D234-H240 PolarHBondContact OD2-NE2 3.34Å
235	A	83.9	Confident	84.4	Confident	2 Å²	2	44.3 Å²	44.3	2%	0.017	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-12.1	-179.9	0	0	0	0	0	114.3	F179 S190 T199 N219 F221	F179-A235 HydrophobicContact CB-CB 4.23Å; F179-A235 HydrophobicContact CD1-CB 3.56Å; F179-A235 HydrophobicContact CD2-CB 3.7Å; F179-A235 HydrophobicContact CE1-CB 3.68Å; F179-A235 HydrophobicContact CE2-CB 3.86Å; F179-A235 HydrophobicContact CG-CB 3.56Å; F179-A235 HydrophobicContact CZ-CB 3.84Å; S190-A235 VanDerWaalsContact CB-O 3.31Å; S190-A235 WeakPolarHBondContact CB-O 3.48Å; S190-A235 PolarHBondContact OG-O 2.91Å; T199-A235 PolarHBondContact OG1-O 2.88Å; N219-A235 HydrophobicContact CB-CB 4.35Å; N219-A235 PolarHBondContact O-N 3.1Å; F221-A235 HydrophobicContact CE2-CB 4.41Å
236	N	84.9	Confident	84.6	Confident	112 Å²	112	44.5 Å²	44.5	60%	0.599	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-3.6	178.3	-56.1	-42.1	0	0	0	112.9	D234	D234-N236 PolarHBondContact O-N 3.31Å; D234-N236 VanDerWaalsContact OD1-CA 3.31Å; D234-N236 WeakPolarHBondContact OD1-CA 3.43Å; D234-N236 WeakPolarHBondContact OD1-CB 3.18Å; D234-N236 PolarHBondContact OD1-N 2.94Å
237	G	82	Confident	84.9	Confident	27 Å²	27	43.7 Å²	43.7	28%	0.278	26%	0.259	S	S	.	.	S	Bend	trans	94.7	7.4	-179	0	0	0	0	0	114.7	L201 V233 D234	L201-G237 VanDerWaalsContact CD2-CA 3.44Å; L201-G237 VanDerWaalsContact CD2-N 3.27Å; V233-G237 VanDerWaalsContact CG1-CA 3.43Å; D234-G237 PolarHBondContact O-N 3.02Å; D234-G237 PolarHBondContact OD1-N 3.42Å
238	V	86.1	Confident	85.1	Confident	72 Å²	72	44.9 Å²	44.9	44%	0.436	26%	0.26	S	S	.	.			trans	-96.2	126.9	-178.5	-175	0	0	0	0	110.3	D234	D234-V238 PolarHBondContact N-O 3.17Å; D234-V238 PolarHBondContact OD1-N 3.01Å
239	S	84.4	Confident	85.2	Confident	52 Å²	52	49 Å²	49	36%	0.364	28%	0.28	S	S	.	.			trans	-89.4	109.8	171.5	-168.4	0	0	0	0	109.7	I232 R241	I232-S239 WeakPolarHBondContact O-CA 3.18Å; I232-S239 PolarHBondContact O-OG 3.46Å; S239-R241 VanDerWaalsContact C-N 3.29Å; S239-R241 PolarHBondContact OG-O 2.93Å
240	H	82.6	Confident	85.3	Confident	121 Å²	121	47.9 Å²	47.9	56%	0.56	27%	0.274	S	S	*	.			trans	-83.2	-9.6	176.8	-60.9	-68.1	0	0	0	112.9	D234	D234-H240 IonicContact OD2-CD2 2.74Å; D234-H240 IonicContact OD2-CE1 3.48Å; D234-H240 IonicContact OD2-NE2 3.87Å; D234-H240 PolarHBondContact OD2-NE2 3.34Å
241	R	83.2	Confident	85.2	Confident	75 Å²	75	48.9 Å²	48.9	28%	0.283	28%	0.28	S	S	.	.	S	Bend	trans	-126.9	152.7	-175	-61.1	172.9	-172.6	-86.2	-1.9	109.7	S239	S239-R241 VanDerWaalsContact C-N 3.29Å; S239-R241 PolarHBondContact OG-O 2.93Å
242	A	84.8	Confident	85.2	Confident	51 Å²	51	50.2 Å²	50.2	42%	0.421	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-65.4	152.2	169.6	0	0	0	0	0	110.4	Q276	A242-Q276 VanDerWaalsContact N-NE2 3.11Å; A242-Q276 PolarHBondContact O-NE2 3.2Å
243	P	83.7	Confident	85.3	Confident	63 Å²	63	50.9 Å²	50.9	41%	0.409	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-66.5	144.1	176.4	28.3	-34.9	0	0	0	111.3	L229 G230 I231	L229-P243 HydrophobicContact CB-CB 4.12Å; L229-P243 HydrophobicContact CD1-CB 4.22Å; L229-P243 HydrophobicContact CD1-CG 4.21Å; L229-P243 HydrophobicContact CD2-CB 4.28Å; L229-P243 HydrophobicContact CG-CB 4.45Å; G230-P243 WeakPolarHBondContact O-CA 3.42Å; I231-P243 HydrophobicContact CG1-CB 4.16Å
244	L	85.4	Confident	85.3	Confident	16 Å²	16	52.2 Å²	52.2	8%	0.084	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	128	175.3	-176.9	65.1	0	0	0	109.6	L229 G230 L246 F260 H271	L229-L244 CarbonylContact C-O 3.59Å; L229-L244 WeakPolarHBondContact CA-O 3.42Å; G230-L244 PolarHBondContact N-O 2.79Å; G230-L244 PolarHBondContact O-N 3.46Å; L244-L246 HydrophobicContact CD2-CD2 3.63Å; L244-L246 HydrophobicContact CG-CD2 3.82Å; L244-L246 PolarHBondContact O-N 3.35Å; L244-F260 HydrophobicContact CD2-CB 4.38Å; L244-F260 HydrophobicContact CD2-CD1 3.68Å; L244-F260 HydrophobicContact CD2-CE1 4.35Å; L244-F260 HydrophobicContact CD2-CG 4.33Å; L244-H271 HydrophobicContact CD1-CB 4.08Å; L244-H271 HydrophobicContact CD2-CB 3.55Å; L244-H271 HydrophobicContact CG-CB 4.38Å
245	Q	85.8	Confident	85.2	Confident	118 Å²	118	53.2 Å²	53.2	55%	0.551	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	122.8	172.7	-176.1	63.4	55.7	0	0	109.7	L229	L229-Q245 HydrophobicContact CD2-CB 4.47Å
246	L	84.7	Confident	85.3	Confident	9 Å²	9	54.4 Å²	54.4	5%	0.047	31%	0.307	C	S	.	.			trans	-115.3	168.1	176.6	-51.4	170.6	0	0	0	110.5	Y212 S228 L244 I250 F260 T262	Y212-L246 WeakPolarHBondContact OH-CD1 3.42Å; S228-L246 WeakPolarHBondContact O-CA 2.99Å; S228-L246 VanDerWaalsContact O-CB 3.24Å; S228-L246 WeakPolarHBondContact O-CB 3.31Å; S228-L246 PolarHBondContact O-N 2.81Å; L244-L246 HydrophobicContact CD2-CD2 3.63Å; L244-L246 HydrophobicContact CG-CD2 3.82Å; L244-L246 PolarHBondContact O-N 3.35Å; L246-I250 HydrophobicContact CB-CD1 3.92Å; L246-I250 HydrophobicContact CD1-CD1 3.75Å; L246-I250 HydrophobicContact CG-CD1 4.48Å; L246-F260 HydrophobicContact CD1-CE1 3.7Å; L246-F260 HydrophobicContact CD1-CZ 4.39Å; L246-F260 HydrophobicContact CD2-CD1 3.88Å; L246-F260 HydrophobicContact CD2-CE1 3.67Å; L246-F260 HydrophobicContact CG-CE1 4.33Å; L246-T262 HydrophobicContact CD2-CG2 4.05Å
247	S	86.1	Confident	85.3	Confident	38 Å²	38	53.2 Å²	53.2	27%	0.266	30%	0.296	S	S	.	.			trans	-75.2	155.6	171.5	-62.8	0	0	0	0	111.4	I250	S247-I250 VanDerWaalsContact O-CG1 3.28Å; S247-I250 WeakPolarHBondContact O-CG1 3.35Å
248	S	83	Confident	85.5	Confident	71 Å²	71	54.8 Å²	54.8	50%	0.497	30%	0.298	S	S	.	.	S	Bend	trans	-69.6	165.3	172.1	49.4	0	0	0	0	111.9	I250 T264	S248-I250 PolarHBondContact O-N 3.5Å; S248-T264 VanDerWaalsContact O-CG2 3.31Å; S248-T264 WeakPolarHBondContact O-CG2 3.2Å
249	N	84.5	Confident	85.7	Confident	109 Å²	109	51.5 Å²	51.5	58%	0.583	28%	0.278	S	S	*	.	S	Bend	trans	56.5	44.6	173.9	-56.9	-15.7	0	0	0	114.3	V251 T264 D265	N249-V251 PolarHBondContact O-N 3.44Å; N249-V251 VanDerWaalsContact O-N 3.16Å; N249-T264 WeakPolarHBondContact O-CA 3.1Å; N249-T264 WeakPolarHBondContact O-CB 3.19Å; N249-D265 WeakPolarHBondContact CB-OD1 3.34Å; N249-D265 WeakPolarHBondContact CB-OD2 3.4Å; N249-D265 PolarHBondContact ND2-OD2 3.4Å; N249-D265 PolarHBondContact O-N 3Å
250	I	86.4	Confident	85.8	Confident	17 Å²	17	49 Å²	49	9%	0.087	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	118.9	176.9	-58.3	171.1	0	0	0	109.8	Y212 L246 S247 S248 V253 I263 T264	Y212-I250 HydrophobicContact CE1-CD1 3.92Å; L246-I250 HydrophobicContact CB-CD1 3.92Å; L246-I250 HydrophobicContact CD1-CD1 3.75Å; L246-I250 HydrophobicContact CG-CD1 4.48Å; S247-I250 VanDerWaalsContact O-CG1 3.28Å; S247-I250 WeakPolarHBondContact O-CG1 3.35Å; S248-I250 PolarHBondContact O-N 3.5Å; I250-V253 HydrophobicContact CG2-CG2 3.48Å; I250-V253 VanDerWaalsContact CG2-CG2 3.48Å; I250-I263 CarbonylContact C-O 3.31Å; I250-T264 HydrophobicContact CG1-CG2 4.17Å
251	V	85.1	Confident	86.2	Confident	23 Å²	23	43.3 Å²	43.3	14%	0.139	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-54.2	173.2	177.7	0	0	0	0	108.7	R210 N249 I263 S288	R210-V251 PolarHBondContact NH1-O 3.19Å; N249-V251 PolarHBondContact O-N 3.44Å; N249-V251 VanDerWaalsContact O-N 3.16Å; V251-I263 WeakPolarHBondContact CA-O 3.46Å; V251-I263 HydrophobicContact CB-CG2 4.32Å; V251-I263 WeakPolarHBondContact CB-O 3.37Å; V251-I263 PolarHBondContact N-O 3.34Å; V251-S288 VanDerWaalsContact CG1-O 3.3Å; V251-S288 WeakPolarHBondContact CG1-O 3.42Å
252	E	87.7	Confident	86.5	Confident	49 Å²	49	39.8 Å²	39.8	23%	0.229	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	156.3	-175.3	-149.8	160.7	-175.4	0	0	113.3	F254 I263 A290	E252-F254 HydrophobicContact CB-CE2 4.12Å; E252-F254 HydrophobicContact CB-CZ 4.03Å; E252-F254 HydrophobicContact CG-CE1 3.95Å; E252-F254 HydrophobicContact CG-CE2 4.03Å; E252-F254 HydrophobicContact CG-CZ 3.49Å; E252-F254 VanDerWaalsContact CG-CZ 3.49Å; E252-I263 PolarHBondContact N-O 3.4Å; E252-I263 VanDerWaalsContact N-O 3.15Å; E252-I263 PolarHBondContact O-N 2.93Å; E252-A290 HydrophobicContact CB-CB 4.43Å; E252-A290 WeakPolarHBondContact OE2-CA 3.28Å; E252-A290 WeakPolarHBondContact OE2-CB 3.39Å; E252-A290 PolarHBondContact OE2-N 3.28Å
253	V	89.2	Confident	86.8	Confident	23 Å²	23	37.3 Å²	37.3	14%	0.139	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	133.1	-173.3	175.3	0	0	0	0	109.7	Y212 I250 F260 F261 T262	Y212-V253 HydrophobicContact CD1-CG2 4.1Å; Y212-V253 HydrophobicContact CD2-CB 4.37Å; Y212-V253 HydrophobicContact CD2-CG1 4.32Å; Y212-V253 HydrophobicContact CD2-CG2 3.99Å; Y212-V253 HydrophobicContact CE1-CG2 4.37Å; Y212-V253 HydrophobicContact CE2-CG2 4.26Å; Y212-V253 HydrophobicContact CG-CB 4.49Å; Y212-V253 HydrophobicContact CG-CG2 3.92Å; I250-V253 HydrophobicContact CG2-CG2 3.48Å; I250-V253 VanDerWaalsContact CG2-CG2 3.48Å; V253-F260 HydrophobicContact CB-CZ 4.37Å; V253-F260 HydrophobicContact CG1-CD2 4.01Å; V253-F260 HydrophobicContact CG1-CE1 4.07Å; V253-F260 HydrophobicContact CG1-CE2 3.09Å; V253-F260 HydrophobicContact CG1-CZ 3.13Å; V253-F260 HydrophobicContact CG2-CZ 4.32Å; V253-F261 WeakPolarHBondContact CA-O 3.39Å; V253-T262 HydrophobicContact CG2-CG2 4.28Å
254	F	89.6	Confident	87.1	Confident	30 Å²	30	34.4 Å²	34.4	13%	0.132	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.5	175.6	-47.5	-79.4	0	0	0	111.2	E252 F261 I263 A290 F292 L299	E252-F254 HydrophobicContact CB-CE2 4.12Å; E252-F254 HydrophobicContact CB-CZ 4.03Å; E252-F254 HydrophobicContact CG-CE1 3.95Å; E252-F254 HydrophobicContact CG-CE2 4.03Å; E252-F254 HydrophobicContact CG-CZ 3.49Å; E252-F254 VanDerWaalsContact CG-CZ 3.49Å; F254-F261 HydrophobicContact CB-CB 4.18Å; F254-F261 HydrophobicContact CD2-CB 4.48Å; F254-F261 PolarHBondContact N-O 2.9Å; F254-F261 PolarHBondContact O-N 2.7Å; F254-I263 HydrophobicContact CE2-CD1 3.93Å; F254-A290 HydrophobicContact CE2-CB 4.17Å; F254-A290 HydrophobicContact CZ-CB 4.15Å; F254-F292 HydrophobicContact CB-CB 3.93Å; F254-F292 HydrophobicContact CB-CG 4.33Å; F254-F292 HydrophobicContact CD1-CB 3.69Å; F254-F292 HydrophobicContact CD2-CB 3.89Å; F254-F292 HydrophobicContact CE1-CB 4.15Å; F254-F292 HydrophobicContact CE2-CB 4.32Å; F254-F292 HydrophobicContact CG-CB 3.54Å; F254-F292 HydrophobicContact CG-CG 4.43Å; F254-F292 HydrophobicContact CZ-CB 4.43Å; F254-L299 HydrophobicContact CD2-CD1 3.99Å; F254-L299 HydrophobicContact CE2-CD1 4.03Å
255	V	87.3	Confident	87.1	Confident	39 Å²	39	36.2 Å²	36.2	24%	0.236	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	128.1	174.3	177.3	0	0	0	0	108.2	A214 F216 I222 F260	A214-V255 HydrophobicContact CB-CG2 3.49Å; A214-V255 VanDerWaalsContact CB-CG2 3.49Å; F216-V255 HydrophobicContact CD2-CG1 3.84Å; I222-V255 HydrophobicContact CD1-CG2 3.83Å; V255-F260 HydrophobicContact CG2-CD2 3.8Å; V255-F260 HydrophobicContact CG2-CE2 4.01Å
256	W	85.6	Confident	87.2	Confident	28 Å²	28	35.9 Å²	35.9	11%	0.106	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	119.6	172	178.5	78.8	0	0	0	110.5	I9 P11 N258 Y259 F261 F292 H297	I9-W256 WeakPolarHBondContact O-CH2 3.39Å; I9-W256 WeakPolarHBondContact O-CZ3 3.46Å; P11-W256 HydrophobicContact CG-CZ3 4.4Å; W256-N258 PolarHBondContact O-N 3.23Å; W256-Y259 HydrophobicContact CE3-CD2 4.32Å; W256-Y259 HydrophobicContact CZ3-CD2 4.47Å; W256-Y259 PolarHBondContact N-O 3.42Å; W256-Y259 WeakPolarHBondContact O-CB 3.31Å; W256-Y259 PolarHBondContact O-N 3.05Å; W256-F261 HydrophobicContact CB-CE2 4.01Å; W256-F261 HydrophobicContact CE3-CE2 4.37Å; W256-F292 HydrophobicContact CB-CE1 3.67Å; W256-F292 HydrophobicContact CB-CZ 4.06Å; W256-F292 AromaticContact CD1-CE1 3.89Å; W256-F292 HydrophobicContact CD2-CZ 4.31Å; W256-F292 AromaticContact CG-CE1 3.77Å; W256-F292 HydrophobicContact CG-CE1 3.77Å; W256-F292 AromaticContact CG-CZ 3.99Å; W256-F292 HydrophobicContact CG-CZ 3.99Å; W256-H297 AromaticContact CE2-CE1 3.73Å; W256-H297 AromaticContact CE2-ND1 3.72Å; W256-H297 AromaticContact CH2-CE1 3.81Å; W256-H297 AromaticContact CH2-ND1 3.86Å; W256-H297 AromaticContact CZ2-CE1 3.14Å; W256-H297 WeakPolarHBondContact CZ2-CE1 3.24Å; W256-H297 AromaticContact CZ2-ND1 3.4Å; W256-H297 WeakPolarHBondContact CZ2-ND1 3.5Å; W256-H297 AromaticContact CZ2-NE2 3.95Å
257	K	84.8	Confident	87.5	Confident	86 Å²	86	38.3 Å²	38.3	37%	0.374	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	-119.3	-169.9	-60	-179.3	177.2	177.7	0	110.6	N8 F216 Y259	N8-K257 PolarHBondContact OD1-NZ 2.94Å; F216-K257 VanDerWaalsContact CE2-O 3.24Å; F216-K257 WeakPolarHBondContact CE2-O 3.4Å; K257-Y259 HydrophobicContact CB-CD2 4.43Å
258	N	86.7	Confident	87.8	Confident	60 Å²	60	36.5 Å²	36.5	32%	0.321	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	11	-180	-63.1	-32.6	0	0	0	113.1	W256 I273 L274	W256-N258 PolarHBondContact O-N 3.23Å; N258-I273 WeakPolarHBondContact O-CB 3.14Å; N258-I273 WeakPolarHBondContact O-CG1 3.33Å; N258-I273 PolarHBondContact O-N 3.39Å; N258-L274 HydrophobicContact CB-CD1 4.1Å; N258-L274 HydrophobicContact CB-CG 4.11Å; N258-L274 WeakPolarHBondContact ND2-CD1 3.45Å
259	Y	88.3	Confident	88.2	Confident	3 Å²	3	33.2 Å²	33.2	1%	0.012	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.2	-170.9	-59.1	-77.3	0	0	0	111.7	E10 P11 E12 W256 K257 I270 H271 N272 I279	E10-Y259 HydrophobicContact CB-CE2 4.22Å; E10-Y259 WeakPolarHBondContact CB-OH 3.38Å; E10-Y259 HydrophobicContact CG-CE2 4.08Å; E10-Y259 PolarHBondContact OE2-OH 3.06Å; P11-Y259 HydrophobicContact CB-CD1 4.05Å; P11-Y259 HydrophobicContact CB-CE1 4.2Å; P11-Y259 HydrophobicContact CB-CG 4.38Å; P11-Y259 VanDerWaalsContact CD-CD2 3.49Å; P11-Y259 HydrophobicContact CG-CD1 3.88Å; P11-Y259 HydrophobicContact CG-CD2 3.9Å; P11-Y259 HydrophobicContact CG-CE1 4.22Å; P11-Y259 HydrophobicContact CG-CE2 4.25Å; P11-Y259 HydrophobicContact CG-CG 3.7Å; E12-Y259 HydrophobicContact CG-CE1 3.85Å; W256-Y259 HydrophobicContact CE3-CD2 4.32Å; W256-Y259 HydrophobicContact CZ3-CD2 4.47Å; W256-Y259 PolarHBondContact N-O 3.42Å; W256-Y259 WeakPolarHBondContact O-CB 3.31Å; W256-Y259 PolarHBondContact O-N 3.05Å; K257-Y259 HydrophobicContact CB-CD2 4.43Å; Y259-I270 HydrophobicContact CD1-CG2 4.45Å; Y259-H271 WeakPolarHBondContact CA-O 3.33Å; Y259-N272 HydrophobicContact CD1-CB 4.35Å; Y259-N272 HydrophobicContact CE1-CB 4.16Å; Y259-I279 HydrophobicContact CD1-CD1 3.68Å; Y259-I279 HydrophobicContact CE1-CD1 3.59Å
260	F	88	Confident	88.5	Confident	1 Å²	1	28 Å²	28	0%	0.004	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	109.8	179.9	-165.9	-116.4	0	0	0	109.6	Y212 I222 L244 L246 V253 V255 T262 H271 I273	Y212-F260 HydrophobicContact CE2-CZ 4.1Å; I222-F260 HydrophobicContact CB-CE2 4.34Å; I222-F260 HydrophobicContact CD1-CD2 3.75Å; I222-F260 HydrophobicContact CD1-CE2 3.8Å; I222-F260 HydrophobicContact CG2-CE2 3.81Å; I222-F260 HydrophobicContact CG2-CZ 3.92Å; L244-F260 HydrophobicContact CD2-CB 4.38Å; L244-F260 HydrophobicContact CD2-CD1 3.68Å; L244-F260 HydrophobicContact CD2-CE1 4.35Å; L244-F260 HydrophobicContact CD2-CG 4.33Å; L246-F260 HydrophobicContact CD1-CE1 3.7Å; L246-F260 HydrophobicContact CD1-CZ 4.39Å; L246-F260 HydrophobicContact CD2-CD1 3.88Å; L246-F260 HydrophobicContact CD2-CE1 3.67Å; L246-F260 HydrophobicContact CG-CE1 4.33Å; V253-F260 HydrophobicContact CB-CZ 4.37Å; V253-F260 HydrophobicContact CG1-CD2 4.01Å; V253-F260 HydrophobicContact CG1-CE1 4.07Å; V253-F260 HydrophobicContact CG1-CE2 3.09Å; V253-F260 HydrophobicContact CG1-CZ 3.13Å; V253-F260 HydrophobicContact CG2-CZ 4.32Å; V255-F260 HydrophobicContact CG2-CD2 3.8Å; V255-F260 HydrophobicContact CG2-CE2 4.01Å; F260-T262 HydrophobicContact CD1-CG2 3.47Å; F260-T262 VanDerWaalsContact CD1-CG2 3.47Å; F260-T262 HydrophobicContact CE1-CG2 3.23Å; F260-T262 HydrophobicContact CG-CG2 4.43Å; F260-T262 HydrophobicContact CZ-CG2 4.07Å; F260-H271 HydrophobicContact CB-CB 4.27Å; F260-H271 PolarHBondContact N-O 3.16Å; F260-H271 PolarHBondContact O-N 3.16Å; F260-I273 HydrophobicContact CB-CD1 4.02Å; F260-I273 HydrophobicContact CB-CG1 3.87Å
261	F	90.3	Very high	88.6	Confident	1 Å²	1	27.3 Å²	27.3	0%	0.004	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.5	179.3	-62.9	-85	0	0	0	108.7	P11 Y16 V253 F254 W256 F268 T269 I270 F292	P11-F261 HydrophobicContact CG-CE1 4.4Å; P11-F261 HydrophobicContact CG-CZ 3.79Å; Y16-F261 HydrophobicContact CE1-CE1 4.12Å; V253-F261 WeakPolarHBondContact CA-O 3.39Å; F254-F261 HydrophobicContact CB-CB 4.18Å; F254-F261 HydrophobicContact CD2-CB 4.48Å; F254-F261 PolarHBondContact N-O 2.9Å; F254-F261 PolarHBondContact O-N 2.7Å; W256-F261 HydrophobicContact CB-CE2 4.01Å; W256-F261 HydrophobicContact CE3-CE2 4.37Å; F261-F268 HydrophobicContact CB-CE2 4.13Å; F261-F268 AromaticContact CD1-CE2 3.69Å; F261-F268 HydrophobicContact CD1-CE2 3.69Å; F261-F268 AromaticContact CD1-CZ 3.5Å; F261-F268 HydrophobicContact CD1-CZ 3.5Å; F261-F268 HydrophobicContact CE1-CZ 4.04Å; F261-F268 HydrophobicContact CG-CE2 4.39Å; F261-T269 WeakPolarHBondContact CA-O 3.45Å; F261-I270 HydrophobicContact CD1-CB 4.36Å; F261-I270 HydrophobicContact CD1-CD1 4.24Å; F261-I270 HydrophobicContact CD1-CG1 3.75Å; F261-I270 HydrophobicContact CD1-CG2 4.05Å; F261-I270 HydrophobicContact CE1-CB 4.33Å; F261-I270 HydrophobicContact CE1-CD1 3.75Å; F261-I270 HydrophobicContact CE1-CG1 3.74Å; F261-I270 HydrophobicContact CE1-CG2 3.73Å; F261-I270 HydrophobicContact CZ-CG2 4.21Å; F261-F292 HydrophobicContact CE2-CZ 4.46Å
262	T	89.7	Confident	88.8	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	140.2	174.6	73.4	0	0	0	0	110.8	L246 V253 F260 F268 T269	L246-T262 HydrophobicContact CD2-CG2 4.05Å; V253-T262 HydrophobicContact CG2-CG2 4.28Å; F260-T262 HydrophobicContact CD1-CG2 3.47Å; F260-T262 VanDerWaalsContact CD1-CG2 3.47Å; F260-T262 HydrophobicContact CE1-CG2 3.23Å; F260-T262 HydrophobicContact CG-CG2 4.43Å; F260-T262 HydrophobicContact CZ-CG2 4.07Å; T262-F268 WeakPolarHBondContact O-CA 3.44Å; T262-T269 PolarHBondContact N-O 3.1Å; T262-T269 PolarHBondContact O-N 2.97Å; T262-T269 PolarHBondContact OG1-OG1 2.91Å
263	I	90.9	Very high	88.6	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124	173.8	-62.6	167.6	0	0	0	106.6	I250 V251 E252 F254 F267 F268 L284 P287 A290 L299	I250-I263 CarbonylContact C-O 3.31Å; V251-I263 WeakPolarHBondContact CA-O 3.46Å; V251-I263 HydrophobicContact CB-CG2 4.32Å; V251-I263 WeakPolarHBondContact CB-O 3.37Å; V251-I263 PolarHBondContact N-O 3.34Å; E252-I263 PolarHBondContact N-O 3.4Å; E252-I263 VanDerWaalsContact N-O 3.15Å; E252-I263 PolarHBondContact O-N 2.93Å; F254-I263 HydrophobicContact CE2-CD1 3.93Å; I263-F267 WeakPolarHBondContact CA-O 3.46Å; I263-F268 HydrophobicContact CG1-CD2 3.83Å; I263-L284 HydrophobicContact CG2-CD1 4.32Å; I263-P287 HydrophobicContact CG2-CB 3.96Å; I263-P287 HydrophobicContact CG2-CG 3.61Å; I263-A290 HydrophobicContact CD1-CB 3.16Å; I263-L299 HydrophobicContact CD1-CD1 3.67Å; I263-L299 HydrophobicContact CD1-CD2 3.46Å; I263-L299 VanDerWaalsContact CD1-CD2 3.46Å; I263-L299 HydrophobicContact CD1-CG 4.04Å; I263-L299 HydrophobicContact CG1-CD1 4.23Å; I263-L299 HydrophobicContact CG1-CD2 4.4Å
264	T	89.3	Confident	88.3	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.006	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	176.3	167.2	75.1	0	0	0	0	109.7	S248 N249 I250 E266 F267 P287	S248-T264 VanDerWaalsContact O-CG2 3.31Å; S248-T264 WeakPolarHBondContact O-CG2 3.2Å; N249-T264 WeakPolarHBondContact O-CA 3.1Å; N249-T264 WeakPolarHBondContact O-CB 3.19Å; I250-T264 HydrophobicContact CG1-CG2 4.17Å; T264-E266 PolarHBondContact O-N 3.07Å; T264-E266 VanDerWaalsContact O-N 3.08Å; T264-E266 PolarHBondContact OG1-N 3.46Å; T264-F267 PolarHBondContact N-O 3.28Å; T264-F267 PolarHBondContact OG1-N 3.18Å; T264-F267 PolarHBondContact OG1-O 2.9Å; T264-P287 WeakPolarHBondContact O-CG 3.16Å
265	D	86.3	Confident	88.1	Confident	54 Å²	54	29.8 Å²	29.8	29%	0.289	15%	0.15	S	C	.	.	S	Bend	trans	-59.1	-7.8	170	56.4	-9.2	0	0	0	115.1	N249 K286 P287	N249-D265 WeakPolarHBondContact CB-OD1 3.34Å; N249-D265 WeakPolarHBondContact CB-OD2 3.4Å; N249-D265 PolarHBondContact ND2-OD2 3.4Å; N249-D265 PolarHBondContact O-N 3Å; D265-K286 VanDerWaalsContact O-CA 3.23Å; D265-K286 WeakPolarHBondContact O-CA 2.95Å; D265-K286 PolarHBondContact O-N 2.82Å; D265-P287 WeakPolarHBondContact O-CD 3.47Å
266	E	88.5	Confident	87.8	Confident	111 Å²	111	31.9 Å²	31.9	52%	0.519	16%	0.157	S	C	.	.	S	Bend	trans	-135	-26.1	-178.9	-65.7	-172.2	164	0	0	114.1	T264 L284	T264-E266 PolarHBondContact O-N 3.07Å; T264-E266 VanDerWaalsContact O-N 3.08Å; T264-E266 PolarHBondContact OG1-N 3.46Å; E266-L284 PolarHBondContact O-N 2.73Å
267	F	91	Very high	87.9	Confident	61 Å²	61	32.9 Å²	32.9	27%	0.268	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	143.5	-169.6	-54	-72.9	0	0	0	112.3	I263 T264 T269 T281 I282 N283	I263-F267 WeakPolarHBondContact CA-O 3.46Å; T264-F267 PolarHBondContact N-O 3.28Å; T264-F267 PolarHBondContact OG1-N 3.18Å; T264-F267 PolarHBondContact OG1-O 2.9Å; F267-T269 HydrophobicContact CB-CG2 4.36Å; F267-T281 HydrophobicContact CB-CG2 4.12Å; F267-T281 HydrophobicContact CD1-CG2 3.85Å; F267-T281 HydrophobicContact CG-CG2 4.22Å; F267-I282 CarbonylContact C-O 3.53Å; F267-I282 WeakPolarHBondContact CA-O 3.48Å; F267-N283 HydrophobicContact CD1-CB 4.39Å; F267-N283 WeakPolarHBondContact CD1-OD1 3.46Å; F267-N283 HydrophobicContact CE1-CB 4.42Å; F267-N283 WeakPolarHBondContact CE1-OD1 3.18Å
268	F	92.1	Very high	88	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	131.1	157.8	164.7	-99.4	0	0	0	109.4	Y16 F261 T262 I263 I270 T281 I282 L284 L299 L320	Y16-F268 HydrophobicContact CD1-CE1 4.38Å; Y16-F268 HydrophobicContact CD1-CZ 4.34Å; F261-F268 HydrophobicContact CB-CE2 4.13Å; F261-F268 AromaticContact CD1-CE2 3.69Å; F261-F268 HydrophobicContact CD1-CE2 3.69Å; F261-F268 AromaticContact CD1-CZ 3.5Å; F261-F268 HydrophobicContact CD1-CZ 3.5Å; F261-F268 HydrophobicContact CE1-CZ 4.04Å; F261-F268 HydrophobicContact CG-CE2 4.39Å; T262-F268 WeakPolarHBondContact O-CA 3.44Å; I263-F268 HydrophobicContact CG1-CD2 3.83Å; F268-I270 HydrophobicContact CD1-CG1 4.45Å; F268-I270 HydrophobicContact CE1-CD1 3.73Å; F268-I270 HydrophobicContact CE1-CG1 3.51Å; F268-I270 HydrophobicContact CE2-CG1 4.47Å; F268-I270 HydrophobicContact CZ-CD1 3.9Å; F268-I270 HydrophobicContact CZ-CG1 3.56Å; F268-T281 CarbonylContact O-C 3.29Å; F268-T281 WeakPolarHBondContact O-CA 3.46Å; F268-I282 HydrophobicContact CB-CB 4.45Å; F268-I282 HydrophobicContact CD1-CB 4.19Å; F268-I282 HydrophobicContact CD1-CD1 3.9Å; F268-I282 HydrophobicContact CD1-CG1 4.19Å; F268-I282 HydrophobicContact CE1-CD1 4.19Å; F268-I282 PolarHBondContact N-O 3.4Å; F268-I282 PolarHBondContact O-N 3.44Å; F268-L284 HydrophobicContact CB-CD1 3.68Å; F268-L284 HydrophobicContact CB-CG 4.11Å; F268-L299 HydrophobicContact CD2-CD1 4.02Å; F268-L299 HydrophobicContact CE2-CD1 3.53Å; F268-L299 HydrophobicContact CZ-CD1 4.43Å; F268-L320 HydrophobicContact CB-CD1 3.96Å; F268-L320 HydrophobicContact CD1-CD1 3.5Å; F268-L320 VanDerWaalsContact CD1-CD1 3.5Å; F268-L320 HydrophobicContact CD1-CD2 3.78Å; F268-L320 HydrophobicContact CD1-CG 4.3Å; F268-L320 HydrophobicContact CD2-CD1 4.43Å; F268-L320 HydrophobicContact CE1-CD1 3.98Å; F268-L320 HydrophobicContact CE1-CD2 3.33Å; F268-L320 HydrophobicContact CE1-CG 4.31Å; F268-L320 HydrophobicContact CG-CD1 3.71Å; F268-L320 HydrophobicContact CZ-CD2 3.73Å
269	T	91.4	Very high	88	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	145.6	179.4	59.1	0	0	0	0	111.9	F261 T262 F267 H271 Q280 T281	F261-T269 WeakPolarHBondContact CA-O 3.45Å; T262-T269 PolarHBondContact N-O 3.1Å; T262-T269 PolarHBondContact O-N 2.97Å; T262-T269 PolarHBondContact OG1-OG1 2.91Å; F267-T269 HydrophobicContact CB-CG2 4.36Å; T269-H271 PolarHBondContact OG1-CE1 3.31Å; T269-Q280 VanDerWaalsContact CA-O 3.31Å; T269-Q280 WeakPolarHBondContact CA-O 3.21Å; T269-T281 HydrophobicContact CG2-CG2 3.92Å
270	I	90.9	Very high	88.1	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.4	175.5	-46.6	177	0	0	0	108.2	P11 Y16 Y259 F261 F268 I279 Q280	P11-I270 HydrophobicContact CB-CD1 4.32Å; P11-I270 HydrophobicContact CB-CG2 3.91Å; P11-I270 HydrophobicContact CG-CG2 4.41Å; Y16-I270 HydrophobicContact CD1-CD1 4.05Å; Y16-I270 HydrophobicContact CD2-CD1 3.64Å; Y16-I270 HydrophobicContact CE1-CD1 4.49Å; Y16-I270 HydrophobicContact CE2-CD1 4.13Å; Y16-I270 HydrophobicContact CG-CD1 3.62Å; Y259-I270 HydrophobicContact CD1-CG2 4.45Å; F261-I270 HydrophobicContact CD1-CB 4.36Å; F261-I270 HydrophobicContact CD1-CD1 4.24Å; F261-I270 HydrophobicContact CD1-CG1 3.75Å; F261-I270 HydrophobicContact CD1-CG2 4.05Å; F261-I270 HydrophobicContact CE1-CB 4.33Å; F261-I270 HydrophobicContact CE1-CD1 3.75Å; F261-I270 HydrophobicContact CE1-CG1 3.74Å; F261-I270 HydrophobicContact CE1-CG2 3.73Å; F261-I270 HydrophobicContact CZ-CG2 4.21Å; F268-I270 HydrophobicContact CD1-CG1 4.45Å; F268-I270 HydrophobicContact CE1-CD1 3.73Å; F268-I270 HydrophobicContact CE1-CG1 3.51Å; F268-I270 HydrophobicContact CE2-CG1 4.47Å; F268-I270 HydrophobicContact CZ-CD1 3.9Å; F268-I270 HydrophobicContact CZ-CG1 3.56Å; I270-I279 HydrophobicContact CB-CB 4.46Å; I270-I279 HydrophobicContact CG2-CD1 3.99Å; I270-I279 PolarHBondContact O-N 3.49Å; I270-Q280 HydrophobicContact CD1-CB 4.47Å; I270-Q280 PolarHBondContact N-O 3.05Å
271	H	88.8	Confident	88.2	Confident	3 Å²	3	37.9 Å²	37.9	1%	0.014	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	141	175.3	-53.2	85.5	0	0	0	110.5	L244 Y259 F260 T269 S277	L244-H271 HydrophobicContact CD1-CB 4.08Å; L244-H271 HydrophobicContact CD2-CB 3.55Å; L244-H271 HydrophobicContact CG-CB 4.38Å; Y259-H271 WeakPolarHBondContact CA-O 3.33Å; F260-H271 HydrophobicContact CB-CB 4.27Å; F260-H271 PolarHBondContact N-O 3.16Å; F260-H271 PolarHBondContact O-N 3.16Å; T269-H271 PolarHBondContact OG1-CE1 3.31Å; H271-S277 WeakPolarHBondContact CA-O 3.41Å
272	N	88.7	Confident	88.2	Confident	7 Å²	7	39 Å²	39	4%	0.037	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	123.2	166	-179.3	-20.7	0	0	0	108.8	E12 Y259 L274 T275 Q276 S277 I279	E12-N272 PolarHBondContact OE1-ND2 3.04Å; Y259-N272 HydrophobicContact CD1-CB 4.35Å; Y259-N272 HydrophobicContact CE1-CB 4.16Å; N272-L274 WeakPolarHBondContact OD1-CA 3.48Å; N272-L274 WeakPolarHBondContact OD1-CB 3.31Å; N272-L274 PolarHBondContact OD1-N 3.09Å; N272-T275 WeakPolarHBondContact CB-OG1 3.38Å; N272-T275 VanDerWaalsContact CG-OG1 3.22Å; N272-T275 PolarHBondContact ND2-OG1 3.45Å; N272-T275 PolarHBondContact OD1-N 3.44Å; N272-Q276 WeakPolarHBondContact O-CA 3.44Å; N272-Q276 PolarHBondContact O-N 3.24Å; N272-S277 PolarHBondContact N-O 3.11Å; N272-S277 PolarHBondContact O-N 3.01Å; N272-I279 HydrophobicContact CB-CD1 4.07Å; N272-I279 HydrophobicContact CB-CG1 4.35Å
273	I	83.4	Confident	88.3	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.021	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-33.5	-177.8	-66.2	166.8	0	0	0	112.1	F216 I222 I232 N258 F260	F216-I273 HydrophobicContact CD2-CD1 3.6Å; F216-I273 HydrophobicContact CE1-CG2 3.85Å; F216-I273 HydrophobicContact CE2-CB 4.22Å; F216-I273 HydrophobicContact CE2-CD1 3.35Å; F216-I273 HydrophobicContact CE2-CG1 4.38Å; F216-I273 HydrophobicContact CE2-CG2 4.03Å; F216-I273 HydrophobicContact CG-CD1 4.47Å; F216-I273 HydrophobicContact CZ-CB 4.1Å; F216-I273 HydrophobicContact CZ-CD1 4.08Å; F216-I273 HydrophobicContact CZ-CG2 3.58Å; I222-I273 HydrophobicContact CD1-CD1 3.86Å; I232-I273 HydrophobicContact CD1-CG2 3.38Å; N258-I273 WeakPolarHBondContact O-CB 3.14Å; N258-I273 WeakPolarHBondContact O-CG1 3.33Å; N258-I273 PolarHBondContact O-N 3.39Å; F260-I273 HydrophobicContact CB-CD1 4.02Å; F260-I273 HydrophobicContact CB-CG1 3.87Å
274	L	83.6	Confident	88.1	Confident	85 Å²	85	45.6 Å²	45.6	45%	0.445	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-46.3	-178	-62.5	-179.3	0	0	0	112.1	N258 N272	N258-L274 HydrophobicContact CB-CD1 4.1Å; N258-L274 HydrophobicContact CB-CG 4.11Å; N258-L274 WeakPolarHBondContact ND2-CD1 3.45Å; N272-L274 WeakPolarHBondContact OD1-CA 3.48Å; N272-L274 WeakPolarHBondContact OD1-CB 3.31Å; N272-L274 PolarHBondContact OD1-N 3.09Å
275	T	83.6	Confident	87.8	Confident	81 Å²	81	52.3 Å²	52.3	50%	0.497	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-11.8	179.9	59.3	0	0	0	0	112.8	N272 S277	N272-T275 WeakPolarHBondContact CB-OG1 3.38Å; N272-T275 VanDerWaalsContact CG-OG1 3.22Å; N272-T275 PolarHBondContact ND2-OG1 3.45Å; N272-T275 PolarHBondContact OD1-N 3.44Å; T275-S277 PolarHBondContact O-N 3.36Å; T275-S277 PolarHBondContact OG1-OG 2.76Å
276	Q	82.4	Confident	87.5	Confident	82 Å²	82	54.3 Å²	54.3	38%	0.383	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	25.7	-176	-52.4	-172.6	-41.5	0	0	113.5	A242 N272	A242-Q276 VanDerWaalsContact N-NE2 3.11Å; A242-Q276 PolarHBondContact O-NE2 3.2Å; N272-Q276 WeakPolarHBondContact O-CA 3.44Å; N272-Q276 PolarHBondContact O-N 3.24Å
277	S	86.3	Confident	87.3	Confident	50 Å²	50	49.2 Å²	49.2	35%	0.35	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	141.1	-179.1	61.3	0	0	0	0	111.5	H271 N272 T275	H271-S277 WeakPolarHBondContact CA-O 3.41Å; N272-S277 PolarHBondContact N-O 3.11Å; N272-S277 PolarHBondContact O-N 3.01Å; T275-S277 PolarHBondContact O-N 3.36Å; T275-S277 PolarHBondContact OG1-OG 2.76Å
278	Q	87.7	Confident	86.9	Confident	109 Å²	109	48.2 Å²	48.2	51%	0.509	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	120.7	166.8	-173	178.6	-36.9	0	0	109.4	T281	Q278-T281 PolarHBondContact NE2-OG1 2.97Å
279	I	87	Confident	86.7	Confident	55 Å²	55	49.1 Å²	49.1	28%	0.282	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-48.6	-175.3	-54.4	171.8	0	0	0	110.2	P11 E12 Y259 I270 N272	P11-I279 HydrophobicContact CB-CD1 4.28Å; E12-I279 HydrophobicContact CG-CD1 3.76Å; E12-I279 HydrophobicContact CG-CG1 4.42Å; Y259-I279 HydrophobicContact CD1-CD1 3.68Å; Y259-I279 HydrophobicContact CE1-CD1 3.59Å; I270-I279 HydrophobicContact CB-CB 4.46Å; I270-I279 HydrophobicContact CG2-CD1 3.99Å; I270-I279 PolarHBondContact O-N 3.49Å; N272-I279 HydrophobicContact CB-CD1 4.07Å; N272-I279 HydrophobicContact CB-CG1 4.35Å
280	Q	89.3	Confident	86.6	Confident	34 Å²	34	49.1 Å²	49.1	16%	0.159	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	146.6	-173.1	-169.4	173.7	-0.8	0	0	111.6	Y16 T269 I270 I282	Y16-Q280 PolarHBondContact O-NE2 3.17Å; T269-Q280 VanDerWaalsContact CA-O 3.31Å; T269-Q280 WeakPolarHBondContact CA-O 3.21Å; I270-Q280 HydrophobicContact CD1-CB 4.47Å; I270-Q280 PolarHBondContact N-O 3.05Å; Q280-I282 HydrophobicContact CG-CG1 4.26Å
281	T	91.5	Very high	86.5	Confident	57 Å²	57	49.6 Å²	49.6	35%	0.35	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	138.2	168.3	-57.8	0	0	0	0	109.7	F267 F268 T269 Q278	F267-T281 HydrophobicContact CB-CG2 4.12Å; F267-T281 HydrophobicContact CD1-CG2 3.85Å; F267-T281 HydrophobicContact CG-CG2 4.22Å; F268-T281 CarbonylContact O-C 3.29Å; F268-T281 WeakPolarHBondContact O-CA 3.46Å; T269-T281 HydrophobicContact CG2-CG2 3.92Å; Q278-T281 PolarHBondContact NE2-OG1 2.97Å
282	I	90.6	Very high	86.6	Confident	23 Å²	23	50.6 Å²	50.6	12%	0.118	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	126.7	175.6	-59	176.8	0	0	0	107.2	Y16 F267 F268 Q280 L284 L320	Y16-I282 WeakPolarHBondContact O-CD1 3.23Å; F267-I282 CarbonylContact C-O 3.53Å; F267-I282 WeakPolarHBondContact CA-O 3.48Å; F268-I282 HydrophobicContact CB-CB 4.45Å; F268-I282 HydrophobicContact CD1-CB 4.19Å; F268-I282 HydrophobicContact CD1-CD1 3.9Å; F268-I282 HydrophobicContact CD1-CG1 4.19Å; F268-I282 HydrophobicContact CE1-CD1 4.19Å; F268-I282 PolarHBondContact N-O 3.4Å; F268-I282 PolarHBondContact O-N 3.44Å; Q280-I282 HydrophobicContact CG-CG1 4.26Å; I282-L284 HydrophobicContact CG2-CD2 4.07Å; I282-L320 HydrophobicContact CB-CD1 4.47Å; I282-L320 HydrophobicContact CD1-CD1 3.95Å; I282-L320 HydrophobicContact CD1-CD2 3.98Å; I282-L320 HydrophobicContact CD1-CG 4.12Å; I282-L320 HydrophobicContact CG2-CD1 4.34Å
283	N	90.5	Very high	86.5	Confident	124 Å²	124	50.4 Å²	50.4	66%	0.663	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	130.7	177	-60.2	-0.2	0	0	0	109.3	F267	F267-N283 HydrophobicContact CD1-CB 4.39Å; F267-N283 WeakPolarHBondContact CD1-OD1 3.46Å; F267-N283 HydrophobicContact CE1-CB 4.42Å; F267-N283 WeakPolarHBondContact CE1-OD1 3.18Å
284	L	86.8	Confident	86.1	Confident	15 Å²	15	52.3 Å²	52.3	8%	0.079	28%	0.281	C	S	.	.			trans	-119.9	157.4	-179.5	-59.1	-172.1	0	0	0	110	I263 E266 F268 I282 P287 F301 L320	I263-L284 HydrophobicContact CG2-CD1 4.32Å; E266-L284 PolarHBondContact O-N 2.73Å; F268-L284 HydrophobicContact CB-CD1 3.68Å; F268-L284 HydrophobicContact CB-CG 4.11Å; I282-L284 HydrophobicContact CG2-CD2 4.07Å; L284-P287 HydrophobicContact CB-CG 4.21Å; L284-P287 HydrophobicContact CD1-CB 4.41Å; L284-P287 HydrophobicContact CD1-CG 4.08Å; L284-F301 HydrophobicContact CB-CE2 4.44Å; L284-F301 HydrophobicContact CD1-CD2 4.33Å; L284-F301 HydrophobicContact CD1-CE1 4.22Å; L284-F301 HydrophobicContact CD1-CE2 4.01Å; L284-F301 HydrophobicContact CD1-CZ 3.94Å; L284-F301 HydrophobicContact CD2-CE1 4.08Å; L284-F301 HydrophobicContact CD2-CE2 4.05Å; L284-F301 HydrophobicContact CD2-CZ 3.46Å; L284-F301 VanDerWaalsContact CD2-CZ 3.46Å; L284-F301 HydrophobicContact CG-CE2 4.4Å; L284-F301 HydrophobicContact CG-CZ 4.22Å; L284-L320 HydrophobicContact CD2-CD1 4.23Å
285	Q	82.8	Confident	85.6	Confident	142 Å²	142	53.2 Å²	53.2	66%	0.664	29%	0.286	S	S	*	.	S	Bend	trans	-100.8	96.1	176.6	-59.1	-172.1	-15.2	0	0	110.4	E303	Q285-E303 WeakPolarHBondContact CB-OE1 3.45Å; Q285-E303 PolarHBondContact N-OE1 3.42Å; Q285-E303 WeakPolarHBondContact O-CB 3.21Å; Q285-E303 VanDerWaalsContact O-CG 3.27Å; Q285-E303 WeakPolarHBondContact O-CG 3.44Å
286	K	80.6	Confident	85.2	Confident	96 Å²	96	51.1 Å²	51.1	42%	0.417	28%	0.277	S	S	.	.			trans	45	60.2	173.1	-62.6	174	178	158.6	0	113.9	D265 S288 T304 D306	D265-K286 VanDerWaalsContact O-CA 3.23Å; D265-K286 WeakPolarHBondContact O-CA 2.95Å; D265-K286 PolarHBondContact O-N 2.82Å; K286-S288 PolarHBondContact O-N 3.12Å; K286-T304 WeakPolarHBondContact CB-OG1 3.29Å; K286-T304 PolarHBondContact O-N 3.43Å; K286-T304 VanDerWaalsContact O-N 3.17Å; K286-T304 PolarHBondContact O-OG1 2.76Å; K286-T304 VanDerWaalsContact O-OG1 3.06Å; K286-D306 IonicContact NZ-OD1 3.63Å; K286-D306 PolarHBondContact NZ-OD1 3.38Å; K286-D306 IonicContact NZ-OD2 2.78Å; K286-D306 PolarHBondContact NZ-OD2 3.49Å
287	P	84.5	Confident	85.2	Confident	5 Å²	5	49 Å²	49	3%	0.032	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	133	174.5	31	-37	0	0	0	110.2	I263 T264 D265 L284 F301 T302	I263-P287 HydrophobicContact CG2-CB 3.96Å; I263-P287 HydrophobicContact CG2-CG 3.61Å; T264-P287 WeakPolarHBondContact O-CG 3.16Å; D265-P287 WeakPolarHBondContact O-CD 3.47Å; L284-P287 HydrophobicContact CB-CG 4.21Å; L284-P287 HydrophobicContact CD1-CB 4.41Å; L284-P287 HydrophobicContact CD1-CG 4.08Å; P287-F301 HydrophobicContact CB-CB 4.43Å; P287-F301 HydrophobicContact CB-CD2 3.75Å; P287-F301 HydrophobicContact CB-CE2 4.44Å; P287-F301 HydrophobicContact CB-CG 4.39Å; P287-T302 CarbonylContact C-O 3.45Å; P287-T302 VanDerWaalsContact CA-O 3.27Å; P287-T302 WeakPolarHBondContact CA-O 3.39Å
288	S	83.2	Confident	85.3	Confident	40 Å²	40	46.9 Å²	46.9	28%	0.28	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-39.5	-178.9	55.4	0	0	0	0	113.4	V251 K286 T302	V251-S288 VanDerWaalsContact CG1-O 3.3Å; V251-S288 WeakPolarHBondContact CG1-O 3.42Å; K286-S288 PolarHBondContact O-N 3.12Å; S288-T302 PolarHBondContact N-O 2.96Å; S288-T302 PolarHBondContact OG-O 3.37Å; S288-T302 PolarHBondContact OG-OG1 3.16Å
289	V	86.2	Confident	85.4	Confident	19 Å²	19	41.8 Å²	41.8	12%	0.115	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	141.3	-175.6	-177.4	0	0	0	0	108.3	M38 F301 T302	M38-V289 HydrophobicContact CB-CG1 4.02Å; M38-V289 HydrophobicContact CG-CG1 3.75Å; M38-V289 HydrophobicContact SD-CB 4.49Å; M38-V289 HydrophobicContact SD-CG1 4.13Å; V289-F301 CarbonylContact O-C 3.58Å; V289-F301 WeakPolarHBondContact O-CA 3.32Å; V289-F301 WeakPolarHBondContact O-CB 3.38Å; V289-T302 PolarHBondContact O-N 3.39Å
290	A	89.8	Confident	85.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	170.7	176.1	0	0	0	0	0	113.2	E252 F254 I263 L299 Y300 F301	E252-A290 HydrophobicContact CB-CB 4.43Å; E252-A290 WeakPolarHBondContact OE2-CA 3.28Å; E252-A290 WeakPolarHBondContact OE2-CB 3.39Å; E252-A290 PolarHBondContact OE2-N 3.28Å; F254-A290 HydrophobicContact CE2-CB 4.17Å; F254-A290 HydrophobicContact CZ-CB 4.15Å; I263-A290 HydrophobicContact CD1-CB 3.16Å; A290-L299 HydrophobicContact CB-CD2 4.5Å; A290-Y300 CarbonylContact C-O 3.6Å; A290-Y300 WeakPolarHBondContact CA-O 3.47Å; A290-Y300 WeakPolarHBondContact CB-O 3.48Å; A290-F301 HydrophobicContact CB-CB 3.9Å
291	C	90.1	Very high	85.6	Confident	10 Å²	10	37.7 Å²	37.7	7%	0.068	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	139.6	171.1	176.7	0	0	0	0	109.5	M38 C39 S40 L299 Y300	M38-C291 HydrophobicContact CB-CB 3.91Å; C39-C291 VanDerWaalsContact C-SG 3.56Å; C39-C291 WeakPolarHBondContact CA-SG 3.47Å; S40-C291 PolarHBondContact N-SG 3.28Å; S40-C291 PolarHBondContact OG-SG 3.12Å; C291-L299 CarbonylContact O-C 3.49Å; C291-L299 WeakPolarHBondContact O-CA 3.49Å; C291-Y300 PolarHBondContact N-O 3.23Å; C291-Y300 PolarHBondContact O-N 3.18Å
292	F	89.6	Confident	85.3	Confident	24 Å²	24	35.2 Å²	35.2	11%	0.105	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	129.1	171.9	179.3	-106.4	0	0	0	111.4	S40 F254 W256 F261 A294 L299	S40-F292 PolarHBondContact OG-O 3.33Å; F254-F292 HydrophobicContact CB-CB 3.93Å; F254-F292 HydrophobicContact CB-CG 4.33Å; F254-F292 HydrophobicContact CD1-CB 3.69Å; F254-F292 HydrophobicContact CD2-CB 3.89Å; F254-F292 HydrophobicContact CE1-CB 4.15Å; F254-F292 HydrophobicContact CE2-CB 4.32Å; F254-F292 HydrophobicContact CG-CB 3.54Å; F254-F292 HydrophobicContact CG-CG 4.43Å; F254-F292 HydrophobicContact CZ-CB 4.43Å; W256-F292 HydrophobicContact CB-CE1 3.67Å; W256-F292 HydrophobicContact CB-CZ 4.06Å; W256-F292 AromaticContact CD1-CE1 3.89Å; W256-F292 HydrophobicContact CD2-CZ 4.31Å; W256-F292 AromaticContact CG-CE1 3.77Å; W256-F292 HydrophobicContact CG-CE1 3.77Å; W256-F292 AromaticContact CG-CZ 3.99Å; W256-F292 HydrophobicContact CG-CZ 3.99Å; F261-F292 HydrophobicContact CE2-CZ 4.46Å; F292-A294 HydrophobicContact CE1-CB 4.12Å; F292-L299 HydrophobicContact CD2-CB 4.32Å
293	S	87.2	Confident	84.6	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.021	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	110.5	169.2	175.6	0	0	0	0	109.9	S40 D295 A296 H297 L298	S40-S293 VanDerWaalsContact OG-CA 3.26Å; S40-S293 WeakPolarHBondContact OG-CA 3.44Å; S40-S293 WeakPolarHBondContact OG-CB 3.19Å; S293-D295 VanDerWaalsContact C-N 3.27Å; S293-D295 PolarHBondContact O-N 3.19Å; S293-A296 WeakPolarHBondContact OG-CB 3.35Å; S293-A296 PolarHBondContact OG-N 3.06Å; S293-H297 VanDerWaalsContact O-CA 3.28Å; S293-H297 WeakPolarHBondContact O-CA 3.24Å; S293-H297 PolarHBondContact O-N 3.31Å; S293-L298 PolarHBondContact N-O 3.46Å; S293-L298 PolarHBondContact O-N 3.4Å
294	A	74	Confident	83.6	Confident	45 Å²	45	32.3 Å²	32.3	37%	0.372	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-29.4	178.1	0	0	0	0	0	113	F292 H297	F292-A294 HydrophobicContact CE1-CB 4.12Å; A294-H297 PolarHBondContact O-CE1 3.14Å; A294-H297 PolarHBondContact O-ND1 3.06Å
295	D	74.3	Confident	82.2	Confident	103 Å²	103	34.5 Å²	34.5	55%	0.551	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-42.2	-179.1	-63.1	-21	0	0	0	111.8	S293	S293-D295 VanDerWaalsContact C-N 3.27Å; S293-D295 PolarHBondContact O-N 3.19Å
296	A	75.4	Confident	80.7	Confident	37 Å²	37	33.4 Å²	33.4	31%	0.306	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-14.8	179.9	0	0	0	0	0	113.1	S293 L298	S293-A296 WeakPolarHBondContact OG-CB 3.35Å; S293-A296 PolarHBondContact OG-N 3.06Å; A296-L298 HydrophobicContact CB-CB 4.18Å; A296-L298 HydrophobicContact CB-CD1 4.04Å; A296-L298 HydrophobicContact CB-CG 3.96Å; A296-L298 PolarHBondContact O-N 3.49Å
297	H	82	Confident	79.1	Confident	39 Å²	39	36.4 Å²	36.4	18%	0.181	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	33.1	-169	-50.8	-46.4	0	0	0	112.9	W256 S293 A294 P322	W256-H297 AromaticContact CE2-CE1 3.73Å; W256-H297 AromaticContact CE2-ND1 3.72Å; W256-H297 AromaticContact CH2-CE1 3.81Å; W256-H297 AromaticContact CH2-ND1 3.86Å; W256-H297 AromaticContact CZ2-CE1 3.14Å; W256-H297 WeakPolarHBondContact CZ2-CE1 3.24Å; W256-H297 AromaticContact CZ2-ND1 3.4Å; W256-H297 WeakPolarHBondContact CZ2-ND1 3.5Å; W256-H297 AromaticContact CZ2-NE2 3.95Å; S293-H297 VanDerWaalsContact O-CA 3.28Å; S293-H297 WeakPolarHBondContact O-CA 3.24Å; S293-H297 PolarHBondContact O-N 3.31Å; A294-H297 PolarHBondContact O-CE1 3.14Å; A294-H297 PolarHBondContact O-ND1 3.06Å; H297-P322 VanDerWaalsContact O-CD 3.28Å; H297-P322 WeakPolarHBondContact O-CD 3.42Å
298	L	88.9	Confident	77.2	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.026	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	139.9	-179.4	-65	178.9	0	0	0	109.8	F19 F69 S293 A296 Y300 V319	F19-L298 HydrophobicContact CE2-CD2 4.38Å; F69-L298 HydrophobicContact CD1-CD1 4.37Å; F69-L298 HydrophobicContact CE1-CD1 3.54Å; F69-L298 HydrophobicContact CZ-CD1 3.7Å; F69-L298 HydrophobicContact CZ-CD2 4.14Å; S293-L298 PolarHBondContact N-O 3.46Å; S293-L298 PolarHBondContact O-N 3.4Å; A296-L298 HydrophobicContact CB-CB 4.18Å; A296-L298 HydrophobicContact CB-CD1 4.04Å; A296-L298 HydrophobicContact CB-CG 3.96Å; A296-L298 PolarHBondContact O-N 3.49Å; L298-Y300 HydrophobicContact CB-CE1 4.16Å; L298-Y300 HydrophobicContact CB-CE2 4.19Å; L298-Y300 WeakPolarHBondContact CB-OH 3.18Å; L298-Y300 HydrophobicContact CD1-CE1 4.42Å; L298-Y300 WeakPolarHBondContact CD1-OH 3.4Å; L298-V319 HydrophobicContact CB-CG1 4.19Å; L298-V319 HydrophobicContact CD1-CG1 4.12Å; L298-V319 HydrophobicContact CD2-CG1 4.03Å; L298-V319 HydrophobicContact CG-CG1 4.33Å
299	L	90.1	Very high	75.3	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.1	171.9	-168.1	145.1	0	0	0	108.6	F254 I263 F268 A290 C291 F292 F301 V319 L320	F254-L299 HydrophobicContact CD2-CD1 3.99Å; F254-L299 HydrophobicContact CE2-CD1 4.03Å; I263-L299 HydrophobicContact CD1-CD1 3.67Å; I263-L299 HydrophobicContact CD1-CD2 3.46Å; I263-L299 VanDerWaalsContact CD1-CD2 3.46Å; I263-L299 HydrophobicContact CD1-CG 4.04Å; I263-L299 HydrophobicContact CG1-CD1 4.23Å; I263-L299 HydrophobicContact CG1-CD2 4.4Å; F268-L299 HydrophobicContact CD2-CD1 4.02Å; F268-L299 HydrophobicContact CE2-CD1 3.53Å; F268-L299 HydrophobicContact CZ-CD1 4.43Å; A290-L299 HydrophobicContact CB-CD2 4.5Å; C291-L299 CarbonylContact O-C 3.49Å; C291-L299 WeakPolarHBondContact O-CA 3.49Å; F292-L299 HydrophobicContact CD2-CB 4.32Å; L299-F301 HydrophobicContact CD2-CB 4.27Å; L299-F301 HydrophobicContact CD2-CD1 3.73Å; L299-F301 HydrophobicContact CD2-CG 4.44Å; L299-V319 CarbonylContact O-C 3.49Å; L299-V319 WeakPolarHBondContact O-CA 3.44Å; L299-L320 HydrophobicContact CB-CB 4.34Å; L299-L320 PolarHBondContact N-O 3.33Å; L299-L320 PolarHBondContact O-N 2.98Å
300	Y	89.9	Confident	73.1	Confident	3 Å²	3	52.1 Å²	52.1	1%	0.012	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	135.6	176.7	-51.7	-74.2	0	0	0	108.2	L45 I59 F71 A290 C291 L298 Q318 V319	L45-Y300 HydrophobicContact CD1-CD2 3.83Å; L45-Y300 HydrophobicContact CD1-CE2 4.44Å; L45-Y300 HydrophobicContact CD1-CG 4.08Å; L45-Y300 HydrophobicContact CD2-CD1 4.3Å; L45-Y300 HydrophobicContact CD2-CG 4.17Å; I59-Y300 HydrophobicContact CD1-CE1 3.76Å; I59-Y300 HydrophobicContact CD1-CE2 4Å; I59-Y300 VanDerWaalsContact CD1-CZ 3.41Å; I59-Y300 VanDerWaalsContact CD1-OH 3.27Å; I59-Y300 WeakPolarHBondContact CD1-OH 3.4Å; I59-Y300 HydrophobicContact CG1-CE1 4.49Å; I59-Y300 HydrophobicContact CG2-CE1 4.45Å; F71-Y300 HydrophobicContact CE1-CD1 4.33Å; F71-Y300 HydrophobicContact CE1-CE1 4.44Å; A290-Y300 CarbonylContact C-O 3.6Å; A290-Y300 WeakPolarHBondContact CA-O 3.47Å; A290-Y300 WeakPolarHBondContact CB-O 3.48Å; C291-Y300 PolarHBondContact N-O 3.23Å; C291-Y300 PolarHBondContact O-N 3.18Å; L298-Y300 HydrophobicContact CB-CE1 4.16Å; L298-Y300 HydrophobicContact CB-CE2 4.19Å; L298-Y300 WeakPolarHBondContact CB-OH 3.18Å; L298-Y300 HydrophobicContact CD1-CE1 4.42Å; L298-Y300 WeakPolarHBondContact CD1-OH 3.4Å; Y300-Q318 WeakPolarHBondContact CA-O 3.29Å; Y300-V319 HydrophobicContact CD1-CB 4.49Å; Y300-V319 HydrophobicContact CD1-CG1 4.2Å; Y300-V319 HydrophobicContact CD1-CG2 3.89Å; Y300-V319 HydrophobicContact CE1-CG1 3.91Å; Y300-V319 HydrophobicContact CE1-CG2 4Å
301	F	88.8	Confident	70.7	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	158.2	172.5	65.4	-83.7	0	0	0	111.1	L18 L284 P287 V289 A290 L299 E303 I317 Q318 L320	L18-F301 HydrophobicContact CD1-CE1 3.8Å; L18-F301 HydrophobicContact CD1-CZ 3.64Å; L284-F301 HydrophobicContact CB-CE2 4.44Å; L284-F301 HydrophobicContact CD1-CD2 4.33Å; L284-F301 HydrophobicContact CD1-CE1 4.22Å; L284-F301 HydrophobicContact CD1-CE2 4.01Å; L284-F301 HydrophobicContact CD1-CZ 3.94Å; L284-F301 HydrophobicContact CD2-CE1 4.08Å; L284-F301 HydrophobicContact CD2-CE2 4.05Å; L284-F301 HydrophobicContact CD2-CZ 3.46Å; L284-F301 VanDerWaalsContact CD2-CZ 3.46Å; L284-F301 HydrophobicContact CG-CE2 4.4Å; L284-F301 HydrophobicContact CG-CZ 4.22Å; P287-F301 HydrophobicContact CB-CB 4.43Å; P287-F301 HydrophobicContact CB-CD2 3.75Å; P287-F301 HydrophobicContact CB-CE2 4.44Å; P287-F301 HydrophobicContact CB-CG 4.39Å; V289-F301 CarbonylContact O-C 3.58Å; V289-F301 WeakPolarHBondContact O-CA 3.32Å; V289-F301 WeakPolarHBondContact O-CB 3.38Å; A290-F301 HydrophobicContact CB-CB 3.9Å; L299-F301 HydrophobicContact CD2-CB 4.27Å; L299-F301 HydrophobicContact CD2-CD1 3.73Å; L299-F301 HydrophobicContact CD2-CG 4.44Å; F301-E303 HydrophobicContact CD2-CG 4.1Å; F301-E303 HydrophobicContact CE2-CG 3.68Å; F301-I317 WeakPolarHBondContact O-CA 3.38Å; F301-Q318 HydrophobicContact CD1-CB 4.29Å; F301-Q318 HydrophobicContact CD2-CB 4.34Å; F301-Q318 HydrophobicContact CE1-CB 3.73Å; F301-Q318 HydrophobicContact CE2-CB 3.8Å; F301-Q318 HydrophobicContact CE2-CG 4.27Å; F301-Q318 VanDerWaalsContact CE2-OE1 3.27Å; F301-Q318 HydrophobicContact CZ-CB 3.47Å; F301-Q318 VanDerWaalsContact CZ-CB 3.47Å; F301-Q318 HydrophobicContact CZ-CG 4.23Å; F301-Q318 PolarHBondContact N-O 3.32Å; F301-Q318 VanDerWaalsContact N-O 3.08Å; F301-Q318 PolarHBondContact O-N 2.96Å; F301-L320 HydrophobicContact CE1-CB 4.13Å; F301-L320 HydrophobicContact CE1-CD1 4.29Å
302	T	85.5	Confident	68.1	Low	5 Å²	5	57.1 Å²	57.1	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	131.4	176.3	53.2	0	0	0	0	110.9	I35 M38 P287 S288 V289 N316 I317	I35-T302 HydrophobicContact CB-CG2 4.05Å; I35-T302 HydrophobicContact CD1-CG2 3.67Å; I35-T302 HydrophobicContact CG1-CG2 4.44Å; I35-T302 HydrophobicContact CG2-CG2 3.94Å; M38-T302 HydrophobicContact SD-CG2 3.69Å; P287-T302 CarbonylContact C-O 3.45Å; P287-T302 VanDerWaalsContact CA-O 3.27Å; P287-T302 WeakPolarHBondContact CA-O 3.39Å; S288-T302 PolarHBondContact N-O 2.96Å; S288-T302 PolarHBondContact OG-O 3.37Å; S288-T302 PolarHBondContact OG-OG1 3.16Å; V289-T302 PolarHBondContact O-N 3.39Å; T302-N316 WeakPolarHBondContact CA-O 3.42Å; T302-I317 HydrophobicContact CG2-CG1 3.96Å
303	E	77.2	Confident	66	Low	27 Å²	27	57.2 Å²	57.2	13%	0.126	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	147.2	171.7	-64.2	-169.3	153.1	0	0	111.7	Q285 F301 N316 Q318	Q285-E303 WeakPolarHBondContact CB-OE1 3.45Å; Q285-E303 PolarHBondContact N-OE1 3.42Å; Q285-E303 WeakPolarHBondContact O-CB 3.21Å; Q285-E303 VanDerWaalsContact O-CG 3.27Å; Q285-E303 WeakPolarHBondContact O-CG 3.44Å; F301-E303 HydrophobicContact CD2-CG 4.1Å; F301-E303 HydrophobicContact CE2-CG 3.68Å; E303-N316 PolarHBondContact N-O 3.08Å; E303-N316 VanDerWaalsContact N-O 3.1Å; E303-N316 WeakPolarHBondContact O-CB 3.21Å; E303-N316 PolarHBondContact O-ND2 3.4Å; E303-Q318 HydrophobicContact CG-CG 4.42Å; E303-Q318 VanDerWaalsContact OE1-CD 3.32Å; E303-Q318 PolarHBondContact OE1-NE2 2.96Å; E303-Q318 PolarHBondContact OE1-OE1 3.03Å; E303-Q318 PolarHBondContact OE2-NE2 3.23Å
304	T	68.8	Low	64.3	Low	60 Å²	60	58 Å²	58	37%	0.368	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-90.3	117.4	169.7	50.6	0	0	0	0	108.9	K286	K286-T304 WeakPolarHBondContact CB-OG1 3.29Å; K286-T304 PolarHBondContact O-N 3.43Å; K286-T304 VanDerWaalsContact O-N 3.17Å; K286-T304 PolarHBondContact O-OG1 2.76Å; K286-T304 VanDerWaalsContact O-OG1 3.06Å
305	S	58.3	Low	63.3	Low	61 Å²	61	64.5 Å²	64.5	43%	0.427	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-77.1	126.5	178.4	54.2	0	0	0	0	110.3	F307	S305-F307 PolarHBondContact O-N 2.68Å
306	D	50.8	Low	63.1	Low	118 Å²	118	61.5 Å²	61.5	63%	0.631	33%	0.331	S	S	*	.			trans	-70.4	-13.1	175.2	-78.9	-28.2	0	0	0	113.4	K286	K286-D306 IonicContact NZ-OD1 3.63Å; K286-D306 PolarHBondContact NZ-OD1 3.38Å; K286-D306 IonicContact NZ-OD2 2.78Å; K286-D306 PolarHBondContact NZ-OD2 3.49Å
307	F	46.5	Very low	63.4	Low	160 Å²	160	59.8 Å²	59.8	70%	0.702	32%	0.317	S	S	*	.			trans	-85.8	120.5	-176.5	-63.3	-73	0	0	0	111.1	S305 T309	S305-F307 PolarHBondContact O-N 2.68Å; F307-T309 HydrophobicContact CB-CG2 4.21Å; F307-T309 PolarHBondContact O-N 3.25Å
308	N	45.1	Very low	63.6	Low	167 Å²	167	59.7 Å²	59.7	89%	0.893	32%	0.317	S	S	*	.			trans	-56.4	19.7	161.1	-85.7	-16.8	0	0	0	114	D310	N308-D310 PolarHBondContact O-N 3.05Å
309	T	41.9	Very low	63.6	Low	90 Å²	90	59.6 Å²	59.6	55%	0.552	32%	0.316	S	S	*	.			trans	-78.1	116.7	169.6	52.5	0	0	0	0	107.5	F307 T311	F307-T309 HydrophobicContact CB-CG2 4.21Å; F307-T309 PolarHBondContact O-N 3.25Å; T309-T311 PolarHBondContact O-N 2.95Å
310	D	40.1	Very low	63.6	Low	137 Å²	137	59.5 Å²	59.5	73%	0.733	32%	0.316	S	S	*	.	S	Bend	trans	-55.8	30.4	-175.4	-64.7	-45.5	0	0	0	116.7	N308	N308-D310 PolarHBondContact O-N 3.05Å
311	T	40.1	Very low	63.6	Low	76 Å²	76	59.4 Å²	59.4	47%	0.466	32%	0.315	S	S	.	.			trans	-129.8	71	178.8	65.5	0	0	0	0	109.7	T309 S313	T309-T311 PolarHBondContact O-N 2.95Å; T311-S313 PolarHBondContact O-N 2.78Å
312	A	35.9	Very low	63.5	Low	39 Å²	39	59.6 Å²	59.6	32%	0.322	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-68.4	53.8	153.8	0	0	0	0	0	109.3	T31	T31-A312 CarbonylContact C-O 3.51Å; T31-A312 CarbonylContact O-C 3.59Å; T31-A312 VanDerWaalsContact O-CA 3.22Å; T31-A312 WeakPolarHBondContact O-CA 3.34Å; T31-A312 WeakPolarHBondContact O-CB 3.39Å; T31-A312 PolarHBondContact O-N 2.87Å
313	S	45.8	Very low	63.5	Low	25 Å²	25	60.7 Å²	60.7	18%	0.175	32%	0.322	C	S	.	.			trans	-67	151.8	163	69	0	0	0	0	107.5	T311 R315	T311-S313 PolarHBondContact O-N 2.78Å; S313-R315 PolarHBondContact O-N 3.19Å; S313-R315 WeakPolarHBondContact OG-CD 3.47Å; S313-R315 WeakPolarHBondContact OG-CG 3.46Å
314	I	50.2	Low	64	Low	19 Å²	19	61.5 Å²	61.5	10%	0.097	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-62.4	12.2	-179.6	-57.1	-173.7	0	0	0	113.4	T27 M29 I35 N316 I317	T27-I314 HydrophobicContact CG2-CB 3.98Å; T27-I314 HydrophobicContact CG2-CD1 4.03Å; T27-I314 HydrophobicContact CG2-CG1 4.48Å; T27-I314 HydrophobicContact CG2-CG2 4Å; M29-I314 HydrophobicContact CB-CD1 3.77Å; M29-I314 HydrophobicContact CE-CD1 4.39Å; M29-I314 HydrophobicContact CG-CD1 3.77Å; M29-I314 HydrophobicContact SD-CD1 3.28Å; M29-I314 WeakPolarHBondContact SD-CD1 3.43Å; I35-I314 HydrophobicContact CD1-CG2 4.44Å; I314-N316 PolarHBondContact O-N 3.06Å; I314-I317 HydrophobicContact CG2-CD1 3.29Å; I314-I317 HydrophobicContact CG2-CG1 3.73Å; I314-I317 PolarHBondContact O-N 3.38Å
315	R	53.6	Low	64.9	Low	182 Å²	182	59 Å²	59	69%	0.687	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-52.7	-12.3	165.7	-73.6	-176.5	-179.3	174.3	2.2	113.8	S313	S313-R315 PolarHBondContact O-N 3.19Å; S313-R315 WeakPolarHBondContact OG-CD 3.47Å; S313-R315 WeakPolarHBondContact OG-CG 3.46Å
316	N	70	Confident	66.4	Low	41 Å²	41	56.1 Å²	56.1	22%	0.219	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-84.6	-7.6	-179.2	-65.5	10.4	0	0	0	114.8	T302 E303 I314 Q318	T302-N316 WeakPolarHBondContact CA-O 3.42Å; E303-N316 PolarHBondContact N-O 3.08Å; E303-N316 VanDerWaalsContact N-O 3.1Å; E303-N316 WeakPolarHBondContact O-CB 3.21Å; E303-N316 PolarHBondContact O-ND2 3.4Å; I314-N316 PolarHBondContact O-N 3.06Å; N316-Q318 PolarHBondContact O-N 2.84Å
317	I	82.1	Confident	68.2	Low	1 Å²	1	52 Å²	52	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	117.3	173.8	-56.4	171.8	0	0	0	109.3	I35 M38 L45 I47 L57 F71 F301 T302 I314	I35-I317 HydrophobicContact CD1-CD1 4.32Å; I35-I317 HydrophobicContact CD1-CG1 4.15Å; M38-I317 HydrophobicContact CE-CG2 4.38Å; L45-I317 HydrophobicContact CD2-CD1 4.39Å; L45-I317 HydrophobicContact CD2-CG2 4.5Å; I47-I317 HydrophobicContact CD1-CD1 3.24Å; I47-I317 HydrophobicContact CD1-CG1 4.37Å; L57-I317 HydrophobicContact CD1-CD1 4.02Å; F71-I317 HydrophobicContact CE1-CG2 3.99Å; F71-I317 HydrophobicContact CE2-CB 4.16Å; F71-I317 HydrophobicContact CE2-CG2 4.02Å; F71-I317 HydrophobicContact CZ-CB 4.17Å; F71-I317 HydrophobicContact CZ-CG2 3.52Å; F301-I317 WeakPolarHBondContact O-CA 3.38Å; T302-I317 HydrophobicContact CG2-CG1 3.96Å; I314-I317 HydrophobicContact CG2-CD1 3.29Å; I314-I317 HydrophobicContact CG2-CG1 3.73Å; I314-I317 PolarHBondContact O-N 3.38Å
318	Q	85.4	Confident	70.1	Confident	37 Å²	37	46.4 Å²	46.4	17%	0.173	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	151	172.3	-65	-168.3	-5	0	0	111	L18 Y300 F301 E303 N316	L18-Q318 HydrophobicContact CD1-CB 3.98Å; Y300-Q318 WeakPolarHBondContact CA-O 3.29Å; F301-Q318 HydrophobicContact CD1-CB 4.29Å; F301-Q318 HydrophobicContact CD2-CB 4.34Å; F301-Q318 HydrophobicContact CE1-CB 3.73Å; F301-Q318 HydrophobicContact CE2-CB 3.8Å; F301-Q318 HydrophobicContact CE2-CG 4.27Å; F301-Q318 VanDerWaalsContact CE2-OE1 3.27Å; F301-Q318 HydrophobicContact CZ-CB 3.47Å; F301-Q318 VanDerWaalsContact CZ-CB 3.47Å; F301-Q318 HydrophobicContact CZ-CG 4.23Å; F301-Q318 PolarHBondContact N-O 3.32Å; F301-Q318 VanDerWaalsContact N-O 3.08Å; F301-Q318 PolarHBondContact O-N 2.96Å; E303-Q318 HydrophobicContact CG-CG 4.42Å; E303-Q318 VanDerWaalsContact OE1-CD 3.32Å; E303-Q318 PolarHBondContact OE1-NE2 2.96Å; E303-Q318 PolarHBondContact OE1-OE1 3.03Å; E303-Q318 PolarHBondContact OE2-NE2 3.23Å; N316-Q318 PolarHBondContact O-N 2.84Å
319	V	89.6	Confident	72.2	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.012	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130.9	-179.8	-171.7	0	0	0	0	108.8	F19 F69 F71 L298 L299 Y300	F19-V319 HydrophobicContact CB-CB 4.28Å; F19-V319 HydrophobicContact CD2-CG1 4.26Å; F19-V319 PolarHBondContact N-O 3.07Å; F69-V319 HydrophobicContact CB-CG2 3.8Å; F69-V319 HydrophobicContact CD2-CB 3.79Å; F69-V319 HydrophobicContact CD2-CG1 3.78Å; F69-V319 HydrophobicContact CD2-CG2 3.94Å; F69-V319 HydrophobicContact CE2-CB 4.28Å; F69-V319 HydrophobicContact CE2-CG1 3.84Å; F69-V319 HydrophobicContact CG-CB 4.26Å; F69-V319 HydrophobicContact CG-CG1 4.21Å; F69-V319 HydrophobicContact CG-CG2 3.92Å; F69-V319 HydrophobicContact CZ-CG1 4.3Å; F71-V319 HydrophobicContact CE1-CG2 4.31Å; F71-V319 HydrophobicContact CE2-CG2 4.24Å; F71-V319 HydrophobicContact CZ-CG2 3.45Å; F71-V319 VanDerWaalsContact CZ-CG2 3.45Å; L298-V319 HydrophobicContact CB-CG1 4.19Å; L298-V319 HydrophobicContact CD1-CG1 4.12Å; L298-V319 HydrophobicContact CD2-CG1 4.03Å; L298-V319 HydrophobicContact CG-CG1 4.33Å; L299-V319 CarbonylContact O-C 3.49Å; L299-V319 WeakPolarHBondContact O-CA 3.44Å; Y300-V319 HydrophobicContact CD1-CB 4.49Å; Y300-V319 HydrophobicContact CD1-CG1 4.2Å; Y300-V319 HydrophobicContact CD1-CG2 3.89Å; Y300-V319 HydrophobicContact CE1-CG1 3.91Å; Y300-V319 HydrophobicContact CE1-CG2 4Å
320	L	90.2	Very high	74.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.7	177.6	-163.8	163.3	0	0	0	108.3	Y16 F268 I282 L284 L299 F301	Y16-L320 HydrophobicContact CD1-CD2 3.58Å; Y16-L320 HydrophobicContact CG-CD2 4.19Å; F268-L320 HydrophobicContact CB-CD1 3.96Å; F268-L320 HydrophobicContact CD1-CD1 3.5Å; F268-L320 VanDerWaalsContact CD1-CD1 3.5Å; F268-L320 HydrophobicContact CD1-CD2 3.78Å; F268-L320 HydrophobicContact CD1-CG 4.3Å; F268-L320 HydrophobicContact CD2-CD1 4.43Å; F268-L320 HydrophobicContact CE1-CD1 3.98Å; F268-L320 HydrophobicContact CE1-CD2 3.33Å; F268-L320 HydrophobicContact CE1-CG 4.31Å; F268-L320 HydrophobicContact CG-CD1 3.71Å; F268-L320 HydrophobicContact CZ-CD2 3.73Å; I282-L320 HydrophobicContact CB-CD1 4.47Å; I282-L320 HydrophobicContact CD1-CD1 3.95Å; I282-L320 HydrophobicContact CD1-CD2 3.98Å; I282-L320 HydrophobicContact CD1-CG 4.12Å; I282-L320 HydrophobicContact CG2-CD1 4.34Å; L284-L320 HydrophobicContact CD2-CD1 4.23Å; L299-L320 HydrophobicContact CB-CB 4.34Å; L299-L320 PolarHBondContact N-O 3.33Å; L299-L320 PolarHBondContact O-N 2.98Å; F301-L320 HydrophobicContact CE1-CB 4.13Å; F301-L320 HydrophobicContact CE1-CD1 4.29Å
321	G	88.8	Confident	76.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	-179.7	-179.9	0	0	0	0	0	112.9	Y16 S17	Y16-G321 CarbonylContact C-O 3.37Å; Y16-G321 VanDerWaalsContact CA-O 3.31Å; Y16-G321 WeakPolarHBondContact CA-O 3.45Å; S17-G321 PolarHBondContact N-O 3.49Å; S17-G321 PolarHBondContact O-N 3.43Å
322	P	87.8	Confident	79.2	Confident	5 Å²	5	34.7 Å²	34.7	3%	0.032	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	135.8	-179.9	27.3	-34.2	0	0	0	110.8	I9 T14 Y16 F19 H297	I9-P322 HydrophobicContact CG2-CB 4.2Å; I9-P322 HydrophobicContact CG2-CG 4.18Å; T14-P322 HydrophobicContact CG2-CB 4.49Å; Y16-P322 HydrophobicContact CE2-CB 4.2Å; F19-P322 WeakPolarHBondContact CZ-O 3.33Å; H297-P322 VanDerWaalsContact O-CD 3.28Å; H297-P322 WeakPolarHBondContact O-CD 3.42Å
323	E	85	Confident	81.8	Confident	28 Å²	28	32.9 Å²	32.9	13%	0.131	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-51.8	140.5	172.7	-78.7	179.3	179.3	0	0	110.7	K15 S17 L327	K15-E323 HydrophobicContact CB-CG 4.46Å; K15-E323 WeakPolarHBondContact CD-OE1 3.12Å; K15-E323 IonicContact NZ-OE1 2.86Å; K15-E323 WeakPolarHBondContact O-CG 3.39Å; K15-E323 PolarHBondContact O-N 3.18Å; S17-E323 WeakPolarHBondContact OG-CG 3.39Å; E323-L327 HydrophobicContact CB-CB 4.39Å; E323-L327 HydrophobicContact CB-CD1 4.06Å; E323-L327 HydrophobicContact CG-CD1 3.86Å
324	R	87.5	Confident	83.9	Confident	44 Å²	44	34.1 Å²	34.1	17%	0.166	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-75.2	156	179.3	-59.5	-52.5	-167.5	-158.4	5.8	111.1	E61 T67 D326 L327	E61-R324 IonicContact OE1-CZ 2.79Å; E61-R324 IonicContact OE1-NE 3.86Å; E61-R324 PolarHBondContact OE1-NE 2.86Å; E61-R324 IonicContact OE1-NH2 3.8Å; E61-R324 IonicContact OE2-CZ 2.63Å; E61-R324 IonicContact OE2-NE 3.37Å; E61-R324 PolarHBondContact OE2-NE 2.82Å; E61-R324 IonicContact OE2-NH2 3.49Å; E61-R324 PolarHBondContact OE2-NH2 2.99Å; T67-R324 HydrophobicContact CG2-CB 4.42Å; T67-R324 HydrophobicContact CG2-CG 3.94Å; R324-D326 VanDerWaalsContact C-OD1 3.31Å; R324-D326 WeakPolarHBondContact CB-OD1 3.3Å; R324-D326 PolarHBondContact O-N 3.35Å; R324-L327 PolarHBondContact O-N 2.98Å
325	W	88.5	Confident	85.7	Confident	8 Å²	8	37.9 Å²	37.9	3%	0.03	17%	0.171	C	C	.	.	H	α-helix	trans	-57.1	-25.9	-169.4	71.6	-100.2	0	0	0	114.8	I328 A329 V344 Q345 E348 F370 R373 R374 V377	W325-I328 WeakPolarHBondContact O-CB 3.35Å; W325-I328 PolarHBondContact O-N 3.35Å; W325-A329 HydrophobicContact CE3-CB 4.17Å; W325-A329 HydrophobicContact CZ3-CB 4.32Å; W325-A329 VanDerWaalsContact O-CB 3.31Å; W325-A329 WeakPolarHBondContact O-CB 3.41Å; W325-A329 PolarHBondContact O-N 3.02Å; W325-V344 HydrophobicContact CB-CG1 3.83Å; W325-V344 HydrophobicContact CE3-CG1 4.25Å; W325-Q345 HydrophobicContact CE3-CB 4.49Å; W325-Q345 HydrophobicContact CH2-CB 4.28Å; W325-Q345 HydrophobicContact CH2-CG 3.86Å; W325-Q345 HydrophobicContact CZ3-CB 3.81Å; W325-Q345 HydrophobicContact CZ3-CG 3.92Å; W325-E348 HydrophobicContact CB-CG 3.61Å; W325-E348 HydrophobicContact CD2-CB 4.43Å; W325-E348 HydrophobicContact CD2-CG 4.11Å; W325-E348 HydrophobicContact CG-CB 4.25Å; W325-E348 HydrophobicContact CG-CG 3.5Å; W325-E348 VanDerWaalsContact CG-CG 3.5Å; W325-F370 HydrophobicContact CZ2-CD2 4.02Å; W325-F370 AromaticContact CZ2-CE2 4Å; W325-F370 HydrophobicContact CZ2-CE2 4Å; W325-R373 HydrophobicContact CH2-CB 4.49Å; W325-R373 HydrophobicContact CZ2-CB 3.68Å; W325-R374 HydrophobicContact CH2-CB 4.08Å; W325-R374 HydrophobicContact CZ2-CB 4.29Å; W325-V377 HydrophobicContact CH2-CB 4.49Å; W325-V377 HydrophobicContact CH2-CG2 4.11Å; W325-V377 HydrophobicContact CZ3-CB 4.34Å; W325-V377 HydrophobicContact CZ3-CG1 4.47Å; W325-V377 HydrophobicContact CZ3-CG2 3.8Å
326	D	89.5	Confident	87.3	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-69	-34	177.9	54.7	-27.7	0	0	0	112.5	R324 R330 R373 R376 V377 F427	R324-D326 VanDerWaalsContact C-OD1 3.31Å; R324-D326 WeakPolarHBondContact CB-OD1 3.3Å; R324-D326 PolarHBondContact O-N 3.35Å; D326-R330 VanDerWaalsContact O-CB 3.31Å; D326-R330 WeakPolarHBondContact O-CB 3.43Å; D326-R330 PolarHBondContact O-N 3.36Å; D326-R373 HydrophobicContact CB-CB 4.08Å; D326-R373 HydrophobicContact CB-CG 4.28Å; D326-R373 WeakPolarHBondContact OD2-CG 3.45Å; D326-R373 IonicContact OD2-NE 2.92Å; D326-R376 IonicContact OD2-CZ 2.79Å; D326-R376 IonicContact OD2-NE 3.56Å; D326-R376 IonicContact OD2-NH2 3.67Å; D326-R376 PolarHBondContact OD2-NH2 3.08Å; D326-V377 HydrophobicContact CB-CG2 3.77Å; D326-F427 HydrophobicContact CB-CZ 4.41Å; D326-F427 WeakPolarHBondContact O-CZ 3.36Å
327	L	87.8	Confident	88.2	Confident	32 Å²	32	31.3 Å²	31.3	17%	0.168	16%	0.161	C	C	.	.	H	α-helix	trans	-69.8	-37.9	171	-65	178	0	0	0	111.7	E323 R324 R330 R331 W426 F427	E323-L327 HydrophobicContact CB-CB 4.39Å; E323-L327 HydrophobicContact CB-CD1 4.06Å; E323-L327 HydrophobicContact CG-CD1 3.86Å; R324-L327 PolarHBondContact O-N 2.98Å; L327-R330 PolarHBondContact O-N 3.29Å; L327-R331 WeakPolarHBondContact O-CG 3.37Å; L327-R331 PolarHBondContact O-N 3.3Å; L327-W426 HydrophobicContact CD2-CH2 3.62Å; L327-W426 HydrophobicContact CD2-CZ2 4.27Å; L327-F427 HydrophobicContact CD2-CD2 4.43Å; L327-F427 HydrophobicContact CD2-CE2 4.08Å
328	I	87.9	Confident	88.6	Confident	42 Å²	42	33 Å²	33	22%	0.215	17%	0.17	C	C	.	.	H	α-helix	trans	-64.4	-48.1	174.6	-57.6	175.6	0	0	0	109.9	W325 R330 R331 F332 V344	W325-I328 WeakPolarHBondContact O-CB 3.35Å; W325-I328 PolarHBondContact O-N 3.35Å; I328-R330 VanDerWaalsContact C-N 3.32Å; I328-R330 PolarHBondContact O-N 3.1Å; I328-R331 WeakPolarHBondContact O-CB 3.27Å; I328-R331 PolarHBondContact O-N 2.93Å; I328-F332 HydrophobicContact CG2-CD2 3.91Å; I328-F332 HydrophobicContact CG2-CE2 3.5Å; I328-F332 HydrophobicContact CG2-CZ 4.41Å; I328-F332 WeakPolarHBondContact O-CD2 3.34Å; I328-F332 PolarHBondContact O-N 3.11Å; I328-V344 HydrophobicContact CG2-CG2 4.31Å
329	A	89.2	Confident	88.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.7	-42.8	175.7	0	0	0	0	0	111.2	W325 R331 F332 I333 A341 V377	W325-A329 HydrophobicContact CE3-CB 4.17Å; W325-A329 HydrophobicContact CZ3-CB 4.32Å; W325-A329 VanDerWaalsContact O-CB 3.31Å; W325-A329 WeakPolarHBondContact O-CB 3.41Å; W325-A329 PolarHBondContact O-N 3.02Å; A329-R331 PolarHBondContact O-N 3.01Å; A329-F332 PolarHBondContact O-N 3.35Å; A329-I333 VanDerWaalsContact O-CG1 3.26Å; A329-I333 WeakPolarHBondContact O-CG1 3.43Å; A329-I333 PolarHBondContact O-N 3.44Å; A329-A341 HydrophobicContact CB-CB 4.42Å; A329-V377 HydrophobicContact CB-CG1 4.11Å; A329-V377 HydrophobicContact CB-CG2 4.15Å
330	R	90.4	Very high	88.7	Confident	28 Å²	28	44.6 Å²	44.6	11%	0.106	22%	0.221	C	C	.	.	H	α-helix	trans	-56.4	-49.3	173.6	172.5	169.5	-174.1	-66.4	-2.6	111.5	D326 L327 I328 F332 I333 L334 L380 F427 K429	D326-R330 VanDerWaalsContact O-CB 3.31Å; D326-R330 WeakPolarHBondContact O-CB 3.43Å; D326-R330 PolarHBondContact O-N 3.36Å; L327-R330 PolarHBondContact O-N 3.29Å; I328-R330 VanDerWaalsContact C-N 3.32Å; I328-R330 PolarHBondContact O-N 3.1Å; R330-F332 VanDerWaalsContact C-N 3.32Å; R330-F332 PolarHBondContact O-N 3.08Å; R330-I333 PolarHBondContact O-N 3.32Å; R330-I333 VanDerWaalsContact O-N 3.11Å; R330-L334 HydrophobicContact CG-CD1 4.46Å; R330-L334 HydrophobicContact CG-CG 4.32Å; R330-L334 WeakPolarHBondContact O-CG 3.28Å; R330-L334 PolarHBondContact O-N 2.96Å; R330-L380 HydrophobicContact CB-CD2 3.71Å; R330-L380 HydrophobicContact CG-CD2 3.55Å; R330-F427 HydrophobicContact CB-CE1 4.34Å; R330-F427 HydrophobicContact CB-CE2 4.03Å; R330-F427 HydrophobicContact CB-CZ 3.75Å; R330-F427 HydrophobicContact CG-CE2 4.48Å; R330-F427 HydrophobicContact CG-CZ 4.39Å; R330-F427 PolarHBondContact NE-O 3.09Å; R330-K429 PolarHBondContact NH2-O 3.42Å
331	R	87.8	Confident	88.6	Confident	136 Å²	136	44.7 Å²	44.7	51%	0.513	22%	0.222	S	C	.	.	H	α-helix	trans	-56.7	-45.8	177.1	-73.8	170.3	60.6	-174	-3.4	111.6	L327 I328 A329 I333 L334 T335	L327-R331 WeakPolarHBondContact O-CG 3.37Å; L327-R331 PolarHBondContact O-N 3.3Å; I328-R331 WeakPolarHBondContact O-CB 3.27Å; I328-R331 PolarHBondContact O-N 2.93Å; A329-R331 PolarHBondContact O-N 3.01Å; R331-I333 VanDerWaalsContact C-N 3.32Å; R331-I333 PolarHBondContact O-N 2.88Å; R331-L334 PolarHBondContact O-N 3.08Å; R331-T335 WeakPolarHBondContact O-CG2 3.39Å; R331-T335 PolarHBondContact O-N 3.26Å; R331-T335 PolarHBondContact O-OG1 2.82Å
332	F	89.3	Confident	88.6	Confident	60 Å²	60	48.3 Å²	48.3	26%	0.263	24%	0.238	S	C	.	.	H	α-helix	trans	-63	-36.2	176.3	-73.2	-51.8	0	0	0	113.3	I328 A329 R330 T335 G336 C337 Q340 A341 V344	I328-F332 HydrophobicContact CG2-CD2 3.91Å; I328-F332 HydrophobicContact CG2-CE2 3.5Å; I328-F332 HydrophobicContact CG2-CZ 4.41Å; I328-F332 WeakPolarHBondContact O-CD2 3.34Å; I328-F332 PolarHBondContact O-N 3.11Å; A329-F332 PolarHBondContact O-N 3.35Å; R330-F332 VanDerWaalsContact C-N 3.32Å; R330-F332 PolarHBondContact O-N 3.08Å; F332-T335 PolarHBondContact O-OG1 3.23Å; F332-T335 VanDerWaalsContact O-OG1 3.11Å; F332-G336 PolarHBondContact O-N 2.87Å; F332-C337 HydrophobicContact CB-CB 4.38Å; F332-C337 HydrophobicContact CD1-CB 4.18Å; F332-C337 WeakPolarHBondContact O-CA 3.3Å; F332-C337 PolarHBondContact O-N 3.14Å; F332-Q340 HydrophobicContact CB-CB 4.42Å; F332-Q340 HydrophobicContact CD1-CB 3.87Å; F332-Q340 HydrophobicContact CD2-CB 4.1Å; F332-Q340 HydrophobicContact CE1-CB 4.1Å; F332-Q340 HydrophobicContact CE2-CB 4.3Å; F332-Q340 HydrophobicContact CG-CB 3.89Å; F332-Q340 HydrophobicContact CZ-CB 4.31Å; F332-A341 HydrophobicContact CB-CB 3.98Å; F332-V344 HydrophobicContact CD2-CG2 4.1Å; F332-V344 HydrophobicContact CE2-CG2 3.8Å
333	I	91.6	Very high	88.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-66.7	-45.4	175.6	-67.5	161.7	0	0	0	110.3	A329 R330 R331 T335 G336 L338 A341 V377 L380 L381 Y384	A329-I333 VanDerWaalsContact O-CG1 3.26Å; A329-I333 WeakPolarHBondContact O-CG1 3.43Å; A329-I333 PolarHBondContact O-N 3.44Å; R330-I333 PolarHBondContact O-N 3.32Å; R330-I333 VanDerWaalsContact O-N 3.11Å; R331-I333 VanDerWaalsContact C-N 3.32Å; R331-I333 PolarHBondContact O-N 2.88Å; I333-T335 VanDerWaalsContact C-N 3.28Å; I333-T335 PolarHBondContact O-N 3.49Å; I333-G336 WeakPolarHBondContact O-CA 3.33Å; I333-G336 PolarHBondContact O-N 3.26Å; I333-L338 HydrophobicContact CB-CD2 4.44Å; I333-L338 HydrophobicContact CG1-CD2 4.15Å; I333-L338 HydrophobicContact CG2-CD2 4.24Å; I333-A341 HydrophobicContact CD1-CB 4.31Å; I333-A341 HydrophobicContact CG1-CB 3.77Å; I333-V377 HydrophobicContact CD1-CG1 3.87Å; I333-L380 HydrophobicContact CB-CD2 4.25Å; I333-L380 HydrophobicContact CD1-CD2 3.91Å; I333-L380 HydrophobicContact CD1-CG 4.3Å; I333-L380 HydrophobicContact CG2-CD2 4.23Å; I333-L380 HydrophobicContact CG2-CG 4.12Å; I333-L381 HydrophobicContact CD1-CD2 3.78Å; I333-L381 HydrophobicContact CD1-CG 3.76Å; I333-L381 HydrophobicContact CG1-CD2 3.81Å; I333-L381 HydrophobicContact CG1-CG 4.36Å; I333-L381 HydrophobicContact CG2-CD2 4.36Å; I333-Y384 HydrophobicContact CG2-CD2 3.73Å; I333-Y384 HydrophobicContact CG2-CE2 4.45Å; I333-Y384 HydrophobicContact CG2-CG 3.89Å; I333-Y384 VanDerWaalsContact O-CE2 3.22Å; I333-Y384 WeakPolarHBondContact O-CE2 3.38Å
334	L	89.2	Confident	88.7	Confident	52 Å²	52	51.4 Å²	51.4	27%	0.272	25%	0.253	S	S	.	.	H	α-helix	trans	-62.1	-34.7	178.1	-65.8	-166.9	0	0	0	112.9	R330 R331 G336 L430	R330-L334 HydrophobicContact CG-CD1 4.46Å; R330-L334 HydrophobicContact CG-CG 4.32Å; R330-L334 WeakPolarHBondContact O-CG 3.28Å; R330-L334 PolarHBondContact O-N 2.96Å; R331-L334 PolarHBondContact O-N 3.08Å; L334-G336 PolarHBondContact O-N 3.38Å; L334-L430 HydrophobicContact CD2-CB 4.17Å; L334-L430 HydrophobicContact CD2-CG 4.01Å; L334-L430 WeakPolarHBondContact CD2-O 3.49Å
335	T	87.8	Confident	88.7	Confident	98 Å²	98	50.6 Å²	50.6	60%	0.601	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	0	174.4	63.7	0	0	0	0	113.4	R331 F332 I333 C337	R331-T335 WeakPolarHBondContact O-CG2 3.39Å; R331-T335 PolarHBondContact O-N 3.26Å; R331-T335 PolarHBondContact O-OG1 2.82Å; F332-T335 PolarHBondContact O-OG1 3.23Å; F332-T335 VanDerWaalsContact O-OG1 3.11Å; I333-T335 VanDerWaalsContact C-N 3.28Å; I333-T335 PolarHBondContact O-N 3.49Å; T335-C337 VanDerWaalsContact C-N 3.31Å; T335-C337 PolarHBondContact O-N 3.3Å
336	G	87.7	Confident	88.6	Confident	35 Å²	35	54.4 Å²	54.4	36%	0.361	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	7.4	-178.1	0	0	0	0	0	115.8	F332 I333 L334 L338 Y384	F332-G336 PolarHBondContact O-N 2.87Å; I333-G336 WeakPolarHBondContact O-CA 3.33Å; I333-G336 PolarHBondContact O-N 3.26Å; L334-G336 PolarHBondContact O-N 3.38Å; G336-L338 VanDerWaalsContact C-N 3.29Å; G336-L338 PolarHBondContact O-N 3.4Å; G336-Y384 WeakPolarHBondContact CA-OH 3.46Å
337	C	89.9	Confident	88.3	Confident	50 Å²	50	56.4 Å²	56.4	34%	0.338	28%	0.278	S	S	.	.			trans	-84.3	59	-180	-67.5	0	0	0	0	112.6	F332 T335 K339 Q340 A341	F332-C337 HydrophobicContact CB-CB 4.38Å; F332-C337 HydrophobicContact CD1-CB 4.18Å; F332-C337 WeakPolarHBondContact O-CA 3.3Å; F332-C337 PolarHBondContact O-N 3.14Å; T335-C337 VanDerWaalsContact C-N 3.31Å; T335-C337 PolarHBondContact O-N 3.3Å; C337-K339 VanDerWaalsContact C-N 3.29Å; C337-K339 PolarHBondContact O-N 3.09Å; C337-Q340 HydrophobicContact CB-CB 4.34Å; C337-Q340 HydrophobicContact CB-CG 4.45Å; C337-Q340 WeakPolarHBondContact O-CB 3.36Å; C337-Q340 PolarHBondContact O-N 3.19Å; C337-A341 PolarHBondContact O-N 3.04Å
338	L	89.5	Confident	88.2	Confident	35 Å²	35	56.3 Å²	56.3	18%	0.183	28%	0.277	C	S	.	.	H	α-helix	trans	-58.2	-36	-172.7	-58.3	-174.8	0	0	0	114.1	I333 G336 Q340 A341 F342 L381 Y384	I333-L338 HydrophobicContact CB-CD2 4.44Å; I333-L338 HydrophobicContact CG1-CD2 4.15Å; I333-L338 HydrophobicContact CG2-CD2 4.24Å; G336-L338 VanDerWaalsContact C-N 3.29Å; G336-L338 PolarHBondContact O-N 3.4Å; L338-Q340 VanDerWaalsContact C-N 3.26Å; L338-Q340 PolarHBondContact O-N 3.41Å; L338-A341 WeakPolarHBondContact O-CB 3.25Å; L338-A341 PolarHBondContact O-N 3.11Å; L338-F342 HydrophobicContact CB-CE2 4.39Å; L338-F342 WeakPolarHBondContact O-CD2 3.3Å; L338-F342 PolarHBondContact O-N 3.02Å; L338-L381 HydrophobicContact CD2-CD2 3.73Å; L338-Y384 HydrophobicContact CD1-CD1 4.28Å; L338-Y384 HydrophobicContact CD1-CE1 3.81Å; L338-Y384 HydrophobicContact CD2-CD1 4.1Å; L338-Y384 HydrophobicContact CD2-CE1 3.9Å; L338-Y384 HydrophobicContact CG-CE1 4.17Å
339	K	90.2	Very high	88.1	Confident	192 Å²	192	60.8 Å²	60.8	84%	0.835	29%	0.291	S	S	*	.	H	α-helix	trans	-59.7	-37.4	177.9	-67.7	-178.1	-179.9	177.2	0	112.1	C337 H343	C337-K339 VanDerWaalsContact C-N 3.29Å; C337-K339 PolarHBondContact O-N 3.09Å; K339-H343 WeakPolarHBondContact O-CB 3.29Å; K339-H343 PolarHBondContact O-N 3.23Å; K339-H343 VanDerWaalsContact O-N 3.09Å
340	Q	87.8	Confident	87.9	Confident	92 Å²	92	64.4 Å²	64.4	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-72.5	-39.7	177.9	-68.1	174.2	-26.2	0	0	110.8	F332 C337 L338 F342 H343 V344	F332-Q340 HydrophobicContact CB-CB 4.42Å; F332-Q340 HydrophobicContact CD1-CB 3.87Å; F332-Q340 HydrophobicContact CD2-CB 4.1Å; F332-Q340 HydrophobicContact CE1-CB 4.1Å; F332-Q340 HydrophobicContact CE2-CB 4.3Å; F332-Q340 HydrophobicContact CG-CB 3.89Å; F332-Q340 HydrophobicContact CZ-CB 4.31Å; C337-Q340 HydrophobicContact CB-CB 4.34Å; C337-Q340 HydrophobicContact CB-CG 4.45Å; C337-Q340 WeakPolarHBondContact O-CB 3.36Å; C337-Q340 PolarHBondContact O-N 3.19Å; L338-Q340 VanDerWaalsContact C-N 3.26Å; L338-Q340 PolarHBondContact O-N 3.41Å; Q340-F342 PolarHBondContact O-N 3.33Å; Q340-H343 WeakPolarHBondContact O-CB 3.46Å; Q340-H343 PolarHBondContact O-N 3.45Å; Q340-H343 VanDerWaalsContact O-N 3.16Å; Q340-V344 WeakPolarHBondContact O-CG2 3.22Å; Q340-V344 PolarHBondContact O-N 3.14Å
341	A	87.5	Confident	87.6	Confident	2 Å²	2	67.6 Å²	67.6	2%	0.017	32%	0.323	C	S	.	.	H	α-helix	trans	-59.3	-45.9	174.9	0	0	0	0	0	112.3	A329 F332 I333 C337 L338 H343 V344 Q345	A329-A341 HydrophobicContact CB-CB 4.42Å; F332-A341 HydrophobicContact CB-CB 3.98Å; I333-A341 HydrophobicContact CD1-CB 4.31Å; I333-A341 HydrophobicContact CG1-CB 3.77Å; C337-A341 PolarHBondContact O-N 3.04Å; L338-A341 WeakPolarHBondContact O-CB 3.25Å; L338-A341 PolarHBondContact O-N 3.11Å; A341-H343 VanDerWaalsContact C-N 3.32Å; A341-H343 PolarHBondContact O-N 3.34Å; A341-V344 PolarHBondContact O-N 3.4Å; A341-Q345 PolarHBondContact O-N 3.25Å; A341-Q345 VanDerWaalsContact O-N 3.11Å
342	F	89.4	Confident	87.2	Confident	76 Å²	76	61.8 Å²	61.8	33%	0.333	30%	0.302	S	S	.	.	H	α-helix	trans	-65.4	-34.6	174.9	-73.6	-62.9	0	0	0	112.9	L338 Q340 Q345 Q346 L381 Y397	L338-F342 HydrophobicContact CB-CE2 4.39Å; L338-F342 WeakPolarHBondContact O-CD2 3.3Å; L338-F342 PolarHBondContact O-N 3.02Å; Q340-F342 PolarHBondContact O-N 3.33Å; F342-Q345 PolarHBondContact O-N 3.16Å; F342-Q346 WeakPolarHBondContact O-CB 3.32Å; F342-Q346 PolarHBondContact O-N 3.06Å; F342-L381 HydrophobicContact CE1-CD1 3.76Å; F342-L381 HydrophobicContact CZ-CD1 3.65Å; F342-L381 HydrophobicContact CZ-CD2 4.47Å; F342-Y397 HydrophobicContact CZ-CE1 4.15Å; F342-Y397 WeakPolarHBondContact CZ-OH 3.44Å
343	H	87.3	Confident	86.8	Confident	79 Å²	79	61.9 Å²	61.9	37%	0.366	31%	0.308	S	S	.	.	H	α-helix	trans	-63.6	-46.3	176.1	-168.8	63.2	0	0	0	111.5	K339 Q340 A341 Q345 Q346 Q347	K339-H343 WeakPolarHBondContact O-CB 3.29Å; K339-H343 PolarHBondContact O-N 3.23Å; K339-H343 VanDerWaalsContact O-N 3.09Å; Q340-H343 WeakPolarHBondContact O-CB 3.46Å; Q340-H343 PolarHBondContact O-N 3.45Å; Q340-H343 VanDerWaalsContact O-N 3.16Å; A341-H343 VanDerWaalsContact C-N 3.32Å; A341-H343 PolarHBondContact O-N 3.34Å; H343-Q345 VanDerWaalsContact C-N 3.34Å; H343-Q345 PolarHBondContact O-N 2.96Å; H343-Q346 PolarHBondContact O-N 3.26Å; H343-Q347 PolarHBondContact CD2-NE2 3.09Å; H343-Q347 PolarHBondContact NE2-NE2 3.39Å; H343-Q347 VanDerWaalsContact O-CG 3.27Å; H343-Q347 WeakPolarHBondContact O-CG 3.3Å; H343-Q347 PolarHBondContact O-N 3.24Å
344	V	85.9	Confident	86.1	Confident	19 Å²	19	66.6 Å²	66.6	12%	0.115	33%	0.33	C	S	.	.	H	α-helix	trans	-58.6	-45.4	175.8	172.3	0	0	0	0	111.1	W325 I328 F332 Q340 A341 Q346 Q347 E348	W325-V344 HydrophobicContact CB-CG1 3.83Å; W325-V344 HydrophobicContact CE3-CG1 4.25Å; I328-V344 HydrophobicContact CG2-CG2 4.31Å; F332-V344 HydrophobicContact CD2-CG2 4.1Å; F332-V344 HydrophobicContact CE2-CG2 3.8Å; Q340-V344 WeakPolarHBondContact O-CG2 3.22Å; Q340-V344 PolarHBondContact O-N 3.14Å; A341-V344 PolarHBondContact O-N 3.4Å; V344-Q346 PolarHBondContact O-N 2.72Å; V344-Q347 PolarHBondContact O-N 3Å; V344-E348 PolarHBondContact O-N 3.01Å; V344-E348 VanDerWaalsContact O-N 3.1Å
345	Q	88.4	Confident	85.3	Confident	26 Å²	26	65.7 Å²	65.7	12%	0.121	33%	0.326	C	S	.	.	H	α-helix	trans	-61.6	-43.6	176.7	-177.2	-174.7	-39.5	0	0	112.3	W325 A341 F342 H343 Q347 E348 R349 F370	W325-Q345 HydrophobicContact CE3-CB 4.49Å; W325-Q345 HydrophobicContact CH2-CB 4.28Å; W325-Q345 HydrophobicContact CH2-CG 3.86Å; W325-Q345 HydrophobicContact CZ3-CB 3.81Å; W325-Q345 HydrophobicContact CZ3-CG 3.92Å; A341-Q345 PolarHBondContact O-N 3.25Å; A341-Q345 VanDerWaalsContact O-N 3.11Å; F342-Q345 PolarHBondContact O-N 3.16Å; H343-Q345 VanDerWaalsContact C-N 3.34Å; H343-Q345 PolarHBondContact O-N 2.96Å; Q345-Q347 VanDerWaalsContact C-N 3.33Å; Q345-E348 PolarHBondContact O-N 3.4Å; Q345-R349 PolarHBondContact O-N 3.17Å; Q345-R349 VanDerWaalsContact O-N 3.1Å; Q345-F370 HydrophobicContact CG-CZ 4.49Å
346	Q	87.4	Confident	84.8	Confident	89 Å²	89	65.3 Å²	65.3	42%	0.416	32%	0.318	S	S	.	.	H	α-helix	trans	-67.6	-35.2	179.4	-176	59.2	35.1	0	0	111.8	F342 H343 V344 R349 N350	F342-Q346 WeakPolarHBondContact O-CB 3.32Å; F342-Q346 PolarHBondContact O-N 3.06Å; H343-Q346 PolarHBondContact O-N 3.26Å; V344-Q346 PolarHBondContact O-N 2.72Å; Q346-R349 WeakPolarHBondContact O-CB 3.41Å; Q346-R349 PolarHBondContact O-N 3.08Å; Q346-N350 PolarHBondContact NE2-OD1 3.42Å; Q346-N350 VanDerWaalsContact NE2-OD1 3.16Å; Q346-N350 PolarHBondContact O-N 2.65Å; Q346-N350 PolarHBondContact O-ND2 3.48Å; Q346-N350 PolarHBondContact O-OD1 3.06Å
347	Q	82.7	Confident	83.8	Confident	41 Å²	41	70.9 Å²	70.9	19%	0.192	34%	0.335	C	S	.	.	H	α-helix	trans	-63.4	-45.2	175	-74.9	176.4	-15.3	0	0	111.8	H343 V344 Q345 R349 N350 R351	H343-Q347 PolarHBondContact CD2-NE2 3.09Å; H343-Q347 PolarHBondContact NE2-NE2 3.39Å; H343-Q347 VanDerWaalsContact O-CG 3.27Å; H343-Q347 WeakPolarHBondContact O-CG 3.3Å; H343-Q347 PolarHBondContact O-N 3.24Å; V344-Q347 PolarHBondContact O-N 3Å; Q345-Q347 VanDerWaalsContact C-N 3.33Å; Q347-R349 VanDerWaalsContact C-N 3.28Å; Q347-R349 PolarHBondContact O-N 3.43Å; Q347-N350 CarbonylContact O-C 3.56Å; Q347-N350 WeakPolarHBondContact O-CA 3.48Å; Q347-N350 WeakPolarHBondContact O-CB 2.88Å; Q347-N350 PolarHBondContact O-N 3Å; Q347-R351 PolarHBondContact O-N 3.48Å
348	E	84.8	Confident	82.9	Confident	30 Å²	30	75.5 Å²	75.5	14%	0.14	36%	0.356	C	S	.	.	H	α-helix	trans	-64.9	-34.6	177	-77.5	-72.8	163.8	0	0	112.6	W325 V344 Q345 N350 R351 L352 F370	W325-E348 HydrophobicContact CB-CG 3.61Å; W325-E348 HydrophobicContact CD2-CB 4.43Å; W325-E348 HydrophobicContact CD2-CG 4.11Å; W325-E348 HydrophobicContact CG-CB 4.25Å; W325-E348 HydrophobicContact CG-CG 3.5Å; W325-E348 VanDerWaalsContact CG-CG 3.5Å; V344-E348 PolarHBondContact O-N 3.01Å; V344-E348 VanDerWaalsContact O-N 3.1Å; Q345-E348 PolarHBondContact O-N 3.4Å; E348-N350 VanDerWaalsContact C-N 3.31Å; E348-N350 PolarHBondContact O-N 3.06Å; E348-R351 WeakPolarHBondContact O-CB 3.25Å; E348-R351 PolarHBondContact O-N 2.93Å; E348-R351 IonicContact OE1-NE 3.5Å; E348-R351 IonicContact OE2-CZ 3.48Å; E348-R351 IonicContact OE2-NE 3.82Å; E348-R351 PolarHBondContact OE2-NE 3.31Å; E348-R351 IonicContact OE2-NH2 3.98Å; E348-R351 PolarHBondContact OE2-NH2 3.19Å; E348-L352 WeakPolarHBondContact O-CB 3.49Å; E348-L352 PolarHBondContact O-N 3.12Å; E348-F370 HydrophobicContact CB-CD2 4.26Å; E348-F370 HydrophobicContact CB-CE2 3.97Å
349	R	86.4	Confident	82	Confident	136 Å²	136	78.4 Å²	78.4	51%	0.513	37%	0.368	S	S	.	.	H	α-helix	trans	-62.2	-39.9	170.2	-170.3	177.5	-178.1	178.6	2.2	111.9	Q345 Q346 Q347 L352 T353 F370	Q345-R349 PolarHBondContact O-N 3.17Å; Q345-R349 VanDerWaalsContact O-N 3.1Å; Q346-R349 WeakPolarHBondContact O-CB 3.41Å; Q346-R349 PolarHBondContact O-N 3.08Å; Q347-R349 VanDerWaalsContact C-N 3.28Å; Q347-R349 PolarHBondContact O-N 3.43Å; R349-L352 PolarHBondContact O-N 3.49Å; R349-T353 PolarHBondContact O-N 2.9Å; R349-T353 PolarHBondContact O-OG1 2.85Å; R349-F370 HydrophobicContact CB-CE2 4.2Å; R349-F370 HydrophobicContact CB-CZ 3.86Å; R349-F370 HydrophobicContact CG-CZ 4.3Å
350	N	85.4	Confident	81	Confident	77 Å²	77	74.3 Å²	74.3	41%	0.412	36%	0.359	S	S	.	.	H	α-helix	trans	-67.3	-41.5	176	-63	-15.6	0	0	0	111.2	Q346 Q347 E348 T353 Q354	Q346-N350 PolarHBondContact NE2-OD1 3.42Å; Q346-N350 VanDerWaalsContact NE2-OD1 3.16Å; Q346-N350 PolarHBondContact O-N 2.65Å; Q346-N350 PolarHBondContact O-ND2 3.48Å; Q346-N350 PolarHBondContact O-OD1 3.06Å; Q347-N350 CarbonylContact O-C 3.56Å; Q347-N350 WeakPolarHBondContact O-CA 3.48Å; Q347-N350 WeakPolarHBondContact O-CB 2.88Å; Q347-N350 PolarHBondContact O-N 3Å; E348-N350 VanDerWaalsContact C-N 3.31Å; E348-N350 PolarHBondContact O-N 3.06Å; N350-T353 WeakPolarHBondContact O-CB 3.11Å; N350-T353 PolarHBondContact O-N 3.24Å; N350-Q354 WeakPolarHBondContact O-CG 3.38Å; N350-Q354 PolarHBondContact O-N 2.75Å
351	R	82.5	Confident	79.9	Confident	94 Å²	94	78.4 Å²	78.4	36%	0.355	38%	0.378	S	S	.	.	H	α-helix	trans	-57	-48.9	173	-172.5	-175.4	76.7	98	8.7	111	Q347 E348 T353 Q354 V355 E366	Q347-R351 PolarHBondContact O-N 3.48Å; E348-R351 WeakPolarHBondContact O-CB 3.25Å; E348-R351 PolarHBondContact O-N 2.93Å; E348-R351 IonicContact OE1-NE 3.5Å; E348-R351 IonicContact OE2-CZ 3.48Å; E348-R351 IonicContact OE2-NE 3.82Å; E348-R351 PolarHBondContact OE2-NE 3.31Å; E348-R351 IonicContact OE2-NH2 3.98Å; E348-R351 PolarHBondContact OE2-NH2 3.19Å; R351-T353 VanDerWaalsContact C-N 3.28Å; R351-T353 PolarHBondContact O-N 3.4Å; R351-Q354 WeakPolarHBondContact O-CB 3.24Å; R351-Q354 PolarHBondContact O-N 3.07Å; R351-Q354 VanDerWaalsContact O-N 3.12Å; R351-V355 WeakPolarHBondContact O-CG2 3.46Å; R351-V355 PolarHBondContact O-N 3.23Å; R351-E366 IonicContact CZ-OE2 3.57Å; R351-E366 IonicContact NH2-OE2 3.52Å; R351-E366 PolarHBondContact NH2-OE2 3.44Å
352	L	81.2	Confident	79.1	Confident	15 Å²	15	81.7 Å²	81.7	8%	0.079	39%	0.392	C	S	.	.	H	α-helix	trans	-59.2	-39.7	176.9	-169.6	109.7	0	0	0	112.2	E348 R349 Q354 V355 M356 F363 E366 Q367 F370	E348-L352 WeakPolarHBondContact O-CB 3.49Å; E348-L352 PolarHBondContact O-N 3.12Å; R349-L352 PolarHBondContact O-N 3.49Å; L352-Q354 VanDerWaalsContact C-N 3.32Å; L352-Q354 PolarHBondContact O-N 3.03Å; L352-V355 PolarHBondContact O-N 3.16Å; L352-M356 PolarHBondContact O-N 3.25Å; L352-F363 HydrophobicContact CD2-CD2 4.3Å; L352-F363 HydrophobicContact CD2-CE2 3.49Å; L352-F363 VanDerWaalsContact CD2-CE2 3.49Å; L352-F363 HydrophobicContact CD2-CZ 4.17Å; L352-F363 HydrophobicContact CG-CD2 4.15Å; L352-F363 HydrophobicContact CG-CE2 3.82Å; L352-E366 HydrophobicContact CD1-CB 3.88Å; L352-Q367 HydrophobicContact CD1-CB 4.32Å; L352-Q367 HydrophobicContact CD2-CB 4.37Å; L352-Q367 HydrophobicContact CD2-CG 4.37Å; L352-F370 HydrophobicContact CD1-CB 4.01Å
353	T	80.5	Confident	78.5	Confident	62 Å²	62	79.5 Å²	79.5	38%	0.38	38%	0.383	S	S	.	.	H	α-helix	trans	-66	-34.3	177.6	-52.2	0	0	0	0	111.8	R349 N350 R351 M356	R349-T353 PolarHBondContact O-N 2.9Å; R349-T353 PolarHBondContact O-OG1 2.85Å; N350-T353 WeakPolarHBondContact O-CB 3.11Å; N350-T353 PolarHBondContact O-N 3.24Å; R351-T353 VanDerWaalsContact C-N 3.28Å; R351-T353 PolarHBondContact O-N 3.4Å; T353-M356 WeakPolarHBondContact O-CB 3.39Å
354	Q	75.8	Confident	78.2	Confident	99 Å²	99	82.5 Å²	82.5	46%	0.463	39%	0.394	S	S	.	.	H	α-helix	trans	-70.8	-41.5	173	-68.7	173.1	-7	0	0	111.8	N350 R351 L352 M356 Q357 L358	N350-Q354 WeakPolarHBondContact O-CG 3.38Å; N350-Q354 PolarHBondContact O-N 2.75Å; R351-Q354 WeakPolarHBondContact O-CB 3.24Å; R351-Q354 PolarHBondContact O-N 3.07Å; R351-Q354 VanDerWaalsContact O-N 3.12Å; L352-Q354 VanDerWaalsContact C-N 3.32Å; L352-Q354 PolarHBondContact O-N 3.03Å; Q354-M356 VanDerWaalsContact C-N 3.27Å; Q354-M356 PolarHBondContact O-N 3.27Å; Q354-Q357 WeakPolarHBondContact O-CB 3.48Å; Q354-Q357 PolarHBondContact O-N 2.81Å; Q354-Q357 VanDerWaalsContact O-N 3.09Å; Q354-L358 PolarHBondContact O-N 3.44Å
355	V	73.9	Confident	78	Confident	33 Å²	33	84.5 Å²	84.5	20%	0.2	40%	0.403	C	S	.	.	H	α-helix	trans	-60.5	-38.5	174.9	174.6	0	0	0	0	111.1	R351 L352 Q357 L358 Q359	R351-V355 WeakPolarHBondContact O-CG2 3.46Å; R351-V355 PolarHBondContact O-N 3.23Å; L352-V355 PolarHBondContact O-N 3.16Å; V355-Q357 PolarHBondContact O-N 3.19Å; V355-L358 PolarHBondContact O-N 3.47Å; V355-L358 VanDerWaalsContact O-N 3.07Å; V355-Q359 PolarHBondContact O-N 2.95Å
356	M	76.1	Confident	77.7	Confident	89 Å²	89	85.3 Å²	85.3	44%	0.438	41%	0.406	S	S	.	.	H	α-helix	trans	-55.3	-36.2	174.4	-165.8	-178.6	68.9	0	0	113	L352 T353 Q354 L358 F363	L352-M356 PolarHBondContact O-N 3.25Å; T353-M356 WeakPolarHBondContact O-CB 3.39Å; Q354-M356 VanDerWaalsContact C-N 3.27Å; Q354-M356 PolarHBondContact O-N 3.27Å; M356-L358 VanDerWaalsContact C-N 3.34Å; M356-F363 HydrophobicContact CB-CD2 3.44Å; M356-F363 VanDerWaalsContact CB-CD2 3.44Å; M356-F363 HydrophobicContact CB-CE2 3.53Å; M356-F363 HydrophobicContact CB-CG 4.08Å; M356-F363 HydrophobicContact CB-CZ 4.25Å; M356-F363 HydrophobicContact CG-CD1 4.16Å; M356-F363 HydrophobicContact CG-CD2 3.73Å; M356-F363 HydrophobicContact CG-CE1 4.09Å; M356-F363 HydrophobicContact CG-CE2 3.64Å; M356-F363 HydrophobicContact CG-CG 3.98Å; M356-F363 HydrophobicContact CG-CZ 3.83Å; M356-F363 HydrophobicContact SD-CE1 4.18Å; M356-F363 HydrophobicContact SD-CE2 3.89Å; M356-F363 HydrophobicContact SD-CZ 3.67Å
357	Q	68.2	Low	77.7	Confident	153 Å²	153	84.6 Å²	84.6	72%	0.715	40%	0.403	S	S	*	.	H	α-helix	trans	-74.5	-26	-179.7	-66.3	175.5	-7.5	0	0	112.6	Q354 V355	Q354-Q357 WeakPolarHBondContact O-CB 3.48Å; Q354-Q357 PolarHBondContact O-N 2.81Å; Q354-Q357 VanDerWaalsContact O-N 3.09Å; V355-Q357 PolarHBondContact O-N 3.19Å
358	L	70.1	Confident	77.9	Confident	147 Å²	147	88.1 Å²	88.1	77%	0.77	42%	0.42	S	S	*	.	H	α-helix	trans	-97.2	-44.2	-174.9	-69.1	166.1	0	0	0	112.8	Q354 V355 M356	Q354-L358 PolarHBondContact O-N 3.44Å; V355-L358 PolarHBondContact O-N 3.47Å; V355-L358 VanDerWaalsContact O-N 3.07Å; M356-L358 VanDerWaalsContact C-N 3.34Å
359	Q	69.9	Low	78.1	Confident	96 Å²	96	87 Å²	87	45%	0.449	41%	0.414	S	S	.	.			trans	-144.2	101.3	-169	-68.4	-176.3	-11.5	0	0	112.3	V355 E361 K362 F363	V355-Q359 PolarHBondContact O-N 2.95Å; Q359-E361 PolarHBondContact O-N 3.43Å; Q359-K362 HydrophobicContact CB-CB 4.5Å; Q359-F363 WeakPolarHBondContact O-CB 3.47Å; Q359-F363 PolarHBondContact O-N 3.24Å
360	V	69.2	Low	78.3	Confident	105 Å²	105	81.2 Å²	81.2	64%	0.636	39%	0.393	S	S	*	.	H	α-helix	trans	-67.7	-33.2	-175.6	179.7	0	0	0	0	113.3	F363	V360-F363 WeakPolarHBondContact O-CB 3.28Å
361	E	64.5	Low	78.5	Confident	179 Å²	179	80.2 Å²	80.2	84%	0.836	39%	0.387	S	S	*	.	H	α-helix	trans	-73.9	-48.4	-176.2	-66.7	-175.1	169.1	0	0	112.4	Q359 F363 K364	Q359-E361 PolarHBondContact O-N 3.43Å; E361-F363 PolarHBondContact O-N 2.9Å; E361-K364 PolarHBondContact O-N 3.14Å
362	K	71.3	Confident	78.8	Confident	70 Å²	70	81.1 Å²	81.1	30%	0.304	39%	0.391	S	S	.	.	H	α-helix	trans	-62.9	-31.6	175.1	-63.4	-160.5	-166.2	-175.3	0	112.3	D43 Q359 K364 H365 E366	D43-K362 IonicContact OD1-NZ 2.81Å; D43-K362 PolarHBondContact OD1-NZ 3.29Å; D43-K362 WeakPolarHBondContact OD2-CE 3.3Å; D43-K362 IonicContact OD2-NZ 3.36Å; D43-K362 PolarHBondContact OD2-NZ 3.1Å; Q359-K362 HydrophobicContact CB-CB 4.5Å; K362-K364 VanDerWaalsContact C-N 3.34Å; K362-K364 PolarHBondContact O-N 3.11Å; K362-H365 PolarHBondContact O-N 3.13Å; K362-E366 PolarHBondContact O-N 3.21Å
363	F	76.2	Confident	79.3	Confident	31 Å²	31	80.7 Å²	80.7	14%	0.136	39%	0.388	C	S	.	.	H	α-helix	trans	-55.7	-43.5	-179.5	171.9	-100.1	0	0	0	113.2	L352 M356 Q359 V360 E361 H365 E366 Q367	L352-F363 HydrophobicContact CD2-CD2 4.3Å; L352-F363 HydrophobicContact CD2-CE2 3.49Å; L352-F363 VanDerWaalsContact CD2-CE2 3.49Å; L352-F363 HydrophobicContact CD2-CZ 4.17Å; L352-F363 HydrophobicContact CG-CD2 4.15Å; L352-F363 HydrophobicContact CG-CE2 3.82Å; M356-F363 HydrophobicContact CB-CD2 3.44Å; M356-F363 VanDerWaalsContact CB-CD2 3.44Å; M356-F363 HydrophobicContact CB-CE2 3.53Å; M356-F363 HydrophobicContact CB-CG 4.08Å; M356-F363 HydrophobicContact CB-CZ 4.25Å; M356-F363 HydrophobicContact CG-CD1 4.16Å; M356-F363 HydrophobicContact CG-CD2 3.73Å; M356-F363 HydrophobicContact CG-CE1 4.09Å; M356-F363 HydrophobicContact CG-CE2 3.64Å; M356-F363 HydrophobicContact CG-CG 3.98Å; M356-F363 HydrophobicContact CG-CZ 3.83Å; M356-F363 HydrophobicContact SD-CE1 4.18Å; M356-F363 HydrophobicContact SD-CE2 3.89Å; M356-F363 HydrophobicContact SD-CZ 3.67Å; Q359-F363 WeakPolarHBondContact O-CB 3.47Å; Q359-F363 PolarHBondContact O-N 3.24Å; V360-F363 WeakPolarHBondContact O-CB 3.28Å; E361-F363 PolarHBondContact O-N 2.9Å; F363-H365 VanDerWaalsContact C-N 3.32Å; F363-H365 PolarHBondContact O-N 3.18Å; F363-E366 PolarHBondContact O-N 2.96Å; F363-Q367 HydrophobicContact CZ-CB 4.46Å; F363-Q367 WeakPolarHBondContact O-CB 3.42Å; F363-Q367 PolarHBondContact O-N 3.05Å
364	K	81.9	Confident	79.9	Confident	141 Å²	141	81.7 Å²	81.7	61%	0.613	39%	0.385	S	S	*	.	H	α-helix	trans	-62.3	-41.3	-178.8	-71.8	-176.8	-180	176.4	0	112.2	E361 K362 Q368	E361-K364 PolarHBondContact O-N 3.14Å; K362-K364 VanDerWaalsContact C-N 3.34Å; K362-K364 PolarHBondContact O-N 3.11Å; K364-Q368 WeakPolarHBondContact O-CG 3.48Å; K364-Q368 PolarHBondContact O-N 3.41Å
365	H	82.3	Confident	80.6	Confident	62 Å²	62	80.3 Å²	80.3	29%	0.287	38%	0.379	S	S	.	.	H	α-helix	trans	-69.3	-48.7	179.2	-173.9	65.4	0	0	0	111.4	E61 K362 F363 Q367 Q368 L369	E61-H365 PolarHBondContact O-CE1 3.28Å; E61-H365 VanDerWaalsContact O-CE1 3.31Å; E61-H365 PolarHBondContact O-NE2 3.23Å; K362-H365 PolarHBondContact O-N 3.13Å; F363-H365 VanDerWaalsContact C-N 3.32Å; F363-H365 PolarHBondContact O-N 3.18Å; H365-Q367 VanDerWaalsContact C-N 3.26Å; H365-Q367 PolarHBondContact O-N 3.23Å; H365-Q368 PolarHBondContact O-N 3.35Å; H365-L369 WeakPolarHBondContact O-CG 3.43Å; H365-L369 PolarHBondContact O-N 2.77Å
366	E	82.4	Confident	81.4	Confident	42 Å²	42	79.2 Å²	79.2	20%	0.196	37%	0.371	C	S	.	.	H	α-helix	trans	-59.7	-36.7	175.3	-74.6	-74	139.6	0	0	112.1	R351 L352 K362 F363 L369 F370	R351-E366 IonicContact CZ-OE2 3.57Å; R351-E366 IonicContact NH2-OE2 3.52Å; R351-E366 PolarHBondContact NH2-OE2 3.44Å; L352-E366 HydrophobicContact CD1-CB 3.88Å; K362-E366 PolarHBondContact O-N 3.21Å; F363-E366 PolarHBondContact O-N 2.96Å; E366-L369 PolarHBondContact O-N 3.4Å; E366-F370 WeakPolarHBondContact O-CB 3.37Å; E366-F370 PolarHBondContact O-N 2.89Å
367	Q	86.9	Confident	82.1	Confident	75 Å²	75	75 Å²	75	35%	0.35	35%	0.35	S	S	.	.	H	α-helix	trans	-65.3	-43.3	177.8	-175.5	177.3	10.6	0	0	111.3	L352 F363 H365 L369 F370 D371	L352-Q367 HydrophobicContact CD1-CB 4.32Å; L352-Q367 HydrophobicContact CD2-CB 4.37Å; L352-Q367 HydrophobicContact CD2-CG 4.37Å; F363-Q367 HydrophobicContact CZ-CB 4.46Å; F363-Q367 WeakPolarHBondContact O-CB 3.42Å; F363-Q367 PolarHBondContact O-N 3.05Å; H365-Q367 VanDerWaalsContact C-N 3.26Å; H365-Q367 PolarHBondContact O-N 3.23Å; Q367-L369 VanDerWaalsContact C-N 3.35Å; Q367-L369 PolarHBondContact O-N 2.87Å; Q367-F370 PolarHBondContact O-N 3.39Å; Q367-D371 WeakPolarHBondContact O-CB 3.5Å; Q367-D371 PolarHBondContact O-N 2.97Å
368	Q	87.4	Confident	83.4	Confident	115 Å²	115	68 Å²	68	54%	0.537	32%	0.317	S	S	.	.	H	α-helix	trans	-62.3	-42.1	175.4	-71.2	176	8.2	0	0	111.9	K364 H365 D371 R372	K364-Q368 WeakPolarHBondContact O-CG 3.48Å; K364-Q368 PolarHBondContact O-N 3.41Å; H365-Q368 PolarHBondContact O-N 3.35Å; Q368-D371 PolarHBondContact O-N 3.5Å; Q368-R372 WeakPolarHBondContact O-CG 3.33Å; Q368-R372 PolarHBondContact O-N 2.84Å; Q368-R372 VanDerWaalsContact O-N 3.09Å
369	L	88.3	Confident	84.4	Confident	6 Å²	6	61 Å²	61	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-63.3	-43.8	175	-67.1	178	0	0	0	111.5	E61 H365 E366 Q367 R373	E61-L369 HydrophobicContact CB-CD1 4.17Å; E61-L369 HydrophobicContact CG-CD1 4.14Å; H365-L369 WeakPolarHBondContact O-CG 3.43Å; H365-L369 PolarHBondContact O-N 2.77Å; E366-L369 PolarHBondContact O-N 3.4Å; Q367-L369 VanDerWaalsContact C-N 3.35Å; Q367-L369 PolarHBondContact O-N 2.87Å; L369-R373 WeakPolarHBondContact O-CB 3.3Å; L369-R373 VanDerWaalsContact O-CG 3.31Å; L369-R373 WeakPolarHBondContact O-CG 3.12Å; L369-R373 PolarHBondContact O-N 3.48Å
370	F	90	Very high	85.5	Confident	15 Å²	15	56.4 Å²	56.4	7%	0.066	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-47.7	176.8	175.1	-93.2	0	0	0	111.6	W325 Q345 E348 R349 L352 E366 Q367 R373 R374	W325-F370 HydrophobicContact CZ2-CD2 4.02Å; W325-F370 AromaticContact CZ2-CE2 4Å; W325-F370 HydrophobicContact CZ2-CE2 4Å; Q345-F370 HydrophobicContact CG-CZ 4.49Å; E348-F370 HydrophobicContact CB-CD2 4.26Å; E348-F370 HydrophobicContact CB-CE2 3.97Å; R349-F370 HydrophobicContact CB-CE2 4.2Å; R349-F370 HydrophobicContact CB-CZ 3.86Å; R349-F370 HydrophobicContact CG-CZ 4.3Å; L352-F370 HydrophobicContact CD1-CB 4.01Å; E366-F370 WeakPolarHBondContact O-CB 3.37Å; E366-F370 PolarHBondContact O-N 2.89Å; Q367-F370 PolarHBondContact O-N 3.39Å; F370-R373 PolarHBondContact O-N 3.2Å; F370-R374 HydrophobicContact CE1-CB 4.41Å; F370-R374 WeakPolarHBondContact O-CB 3.41Å; F370-R374 PolarHBondContact O-N 3.39Å
371	D	90.1	Very high	86.7	Confident	55 Å²	55	51.4 Å²	51.4	29%	0.294	23%	0.229	S	C	.	.	H	α-helix	trans	-63.7	-43.8	-178.3	-73.9	-29.3	0	0	0	111.6	Q367 Q368 R374 Q375	Q367-D371 WeakPolarHBondContact O-CB 3.5Å; Q367-D371 PolarHBondContact O-N 2.97Å; Q368-D371 PolarHBondContact O-N 3.5Å; D371-R374 PolarHBondContact O-N 3.47Å; D371-Q375 WeakPolarHBondContact O-CB 3.48Å; D371-Q375 VanDerWaalsContact O-CG 3.27Å; D371-Q375 WeakPolarHBondContact O-CG 3.49Å; D371-Q375 PolarHBondContact O-N 3.33Å
372	R	88.8	Confident	88.1	Confident	113 Å²	113	42.9 Å²	42.9	43%	0.426	19%	0.19	S	C	.	.	H	α-helix	trans	-62.3	-44.9	175.8	-71.9	-176.7	-174.6	-170	0.2	112.3	Y63 D64 Q368 Q375 R376	Y63-R372 HydrophobicContact CD1-CB 3.56Å; Y63-R372 HydrophobicContact CD1-CG 4.4Å; Y63-R372 HydrophobicContact CE1-CB 3.78Å; Y63-R372 WeakPolarHBondContact O-CD 3.09Å; Y63-R372 PolarHBondContact O-NH1 3.01Å; D64-R372 IonicContact OD1-NH1 3.91Å; D64-R372 PolarHBondContact OD1-NH1 3.44Å; Q368-R372 WeakPolarHBondContact O-CG 3.33Å; Q368-R372 PolarHBondContact O-N 2.84Å; Q368-R372 VanDerWaalsContact O-N 3.09Å; R372-Q375 PolarHBondContact O-N 3.12Å; R372-R376 PolarHBondContact O-N 2.88Å; R372-R376 VanDerWaalsContact O-N 3.11Å
373	R	91.3	Very high	89.2	Confident	6 Å²	6	39.6 Å²	39.6	2%	0.023	18%	0.175	C	C	.	.	H	α-helix	trans	-64.5	-42.3	177.2	-74.5	-178.6	-176.6	143.8	11.3	111.9	E61 Y63 T67 W325 D326 L369 F370 R376 V377	E61-R373 IonicContact OE1-CZ 3.71Å; E61-R373 IonicContact OE1-NH1 2.72Å; E61-R373 IonicContact OE1-NH2 2.7Å; E61-R373 PolarHBondContact OE1-NH2 3.29Å; Y63-R373 HydrophobicContact CD1-CG 4.49Å; Y63-R373 HydrophobicContact CD2-CG 4.45Å; Y63-R373 HydrophobicContact CG-CG 4.46Å; T67-R373 VanDerWaalsContact CG2-NH2 3.28Å; W325-R373 HydrophobicContact CH2-CB 4.49Å; W325-R373 HydrophobicContact CZ2-CB 3.68Å; D326-R373 HydrophobicContact CB-CB 4.08Å; D326-R373 HydrophobicContact CB-CG 4.28Å; D326-R373 WeakPolarHBondContact OD2-CG 3.45Å; D326-R373 IonicContact OD2-NE 2.92Å; L369-R373 WeakPolarHBondContact O-CB 3.3Å; L369-R373 VanDerWaalsContact O-CG 3.31Å; L369-R373 WeakPolarHBondContact O-CG 3.12Å; L369-R373 PolarHBondContact O-N 3.48Å; F370-R373 PolarHBondContact O-N 3.2Å; R373-R376 PolarHBondContact O-N 3.43Å; R373-V377 WeakPolarHBondContact O-CG2 3.46Å; R373-V377 PolarHBondContact O-N 3.42Å
374	R	92.9	Very high	90	Very high	83 Å²	83	39.1 Å²	39.1	31%	0.313	17%	0.173	S	C	.	.	H	α-helix	trans	-62.2	-47	176.5	176.4	-177.4	167	-137.2	-7.2	111.7	W325 F370 D371 R376 V377 L378	W325-R374 HydrophobicContact CH2-CB 4.08Å; W325-R374 HydrophobicContact CZ2-CB 4.29Å; F370-R374 HydrophobicContact CE1-CB 4.41Å; F370-R374 WeakPolarHBondContact O-CB 3.41Å; F370-R374 PolarHBondContact O-N 3.39Å; D371-R374 PolarHBondContact O-N 3.47Å; R374-R376 VanDerWaalsContact C-N 3.25Å; R374-R376 PolarHBondContact O-N 2.91Å; R374-V377 PolarHBondContact O-N 2.87Å; R374-L378 HydrophobicContact CG-CD1 3.87Å; R374-L378 HydrophobicContact CG-CG 4.38Å; R374-L378 WeakPolarHBondContact O-CB 3.39Å; R374-L378 VanDerWaalsContact O-CG 3.28Å; R374-L378 WeakPolarHBondContact O-CG 3.39Å; R374-L378 PolarHBondContact O-N 3.23Å
375	Q	91.1	Very high	90.5	Very high	70 Å²	70	32.9 Å²	32.9	33%	0.327	15%	0.146	S	C	.	.	H	α-helix	trans	-54.2	-45.5	174.6	-79.8	169.4	-13.5	0	0	110.8	D371 R372 L378 G379 S401 T402	D371-Q375 WeakPolarHBondContact O-CB 3.48Å; D371-Q375 VanDerWaalsContact O-CG 3.27Å; D371-Q375 WeakPolarHBondContact O-CG 3.49Å; D371-Q375 PolarHBondContact O-N 3.33Å; R372-Q375 PolarHBondContact O-N 3.12Å; Q375-L378 PolarHBondContact O-N 3.14Å; Q375-G379 PolarHBondContact O-N 3.25Å; Q375-S401 WeakPolarHBondContact CB-O 3.39Å; Q375-S401 WeakPolarHBondContact O-CB 3.33Å; Q375-T402 VanDerWaalsContact CD-OG1 3.24Å; Q375-T402 PolarHBondContact NE2-OG1 3.07Å
376	R	89.9	Confident	91	Very high	10 Å²	10	30 Å²	30	4%	0.038	13%	0.132	C	C	.	.	H	α-helix	trans	-64.1	-45	177	-171.8	173.4	66.4	172.8	-3.7	113.6	Y63 D65 D326 R372 R373 R374 L378 G379 L380 F427 Y428	Y63-R376 WeakPolarHBondContact OH-CD 3.47Å; Y63-R376 PolarHBondContact OH-NE 3.42Å; Y63-R376 PolarHBondContact OH-NH1 2.84Å; D65-R376 PolarHBondContact O-NH1 2.72Å; D326-R376 IonicContact OD2-CZ 2.79Å; D326-R376 IonicContact OD2-NE 3.56Å; D326-R376 IonicContact OD2-NH2 3.67Å; D326-R376 PolarHBondContact OD2-NH2 3.08Å; R372-R376 PolarHBondContact O-N 2.88Å; R372-R376 VanDerWaalsContact O-N 3.11Å; R373-R376 PolarHBondContact O-N 3.43Å; R374-R376 VanDerWaalsContact C-N 3.25Å; R374-R376 PolarHBondContact O-N 2.91Å; R376-L378 VanDerWaalsContact C-N 3.3Å; R376-L378 PolarHBondContact O-N 3.08Å; R376-G379 PolarHBondContact O-N 2.8Å; R376-G379 VanDerWaalsContact O-N 3.13Å; R376-L380 PolarHBondContact O-N 3.49Å; R376-F427 VanDerWaalsContact CD-CG 3.4Å; R376-F427 HydrophobicContact CG-CB 4.39Å; R376-F427 HydrophobicContact CG-CD1 3.36Å; R376-F427 HydrophobicContact CG-CD2 4.46Å; R376-F427 HydrophobicContact CG-CE1 3.57Å; R376-F427 HydrophobicContact CG-CG 3.83Å; R376-F427 HydrophobicContact CG-CZ 4.18Å; R376-F427 VanDerWaalsContact CZ-CE2 3.4Å; R376-F427 VanDerWaalsContact NE-CD2 3.28Å; R376-F427 VanDerWaalsContact NE-CE2 3.33Å; R376-Y428 HydrophobicContact CG-CE1 4.07Å; R376-Y428 WeakPolarHBondContact O-CE1 3.48Å
377	V	92.3	Very high	91.4	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	13%	0.125	C	C	.	.	H	α-helix	trans	-61.8	-39.5	176.6	172.4	0	0	0	0	111.2	W325 D326 A329 I333 R373 R374 G379 L380 L381 F427	W325-V377 HydrophobicContact CH2-CB 4.49Å; W325-V377 HydrophobicContact CH2-CG2 4.11Å; W325-V377 HydrophobicContact CZ3-CB 4.34Å; W325-V377 HydrophobicContact CZ3-CG1 4.47Å; W325-V377 HydrophobicContact CZ3-CG2 3.8Å; D326-V377 HydrophobicContact CB-CG2 3.77Å; A329-V377 HydrophobicContact CB-CG1 4.11Å; A329-V377 HydrophobicContact CB-CG2 4.15Å; I333-V377 HydrophobicContact CD1-CG1 3.87Å; R373-V377 WeakPolarHBondContact O-CG2 3.46Å; R373-V377 PolarHBondContact O-N 3.42Å; R374-V377 PolarHBondContact O-N 2.87Å; V377-G379 VanDerWaalsContact C-N 3.33Å; V377-L380 PolarHBondContact O-N 2.93Å; V377-L381 HydrophobicContact CG1-CD1 4.42Å; V377-L381 WeakPolarHBondContact O-CG 3.44Å; V377-L381 PolarHBondContact O-N 2.93Å; V377-F427 HydrophobicContact CG2-CZ 4.24Å
378	L	94	Very high	91.5	Very high	5 Å²	5	29.5 Å²	29.5	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-64.9	-37.3	173.9	-68.8	167.3	0	0	0	111.8	R374 Q375 R376 L380 L381 G382 Y397 Q400	R374-L378 HydrophobicContact CG-CD1 3.87Å; R374-L378 HydrophobicContact CG-CG 4.38Å; R374-L378 WeakPolarHBondContact O-CB 3.39Å; R374-L378 VanDerWaalsContact O-CG 3.28Å; R374-L378 WeakPolarHBondContact O-CG 3.39Å; R374-L378 PolarHBondContact O-N 3.23Å; Q375-L378 PolarHBondContact O-N 3.14Å; R376-L378 VanDerWaalsContact C-N 3.3Å; R376-L378 PolarHBondContact O-N 3.08Å; L378-L380 VanDerWaalsContact C-N 3.34Å; L378-L380 PolarHBondContact O-N 3.32Å; L378-L381 HydrophobicContact CD2-CD1 4.23Å; L378-L381 WeakPolarHBondContact O-CB 3.49Å; L378-L381 PolarHBondContact O-N 2.93Å; L378-G382 PolarHBondContact O-N 3.27Å; L378-Y397 HydrophobicContact CD2-CD1 3.86Å; L378-Y397 HydrophobicContact CD2-CE1 4.22Å; L378-Q400 HydrophobicContact CD1-CB 3.99Å
379	G	92.8	Very high	91.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.2	-40.4	175	0	0	0	0	0	111.9	Q375 R376 V377 G382 F383 S401	Q375-G379 PolarHBondContact O-N 3.25Å; R376-G379 PolarHBondContact O-N 2.8Å; R376-G379 VanDerWaalsContact O-N 3.13Å; V377-G379 VanDerWaalsContact C-N 3.33Å; G379-G382 PolarHBondContact O-N 2.8Å; G379-F383 WeakPolarHBondContact O-CD2 3.39Å; G379-F383 PolarHBondContact O-N 3.21Å; G379-S401 VanDerWaalsContact CA-CB 3.44Å; G379-S401 WeakPolarHBondContact CA-OG 3.37Å
380	L	93.1	Very high	91.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.4	-39.7	173.9	177	65	0	0	0	111.8	R330 I333 R376 V377 L378 G382 F383 Y384 F427 Y428 L430	R330-L380 HydrophobicContact CB-CD2 3.71Å; R330-L380 HydrophobicContact CG-CD2 3.55Å; I333-L380 HydrophobicContact CB-CD2 4.25Å; I333-L380 HydrophobicContact CD1-CD2 3.91Å; I333-L380 HydrophobicContact CD1-CG 4.3Å; I333-L380 HydrophobicContact CG2-CD2 4.23Å; I333-L380 HydrophobicContact CG2-CG 4.12Å; R376-L380 PolarHBondContact O-N 3.49Å; V377-L380 PolarHBondContact O-N 2.93Å; L378-L380 VanDerWaalsContact C-N 3.34Å; L378-L380 PolarHBondContact O-N 3.32Å; L380-G382 VanDerWaalsContact C-N 3.3Å; L380-F383 PolarHBondContact O-N 3.26Å; L380-Y384 WeakPolarHBondContact O-CB 3.32Å; L380-Y384 PolarHBondContact O-N 2.89Å; L380-F427 HydrophobicContact CB-CD1 4.16Å; L380-F427 HydrophobicContact CB-CE1 3.88Å; L380-F427 HydrophobicContact CD2-CD1 4.26Å; L380-F427 HydrophobicContact CD2-CE1 3.74Å; L380-F427 HydrophobicContact CD2-CZ 4.4Å; L380-F427 HydrophobicContact CG-CE1 4.41Å; L380-Y428 HydrophobicContact CB-CD1 4.11Å; L380-Y428 HydrophobicContact CB-CE1 4.4Å; L380-L430 HydrophobicContact CD1-CD1 3.89Å; L380-L430 HydrophobicContact CD1-CG 4.33Å
381	L	93.3	Very high	91.9	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-62	-40.1	172.2	-76.2	168	0	0	0	111.6	I333 L338 F342 V377 L378 Y384 H385 Y397	I333-L381 HydrophobicContact CD1-CD2 3.78Å; I333-L381 HydrophobicContact CD1-CG 3.76Å; I333-L381 HydrophobicContact CG1-CD2 3.81Å; I333-L381 HydrophobicContact CG1-CG 4.36Å; I333-L381 HydrophobicContact CG2-CD2 4.36Å; L338-L381 HydrophobicContact CD2-CD2 3.73Å; F342-L381 HydrophobicContact CE1-CD1 3.76Å; F342-L381 HydrophobicContact CZ-CD1 3.65Å; F342-L381 HydrophobicContact CZ-CD2 4.47Å; V377-L381 HydrophobicContact CG1-CD1 4.42Å; V377-L381 WeakPolarHBondContact O-CG 3.44Å; V377-L381 PolarHBondContact O-N 2.93Å; L378-L381 HydrophobicContact CD2-CD1 4.23Å; L378-L381 WeakPolarHBondContact O-CB 3.49Å; L378-L381 PolarHBondContact O-N 2.93Å; L381-Y384 PolarHBondContact O-N 2.73Å; L381-H385 PolarHBondContact O-CD2 3.45Å; L381-H385 PolarHBondContact O-N 3.08Å; L381-Y397 HydrophobicContact CB-CD1 4.21Å; L381-Y397 HydrophobicContact CB-CD2 4.33Å; L381-Y397 HydrophobicContact CB-CG 4.13Å; L381-Y397 HydrophobicContact CD1-CE1 4.28Å
382	G	93.7	Very high	92	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-55.5	-51	172.1	0	0	0	0	0	111.3	L378 G379 L380 Y384 H385 F386 A394 F398	L378-G382 PolarHBondContact O-N 3.27Å; G379-G382 PolarHBondContact O-N 2.8Å; L380-G382 VanDerWaalsContact C-N 3.3Å; G382-Y384 PolarHBondContact O-N 3.42Å; G382-H385 PolarHBondContact O-N 3.09Å; G382-F386 VanDerWaalsContact O-CB 3.23Å; G382-F386 WeakPolarHBondContact O-CB 3.45Å; G382-F386 PolarHBondContact O-N 3.5Å; G382-A394 WeakPolarHBondContact O-CB 3.26Å; G382-F398 WeakPolarHBondContact O-CZ 3.38Å
383	F	94.1	Very high	92.2	Very high	1 Å²	1	31.5 Å²	31.5	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-65.8	-35.1	176.6	-77.6	-57.7	0	0	0	114	G379 L380 F386 E387 F398 I403 E407 I408 R411 Y428 L430	G379-F383 WeakPolarHBondContact O-CD2 3.39Å; G379-F383 PolarHBondContact O-N 3.21Å; L380-F383 PolarHBondContact O-N 3.26Å; F383-F386 WeakPolarHBondContact O-CB 2.85Å; F383-F386 PolarHBondContact O-N 2.77Å; F383-E387 WeakPolarHBondContact O-CG 3.39Å; F383-E387 PolarHBondContact O-N 3.45Å; F383-F398 HydrophobicContact CD1-CE1 4.07Å; F383-F398 AromaticContact CD1-CZ 3.88Å; F383-F398 HydrophobicContact CD1-CZ 3.88Å; F383-F398 HydrophobicContact CD2-CE1 4.24Å; F383-F398 HydrophobicContact CE1-CE1 4.17Å; F383-F398 HydrophobicContact CE1-CZ 4.06Å; F383-F398 HydrophobicContact CE2-CE1 4.42Å; F383-F398 HydrophobicContact CG-CE1 4.08Å; F383-F398 HydrophobicContact CG-CZ 4.26Å; F383-F398 HydrophobicContact CZ-CE1 4.34Å; F383-I403 HydrophobicContact CD2-CD1 3.9Å; F383-I403 HydrophobicContact CE2-CD1 3.22Å; F383-I403 HydrophobicContact CE2-CG1 4.47Å; F383-I403 HydrophobicContact CZ-CD1 3.8Å; F383-E407 HydrophobicContact CE2-CB 4.05Å; F383-E407 HydrophobicContact CZ-CB 3.71Å; F383-I408 HydrophobicContact CE1-CG1 4.4Å; F383-I408 HydrophobicContact CZ-CG1 4.24Å; F383-R411 HydrophobicContact CE1-CG 4.05Å; F383-Y428 AromaticContact CD2-CD1 3.74Å; F383-Y428 HydrophobicContact CD2-CD1 3.74Å; F383-Y428 HydrophobicContact CD2-CD2 4.35Å; F383-Y428 AromaticContact CD2-CG 3.64Å; F383-Y428 HydrophobicContact CD2-CG 3.64Å; F383-Y428 HydrophobicContact CE2-CD1 4.07Å; F383-Y428 AromaticContact CE2-CD2 3.87Å; F383-Y428 HydrophobicContact CE2-CD2 3.87Å; F383-Y428 AromaticContact CE2-CG 3.63Å; F383-Y428 HydrophobicContact CE2-CG 3.63Å; F383-L430 HydrophobicContact CB-CD1 3.92Å
384	Y	92.9	Very high	92.3	Very high	21 Å²	21	31.2 Å²	31.2	8%	0.082	15%	0.146	C	C	.	.	H	α-helix	trans	-62	-46.5	174.8	178.4	-89.1	0	0	0	112.4	I333 G336 L338 L380 L381 G382 F386 K388 L430	I333-Y384 HydrophobicContact CG2-CD2 3.73Å; I333-Y384 HydrophobicContact CG2-CE2 4.45Å; I333-Y384 HydrophobicContact CG2-CG 3.89Å; I333-Y384 VanDerWaalsContact O-CE2 3.22Å; I333-Y384 WeakPolarHBondContact O-CE2 3.38Å; G336-Y384 WeakPolarHBondContact CA-OH 3.46Å; L338-Y384 HydrophobicContact CD1-CD1 4.28Å; L338-Y384 HydrophobicContact CD1-CE1 3.81Å; L338-Y384 HydrophobicContact CD2-CD1 4.1Å; L338-Y384 HydrophobicContact CD2-CE1 3.9Å; L338-Y384 HydrophobicContact CG-CE1 4.17Å; L380-Y384 WeakPolarHBondContact O-CB 3.32Å; L380-Y384 PolarHBondContact O-N 2.89Å; L381-Y384 PolarHBondContact O-N 2.73Å; G382-Y384 PolarHBondContact O-N 3.42Å; Y384-F386 VanDerWaalsContact C-N 3.35Å; Y384-K388 HydrophobicContact CD1-CD 4.33Å; Y384-K388 HydrophobicContact CE1-CD 3.69Å; Y384-K388 VanDerWaalsContact CZ-CE 3.45Å; Y384-K388 WeakPolarHBondContact O-CG 3.27Å; Y384-K388 PolarHBondContact O-N 3.19Å; Y384-K388 WeakPolarHBondContact OH-CE 3.44Å; Y384-K388 PolarHBondContact OH-NZ 3.25Å; Y384-L430 HydrophobicContact CD2-CD2 3.78Å; Y384-L430 HydrophobicContact CG-CD2 4.32Å
385	H	92.9	Very high	92.3	Very high	10 Å²	10	28 Å²	28	5%	0.046	14%	0.138	C	C	.	.	H	α-helix	trans	-70.7	-33.4	175.6	-75.4	-70.3	0	0	0	112	L381 G382 K388 G389 E390 K393 A394 Y397	L381-H385 PolarHBondContact O-CD2 3.45Å; L381-H385 PolarHBondContact O-N 3.08Å; G382-H385 PolarHBondContact O-N 3.09Å; H385-K388 PolarHBondContact O-N 3.18Å; H385-G389 PolarHBondContact O-N 3.02Å; H385-E390 HydrophobicContact CB-CB 4.3Å; H385-E390 IonicContact CE1-OE2 2.66Å; H385-E390 PolarHBondContact CE1-OE2 2.87Å; H385-E390 VanDerWaalsContact CE1-OE2 3.22Å; H385-E390 IonicContact CG-OE2 3.39Å; H385-E390 IonicContact ND1-OE2 2.73Å; H385-E390 PolarHBondContact ND1-OE2 3.37Å; H385-E390 PolarHBondContact O-N 2.91Å; H385-K393 HydrophobicContact CB-CB 4.29Å; H385-A394 HydrophobicContact CB-CB 4.06Å; H385-Y397 AromaticContact CD2-CD2 3.58Å; H385-Y397 AromaticContact CD2-CE2 3.29Å; H385-Y397 WeakPolarHBondContact CD2-CE2 3.49Å; H385-Y397 AromaticContact NE2-CE2 3.51Å
386	F	93.5	Very high	92.4	Very high	1 Å²	1	26.8 Å²	26.8	0%	0.004	14%	0.137	C	C	.	.	H	α-helix	trans	-61.4	-51.1	174.4	-178.1	-96.9	0	0	0	111.4	G382 F383 Y384 K388 G389 L391 A394 F398 R411 Y412 T454 L457 Y483 F486	G382-F386 VanDerWaalsContact O-CB 3.23Å; G382-F386 WeakPolarHBondContact O-CB 3.45Å; G382-F386 PolarHBondContact O-N 3.5Å; F383-F386 WeakPolarHBondContact O-CB 2.85Å; F383-F386 PolarHBondContact O-N 2.77Å; Y384-F386 VanDerWaalsContact C-N 3.35Å; F386-K388 PolarHBondContact O-N 3.34Å; F386-G389 PolarHBondContact O-N 3.26Å; F386-L391 HydrophobicContact CD2-CD2 3.98Å; F386-L391 HydrophobicContact CE2-CD2 4.25Å; F386-A394 HydrophobicContact CB-CB 3.99Å; F386-F398 HydrophobicContact CB-CE2 4.28Å; F386-F398 HydrophobicContact CB-CZ 4.02Å; F386-F398 HydrophobicContact CD2-CE2 4.19Å; F386-F398 HydrophobicContact CG-CE2 4.5Å; F386-F398 HydrophobicContact CG-CZ 4.4Å; F386-R411 HydrophobicContact CE1-CB 4.29Å; F386-Y412 HydrophobicContact CE2-CE2 4.19Å; F386-Y412 WeakPolarHBondContact CE2-OH 3.08Å; F386-Y412 AromaticContact CZ-CE2 3.7Å; F386-Y412 HydrophobicContact CZ-CE2 3.7Å; F386-Y412 AromaticContact CZ-CZ 3.93Å; F386-T454 HydrophobicContact CE1-CG2 4.15Å; F386-T454 HydrophobicContact CZ-CG2 3.83Å; F386-L457 HydrophobicContact CD1-CD1 4.16Å; F386-L457 HydrophobicContact CE1-CD1 3.89Å; F386-Y483 HydrophobicContact CD1-CE1 4.27Å; F386-Y483 HydrophobicContact CD2-CD1 4.36Å; F386-Y483 HydrophobicContact CD2-CE1 4.09Å; F386-Y483 HydrophobicContact CE1-CD1 4.23Å; F386-Y483 AromaticContact CE1-CE1 3.92Å; F386-Y483 HydrophobicContact CE1-CE1 3.92Å; F386-Y483 AromaticContact CE2-CD1 3.59Å; F386-Y483 HydrophobicContact CE2-CD1 3.59Å; F386-Y483 AromaticContact CE2-CE1 3.73Å; F386-Y483 HydrophobicContact CE2-CE1 3.73Å; F386-Y483 HydrophobicContact CG-CE1 4.35Å; F386-Y483 AromaticContact CZ-CD1 3.52Å; F386-Y483 HydrophobicContact CZ-CD1 3.52Å; F386-Y483 AromaticContact CZ-CE1 3.64Å; F386-Y483 HydrophobicContact CZ-CE1 3.64Å; F386-Y483 PolarHBondContact O-OH 2.84Å; F386-F486 HydrophobicContact CD2-CD1 4.41Å; F386-F486 AromaticContact CD2-CE1 3.86Å; F386-F486 HydrophobicContact CD2-CE1 3.86Å; F386-F486 AromaticContact CE2-CD1 4Å; F386-F486 HydrophobicContact CE2-CD1 4Å; F386-F486 AromaticContact CE2-CE1 3.76Å; F386-F486 HydrophobicContact CE2-CE1 3.76Å
387	E	90.3	Very high	92.6	Very high	10 Å²	10	28.3 Å²	28.3	5%	0.047	14%	0.143	C	C	.	.	H	α-helix	trans	-64	-28.5	178.7	-69.9	-171.7	-179.4	0	0	112.2	F383 G389 R411 L430 H431 L457 R461	F383-E387 WeakPolarHBondContact O-CG 3.39Å; F383-E387 PolarHBondContact O-N 3.45Å; E387-G389 VanDerWaalsContact C-N 3.31Å; E387-G389 PolarHBondContact O-N 3.36Å; E387-R411 IonicContact OE1-NH1 3.55Å; E387-R411 PolarHBondContact OE1-NH1 3.49Å; E387-R411 VanDerWaalsContact OE1-NH1 3.16Å; E387-L430 WeakPolarHBondContact OE2-CB 3.47Å; E387-L430 WeakPolarHBondContact OE2-CD2 3.21Å; E387-H431 IonicContact OE2-CE1 2.71Å; E387-H431 PolarHBondContact OE2-CE1 2.95Å; E387-H431 IonicContact OE2-ND1 3.39Å; E387-L457 HydrophobicContact CB-CD2 3.92Å; E387-L457 HydrophobicContact CG-CD1 4.07Å; E387-L457 HydrophobicContact CG-CD2 3.92Å; E387-R461 PolarHBondContact O-NE 3.09Å; E387-R461 PolarHBondContact O-NH2 2.85Å
388	K	88.5	Confident	92.6	Very high	97 Å²	97	28.2 Å²	28.2	42%	0.422	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-7.7	172.7	-78.7	-168.7	165.3	-169.9	0	115.3	Y384 H385 F386 E390	Y384-K388 HydrophobicContact CD1-CD 4.33Å; Y384-K388 HydrophobicContact CE1-CD 3.69Å; Y384-K388 VanDerWaalsContact CZ-CE 3.45Å; Y384-K388 WeakPolarHBondContact O-CG 3.27Å; Y384-K388 PolarHBondContact O-N 3.19Å; Y384-K388 WeakPolarHBondContact OH-CE 3.44Å; Y384-K388 PolarHBondContact OH-NZ 3.25Å; H385-K388 PolarHBondContact O-N 3.18Å; F386-K388 PolarHBondContact O-N 3.34Å; K388-E390 VanDerWaalsContact C-N 3.29Å; K388-E390 HydrophobicContact CB-CG 4.47Å; K388-E390 PolarHBondContact O-N 3Å
389	G	88.2	Confident	92.3	Very high	12 Å²	12	31.6 Å²	31.6	12%	0.124	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	8.5	-174.9	0	0	0	0	0	114.9	H385 F386 E387 L391	H385-G389 PolarHBondContact O-N 3.02Å; F386-G389 PolarHBondContact O-N 3.26Å; E387-G389 VanDerWaalsContact C-N 3.31Å; E387-G389 PolarHBondContact O-N 3.36Å; G389-L391 PolarHBondContact O-N 3.23Å
390	E	92.7	Very high	92.1	Very high	73 Å²	73	36.2 Å²	36.2	34%	0.341	18%	0.18	S	C	.	.			trans	-84.5	65.4	174.7	-63.1	-170.8	136.9	0	0	110.7	H385 K388 D392 K393 A394	H385-E390 HydrophobicContact CB-CB 4.3Å; H385-E390 IonicContact CE1-OE2 2.66Å; H385-E390 PolarHBondContact CE1-OE2 2.87Å; H385-E390 VanDerWaalsContact CE1-OE2 3.22Å; H385-E390 IonicContact CG-OE2 3.39Å; H385-E390 IonicContact ND1-OE2 2.73Å; H385-E390 PolarHBondContact ND1-OE2 3.37Å; H385-E390 PolarHBondContact O-N 2.91Å; K388-E390 VanDerWaalsContact C-N 3.29Å; K388-E390 HydrophobicContact CB-CG 4.47Å; K388-E390 PolarHBondContact O-N 3Å; E390-D392 PolarHBondContact O-N 2.9Å; E390-K393 HydrophobicContact CB-CB 4.41Å; E390-K393 HydrophobicContact CB-CD 4.23Å; E390-K393 VanDerWaalsContact CD-NZ 3.25Å; E390-K393 PolarHBondContact O-N 3.34Å; E390-K393 IonicContact OE1-NZ 3.57Å; E390-K393 PolarHBondContact OE1-NZ 2.96Å; E390-K393 WeakPolarHBondContact OE2-CD 3.25Å; E390-K393 IonicContact OE2-NZ 2.7Å; E390-K393 PolarHBondContact OE2-NZ 2.94Å; E390-A394 PolarHBondContact O-N 2.94Å
391	L	93	Very high	91.8	Very high	16 Å²	16	36.4 Å²	36.4	8%	0.084	18%	0.181	C	C	.	.	H	α-helix	trans	-59.9	-40.7	-167	-61.2	177.2	0	0	0	113.8	F386 G389 K393 A394 A395 R482 Y483 F486	F386-L391 HydrophobicContact CD2-CD2 3.98Å; F386-L391 HydrophobicContact CE2-CD2 4.25Å; G389-L391 PolarHBondContact O-N 3.23Å; L391-K393 VanDerWaalsContact C-N 3.35Å; L391-K393 PolarHBondContact O-N 2.82Å; L391-A394 WeakPolarHBondContact O-CB 3.44Å; L391-A394 PolarHBondContact O-N 3.45Å; L391-A394 VanDerWaalsContact O-N 3.16Å; L391-A395 PolarHBondContact O-N 2.88Å; L391-R482 HydrophobicContact CD1-CB 4.46Å; L391-Y483 HydrophobicContact CD2-CD1 3.8Å; L391-Y483 HydrophobicContact CD2-CE1 3.61Å; L391-F486 HydrophobicContact CB-CB 4.37Å; L391-F486 HydrophobicContact CB-CD2 3.6Å; L391-F486 HydrophobicContact CB-CE2 3.98Å; L391-F486 HydrophobicContact CB-CG 3.99Å; L391-F486 HydrophobicContact CD1-CB 3.74Å; L391-F486 HydrophobicContact CD1-CG 4.14Å; L391-F486 HydrophobicContact CD2-CD1 4.11Å; L391-F486 HydrophobicContact CD2-CD2 4.44Å; L391-F486 HydrophobicContact CD2-CE1 4.47Å; L391-F486 HydrophobicContact CD2-CG 4.09Å; L391-F486 HydrophobicContact CG-CB 4.41Å; L391-F486 HydrophobicContact CG-CD2 4.39Å; L391-F486 HydrophobicContact CG-CG 4.28Å; L391-F486 WeakPolarHBondContact O-CE2 3.32Å
392	D	93.2	Very high	91.2	Very high	145 Å²	145	40.4 Å²	40.4	78%	0.775	21%	0.206	S	C	*	.	H	α-helix	trans	-63.3	-41.1	179.2	-61.1	-40.7	0	0	0	112.4	E390 S396	E390-D392 PolarHBondContact O-N 2.9Å; D392-S396 PolarHBondContact O-N 3.43Å
393	K	93.1	Very high	90.9	Very high	99 Å²	99	40.6 Å²	40.6	43%	0.43	21%	0.207	S	C	.	.	H	α-helix	trans	-66.8	-43	174.7	-66	178.1	-170	164.9	0	109.9	H385 E390 L391 A395 S396 Y397	H385-K393 HydrophobicContact CB-CB 4.29Å; E390-K393 HydrophobicContact CB-CB 4.41Å; E390-K393 HydrophobicContact CB-CD 4.23Å; E390-K393 VanDerWaalsContact CD-NZ 3.25Å; E390-K393 PolarHBondContact O-N 3.34Å; E390-K393 IonicContact OE1-NZ 3.57Å; E390-K393 PolarHBondContact OE1-NZ 2.96Å; E390-K393 WeakPolarHBondContact OE2-CD 3.25Å; E390-K393 IonicContact OE2-NZ 2.7Å; E390-K393 PolarHBondContact OE2-NZ 2.94Å; L391-K393 VanDerWaalsContact C-N 3.35Å; L391-K393 PolarHBondContact O-N 2.82Å; K393-A395 PolarHBondContact O-N 3.36Å; K393-S396 PolarHBondContact O-N 3.39Å; K393-S396 VanDerWaalsContact O-N 3.16Å; K393-S396 PolarHBondContact O-OG 2.9Å; K393-Y397 HydrophobicContact CB-CE2 4.4Å; K393-Y397 WeakPolarHBondContact O-CD2 3.12Å; K393-Y397 PolarHBondContact O-N 2.98Å; K393-Y397 VanDerWaalsContact O-N 3.16Å
394	A	93.7	Very high	90.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.5	-48	177.2	0	0	0	0	0	111.6	G382 H385 F386 E390 L391 S396 Y397 F398 F486	G382-A394 WeakPolarHBondContact O-CB 3.26Å; H385-A394 HydrophobicContact CB-CB 4.06Å; F386-A394 HydrophobicContact CB-CB 3.99Å; E390-A394 PolarHBondContact O-N 2.94Å; L391-A394 WeakPolarHBondContact O-CB 3.44Å; L391-A394 PolarHBondContact O-N 3.45Å; L391-A394 VanDerWaalsContact O-N 3.16Å; A394-S396 VanDerWaalsContact C-N 3.33Å; A394-S396 PolarHBondContact O-N 3.46Å; A394-Y397 PolarHBondContact O-N 2.83Å; A394-Y397 VanDerWaalsContact O-N 3.14Å; A394-F398 HydrophobicContact CB-CD2 4.37Å; A394-F398 HydrophobicContact CB-CE2 3.91Å; A394-F398 WeakPolarHBondContact O-CD2 3.35Å; A394-F398 VanDerWaalsContact O-CG 3.32Å; A394-F398 WeakPolarHBondContact O-CG 3.43Å; A394-F398 PolarHBondContact O-N 2.82Å; A394-F486 HydrophobicContact CB-CZ 4.49Å
395	A	92.4	Very high	90.4	Very high	17 Å²	17	41.9 Å²	41.9	14%	0.14	22%	0.215	C	C	.	.	H	α-helix	trans	-54.4	-47.4	174.3	0	0	0	0	0	112.2	L391 K393 Y397 F398 E399 F486 F490	L391-A395 PolarHBondContact O-N 2.88Å; K393-A395 PolarHBondContact O-N 3.36Å; A395-Y397 PolarHBondContact O-N 3.35Å; A395-F398 PolarHBondContact O-N 3.43Å; A395-E399 WeakPolarHBondContact O-CB 3.19Å; A395-E399 VanDerWaalsContact O-CG 3.29Å; A395-E399 WeakPolarHBondContact O-CG 3.43Å; A395-E399 PolarHBondContact O-N 3Å; A395-F486 HydrophobicContact CB-CE2 3.71Å; A395-F486 HydrophobicContact CB-CZ 4.2Å; A395-F490 HydrophobicContact CB-CD2 3.97Å; A395-F490 HydrophobicContact CB-CE2 4.2Å
396	S	92.7	Very high	90.3	Very high	44 Å²	44	44.5 Å²	44.5	31%	0.308	23%	0.225	S	C	.	.	H	α-helix	trans	-60.7	-33.5	-179.5	78.4	0	0	0	0	113.3	D392 K393 A394 Q400	D392-S396 PolarHBondContact O-N 3.43Å; K393-S396 PolarHBondContact O-N 3.39Å; K393-S396 VanDerWaalsContact O-N 3.16Å; K393-S396 PolarHBondContact O-OG 2.9Å; A394-S396 VanDerWaalsContact C-N 3.33Å; A394-S396 PolarHBondContact O-N 3.46Å; S396-Q400 VanDerWaalsContact O-CG 3.27Å; S396-Q400 WeakPolarHBondContact O-CG 3.1Å; S396-Q400 PolarHBondContact O-N 3.41Å; S396-Q400 PolarHBondContact O-NE2 2.85Å; S396-Q400 VanDerWaalsContact O-NE2 3.16Å
397	Y	93.7	Very high	90.1	Very high	41 Å²	41	45 Å²	45	16%	0.161	23%	0.227	C	C	.	.	H	α-helix	trans	-80.9	-35.7	176.9	-71.3	-60.4	0	0	0	112.3	F342 L378 L381 H385 K393 A394 A395 E399 Q400 S401	F342-Y397 HydrophobicContact CZ-CE1 4.15Å; F342-Y397 WeakPolarHBondContact CZ-OH 3.44Å; L378-Y397 HydrophobicContact CD2-CD1 3.86Å; L378-Y397 HydrophobicContact CD2-CE1 4.22Å; L381-Y397 HydrophobicContact CB-CD1 4.21Å; L381-Y397 HydrophobicContact CB-CD2 4.33Å; L381-Y397 HydrophobicContact CB-CG 4.13Å; L381-Y397 HydrophobicContact CD1-CE1 4.28Å; H385-Y397 AromaticContact CD2-CD2 3.58Å; H385-Y397 AromaticContact CD2-CE2 3.29Å; H385-Y397 WeakPolarHBondContact CD2-CE2 3.49Å; H385-Y397 AromaticContact NE2-CE2 3.51Å; K393-Y397 HydrophobicContact CB-CE2 4.4Å; K393-Y397 WeakPolarHBondContact O-CD2 3.12Å; K393-Y397 PolarHBondContact O-N 2.98Å; K393-Y397 VanDerWaalsContact O-N 3.16Å; A394-Y397 PolarHBondContact O-N 2.83Å; A394-Y397 VanDerWaalsContact O-N 3.14Å; A395-Y397 PolarHBondContact O-N 3.35Å; Y397-E399 VanDerWaalsContact C-N 3.33Å; Y397-Q400 PolarHBondContact O-N 3.35Å; Y397-S401 VanDerWaalsContact O-CB 3.24Å; Y397-S401 WeakPolarHBondContact O-CB 3.23Å; Y397-S401 PolarHBondContact O-N 3.44Å; Y397-S401 PolarHBondContact O-OG 3.08Å
398	F	92.4	Very high	90.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-42.4	172.1	-65.8	-40.6	0	0	0	111.6	G382 F383 F386 A394 A395 Q400 S401 I403 I408 F486 F490	G382-F398 WeakPolarHBondContact O-CZ 3.38Å; F383-F398 HydrophobicContact CD1-CE1 4.07Å; F383-F398 AromaticContact CD1-CZ 3.88Å; F383-F398 HydrophobicContact CD1-CZ 3.88Å; F383-F398 HydrophobicContact CD2-CE1 4.24Å; F383-F398 HydrophobicContact CE1-CE1 4.17Å; F383-F398 HydrophobicContact CE1-CZ 4.06Å; F383-F398 HydrophobicContact CE2-CE1 4.42Å; F383-F398 HydrophobicContact CG-CE1 4.08Å; F383-F398 HydrophobicContact CG-CZ 4.26Å; F383-F398 HydrophobicContact CZ-CE1 4.34Å; F386-F398 HydrophobicContact CB-CE2 4.28Å; F386-F398 HydrophobicContact CB-CZ 4.02Å; F386-F398 HydrophobicContact CD2-CE2 4.19Å; F386-F398 HydrophobicContact CG-CE2 4.5Å; F386-F398 HydrophobicContact CG-CZ 4.4Å; A394-F398 HydrophobicContact CB-CD2 4.37Å; A394-F398 HydrophobicContact CB-CE2 3.91Å; A394-F398 WeakPolarHBondContact O-CD2 3.35Å; A394-F398 VanDerWaalsContact O-CG 3.32Å; A394-F398 WeakPolarHBondContact O-CG 3.43Å; A394-F398 PolarHBondContact O-N 2.82Å; A395-F398 PolarHBondContact O-N 3.43Å; F398-Q400 VanDerWaalsContact C-N 3.3Å; F398-Q400 PolarHBondContact O-N 2.95Å; F398-S401 VanDerWaalsContact CA-OG 3.31Å; F398-S401 WeakPolarHBondContact CA-OG 3.3Å; F398-S401 PolarHBondContact O-N 3.07Å; F398-S401 PolarHBondContact O-OG 3.2Å; F398-I403 HydrophobicContact CB-CG2 4.32Å; F398-I403 HydrophobicContact CD1-CD1 4.16Å; F398-I403 HydrophobicContact CD1-CG2 4.05Å; F398-I403 HydrophobicContact CE1-CD1 4.18Å; F398-I403 HydrophobicContact CG-CG2 4.5Å; F398-I408 HydrophobicContact CB-CD1 4.31Å; F398-I408 HydrophobicContact CD1-CD1 4.15Å; F398-I408 HydrophobicContact CD2-CD1 3.87Å; F398-I408 HydrophobicContact CE1-CD1 4.42Å; F398-I408 HydrophobicContact CE2-CD1 4.16Å; F398-I408 HydrophobicContact CG-CD1 3.87Å; F398-I408 HydrophobicContact CZ-CD1 4.43Å; F398-F486 HydrophobicContact CD2-CZ 4.3Å; F398-F486 HydrophobicContact CE2-CZ 4.29Å; F398-F490 HydrophobicContact CB-CE2 3.95Å; F398-F490 HydrophobicContact CB-CZ 3.7Å
399	E	89	Confident	90.2	Very high	75 Å²	75	39.9 Å²	39.9	35%	0.35	21%	0.205	S	C	.	.	H	α-helix	trans	-59	-39.8	174.6	-74	179.8	-177.4	0	0	112.7	A395 Y397 F490 K493 H494	A395-E399 WeakPolarHBondContact O-CB 3.19Å; A395-E399 VanDerWaalsContact O-CG 3.29Å; A395-E399 WeakPolarHBondContact O-CG 3.43Å; A395-E399 PolarHBondContact O-N 3Å; Y397-E399 VanDerWaalsContact C-N 3.33Å; E399-F490 HydrophobicContact CG-CE2 4.18Å; E399-K493 WeakPolarHBondContact OE1-CE 3.45Å; E399-K493 IonicContact OE1-NZ 3.22Å; E399-K493 PolarHBondContact OE1-NZ 2.84Å; E399-K493 IonicContact OE2-NZ 2.81Å; E399-H494 VanDerWaalsContact CD-NE2 3.34Å; E399-H494 WeakPolarHBondContact CG-NE2 3.46Å; E399-H494 IonicContact OE1-CD2 3.51Å; E399-H494 IonicContact OE1-CE1 3.08Å; E399-H494 PolarHBondContact OE1-CE1 3.32Å; E399-H494 IonicContact OE1-NE2 3.32Å; E399-H494 PolarHBondContact OE1-NE2 3.43Å
400	Q	88.8	Confident	90.3	Very high	98 Å²	98	41.3 Å²	41.3	46%	0.458	21%	0.207	S	C	.	.	H	α-helix	trans	-79.6	-20.4	179.7	-67.7	173.6	48.8	0	0	113.9	L378 S396 Y397 F398	L378-Q400 HydrophobicContact CD1-CB 3.99Å; S396-Q400 VanDerWaalsContact O-CG 3.27Å; S396-Q400 WeakPolarHBondContact O-CG 3.1Å; S396-Q400 PolarHBondContact O-N 3.41Å; S396-Q400 PolarHBondContact O-NE2 2.85Å; S396-Q400 VanDerWaalsContact O-NE2 3.16Å; Y397-Q400 PolarHBondContact O-N 3.35Å; F398-Q400 VanDerWaalsContact C-N 3.3Å; F398-Q400 PolarHBondContact O-N 2.95Å
401	S	86.5	Confident	90.1	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-92.7	-7.8	-169.6	55.6	0	0	0	0	115.2	Q375 G379 Y397 F398 I403	Q375-S401 WeakPolarHBondContact CB-O 3.39Å; Q375-S401 WeakPolarHBondContact O-CB 3.33Å; G379-S401 VanDerWaalsContact CA-CB 3.44Å; G379-S401 WeakPolarHBondContact CA-OG 3.37Å; Y397-S401 VanDerWaalsContact O-CB 3.24Å; Y397-S401 WeakPolarHBondContact O-CB 3.23Å; Y397-S401 PolarHBondContact O-N 3.44Å; Y397-S401 PolarHBondContact O-OG 3.08Å; F398-S401 VanDerWaalsContact CA-OG 3.31Å; F398-S401 WeakPolarHBondContact CA-OG 3.3Å; F398-S401 PolarHBondContact O-N 3.07Å; F398-S401 PolarHBondContact O-OG 3.2Å; S401-I403 PolarHBondContact O-N 3.06Å
402	T	79.7	Confident	90	Very high	86 Å²	86	37.4 Å²	37.4	53%	0.528	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.9	38.4	-173	54.8	0	0	0	0	112.3	Q375	Q375-T402 VanDerWaalsContact CD-OG1 3.24Å; Q375-T402 PolarHBondContact NE2-OG1 3.07Å
403	I	87.3	Confident	89.5	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.021	17%	0.167	C	C	.	.			trans	-61.2	149.8	-177.6	-162.9	162.9	0	0	0	111.6	F383 F398 S401 I405 E407 I408 Y428 F499	F383-I403 HydrophobicContact CD2-CD1 3.9Å; F383-I403 HydrophobicContact CE2-CD1 3.22Å; F383-I403 HydrophobicContact CE2-CG1 4.47Å; F383-I403 HydrophobicContact CZ-CD1 3.8Å; F398-I403 HydrophobicContact CB-CG2 4.32Å; F398-I403 HydrophobicContact CD1-CD1 4.16Å; F398-I403 HydrophobicContact CD1-CG2 4.05Å; F398-I403 HydrophobicContact CE1-CD1 4.18Å; F398-I403 HydrophobicContact CG-CG2 4.5Å; S401-I403 PolarHBondContact O-N 3.06Å; I403-I405 PolarHBondContact O-N 3.46Å; I403-E407 HydrophobicContact CD1-CB 4.4Å; I403-E407 HydrophobicContact CG1-CB 4.31Å; I403-E407 HydrophobicContact CG1-CG 4.41Å; I403-I408 HydrophobicContact CG2-CD1 4.01Å; I403-I408 HydrophobicContact CG2-CG1 4.44Å; I403-Y428 HydrophobicContact CD1-CD2 4.42Å; I403-Y428 HydrophobicContact CD1-CE1 4.23Å; I403-Y428 HydrophobicContact CD1-CE2 4Å; I403-Y428 HydrophobicContact CG1-CE2 4.09Å; I403-F499 HydrophobicContact CB-CE2 4.36Å; I403-F499 HydrophobicContact CG2-CE2 3.6Å; I403-F499 HydrophobicContact CG2-CZ 3.56Å; I403-F499 WeakPolarHBondContact O-CD2 3.42Å; I403-F499 WeakPolarHBondContact O-CE2 3.42Å; I403-F499 WeakPolarHBondContact O-CZ 3.42Å
404	D	88.2	Confident	89	Confident	48 Å²	48	31.4 Å²	31.4	26%	0.257	17%	0.165	S	C	.	.			trans	-67.6	121.1	170.9	-173.5	-22.9	0	0	0	109.2	R406 E407 H503	D404-R406 PolarHBondContact O-N 2.95Å; D404-R406 VanDerWaalsContact O-N 3.09Å; D404-R406 WeakPolarHBondContact OD1-CB 3.28Å; D404-R406 WeakPolarHBondContact OD1-CG 3.03Å; D404-R406 IonicContact OD1-CZ 3.42Å; D404-R406 PolarHBondContact OD1-N 3.35Å; D404-R406 IonicContact OD1-NE 3.54Å; D404-R406 PolarHBondContact OD1-NE 3.21Å; D404-R406 IonicContact OD1-NH2 2.7Å; D404-R406 IonicContact OD2-CZ 2.82Å; D404-R406 IonicContact OD2-NE 3.59Å; D404-R406 PolarHBondContact OD2-NE 3.02Å; D404-R406 IonicContact OD2-NH2 3.64Å; D404-R406 PolarHBondContact OD2-NH2 2.66Å; D404-E407 HydrophobicContact CB-CG 4.1Å; D404-E407 VanDerWaalsContact O-CB 3.23Å; D404-E407 WeakPolarHBondContact O-CB 3.4Å; D404-E407 WeakPolarHBondContact O-CG 3.49Å; D404-E407 PolarHBondContact O-N 3.27Å; D404-H503 IonicContact OD1-CD2 3.74Å; D404-H503 IonicContact OD1-NE2 3.7Å
405	I	89.7	Confident	88.6	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-58.7	-26.1	-177	-168.8	53.9	0	0	0	112.9	I403 E407 I408 L409 F490 L491 F499 H503 V507	I403-I405 PolarHBondContact O-N 3.46Å; I405-E407 PolarHBondContact O-N 2.94Å; I405-I408 HydrophobicContact CD1-CB 4.22Å; I405-I408 HydrophobicContact CD1-CD1 4.07Å; I405-I408 PolarHBondContact O-N 2.72Å; I405-L409 HydrophobicContact CG1-CD1 4.44Å; I405-L409 HydrophobicContact CG1-CG 4.33Å; I405-L409 WeakPolarHBondContact O-CG 3.46Å; I405-L409 PolarHBondContact O-N 2.67Å; I405-F490 HydrophobicContact CD1-CE1 4.12Å; I405-L491 HydrophobicContact CD1-CD2 3.51Å; I405-L491 HydrophobicContact CG1-CD2 3.82Å; I405-F499 HydrophobicContact CB-CD1 4.48Å; I405-F499 HydrophobicContact CB-CE1 3.77Å; I405-F499 HydrophobicContact CB-CZ 4.27Å; I405-F499 HydrophobicContact CD1-CE1 3.59Å; I405-F499 HydrophobicContact CD1-CZ 4.16Å; I405-F499 HydrophobicContact CG1-CE1 4.01Å; I405-H503 HydrophobicContact CG2-CB 3.71Å; I405-V507 HydrophobicContact CG1-CG2 3.77Å; I405-V507 HydrophobicContact CG2-CG2 4.05Å
406	R	89	Confident	88.1	Confident	65 Å²	65	31.8 Å²	31.8	25%	0.245	16%	0.164	C	C	.	.	H	α-helix	trans	-61.3	-30.5	174.6	-64.4	175.8	-69.5	-174.9	-7.9	112.3	D404 I408 L409 F410 L416 F422 H503 F506	D404-R406 PolarHBondContact O-N 2.95Å; D404-R406 VanDerWaalsContact O-N 3.09Å; D404-R406 WeakPolarHBondContact OD1-CB 3.28Å; D404-R406 WeakPolarHBondContact OD1-CG 3.03Å; D404-R406 IonicContact OD1-CZ 3.42Å; D404-R406 PolarHBondContact OD1-N 3.35Å; D404-R406 IonicContact OD1-NE 3.54Å; D404-R406 PolarHBondContact OD1-NE 3.21Å; D404-R406 IonicContact OD1-NH2 2.7Å; D404-R406 IonicContact OD2-CZ 2.82Å; D404-R406 IonicContact OD2-NE 3.59Å; D404-R406 PolarHBondContact OD2-NE 3.02Å; D404-R406 IonicContact OD2-NH2 3.64Å; D404-R406 PolarHBondContact OD2-NH2 2.66Å; R406-I408 VanDerWaalsContact C-N 3.27Å; R406-I408 PolarHBondContact O-N 2.97Å; R406-L409 PolarHBondContact O-N 3.25Å; R406-F410 WeakPolarHBondContact O-CB 3.43Å; R406-F410 PolarHBondContact O-N 2.76Å; R406-L416 HydrophobicContact CG-CD2 4.48Å; R406-F422 HydrophobicContact CB-CD1 4.38Å; R406-F422 HydrophobicContact CB-CD2 3.78Å; R406-F422 HydrophobicContact CB-CE1 4.07Å; R406-F422 HydrophobicContact CB-CE2 3.42Å; R406-F422 VanDerWaalsContact CB-CE2 3.42Å; R406-F422 HydrophobicContact CB-CG 4.24Å; R406-F422 HydrophobicContact CB-CZ 3.58Å; R406-F422 HydrophobicContact CG-CD2 4.43Å; R406-F422 HydrophobicContact CG-CE2 4.37Å; R406-H503 PolarHBondContact NE-CE1 3.17Å; R406-H503 PolarHBondContact NE-NE2 2.91Å; R406-H503 PolarHBondContact NH2-CE1 3.45Å; R406-H503 PolarHBondContact NH2-NE2 3.21Å; R406-F506 HydrophobicContact CG-CD2 4.29Å
407	E	89.8	Confident	87.4	Confident	10 Å²	10	30.6 Å²	30.6	5%	0.047	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-36.1	175	-63.8	-74.9	179.8	0	0	111.7	F383 I403 D404 I405 R411 F422 P424 N425 Y428	F383-E407 HydrophobicContact CE2-CB 4.05Å; F383-E407 HydrophobicContact CZ-CB 3.71Å; I403-E407 HydrophobicContact CD1-CB 4.4Å; I403-E407 HydrophobicContact CG1-CB 4.31Å; I403-E407 HydrophobicContact CG1-CG 4.41Å; D404-E407 HydrophobicContact CB-CG 4.1Å; D404-E407 VanDerWaalsContact O-CB 3.23Å; D404-E407 WeakPolarHBondContact O-CB 3.4Å; D404-E407 WeakPolarHBondContact O-CG 3.49Å; D404-E407 PolarHBondContact O-N 3.27Å; I405-E407 PolarHBondContact O-N 2.94Å; E407-R411 WeakPolarHBondContact O-CG 3.29Å; E407-F422 HydrophobicContact CG-CZ 3.98Å; E407-P424 WeakPolarHBondContact OE2-CA 3.45Å; E407-P424 WeakPolarHBondContact OE2-CB 3.45Å; E407-N425 VanDerWaalsContact OE1-CB 3.24Å; E407-N425 WeakPolarHBondContact OE1-CB 3.45Å; E407-N425 PolarHBondContact OE1-N 3.27Å; E407-N425 PolarHBondContact OE2-N 2.93Å; E407-Y428 HydrophobicContact CG-CD2 4.15Å; E407-Y428 HydrophobicContact CG-CE2 4.23Å
408	I	91.7	Very high	86.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-77.5	-48.4	176.9	-57.2	179.5	0	0	0	109.6	F383 F398 I403 I405 R406 F410 R411 Y412 L487 F490	F383-I408 HydrophobicContact CE1-CG1 4.4Å; F383-I408 HydrophobicContact CZ-CG1 4.24Å; F398-I408 HydrophobicContact CB-CD1 4.31Å; F398-I408 HydrophobicContact CD1-CD1 4.15Å; F398-I408 HydrophobicContact CD2-CD1 3.87Å; F398-I408 HydrophobicContact CE1-CD1 4.42Å; F398-I408 HydrophobicContact CE2-CD1 4.16Å; F398-I408 HydrophobicContact CG-CD1 3.87Å; F398-I408 HydrophobicContact CZ-CD1 4.43Å; I403-I408 HydrophobicContact CG2-CD1 4.01Å; I403-I408 HydrophobicContact CG2-CG1 4.44Å; I405-I408 HydrophobicContact CD1-CB 4.22Å; I405-I408 HydrophobicContact CD1-CD1 4.07Å; I405-I408 PolarHBondContact O-N 2.72Å; R406-I408 VanDerWaalsContact C-N 3.27Å; R406-I408 PolarHBondContact O-N 2.97Å; I408-F410 PolarHBondContact O-N 2.99Å; I408-R411 WeakPolarHBondContact O-CB 3.41Å; I408-R411 PolarHBondContact O-N 2.95Å; I408-Y412 HydrophobicContact CG2-CE2 4.35Å; I408-Y412 WeakPolarHBondContact O-CD2 3.46Å; I408-L487 HydrophobicContact CG2-CD1 3.65Å; I408-F490 HydrophobicContact CD1-CE1 3.92Å; I408-F490 HydrophobicContact CD1-CZ 4.36Å
409	L	89.9	Confident	85.2	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.3	-37.5	179.5	-65.8	177.4	0	0	0	112	I405 R406 R411 Y412 L415 L416 L487 L491 F506 V507 A510	I405-L409 HydrophobicContact CG1-CD1 4.44Å; I405-L409 HydrophobicContact CG1-CG 4.33Å; I405-L409 WeakPolarHBondContact O-CG 3.46Å; I405-L409 PolarHBondContact O-N 2.67Å; R406-L409 PolarHBondContact O-N 3.25Å; L409-R411 PolarHBondContact O-N 3.43Å; L409-Y412 PolarHBondContact O-N 2.94Å; L409-Y412 VanDerWaalsContact O-N 3.1Å; L409-L415 HydrophobicContact CD2-CD1 4.21Å; L409-L416 HydrophobicContact CB-CD1 4.44Å; L409-L416 HydrophobicContact CB-CD2 4.13Å; L409-L416 HydrophobicContact CB-CG 3.96Å; L409-L416 HydrophobicContact CD1-CD2 4.28Å; L409-L487 HydrophobicContact CD2-CD2 4.19Å; L409-L491 HydrophobicContact CD2-CD1 4.04Å; L409-F506 HydrophobicContact CD1-CB 3.89Å; L409-V507 HydrophobicContact CD1-CG2 4.43Å; L409-A510 HydrophobicContact CD2-CB 3.76Å
410	F	89.4	Confident	84.5	Confident	42 Å²	42	38.4 Å²	38.4	18%	0.184	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-26.3	177.6	-176.3	-92.1	0	0	0	113.6	R406 I408 Y412 L416 F422 P424 I451	R406-F410 WeakPolarHBondContact O-CB 3.43Å; R406-F410 PolarHBondContact O-N 2.76Å; I408-F410 PolarHBondContact O-N 2.99Å; F410-Y412 PolarHBondContact O-N 3.47Å; F410-L416 HydrophobicContact CB-CD1 3.7Å; F410-L416 HydrophobicContact CD2-CD1 3.95Å; F410-L416 HydrophobicContact CG-CD1 4.34Å; F410-F422 HydrophobicContact CB-CD1 3.98Å; F410-F422 HydrophobicContact CB-CE1 3.84Å; F410-F422 AromaticContact CD2-CD1 3.73Å; F410-F422 HydrophobicContact CD2-CD1 3.73Å; F410-F422 HydrophobicContact CD2-CE1 4.29Å; F410-F422 HydrophobicContact CG-CD1 4.03Å; F410-F422 HydrophobicContact CG-CE1 4.13Å; F410-P424 HydrophobicContact CD1-CB 4.47Å; F410-P424 HydrophobicContact CD1-CG 3.47Å; F410-P424 VanDerWaalsContact CD1-CG 3.47Å; F410-P424 HydrophobicContact CD2-CG 4.13Å; F410-P424 HydrophobicContact CE1-CG 3.38Å; F410-P424 HydrophobicContact CE2-CG 4.02Å; F410-P424 HydrophobicContact CG-CG 3.87Å; F410-P424 HydrophobicContact CZ-CG 3.66Å; F410-I451 HydrophobicContact CD1-CG2 4.26Å; F410-I451 HydrophobicContact CE1-CD1 4.33Å; F410-I451 HydrophobicContact CE1-CG2 4.02Å
411	R	88.7	Confident	83.8	Confident	1 Å²	1	43.1 Å²	43.1	0%	0.004	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-19.5	178	-59.2	-57.1	-179.6	125.8	-0.1	112.8	F383 F386 E387 E407 I408 L409 Y428 I451 L453 T454	F383-R411 HydrophobicContact CE1-CG 4.05Å; F386-R411 HydrophobicContact CE1-CB 4.29Å; E387-R411 IonicContact OE1-NH1 3.55Å; E387-R411 PolarHBondContact OE1-NH1 3.49Å; E387-R411 VanDerWaalsContact OE1-NH1 3.16Å; E407-R411 WeakPolarHBondContact O-CG 3.29Å; I408-R411 WeakPolarHBondContact O-CB 3.41Å; I408-R411 PolarHBondContact O-N 2.95Å; L409-R411 PolarHBondContact O-N 3.43Å; R411-Y428 PolarHBondContact NH2-O 2.95Å; R411-I451 VanDerWaalsContact CD-CG2 3.43Å; R411-I451 VanDerWaalsContact NH1-CG2 3.32Å; R411-L453 CarbonylContact O-C 3.6Å; R411-L453 WeakPolarHBondContact O-CA 3.45Å; R411-T454 HydrophobicContact CB-CG2 4.36Å; R411-T454 WeakPolarHBondContact O-CG2 3.47Å; R411-T454 PolarHBondContact O-N 3.09Å; R411-T454 PolarHBondContact O-OG1 3.02Å
412	Y	90.1	Very high	83.7	Confident	7 Å²	7	44.4 Å²	44.4	3%	0.027	24%	0.238	C	C	.	.	S	Bend	trans	-101.2	135.3	-178.2	-69.4	-107.2	0	0	0	110.5	F386 I408 L409 F410 L415 T454 Y483 L487	F386-Y412 HydrophobicContact CE2-CE2 4.19Å; F386-Y412 WeakPolarHBondContact CE2-OH 3.08Å; F386-Y412 AromaticContact CZ-CE2 3.7Å; F386-Y412 HydrophobicContact CZ-CE2 3.7Å; F386-Y412 AromaticContact CZ-CZ 3.93Å; I408-Y412 HydrophobicContact CG2-CE2 4.35Å; I408-Y412 WeakPolarHBondContact O-CD2 3.46Å; L409-Y412 PolarHBondContact O-N 2.94Å; L409-Y412 VanDerWaalsContact O-N 3.1Å; F410-Y412 PolarHBondContact O-N 3.47Å; Y412-L415 HydrophobicContact CD1-CD1 4.11Å; Y412-L415 HydrophobicContact CD2-CD1 4.33Å; Y412-L415 HydrophobicContact CG-CD1 3.68Å; Y412-L415 HydrophobicContact CG-CG 4.48Å; Y412-T454 HydrophobicContact CD1-CG2 3.82Å; Y412-T454 HydrophobicContact CD2-CG2 3.8Å; Y412-T454 HydrophobicContact CE1-CG2 3.78Å; Y412-T454 HydrophobicContact CE2-CG2 3.72Å; Y412-T454 HydrophobicContact CG-CG2 3.83Å; Y412-Y483 WeakPolarHBondContact CE1-O 3.46Å; Y412-Y483 PolarHBondContact OH-O 3.33Å; Y412-L487 HydrophobicContact CD1-CD2 3.94Å; Y412-L487 HydrophobicContact CD2-CD2 3.57Å; Y412-L487 HydrophobicContact CE1-CB 3.97Å; Y412-L487 HydrophobicContact CE1-CD2 3.92Å; Y412-L487 HydrophobicContact CE2-CB 4.15Å; Y412-L487 HydrophobicContact CE2-CD1 4.44Å; Y412-L487 HydrophobicContact CE2-CD2 3.57Å; Y412-L487 HydrophobicContact CE2-CG 4.28Å; Y412-L487 HydrophobicContact CG-CD2 3.77Å
413	S	83.9	Confident	83.7	Confident	45 Å²	45	45.4 Å²	45.4	32%	0.315	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	136.1	177.2	52.1	0	0	0	0	111.9	L415 R517	S413-L415 PolarHBondContact O-N 3.22Å; S413-L415 VanDerWaalsContact O-N 3.16Å; S413-R517 VanDerWaalsContact O-CZ 3.31Å; S413-R517 PolarHBondContact O-NH1 2.88Å; S413-R517 PolarHBondContact O-NH2 2.95Å
414	D	81.7	Confident	83.5	Confident	72 Å²	72	46 Å²	46	39%	0.385	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	15.1	177.1	-46.6	-65.1	0	0	0	116.9	K513 R517 Y576	D414-K513 WeakPolarHBondContact O-CD 3.16Å; D414-K513 PolarHBondContact O-NZ 3.4Å; D414-R517 IonicContact OD2-NH2 2.67Å; D414-R517 PolarHBondContact OD2-NH2 3.26Å; D414-Y576 HydrophobicContact CB-CD2 4.11Å; D414-Y576 HydrophobicContact CB-CE2 3.96Å
415	L	85.6	Confident	83.4	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-40.8	175	-67.3	-166.6	0	0	0	113.2	L409 Y412 S413 L487 A510 K513 L514	L409-L415 HydrophobicContact CD2-CD1 4.21Å; Y412-L415 HydrophobicContact CD1-CD1 4.11Å; Y412-L415 HydrophobicContact CD2-CD1 4.33Å; Y412-L415 HydrophobicContact CG-CD1 3.68Å; Y412-L415 HydrophobicContact CG-CG 4.48Å; S413-L415 PolarHBondContact O-N 3.22Å; S413-L415 VanDerWaalsContact O-N 3.16Å; L415-L487 HydrophobicContact CD1-CD2 3.24Å; L415-A510 HydrophobicContact CD2-CB 4.5Å; L415-K513 HydrophobicContact CD2-CB 3.98Å; L415-K513 HydrophobicContact CD2-CD 4.38Å; L415-L514 HydrophobicContact CD1-CD1 4.28Å; L415-L514 HydrophobicContact CD1-CD2 4.16Å; L415-L514 HydrophobicContact CD1-CG 4.25Å; L415-L514 HydrophobicContact CD2-CD2 4.19Å; L415-L514 HydrophobicContact CD2-CG 4.07Å
416	L	82.7	Confident	83.2	Confident	24 Å²	24	49.3 Å²	49.3	13%	0.126	25%	0.253	C	S	.	.	S	Bend	trans	-79.1	142.9	169.7	-74.6	168.8	0	0	0	110	R406 L409 F410 F422 F506	R406-L416 HydrophobicContact CG-CD2 4.48Å; L409-L416 HydrophobicContact CB-CD1 4.44Å; L409-L416 HydrophobicContact CB-CD2 4.13Å; L409-L416 HydrophobicContact CB-CG 3.96Å; L409-L416 HydrophobicContact CD1-CD2 4.28Å; F410-L416 HydrophobicContact CB-CD1 3.7Å; F410-L416 HydrophobicContact CD2-CD1 3.95Å; F410-L416 HydrophobicContact CG-CD1 4.34Å; L416-F422 HydrophobicContact CD1-CD1 4.17Å; L416-F506 HydrophobicContact CD2-CD1 4.36Å; L416-F506 HydrophobicContact CD2-CG 4.36Å
417	P	77.3	Confident	83.2	Confident	20 Å²	20	46.2 Å²	46.2	13%	0.13	24%	0.241	C	C	.	.			trans	-59.2	142.3	179.9	-23.1	31.1	0	0	0	112.9	G419 C420 F506 D572	P417-G419 PolarHBondContact O-N 3.03Å; P417-G419 VanDerWaalsContact O-N 3.14Å; P417-C420 HydrophobicContact CB-CB 4.37Å; P417-C420 WeakPolarHBondContact O-CB 3.25Å; P417-C420 PolarHBondContact O-N 2.87Å; P417-C420 VanDerWaalsContact O-N 3.07Å; P417-F506 HydrophobicContact CG-CD1 3.92Å; P417-F506 HydrophobicContact CG-CE1 3.75Å; P417-D572 WeakPolarHBondContact CA-OD1 3.35Å; P417-D572 HydrophobicContact CB-CB 4.04Å; P417-D572 HydrophobicContact CG-CB 4.16Å; P417-D572 WeakPolarHBondContact CG-OD2 3.46Å
418	K	69.9	Low	83.1	Confident	152 Å²	152	46.6 Å²	46.6	66%	0.661	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	115.4	172.8	-66.2	-177.5	-178.6	177.7	0	108.8
419	G	69.5	Low	82.9	Confident	83 Å²	83	48.6 Å²	48.6	86%	0.856	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.4	-7.5	-177	0	0	0	0	0	115	P417 Y421	P417-G419 PolarHBondContact O-N 3.03Å; P417-G419 VanDerWaalsContact O-N 3.14Å; G419-Y421 PolarHBondContact O-N 2.84Å; G419-Y421 VanDerWaalsContact O-N 3.14Å
420	C	74.4	Confident	82.5	Confident	44 Å²	44	49.7 Å²	49.7	30%	0.297	26%	0.257	S	S	.	.			trans	-64.9	114.7	171.1	177.9	0	0	0	0	110	P417 F422	P417-C420 HydrophobicContact CB-CB 4.37Å; P417-C420 WeakPolarHBondContact O-CB 3.25Å; P417-C420 PolarHBondContact O-N 2.87Å; P417-C420 VanDerWaalsContact O-N 3.07Å; C420-F422 PolarHBondContact O-N 2.94Å
421	Y	74.2	Confident	81.7	Confident	198 Å²	198	52 Å²	52	78%	0.776	27%	0.268	S	S	*	.			trans	-72.9	101.2	172.7	-176.2	-99.5	0	0	0	109.7	G419	G419-Y421 PolarHBondContact O-N 2.84Å; G419-Y421 VanDerWaalsContact O-N 3.14Å
422	F	84.3	Confident	80.2	Confident	29 Å²	29	60.1 Å²	60.1	13%	0.127	31%	0.306	C	S	.	.			trans	-130.9	126.6	172.6	178.3	-106.1	0	0	0	109.8	R406 E407 F410 L416 C420 P424	R406-F422 HydrophobicContact CB-CD1 4.38Å; R406-F422 HydrophobicContact CB-CD2 3.78Å; R406-F422 HydrophobicContact CB-CE1 4.07Å; R406-F422 HydrophobicContact CB-CE2 3.42Å; R406-F422 VanDerWaalsContact CB-CE2 3.42Å; R406-F422 HydrophobicContact CB-CG 4.24Å; R406-F422 HydrophobicContact CB-CZ 3.58Å; R406-F422 HydrophobicContact CG-CD2 4.43Å; R406-F422 HydrophobicContact CG-CE2 4.37Å; E407-F422 HydrophobicContact CG-CZ 3.98Å; F410-F422 HydrophobicContact CB-CD1 3.98Å; F410-F422 HydrophobicContact CB-CE1 3.84Å; F410-F422 AromaticContact CD2-CD1 3.73Å; F410-F422 HydrophobicContact CD2-CD1 3.73Å; F410-F422 HydrophobicContact CD2-CE1 4.29Å; F410-F422 HydrophobicContact CG-CD1 4.03Å; F410-F422 HydrophobicContact CG-CE1 4.13Å; L416-F422 HydrophobicContact CD1-CD1 4.17Å; C420-F422 PolarHBondContact O-N 2.94Å; F422-P424 HydrophobicContact CD1-CG 4.3Å; F422-P424 HydrophobicContact CE1-CB 4.34Å; F422-P424 HydrophobicContact CE1-CG 4.01Å
423	M	79.7	Confident	78.2	Confident	108 Å²	108	63.3 Å²	63.3	53%	0.532	33%	0.326	S	S	.	.			trans	-112	110.8	177.3	-173.4	163.8	62.4	0	0	109.2	Q447	M423-Q447 PolarHBondContact SD-OE1 3.37Å
424	P	84	Confident	75.9	Confident	17 Å²	17	67.9 Å²	67.9	11%	0.11	35%	0.347	C	S	.	.			trans	-59.7	142.8	179.9	-24.3	32.9	0	0	0	112.6	E407 F410 F422 W426 I451	E407-P424 WeakPolarHBondContact OE2-CA 3.45Å; E407-P424 WeakPolarHBondContact OE2-CB 3.45Å; F410-P424 HydrophobicContact CD1-CB 4.47Å; F410-P424 HydrophobicContact CD1-CG 3.47Å; F410-P424 VanDerWaalsContact CD1-CG 3.47Å; F410-P424 HydrophobicContact CD2-CG 4.13Å; F410-P424 HydrophobicContact CE1-CG 3.38Å; F410-P424 HydrophobicContact CE2-CG 4.02Å; F410-P424 HydrophobicContact CG-CG 3.87Å; F410-P424 HydrophobicContact CZ-CG 3.66Å; F422-P424 HydrophobicContact CD1-CG 4.3Å; F422-P424 HydrophobicContact CE1-CB 4.34Å; F422-P424 HydrophobicContact CE1-CG 4.01Å; P424-W426 PolarHBondContact O-N 3.02Å; P424-I451 HydrophobicContact CB-CD1 3.42Å; P424-I451 VanDerWaalsContact CB-CD1 3.42Å; P424-I451 HydrophobicContact CG-CD1 3.74Å
425	N	86.5	Confident	73.7	Confident	24 Å²	24	70.4 Å²	70.4	13%	0.128	37%	0.367	C	S	.	.			trans	-65.2	122.8	178	-165.9	-39.5	0	0	0	110.3	D65 E407 F427 Y428	D65-N425 PolarHBondContact OD1-ND2 3.45Å; E407-N425 VanDerWaalsContact OE1-CB 3.24Å; E407-N425 WeakPolarHBondContact OE1-CB 3.45Å; E407-N425 PolarHBondContact OE1-N 3.27Å; E407-N425 PolarHBondContact OE2-N 2.93Å; N425-F427 PolarHBondContact O-N 3.22Å; N425-F427 WeakPolarHBondContact OD1-CB 3.23Å; N425-F427 PolarHBondContact OD1-N 3.41Å; N425-Y428 HydrophobicContact CB-CD2 3.74Å; N425-Y428 HydrophobicContact CB-CE2 4Å; N425-Y428 PolarHBondContact O-N 3.49Å
426	W	85.2	Confident	71	Confident	93 Å²	93	78 Å²	78	35%	0.352	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-53.4	-28.2	-179.8	75.3	-86.3	0	0	0	113.1	L327 P424 Y428 K429	L327-W426 HydrophobicContact CD2-CH2 3.62Å; L327-W426 HydrophobicContact CD2-CZ2 4.27Å; P424-W426 PolarHBondContact O-N 3.02Å; W426-Y428 PolarHBondContact O-N 2.92Å; W426-K429 WeakPolarHBondContact O-CB 3.34Å; W426-K429 WeakPolarHBondContact O-CG 3.44Å; W426-K429 PolarHBondContact O-N 3.37Å
427	F	87.6	Confident	68.5	Low	0 Å²	0	82.3 Å²	82.3	0%	0	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-63.5	-31.4	-178.6	-166.4	-88.2	0	0	0	112.3	D326 L327 R330 R376 V377 L380 N425 K429	D326-F427 HydrophobicContact CB-CZ 4.41Å; D326-F427 WeakPolarHBondContact O-CZ 3.36Å; L327-F427 HydrophobicContact CD2-CD2 4.43Å; L327-F427 HydrophobicContact CD2-CE2 4.08Å; R330-F427 HydrophobicContact CB-CE1 4.34Å; R330-F427 HydrophobicContact CB-CE2 4.03Å; R330-F427 HydrophobicContact CB-CZ 3.75Å; R330-F427 HydrophobicContact CG-CE2 4.48Å; R330-F427 HydrophobicContact CG-CZ 4.39Å; R330-F427 PolarHBondContact NE-O 3.09Å; R376-F427 VanDerWaalsContact CD-CG 3.4Å; R376-F427 HydrophobicContact CG-CB 4.39Å; R376-F427 HydrophobicContact CG-CD1 3.36Å; R376-F427 HydrophobicContact CG-CD2 4.46Å; R376-F427 HydrophobicContact CG-CE1 3.57Å; R376-F427 HydrophobicContact CG-CG 3.83Å; R376-F427 HydrophobicContact CG-CZ 4.18Å; R376-F427 VanDerWaalsContact CZ-CE2 3.4Å; R376-F427 VanDerWaalsContact NE-CD2 3.28Å; R376-F427 VanDerWaalsContact NE-CE2 3.33Å; V377-F427 HydrophobicContact CG2-CZ 4.24Å; L380-F427 HydrophobicContact CB-CD1 4.16Å; L380-F427 HydrophobicContact CB-CE1 3.88Å; L380-F427 HydrophobicContact CD2-CD1 4.26Å; L380-F427 HydrophobicContact CD2-CE1 3.74Å; L380-F427 HydrophobicContact CD2-CZ 4.4Å; L380-F427 HydrophobicContact CG-CE1 4.41Å; N425-F427 PolarHBondContact O-N 3.22Å; N425-F427 WeakPolarHBondContact OD1-CB 3.23Å; N425-F427 PolarHBondContact OD1-N 3.41Å; F427-K429 VanDerWaalsContact C-N 3.29Å; F427-K429 PolarHBondContact O-N 3.35Å
428	Y	89.1	Confident	66.3	Low	19 Å²	19	85.9 Å²	85.9	8%	0.075	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-86.3	8.4	179.4	-57.7	-47.5	0	0	0	114.2	R376 L380 F383 I403 E407 R411 N425 W426 L430	R376-Y428 HydrophobicContact CG-CE1 4.07Å; R376-Y428 WeakPolarHBondContact O-CE1 3.48Å; L380-Y428 HydrophobicContact CB-CD1 4.11Å; L380-Y428 HydrophobicContact CB-CE1 4.4Å; F383-Y428 AromaticContact CD2-CD1 3.74Å; F383-Y428 HydrophobicContact CD2-CD1 3.74Å; F383-Y428 HydrophobicContact CD2-CD2 4.35Å; F383-Y428 AromaticContact CD2-CG 3.64Å; F383-Y428 HydrophobicContact CD2-CG 3.64Å; F383-Y428 HydrophobicContact CE2-CD1 4.07Å; F383-Y428 AromaticContact CE2-CD2 3.87Å; F383-Y428 HydrophobicContact CE2-CD2 3.87Å; F383-Y428 AromaticContact CE2-CG 3.63Å; F383-Y428 HydrophobicContact CE2-CG 3.63Å; I403-Y428 HydrophobicContact CD1-CD2 4.42Å; I403-Y428 HydrophobicContact CD1-CE1 4.23Å; I403-Y428 HydrophobicContact CD1-CE2 4Å; I403-Y428 HydrophobicContact CG1-CE2 4.09Å; E407-Y428 HydrophobicContact CG-CD2 4.15Å; E407-Y428 HydrophobicContact CG-CE2 4.23Å; R411-Y428 PolarHBondContact NH2-O 2.95Å; N425-Y428 HydrophobicContact CB-CD2 3.74Å; N425-Y428 HydrophobicContact CB-CE2 4Å; N425-Y428 PolarHBondContact O-N 3.49Å; W426-Y428 PolarHBondContact O-N 2.92Å; Y428-L430 WeakPolarHBondContact O-CD1 3.42Å
429	K	86.1	Confident	64.6	Low	41 Å²	41	87.4 Å²	87.4	18%	0.178	47%	0.467	C	S	.	.			trans	-80.8	119.3	171.1	-61.1	-176.4	173.9	178.2	0	109.2	R330 W426 F427 Q447 I451	R330-K429 PolarHBondContact NH2-O 3.42Å; W426-K429 WeakPolarHBondContact O-CB 3.34Å; W426-K429 WeakPolarHBondContact O-CG 3.44Å; W426-K429 PolarHBondContact O-N 3.37Å; F427-K429 VanDerWaalsContact C-N 3.29Å; F427-K429 PolarHBondContact O-N 3.35Å; K429-Q447 WeakPolarHBondContact CE-O 3.18Å; K429-Q447 PolarHBondContact NZ-O 3.48Å; K429-I451 HydrophobicContact CG-CD1 4.1Å; K429-I451 HydrophobicContact CG-CG1 3.89Å
430	L	83.1	Confident	62.8	Low	24 Å²	24	89.6 Å²	89.6	13%	0.126	46%	0.459	C	S	.	.			trans	-87.1	-30.7	178.4	-83.4	83.9	0	0	0	112.6	L334 L380 F383 Y384 E387 Y428	L334-L430 HydrophobicContact CD2-CB 4.17Å; L334-L430 HydrophobicContact CD2-CG 4.01Å; L334-L430 WeakPolarHBondContact CD2-O 3.49Å; L380-L430 HydrophobicContact CD1-CD1 3.89Å; L380-L430 HydrophobicContact CD1-CG 4.33Å; F383-L430 HydrophobicContact CB-CD1 3.92Å; Y384-L430 HydrophobicContact CD2-CD2 3.78Å; Y384-L430 HydrophobicContact CG-CD2 4.32Å; E387-L430 WeakPolarHBondContact OE2-CB 3.47Å; E387-L430 WeakPolarHBondContact OE2-CD2 3.21Å; Y428-L430 WeakPolarHBondContact O-CD1 3.42Å
431	H	72.7	Confident	60.8	Low	89 Å²	89	93.2 Å²	93.2	41%	0.412	48%	0.475	S	S	.	.			trans	-99.7	127	-178.1	-58.1	86.3	0	0	0	109.6	E387 G450 N452	E387-H431 IonicContact OE2-CE1 2.71Å; E387-H431 PolarHBondContact OE2-CE1 2.95Å; E387-H431 IonicContact OE2-ND1 3.39Å; H431-G450 WeakPolarHBondContact O-CA 3.44Å; H431-N452 PolarHBondContact CE1-ND2 3.37Å
432	Q	56.9	Low	58.8	Low	172 Å²	172	92.2 Å²	92.2	80%	0.804	48%	0.484	S	S	*	.			trans	-96.3	111	174.6	-155.1	170.3	11.4	0	0	106.8
433	T	48	Very low	56.5	Low	75 Å²	75	95 Å²	95	46%	0.46	50%	0.499	S	S	.	.			trans	-71.7	137.3	168.8	37.4	0	0	0	0	108.9	P435 S449	T433-P435 WeakPolarHBondContact O-CD 3.31Å; T433-S449 WeakPolarHBondContact CG2-O 3.5Å; T433-S449 PolarHBondContact OG1-OG 3.05Å; T433-S449 VanDerWaalsContact OG1-OG 3.13Å
434	N	35	Very low	54.3	Low	141 Å²	141	92.9 Å²	92.9	75%	0.754	51%	0.506	S	S	*	.			trans	-55.1	124.1	165.7	-74.9	-26.2	0	0	0	107	E436	N434-E436 PolarHBondContact O-N 3.22Å
435	P	36.7	Very low	52	Low	124 Å²	124	96.9 Å²	96.9	81%	0.805	53%	0.526	S	S	*	.			trans	-72	80	168	30.4	-29.8	0	0	0	106.4	T433 P437	T433-P435 WeakPolarHBondContact O-CD 3.31Å; P435-P437 WeakPolarHBondContact O-CD 3.26Å
436	E	27.9	Very low	49.7	Very low	162 Å²	162	100.4 Å²	100.4	76%	0.757	55%	0.549	S	S	*	.			trans	-70.9	121.4	157.5	-75.1	-157.7	166.2	0	0	106.7	N434 S438	N434-E436 PolarHBondContact O-N 3.22Å; E436-S438 PolarHBondContact O-N 3.03Å
437	P	31.1	Very low	47.8	Very low	114 Å²	114	101.5 Å²	101.5	74%	0.74	56%	0.558	S	S	*	*			trans	-76.8	77.8	176.4	32.6	-31	0	0	0	107.7	P435 H439	P435-P437 WeakPolarHBondContact O-CD 3.26Å; P437-H439 PolarHBondContact O-N 2.96Å
438	S	29.9	Very low	45.9	Very low	95 Å²	95	105.2 Å²	105.2	66%	0.664	58%	0.577	S	S	*	*			trans	-73.5	110.1	160.7	50.3	0	0	0	0	107.1	E436 D440	E436-S438 PolarHBondContact O-N 3.03Å; S438-D440 PolarHBondContact O-N 3.07Å
439	H	33.7	Very low	44.2	Very low	183 Å²	183	107.2 Å²	107.2	85%	0.847	59%	0.594	S	S	*	*			trans	-65.6	6.9	-176.3	-104.7	-70.1	0	0	0	115.2	P437	P437-H439 PolarHBondContact O-N 2.96Å
440	D	33.2	Very low	43.1	Very low	129 Å²	129	105.4 Å²	105.4	69%	0.69	59%	0.587	S	S	*	*			trans	-132.9	101.5	-178.4	-69.7	-41.4	0	0	0	109.1	S438	S438-D440 PolarHBondContact O-N 3.07Å
441	N	31.4	Very low	42.9	Very low	120 Å²	120	104.8 Å²	104.8	64%	0.642	58%	0.583	S	S	*	*				168.5	117.2	125.7	-83.1	-30.6	0	0	0	110	N443	N441-N443 HydrophobicContact CB-CB 4.32Å; N441-N443 PolarHBondContact O-N 3.42Å
442	N	33.6	Very low	43.4	Very low	178 Å²	178	102 Å²	102	95%	0.952	57%	0.572	S	S	*	*			trans	-64.8	31.6	163.7	-82.5	-30.9	0	0	0	113
443	N	35.2	Very low	44.9	Very low	86 Å²	86	96.4 Å²	96.4	46%	0.46	55%	0.547	S	S	.	.			trans	-92.7	120	174.7	-66.9	2.4	0	0	0	107.1	N441 D445 T446	N441-N443 HydrophobicContact CB-CB 4.32Å; N441-N443 PolarHBondContact O-N 3.42Å; N443-D445 HydrophobicContact CB-CB 4.36Å; N443-D445 PolarHBondContact O-N 3.07Å; N443-T446 PolarHBondContact O-N 2.9Å; N443-T446 PolarHBondContact O-OG1 3.26Å
444	G	32.4	Very low	46.7	Very low	64 Å²	64	93 Å²	93	66%	0.66	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-55.4	-5.2	173.9	0	0	0	0	0	114.5	T446 Q447	G444-T446 VanDerWaalsContact C-N 3.28Å; G444-T446 PolarHBondContact O-N 2.95Å; G444-Q447 PolarHBondContact O-N 3.49Å
445	D	37.2	Very low	49.1	Very low	102 Å²	102	88.3 Å²	88.3	55%	0.545	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-65.8	-23.3	177.7	-58.5	-30.1	0	0	0	113.9	N443 Q447 I448	N443-D445 HydrophobicContact CB-CB 4.36Å; N443-D445 PolarHBondContact O-N 3.07Å; D445-Q447 PolarHBondContact O-N 3.19Å; D445-Q447 VanDerWaalsContact O-N 3.09Å; D445-I448 PolarHBondContact O-N 3.03Å
446	T	36.8	Very low	51.5	Low	98 Å²	98	85.4 Å²	85.4	60%	0.601	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-58.8	-25.9	177.2	41.2	0	0	0	0	112.5	N443 G444 S449	N443-T446 PolarHBondContact O-N 2.9Å; N443-T446 PolarHBondContact O-OG1 3.26Å; G444-T446 VanDerWaalsContact C-N 3.28Å; G444-T446 PolarHBondContact O-N 2.95Å; T446-S449 WeakPolarHBondContact O-CB 3.48Å; T446-S449 PolarHBondContact O-OG 3.37Å
447	Q	45.2	Very low	54.3	Low	115 Å²	115	77.7 Å²	77.7	54%	0.537	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-84.8	-16.2	177.4	-65	-164.1	13.1	0	0	114.7	M423 K429 G444 D445 S449	M423-Q447 PolarHBondContact SD-OE1 3.37Å; K429-Q447 WeakPolarHBondContact CE-O 3.18Å; K429-Q447 PolarHBondContact NZ-O 3.48Å; G444-Q447 PolarHBondContact O-N 3.49Å; D445-Q447 PolarHBondContact O-N 3.19Å; D445-Q447 VanDerWaalsContact O-N 3.09Å; Q447-S449 PolarHBondContact O-N 3Å
448	I	48.6	Very low	56.9	Low	79 Å²	79	72.3 Å²	72.3	41%	0.405	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-17.3	176.9	-59.8	166.9	0	0	0	111	D445 G450 I451	D445-I448 PolarHBondContact O-N 3.03Å; I448-G450 PolarHBondContact O-N 3.46Å; I448-I451 PolarHBondContact O-N 3.42Å
449	S	54.1	Low	59.6	Low	61 Å²	61	72 Å²	72	43%	0.427	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	7.9	-165.7	67.3	0	0	0	0	119.4	T433 T446 Q447	T433-S449 WeakPolarHBondContact CG2-O 3.5Å; T433-S449 PolarHBondContact OG1-OG 3.05Å; T433-S449 VanDerWaalsContact OG1-OG 3.13Å; T446-S449 WeakPolarHBondContact O-CB 3.48Å; T446-S449 PolarHBondContact O-OG 3.37Å; Q447-S449 PolarHBondContact O-N 3Å
450	G	63.2	Low	62	Low	3 Å²	3	67.2 Å²	67.2	3%	0.031	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132	13.1	177.7	0	0	0	0	0	115.1	H431 I448	H431-G450 WeakPolarHBondContact O-CA 3.44Å; I448-G450 PolarHBondContact O-N 3.46Å
451	I	77.6	Confident	64.4	Low	10 Å²	10	62.9 Å²	62.9	5%	0.051	36%	0.355	C	S	.	.			trans	-118	111.7	-176.1	-71.7	173.5	0	0	0	107.9	F410 R411 P424 K429 I448	F410-I451 HydrophobicContact CD1-CG2 4.26Å; F410-I451 HydrophobicContact CE1-CD1 4.33Å; F410-I451 HydrophobicContact CE1-CG2 4.02Å; R411-I451 VanDerWaalsContact CD-CG2 3.43Å; R411-I451 VanDerWaalsContact NH1-CG2 3.32Å; P424-I451 HydrophobicContact CB-CD1 3.42Å; P424-I451 VanDerWaalsContact CB-CD1 3.42Å; P424-I451 HydrophobicContact CG-CD1 3.74Å; K429-I451 HydrophobicContact CG-CD1 4.1Å; K429-I451 HydrophobicContact CG-CG1 3.89Å; I448-I451 PolarHBondContact O-N 3.42Å
452	N	83.4	Confident	66.8	Low	32 Å²	32	57.7 Å²	57.7	17%	0.171	33%	0.329	C	S	.	.			trans	-74.9	129	172.2	-65.4	-12.8	0	0	0	108.6	H431 D456 L457	H431-N452 PolarHBondContact CE1-ND2 3.37Å; N452-D456 HydrophobicContact CB-CB 4.4Å; N452-L457 HydrophobicContact CB-CD2 3.7Å; N452-L457 HydrophobicContact CB-CG 3.88Å
453	L	87.6	Confident	69.1	Low	54 Å²	54	51.6 Å²	51.6	28%	0.283	30%	0.303	S	S	.	.			trans	-74	160.6	168.6	-62.6	177.3	0	0	0	109.1	R411 S455 D456 L457	R411-L453 CarbonylContact O-C 3.6Å; R411-L453 WeakPolarHBondContact O-CA 3.45Å; L453-S455 PolarHBondContact O-N 3.38Å; L453-D456 PolarHBondContact N-OD2 3.02Å; L453-D456 WeakPolarHBondContact O-CB 3.5Å; L453-D456 PolarHBondContact O-N 3.05Å; L453-L457 WeakPolarHBondContact O-CG 3.48Å; L453-L457 PolarHBondContact O-N 3.24Å
454	T	87.2	Confident	71.1	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.012	31%	0.31	C	S	.	.	H	α-helix	trans	-58.5	-33.6	177.9	52.2	0	0	0	0	111.9	F386 R411 Y412 D456 L457 C458 Y483	F386-T454 HydrophobicContact CE1-CG2 4.15Å; F386-T454 HydrophobicContact CZ-CG2 3.83Å; R411-T454 HydrophobicContact CB-CG2 4.36Å; R411-T454 WeakPolarHBondContact O-CG2 3.47Å; R411-T454 PolarHBondContact O-N 3.09Å; R411-T454 PolarHBondContact O-OG1 3.02Å; Y412-T454 HydrophobicContact CD1-CG2 3.82Å; Y412-T454 HydrophobicContact CD2-CG2 3.8Å; Y412-T454 HydrophobicContact CE1-CG2 3.78Å; Y412-T454 HydrophobicContact CE2-CG2 3.72Å; Y412-T454 HydrophobicContact CG-CG2 3.83Å; T454-D456 VanDerWaalsContact C-N 3.31Å; T454-D456 PolarHBondContact O-N 2.94Å; T454-L457 PolarHBondContact O-N 3.41Å; T454-C458 WeakPolarHBondContact O-CB 3.42Å; T454-C458 PolarHBondContact O-N 3.34Å; T454-C458 PolarHBondContact O-SG 3.34Å; T454-Y483 HydrophobicContact CG2-CD1 4.29Å; T454-Y483 HydrophobicContact CG2-CG 4.49Å
455	S	85.5	Confident	73	Confident	43 Å²	43	55.2 Å²	55.2	30%	0.301	30%	0.303	S	S	.	.	H	α-helix	trans	-56.7	-45	172.8	49.6	0	0	0	0	112.1	L453 C458 I459	L453-S455 PolarHBondContact O-N 3.38Å; S455-C458 PolarHBondContact O-N 3.26Å; S455-I459 WeakPolarHBondContact O-CG1 3.43Å; S455-I459 PolarHBondContact O-N 2.81Å
456	D	87.3	Confident	74.5	Confident	63 Å²	63	51.7 Å²	51.7	34%	0.337	29%	0.286	S	S	.	.	H	α-helix	trans	-71.9	-41	-177	-46.6	-30.8	0	0	0	110.1	N452 L453 T454 C458 I459 L460	N452-D456 HydrophobicContact CB-CB 4.4Å; L453-D456 PolarHBondContact N-OD2 3.02Å; L453-D456 WeakPolarHBondContact O-CB 3.5Å; L453-D456 PolarHBondContact O-N 3.05Å; T454-D456 VanDerWaalsContact C-N 3.31Å; T454-D456 PolarHBondContact O-N 2.94Å; D456-C458 VanDerWaalsContact C-N 3.29Å; D456-C458 PolarHBondContact O-N 2.68Å; D456-I459 PolarHBondContact O-N 3.27Å; D456-L460 WeakPolarHBondContact O-CG 3.41Å; D456-L460 PolarHBondContact O-N 3.42Å
457	L	86	Confident	75.6	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-60.8	-38.6	174.2	-66.3	174.2	0	0	0	111.9	F386 E387 N452 L453 T454 I459 L460 R461 Y483	F386-L457 HydrophobicContact CD1-CD1 4.16Å; F386-L457 HydrophobicContact CE1-CD1 3.89Å; E387-L457 HydrophobicContact CB-CD2 3.92Å; E387-L457 HydrophobicContact CG-CD1 4.07Å; E387-L457 HydrophobicContact CG-CD2 3.92Å; N452-L457 HydrophobicContact CB-CD2 3.7Å; N452-L457 HydrophobicContact CB-CG 3.88Å; L453-L457 WeakPolarHBondContact O-CG 3.48Å; L453-L457 PolarHBondContact O-N 3.24Å; T454-L457 PolarHBondContact O-N 3.41Å; L457-I459 VanDerWaalsContact C-N 3.34Å; L457-L460 PolarHBondContact O-N 3.01Å; L457-R461 WeakPolarHBondContact O-CB 3.3Å; L457-R461 VanDerWaalsContact O-CG 3.23Å; L457-R461 WeakPolarHBondContact O-CG 3.3Å; L457-R461 PolarHBondContact O-N 3.45Å; L457-Y483 HydrophobicContact CD1-CE1 4.47Å
458	C	86.6	Confident	76.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-39	177.8	-66.5	0	0	0	0	111.9	T454 S455 D456 A462 W479 L480	T454-C458 WeakPolarHBondContact O-CB 3.42Å; T454-C458 PolarHBondContact O-N 3.34Å; T454-C458 PolarHBondContact O-SG 3.34Å; S455-C458 PolarHBondContact O-N 3.26Å; D456-C458 VanDerWaalsContact C-N 3.29Å; D456-C458 PolarHBondContact O-N 2.68Å; C458-A462 WeakPolarHBondContact O-CB 3.44Å; C458-A462 PolarHBondContact O-N 3.34Å; C458-W479 HydrophobicContact CB-CB 3.94Å; C458-W479 VanDerWaalsContact SG-C 3.55Å; C458-L480 WeakPolarHBondContact SG-CA 3.5Å; C458-L480 PolarHBondContact SG-N 2.95Å
459	I	85.5	Confident	76.5	Confident	88 Å²	88	59.6 Å²	59.6	45%	0.451	33%	0.33	S	S	.	.	H	α-helix	trans	-65.2	-45.7	175.1	-64.3	165.9	0	0	0	110.4	S455 D456 L457 R461 A462 A463	S455-I459 WeakPolarHBondContact O-CG1 3.43Å; S455-I459 PolarHBondContact O-N 2.81Å; D456-I459 PolarHBondContact O-N 3.27Å; L457-I459 VanDerWaalsContact C-N 3.34Å; I459-R461 PolarHBondContact O-N 3.4Å; I459-A462 PolarHBondContact O-N 3.34Å; I459-A463 WeakPolarHBondContact O-CB 3.46Å; I459-A463 PolarHBondContact O-N 3.1Å
460	L	84	Confident	76.5	Confident	84 Å²	84	62.6 Å²	62.6	44%	0.44	34%	0.341	S	S	.	.	H	α-helix	trans	-62.9	-42.3	179	-69.8	172.7	0	0	0	112.3	D456 L457 A463 E464	D456-L460 WeakPolarHBondContact O-CG 3.41Å; D456-L460 PolarHBondContact O-N 3.42Å; L457-L460 PolarHBondContact O-N 3.01Å; L460-A463 PolarHBondContact O-N 3.15Å; L460-E464 PolarHBondContact O-N 2.94Å; L460-E464 VanDerWaalsContact O-N 3.17Å
461	R	84.3	Confident	76.1	Confident	37 Å²	37	69.7 Å²	69.7	14%	0.14	37%	0.373	C	S	.	.	H	α-helix	trans	-72.8	-35.8	178.7	-62.8	-67.2	160.3	-140.7	-19.3	112.1	E387 L457 I459 A463 E464 D465 W479	E387-R461 PolarHBondContact O-NE 3.09Å; E387-R461 PolarHBondContact O-NH2 2.85Å; L457-R461 WeakPolarHBondContact O-CB 3.3Å; L457-R461 VanDerWaalsContact O-CG 3.23Å; L457-R461 WeakPolarHBondContact O-CG 3.3Å; L457-R461 PolarHBondContact O-N 3.45Å; I459-R461 PolarHBondContact O-N 3.4Å; R461-A463 VanDerWaalsContact C-N 3.28Å; R461-A463 PolarHBondContact O-N 3.21Å; R461-E464 IonicContact CZ-OE1 3.35Å; R461-E464 IonicContact CZ-OE2 2.79Å; R461-E464 IonicContact NH1-OE1 2.81Å; R461-E464 PolarHBondContact NH1-OE1 3.41Å; R461-E464 IonicContact NH1-OE2 3.79Å; R461-E464 PolarHBondContact NH1-OE2 2.7Å; R461-E464 PolarHBondContact O-N 3.07Å; R461-D465 PolarHBondContact O-N 3.24Å; R461-W479 HydrophobicContact CB-CD2 3.81Å; R461-W479 HydrophobicContact CB-CE3 4.4Å; R461-W479 HydrophobicContact CB-CG 4.06Å; R461-W479 HydrophobicContact CB-CZ2 4.01Å; R461-W479 HydrophobicContact CG-CD2 4.47Å
462	A	82.7	Confident	75.3	Confident	11 Å²	11	73.4 Å²	73.4	9%	0.091	39%	0.393	C	S	.	.	H	α-helix	trans	-61	-39.1	172.1	0	0	0	0	0	111.8	C458 I459 D465 S466 I475	C458-A462 WeakPolarHBondContact O-CB 3.44Å; C458-A462 PolarHBondContact O-N 3.34Å; I459-A462 PolarHBondContact O-N 3.34Å; A462-D465 PolarHBondContact O-N 3.35Å; A462-S466 VanDerWaalsContact O-CB 3.32Å; A462-S466 WeakPolarHBondContact O-CB 3.37Å; A462-S466 PolarHBondContact O-N 3.14Å; A462-S466 PolarHBondContact O-OG 3.37Å; A462-S466 VanDerWaalsContact O-OG 3.08Å; A462-I475 HydrophobicContact CB-CB 4.05Å; A462-I475 HydrophobicContact CB-CG2 3.75Å
463	A	79.9	Confident	74.6	Confident	51 Å²	51	78.9 Å²	78.9	42%	0.421	42%	0.421	S	S	.	.	H	α-helix	trans	-69.5	-28	176.3	0	0	0	0	0	113.8	I459 L460 R461 S466	I459-A463 WeakPolarHBondContact O-CB 3.46Å; I459-A463 PolarHBondContact O-N 3.1Å; L460-A463 PolarHBondContact O-N 3.15Å; R461-A463 VanDerWaalsContact C-N 3.28Å; R461-A463 PolarHBondContact O-N 3.21Å; A463-S466 WeakPolarHBondContact CA-OG 3.15Å; A463-S466 PolarHBondContact O-OG 3.02Å
464	E	77.8	Confident	74	Confident	130 Å²	130	80.6 Å²	80.6	61%	0.607	43%	0.434	S	S	*	.	H	α-helix	trans	-78.4	-33.1	174.4	-73.6	177.7	-174.3	0	0	112.9	L460 R461	L460-E464 PolarHBondContact O-N 2.94Å; L460-E464 VanDerWaalsContact O-N 3.17Å; R461-E464 IonicContact CZ-OE1 3.35Å; R461-E464 IonicContact CZ-OE2 2.79Å; R461-E464 IonicContact NH1-OE1 2.81Å; R461-E464 PolarHBondContact NH1-OE1 3.41Å; R461-E464 IonicContact NH1-OE2 3.79Å; R461-E464 PolarHBondContact NH1-OE2 2.7Å; R461-E464 PolarHBondContact O-N 3.07Å
465	D	73.1	Confident	73.6	Confident	95 Å²	95	82.5 Å²	82.5	51%	0.508	44%	0.444	S	S	.	.	H	α-helix	trans	-81.3	-24.7	178.1	-73.6	-23.6	0	0	0	112.6	R461 A462 I475 W479	R461-D465 PolarHBondContact O-N 3.24Å; A462-D465 PolarHBondContact O-N 3.35Å; D465-I475 HydrophobicContact CB-CG2 4.36Å; D465-W479 VanDerWaalsContact OD2-CE2 3.3Å; D465-W479 VanDerWaalsContact OD2-CZ2 3.31Å; D465-W479 WeakPolarHBondContact OD2-CZ2 3.28Å; D465-W479 PolarHBondContact OD2-NE1 3.21Å
466	S	67.7	Low	73.4	Confident	28 Å²	28	81.9 Å²	81.9	20%	0.196	44%	0.44	C	S	.	.			trans	-81.3	115.5	178.2	62.9	0	0	0	0	111.3	A462 A463 N468	A462-S466 VanDerWaalsContact O-CB 3.32Å; A462-S466 WeakPolarHBondContact O-CB 3.37Å; A462-S466 PolarHBondContact O-N 3.14Å; A462-S466 PolarHBondContact O-OG 3.37Å; A462-S466 VanDerWaalsContact O-OG 3.08Å; A463-S466 WeakPolarHBondContact CA-OG 3.15Å; A463-S466 PolarHBondContact O-OG 3.02Å; S466-N468 WeakPolarHBondContact CB-O 3.49Å; S466-N468 PolarHBondContact O-N 2.82Å; S466-N468 PolarHBondContact OG-O 2.97Å
467	D	60.9	Low	73.2	Confident	170 Å²	170	82 Å²	82	91%	0.909	45%	0.446	S	S	*	.	S	Bend	trans	-70.2	-15.3	168.2	-76.7	-35.9	0	0	0	112.6
468	N	56.1	Low	73.2	Confident	121 Å²	121	84.6 Å²	84.6	65%	0.647	46%	0.464	S	S	*	.	S	Bend	trans	-110.4	139.9	179.5	-73.8	-25.2	0	0	0	111	S466 D470	S466-N468 WeakPolarHBondContact CB-O 3.49Å; S466-N468 PolarHBondContact O-N 2.82Å; S466-N468 PolarHBondContact OG-O 2.97Å; N468-D470 PolarHBondContact O-N 2.87Å
469	D	56	Low	73.3	Confident	167 Å²	167	85.6 Å²	85.6	89%	0.893	47%	0.468	S	S	*	.	S	Bend	trans	-64.7	-0.6	177.4	-72.4	-39.4	0	0	0	114.7	H471	D469-H471 PolarHBondContact O-N 3.32Å
470	D	54.7	Low	73.4	Confident	124 Å²	124	84.1 Å²	84.1	66%	0.663	46%	0.46	S	S	*	.	S	Bend	trans	-77	111.1	174	-79	-30.8	0	0	0	108.9	N468 D472	N468-D470 PolarHBondContact O-N 2.87Å; D470-D472 PolarHBondContact O-N 3.33Å
471	H	55.2	Low	73.6	Confident	152 Å²	152	82 Å²	82	70%	0.704	45%	0.45	S	S	*	.			trans	-59.1	84.1	173.3	-70.1	-55.9	0	0	0	110.8	D469 L473	D469-H471 PolarHBondContact O-N 3.32Å; H471-L473 PolarHBondContact O-N 2.99Å
472	D	59.8	Low	73.8	Confident	88 Å²	88	86.4 Å²	86.4	47%	0.471	47%	0.466	S	S	.	.			trans	-68	99.2	176.1	-95.9	-12.6	0	0	0	108.7	D470 T474 I475 S476	D470-D472 PolarHBondContact O-N 3.33Å; D472-T474 PolarHBondContact O-N 3.1Å; D472-I475 HydrophobicContact CB-CB 4.47Å; D472-I475 HydrophobicContact CB-CD1 3.89Å; D472-I475 HydrophobicContact CB-CG1 3.94Å; D472-I475 PolarHBondContact O-N 3.28Å; D472-S476 PolarHBondContact O-N 3.37Å
473	L	68.5	Low	74.3	Confident	147 Å²	147	85.9 Å²	85.9	77%	0.77	46%	0.462	S	S	*	.	H	α-helix	trans	-51.2	-24.7	172.2	-67.9	166.4	0	0	0	111.7	H471 S477	H471-L473 PolarHBondContact O-N 2.99Å; L473-S477 WeakPolarHBondContact O-CB 3.44Å; L473-S477 PolarHBondContact O-N 3.44Å; L473-S477 PolarHBondContact O-OG 3.22Å
474	T	75.3	Confident	74.8	Confident	91 Å²	91	84.2 Å²	84.2	56%	0.558	45%	0.445	S	S	*	.	H	α-helix	trans	-67.1	-41.8	175.2	55.2	0	0	0	0	112.7	D472 S477 S478	D472-T474 PolarHBondContact O-N 3.1Å; T474-S477 WeakPolarHBondContact CA-OG 3.35Å; T474-S477 PolarHBondContact O-OG 3.08Å; T474-S478 PolarHBondContact O-N 3.26Å
475	I	78.5	Confident	75.4	Confident	41 Å²	41	81 Å²	81	21%	0.21	43%	0.43	C	S	.	.	H	α-helix	trans	-72.2	-43.9	178.9	-58	173.3	0	0	0	109.6	A462 D465 D472 S477 S478 W479	A462-I475 HydrophobicContact CB-CB 4.05Å; A462-I475 HydrophobicContact CB-CG2 3.75Å; D465-I475 HydrophobicContact CB-CG2 4.36Å; D472-I475 HydrophobicContact CB-CB 4.47Å; D472-I475 HydrophobicContact CB-CD1 3.89Å; D472-I475 HydrophobicContact CB-CG1 3.94Å; D472-I475 PolarHBondContact O-N 3.28Å; I475-S477 VanDerWaalsContact C-N 3.34Å; I475-S477 PolarHBondContact O-N 2.81Å; I475-S478 WeakPolarHBondContact O-CB 3.29Å; I475-S478 PolarHBondContact O-N 3.37Å; I475-S478 VanDerWaalsContact O-N 3.11Å; I475-S478 PolarHBondContact O-OG 3.29Å; I475-W479 PolarHBondContact O-N 2.98Å
476	S	81.5	Confident	76.3	Confident	30 Å²	30	77.4 Å²	77.4	21%	0.21	41%	0.41	C	S	.	.	H	α-helix	trans	-59.9	-42.6	176.6	-179.9	0	0	0	0	112.3	D472 S478 W479 L480	D472-S476 PolarHBondContact O-N 3.37Å; S476-S478 VanDerWaalsContact C-N 3.35Å; S476-S478 PolarHBondContact O-N 2.94Å; S476-W479 PolarHBondContact O-N 3.36Å; S476-L480 PolarHBondContact O-N 3.27Å
477	S	83.9	Confident	77.5	Confident	66 Å²	66	76.1 Å²	76.1	46%	0.462	40%	0.401	S	S	.	.	H	α-helix	trans	-65.5	-35.7	174.4	52.1	0	0	0	0	112.8	L473 T474 I475 L480 L481	L473-S477 WeakPolarHBondContact O-CB 3.44Å; L473-S477 PolarHBondContact O-N 3.44Å; L473-S477 PolarHBondContact O-OG 3.22Å; T474-S477 WeakPolarHBondContact CA-OG 3.35Å; T474-S477 PolarHBondContact O-OG 3.08Å; I475-S477 VanDerWaalsContact C-N 3.34Å; I475-S477 PolarHBondContact O-N 2.81Å; S477-L480 PolarHBondContact O-N 3Å; S477-L481 WeakPolarHBondContact O-CB 3.28Å; S477-L481 PolarHBondContact O-N 2.97Å; S477-L481 VanDerWaalsContact O-N 3.09Å
478	S	86.1	Confident	78.9	Confident	56 Å²	56	68.1 Å²	68.1	39%	0.392	36%	0.358	S	S	.	.	H	α-helix	trans	-63.2	-40.5	174.2	82.5	0	0	0	0	112.6	T474 I475 S476 L481 R482	T474-S478 PolarHBondContact O-N 3.26Å; I475-S478 WeakPolarHBondContact O-CB 3.29Å; I475-S478 PolarHBondContact O-N 3.37Å; I475-S478 VanDerWaalsContact O-N 3.11Å; I475-S478 PolarHBondContact O-OG 3.29Å; S476-S478 VanDerWaalsContact C-N 3.35Å; S476-S478 PolarHBondContact O-N 2.94Å; S478-L481 PolarHBondContact O-N 3.29Å; S478-R482 WeakPolarHBondContact O-CG 3.47Å; S478-R482 PolarHBondContact O-N 3.44Å; S478-R482 VanDerWaalsContact O-N 3.13Å
479	W	87.3	Confident	80.4	Confident	20 Å²	20	65.6 Å²	65.6	8%	0.076	35%	0.345	C	S	.	.	H	α-helix	trans	-66.9	-44	175.2	-85.2	106.9	0	0	0	111.9	C458 R461 D465 I475 S476 L481 R482 Y483	C458-W479 HydrophobicContact CB-CB 3.94Å; C458-W479 VanDerWaalsContact SG-C 3.55Å; R461-W479 HydrophobicContact CB-CD2 3.81Å; R461-W479 HydrophobicContact CB-CE3 4.4Å; R461-W479 HydrophobicContact CB-CG 4.06Å; R461-W479 HydrophobicContact CB-CZ2 4.01Å; R461-W479 HydrophobicContact CG-CD2 4.47Å; D465-W479 VanDerWaalsContact OD2-CE2 3.3Å; D465-W479 VanDerWaalsContact OD2-CZ2 3.31Å; D465-W479 WeakPolarHBondContact OD2-CZ2 3.28Å; D465-W479 PolarHBondContact OD2-NE1 3.21Å; I475-W479 PolarHBondContact O-N 2.98Å; S476-W479 PolarHBondContact O-N 3.36Å; W479-L481 PolarHBondContact O-N 3.27Å; W479-R482 PolarHBondContact O-N 3.41Å; W479-R482 VanDerWaalsContact O-N 3.08Å; W479-Y483 HydrophobicContact CE3-CD2 4.44Å; W479-Y483 AromaticContact CE3-CE2 3.94Å; W479-Y483 HydrophobicContact CE3-CE2 3.94Å; W479-Y483 VanDerWaalsContact O-CD2 3.29Å; W479-Y483 WeakPolarHBondContact O-CD2 3.22Å; W479-Y483 PolarHBondContact O-N 3.4Å
480	L	88.5	Confident	82	Confident	58 Å²	58	58.1 Å²	58.1	30%	0.304	30%	0.304	S	S	.	.	H	α-helix	trans	-55.9	-43.1	178.7	-176.8	67.1	0	0	0	111.1	C458 S476 S477 Y483 Q484	C458-L480 WeakPolarHBondContact SG-CA 3.5Å; C458-L480 PolarHBondContact SG-N 2.95Å; S476-L480 PolarHBondContact O-N 3.27Å; S477-L480 PolarHBondContact O-N 3Å; L480-Y483 PolarHBondContact O-N 3.08Å; L480-Q484 VanDerWaalsContact O-CG 3.28Å; L480-Q484 WeakPolarHBondContact O-CG 3.31Å; L480-Q484 PolarHBondContact O-N 3.44Å
481	L	88.1	Confident	83.6	Confident	40 Å²	40	52.2 Å²	52.2	21%	0.209	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-45.5	176.7	-169.4	106	0	0	0	112	S477 S478 W479 Y483 Q484 E485 L518 A521 I523	S477-L481 WeakPolarHBondContact O-CB 3.28Å; S477-L481 PolarHBondContact O-N 2.97Å; S477-L481 VanDerWaalsContact O-N 3.09Å; S478-L481 PolarHBondContact O-N 3.29Å; W479-L481 PolarHBondContact O-N 3.27Å; L481-Y483 VanDerWaalsContact C-N 3.34Å; L481-Y483 PolarHBondContact O-N 3.35Å; L481-Q484 PolarHBondContact O-N 3.01Å; L481-Q484 VanDerWaalsContact O-N 3.14Å; L481-E485 WeakPolarHBondContact O-CG 3.44Å; L481-E485 PolarHBondContact O-N 3.41Å; L481-L518 HydrophobicContact CD1-CD2 4.43Å; L481-A521 HydrophobicContact CD1-CB 3.37Å; L481-I523 HydrophobicContact CD1-CD1 3.69Å; L481-I523 HydrophobicContact CD1-CG1 4.42Å; L481-I523 HydrophobicContact CD2-CD1 3.19Å; L481-I523 HydrophobicContact CG-CD1 3.79Å
482	R	89.5	Confident	85.1	Confident	129 Å²	129	47.3 Å²	47.3	49%	0.487	25%	0.248	S	C	.	.	H	α-helix	trans	-58.9	-41.6	175.6	-69.8	179.8	80.6	-174.6	5.7	112.7	L391 S478 W479 F486	L391-R482 HydrophobicContact CD1-CB 4.46Å; S478-R482 WeakPolarHBondContact O-CG 3.47Å; S478-R482 PolarHBondContact O-N 3.44Å; S478-R482 VanDerWaalsContact O-N 3.13Å; W479-R482 PolarHBondContact O-N 3.41Å; W479-R482 VanDerWaalsContact O-N 3.08Å; R482-F486 WeakPolarHBondContact O-CB 3.36Å; R482-F486 PolarHBondContact O-N 2.9Å
483	Y	92.3	Very high	86.3	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-65.9	-39.2	175.7	-83.5	-80.2	0	0	0	112	F386 L391 Y412 T454 L457 W479 L480 L481 L487	F386-Y483 HydrophobicContact CD1-CE1 4.27Å; F386-Y483 HydrophobicContact CD2-CD1 4.36Å; F386-Y483 HydrophobicContact CD2-CE1 4.09Å; F386-Y483 HydrophobicContact CE1-CD1 4.23Å; F386-Y483 AromaticContact CE1-CE1 3.92Å; F386-Y483 HydrophobicContact CE1-CE1 3.92Å; F386-Y483 AromaticContact CE2-CD1 3.59Å; F386-Y483 HydrophobicContact CE2-CD1 3.59Å; F386-Y483 AromaticContact CE2-CE1 3.73Å; F386-Y483 HydrophobicContact CE2-CE1 3.73Å; F386-Y483 HydrophobicContact CG-CE1 4.35Å; F386-Y483 AromaticContact CZ-CD1 3.52Å; F386-Y483 HydrophobicContact CZ-CD1 3.52Å; F386-Y483 AromaticContact CZ-CE1 3.64Å; F386-Y483 HydrophobicContact CZ-CE1 3.64Å; F386-Y483 PolarHBondContact O-OH 2.84Å; L391-Y483 HydrophobicContact CD2-CD1 3.8Å; L391-Y483 HydrophobicContact CD2-CE1 3.61Å; Y412-Y483 WeakPolarHBondContact CE1-O 3.46Å; Y412-Y483 PolarHBondContact OH-O 3.33Å; T454-Y483 HydrophobicContact CG2-CD1 4.29Å; T454-Y483 HydrophobicContact CG2-CG 4.49Å; L457-Y483 HydrophobicContact CD1-CE1 4.47Å; W479-Y483 HydrophobicContact CE3-CD2 4.44Å; W479-Y483 AromaticContact CE3-CE2 3.94Å; W479-Y483 HydrophobicContact CE3-CE2 3.94Å; W479-Y483 VanDerWaalsContact O-CD2 3.29Å; W479-Y483 WeakPolarHBondContact O-CD2 3.22Å; W479-Y483 PolarHBondContact O-N 3.4Å; L480-Y483 PolarHBondContact O-N 3.08Å; L481-Y483 VanDerWaalsContact C-N 3.34Å; L481-Y483 PolarHBondContact O-N 3.35Å; Y483-L487 PolarHBondContact O-N 3.48Å
484	Q	90.8	Very high	87	Confident	16 Å²	16	43.1 Å²	43.1	8%	0.075	22%	0.22	C	C	.	.	H	α-helix	trans	-67.9	-44.1	178.1	-72.9	174.7	5.8	0	0	111.9	L480 L481 F486 L487 F488 L514 L518	L480-Q484 VanDerWaalsContact O-CG 3.28Å; L480-Q484 WeakPolarHBondContact O-CG 3.31Å; L480-Q484 PolarHBondContact O-N 3.44Å; L481-Q484 PolarHBondContact O-N 3.01Å; L481-Q484 VanDerWaalsContact O-N 3.14Å; Q484-F486 VanDerWaalsContact C-N 3.33Å; Q484-F486 PolarHBondContact O-N 3.04Å; Q484-L487 PolarHBondContact O-N 2.68Å; Q484-F488 WeakPolarHBondContact O-CB 3.5Å; Q484-F488 PolarHBondContact O-N 2.98Å; Q484-L514 HydrophobicContact CB-CD2 4.11Å; Q484-L514 HydrophobicContact CG-CD2 4.06Å; Q484-L518 HydrophobicContact CB-CD2 4.05Å
485	E	89.6	Confident	87.4	Confident	63 Å²	63	39.9 Å²	39.9	29%	0.294	20%	0.198	S	C	.	.	H	α-helix	trans	-60.5	-42.9	174	-73.5	-177.3	164.4	0	0	111.7	L481 F488 N489 L518 I523	L481-E485 WeakPolarHBondContact O-CG 3.44Å; L481-E485 PolarHBondContact O-N 3.41Å; E485-F488 PolarHBondContact O-N 3.42Å; E485-N489 WeakPolarHBondContact O-CB 3.49Å; E485-N489 PolarHBondContact O-N 3.26Å; E485-N489 PolarHBondContact O-ND2 3.4Å; E485-L518 HydrophobicContact CG-CD1 4.48Å; E485-L518 HydrophobicContact CG-CD2 3.69Å; E485-I523 VanDerWaalsContact OE1-CD1 3.26Å; E485-I523 WeakPolarHBondContact OE1-CD1 3.5Å
486	F	92.2	Very high	87.5	Confident	19 Å²	19	44.9 Å²	44.9	8%	0.083	22%	0.218	C	C	.	.	H	α-helix	trans	-57.7	-52.1	175.1	164.6	-100.1	0	0	0	111.7	F386 L391 A394 A395 F398 R482 Q484 F488 N489 F490	F386-F486 HydrophobicContact CD2-CD1 4.41Å; F386-F486 AromaticContact CD2-CE1 3.86Å; F386-F486 HydrophobicContact CD2-CE1 3.86Å; F386-F486 AromaticContact CE2-CD1 4Å; F386-F486 HydrophobicContact CE2-CD1 4Å; F386-F486 AromaticContact CE2-CE1 3.76Å; F386-F486 HydrophobicContact CE2-CE1 3.76Å; L391-F486 HydrophobicContact CB-CB 4.37Å; L391-F486 HydrophobicContact CB-CD2 3.6Å; L391-F486 HydrophobicContact CB-CE2 3.98Å; L391-F486 HydrophobicContact CB-CG 3.99Å; L391-F486 HydrophobicContact CD1-CB 3.74Å; L391-F486 HydrophobicContact CD1-CG 4.14Å; L391-F486 HydrophobicContact CD2-CD1 4.11Å; L391-F486 HydrophobicContact CD2-CD2 4.44Å; L391-F486 HydrophobicContact CD2-CE1 4.47Å; L391-F486 HydrophobicContact CD2-CG 4.09Å; L391-F486 HydrophobicContact CG-CB 4.41Å; L391-F486 HydrophobicContact CG-CD2 4.39Å; L391-F486 HydrophobicContact CG-CG 4.28Å; L391-F486 WeakPolarHBondContact O-CE2 3.32Å; A394-F486 HydrophobicContact CB-CZ 4.49Å; A395-F486 HydrophobicContact CB-CE2 3.71Å; A395-F486 HydrophobicContact CB-CZ 4.2Å; F398-F486 HydrophobicContact CD2-CZ 4.3Å; F398-F486 HydrophobicContact CE2-CZ 4.29Å; R482-F486 WeakPolarHBondContact O-CB 3.36Å; R482-F486 PolarHBondContact O-N 2.9Å; Q484-F486 VanDerWaalsContact C-N 3.33Å; Q484-F486 PolarHBondContact O-N 3.04Å; F486-F488 PolarHBondContact O-N 2.83Å; F486-N489 PolarHBondContact O-N 3.35Å; F486-F490 VanDerWaalsContact O-CB 3.24Å; F486-F490 WeakPolarHBondContact O-CB 3.38Å; F486-F490 PolarHBondContact O-N 2.67Å
487	L	92.1	Very high	87.5	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.1	-41.7	-178.5	-177.5	61.5	0	0	0	111.3	I408 L409 Y412 L415 Y483 Q484 N489 F490 L491 L514	I408-L487 HydrophobicContact CG2-CD1 3.65Å; L409-L487 HydrophobicContact CD2-CD2 4.19Å; Y412-L487 HydrophobicContact CD1-CD2 3.94Å; Y412-L487 HydrophobicContact CD2-CD2 3.57Å; Y412-L487 HydrophobicContact CE1-CB 3.97Å; Y412-L487 HydrophobicContact CE1-CD2 3.92Å; Y412-L487 HydrophobicContact CE2-CB 4.15Å; Y412-L487 HydrophobicContact CE2-CD1 4.44Å; Y412-L487 HydrophobicContact CE2-CD2 3.57Å; Y412-L487 HydrophobicContact CE2-CG 4.28Å; Y412-L487 HydrophobicContact CG-CD2 3.77Å; L415-L487 HydrophobicContact CD1-CD2 3.24Å; Y483-L487 PolarHBondContact O-N 3.48Å; Q484-L487 PolarHBondContact O-N 2.68Å; L487-N489 PolarHBondContact O-N 3.31Å; L487-F490 PolarHBondContact O-N 3.02Å; L487-L491 HydrophobicContact CD1-CD1 4.02Å; L487-L491 HydrophobicContact CD1-CD2 4.19Å; L487-L491 HydrophobicContact CD1-CG 3.81Å; L487-L491 HydrophobicContact CD2-CD1 4.44Å; L487-L491 HydrophobicContact CG-CD1 3.89Å; L487-L491 HydrophobicContact CG-CG 4.1Å; L487-L491 WeakPolarHBondContact O-CB 3.46Å; L487-L491 VanDerWaalsContact O-CG 3.29Å; L487-L491 WeakPolarHBondContact O-CG 3.22Å; L487-L491 PolarHBondContact O-N 2.7Å; L487-L514 HydrophobicContact CB-CD1 4.08Å; L487-L514 HydrophobicContact CD2-CD1 3.74Å; L487-L514 HydrophobicContact CG-CD1 3.71Å
488	F	90	Very high	87	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.009	24%	0.236	C	C	.	.	H	α-helix	trans	-57.9	-50	177	-178.2	-94	0	0	0	111.3	Q484 E485 F486 F490 L491 R492 L511 L514 Y515 L518 P525 L527	Q484-F488 WeakPolarHBondContact O-CB 3.5Å; Q484-F488 PolarHBondContact O-N 2.98Å; E485-F488 PolarHBondContact O-N 3.42Å; F486-F488 PolarHBondContact O-N 2.83Å; F488-F490 PolarHBondContact O-N 3.08Å; F488-L491 PolarHBondContact O-N 3.41Å; F488-R492 VanDerWaalsContact O-CB 3.29Å; F488-R492 WeakPolarHBondContact O-CB 3.38Å; F488-R492 PolarHBondContact O-N 3.01Å; F488-L511 HydrophobicContact CD2-CD2 3.89Å; F488-L511 HydrophobicContact CE2-CD2 3.96Å; F488-L514 HydrophobicContact CB-CB 4.39Å; F488-L514 HydrophobicContact CB-CD1 4.34Å; F488-L514 HydrophobicContact CD2-CB 3.99Å; F488-Y515 HydrophobicContact CE2-CD2 4.09Å; F488-Y515 HydrophobicContact CZ-CD2 4.01Å; F488-L518 HydrophobicContact CB-CD1 3.98Å; F488-L518 HydrophobicContact CD1-CD1 4.4Å; F488-L518 HydrophobicContact CD2-CD1 4.42Å; F488-L518 HydrophobicContact CG-CD1 4.01Å; F488-P525 HydrophobicContact CD1-CB 3.93Å; F488-P525 HydrophobicContact CE1-CB 3.37Å; F488-P525 HydrophobicContact CE1-CG 4.41Å; F488-P525 HydrophobicContact CE2-CB 4.48Å; F488-P525 HydrophobicContact CZ-CB 3.7Å; F488-P525 HydrophobicContact CZ-CG 4.41Å; F488-L527 HydrophobicContact CZ-CD2 4.26Å
489	N	88.8	Confident	86.3	Confident	69 Å²	69	50.3 Å²	50.3	37%	0.369	23%	0.227	S	C	.	.	H	α-helix	trans	-65.7	-37.5	178.3	-72.8	-45.1	0	0	0	112.4	E485 F486 L487 R492 K493	E485-N489 WeakPolarHBondContact O-CB 3.49Å; E485-N489 PolarHBondContact O-N 3.26Å; E485-N489 PolarHBondContact O-ND2 3.4Å; F486-N489 PolarHBondContact O-N 3.35Å; L487-N489 PolarHBondContact O-N 3.31Å; N489-R492 PolarHBondContact OD1-NH1 2.91Å; N489-R492 PolarHBondContact OD1-NH2 3.15Å; N489-K493 WeakPolarHBondContact O-CB 3.47Å; N489-K493 PolarHBondContact O-N 2.92Å
490	F	89.4	Confident	85.9	Confident	9 Å²	9	49.3 Å²	49.3	4%	0.039	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-48.8	177.5	-176.1	-95.1	0	0	0	111.6	A395 F398 E399 I405 I408 F486 L487 F488 K493 H494 F499	A395-F490 HydrophobicContact CB-CD2 3.97Å; A395-F490 HydrophobicContact CB-CE2 4.2Å; F398-F490 HydrophobicContact CB-CE2 3.95Å; F398-F490 HydrophobicContact CB-CZ 3.7Å; E399-F490 HydrophobicContact CG-CE2 4.18Å; I405-F490 HydrophobicContact CD1-CE1 4.12Å; I408-F490 HydrophobicContact CD1-CE1 3.92Å; I408-F490 HydrophobicContact CD1-CZ 4.36Å; F486-F490 VanDerWaalsContact O-CB 3.24Å; F486-F490 WeakPolarHBondContact O-CB 3.38Å; F486-F490 PolarHBondContact O-N 2.67Å; L487-F490 PolarHBondContact O-N 3.02Å; F488-F490 PolarHBondContact O-N 3.08Å; F490-K493 PolarHBondContact O-N 3.44Å; F490-H494 AromaticContact CD2-CD2 3.98Å; F490-H494 AromaticContact CE2-CD2 3.76Å; F490-H494 AromaticContact CE2-NE2 3.97Å; F490-H494 AromaticContact CZ-CD2 3.89Å; F490-H494 PolarHBondContact O-CD2 3.27Å; F490-H494 VanDerWaalsContact O-CD2 3.3Å; F490-H494 PolarHBondContact O-N 3.21Å; F490-H494 VanDerWaalsContact O-N 3.14Å; F490-F499 HydrophobicContact CE1-CE1 4.07Å; F490-F499 HydrophobicContact CE1-CZ 4.33Å; F490-F499 HydrophobicContact CZ-CE1 4.47Å; F490-F499 HydrophobicContact CZ-CZ 4.45Å
491	L	88.6	Confident	85.4	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-63.9	-40.9	177	-67.7	-180	0	0	0	111.6	I405 L409 L487 F488 H494 H495 V507 A510 L511 L514	I405-L491 HydrophobicContact CD1-CD2 3.51Å; I405-L491 HydrophobicContact CG1-CD2 3.82Å; L409-L491 HydrophobicContact CD2-CD1 4.04Å; L487-L491 HydrophobicContact CD1-CD1 4.02Å; L487-L491 HydrophobicContact CD1-CD2 4.19Å; L487-L491 HydrophobicContact CD1-CG 3.81Å; L487-L491 HydrophobicContact CD2-CD1 4.44Å; L487-L491 HydrophobicContact CG-CD1 3.89Å; L487-L491 HydrophobicContact CG-CG 4.1Å; L487-L491 WeakPolarHBondContact O-CB 3.46Å; L487-L491 VanDerWaalsContact O-CG 3.29Å; L487-L491 WeakPolarHBondContact O-CG 3.22Å; L487-L491 PolarHBondContact O-N 2.7Å; F488-L491 PolarHBondContact O-N 3.41Å; L491-H494 CarbonylContact O-C 3.51Å; L491-H494 PolarHBondContact O-N 3.03Å; L491-H495 WeakPolarHBondContact O-CA 3.45Å; L491-H495 WeakPolarHBondContact O-CB 3.43Å; L491-H495 PolarHBondContact O-N 3.18Å; L491-V507 HydrophobicContact CB-CG1 4.07Å; L491-V507 HydrophobicContact CD1-CG1 4.32Å; L491-V507 HydrophobicContact CD2-CB 4.49Å; L491-V507 HydrophobicContact CD2-CG1 3.87Å; L491-V507 HydrophobicContact CD2-CG2 3.94Å; L491-V507 HydrophobicContact CG-CG1 4.29Å; L491-A510 HydrophobicContact CD1-CB 4.14Å; L491-L511 HydrophobicContact CB-CD2 3.7Å; L491-L511 HydrophobicContact CB-CG 4.11Å; L491-L511 HydrophobicContact CD1-CD2 4.47Å; L491-L511 HydrophobicContact CD1-CG 4.47Å; L491-L514 HydrophobicContact CD1-CD1 4.09Å
492	R	86.3	Confident	85	Confident	49 Å²	49	59.8 Å²	59.8	19%	0.185	27%	0.267	C	S	.	.	H	α-helix	trans	-57.4	-52.2	175.7	-172.4	-174	75.5	-144.4	-9.6	111.5	F488 N489 H494 H495 Y526 L530	F488-R492 VanDerWaalsContact O-CB 3.29Å; F488-R492 WeakPolarHBondContact O-CB 3.38Å; F488-R492 PolarHBondContact O-N 3.01Å; N489-R492 PolarHBondContact OD1-NH1 2.91Å; N489-R492 PolarHBondContact OD1-NH2 3.15Å; R492-H494 VanDerWaalsContact C-N 3.26Å; R492-H494 PolarHBondContact O-N 3.26Å; R492-H495 WeakPolarHBondContact O-CB 3.46Å; R492-H495 PolarHBondContact O-N 2.97Å; R492-Y526 PolarHBondContact NH1-O 3.26Å; R492-L530 HydrophobicContact CG-CD1 3.89Å; R492-L530 HydrophobicContact CG-CG 3.95Å
493	K	85.4	Confident	84.7	Confident	117 Å²	117	55 Å²	55	51%	0.509	25%	0.25	S	C	.	.	H	α-helix	trans	-60.3	-35.7	-179.4	-174.6	-176.5	177.1	-166.3	0	112.4	E399 N489 F490	E399-K493 WeakPolarHBondContact OE1-CE 3.45Å; E399-K493 IonicContact OE1-NZ 3.22Å; E399-K493 PolarHBondContact OE1-NZ 2.84Å; E399-K493 IonicContact OE2-NZ 2.81Å; N489-K493 WeakPolarHBondContact O-CB 3.47Å; N489-K493 PolarHBondContact O-N 2.92Å; F490-K493 PolarHBondContact O-N 3.44Å
494	H	83.9	Confident	84.5	Confident	30 Å²	30	56.4 Å²	56.4	14%	0.139	26%	0.257	C	S	.	.	H	α-helix	trans	-101.4	5.6	-175.3	-70.1	-66.8	0	0	0	114.6	E399 F490 L491 R492 K496 S497 V500	E399-H494 VanDerWaalsContact CD-NE2 3.34Å; E399-H494 WeakPolarHBondContact CG-NE2 3.46Å; E399-H494 IonicContact OE1-CD2 3.51Å; E399-H494 IonicContact OE1-CE1 3.08Å; E399-H494 PolarHBondContact OE1-CE1 3.32Å; E399-H494 IonicContact OE1-NE2 3.32Å; E399-H494 PolarHBondContact OE1-NE2 3.43Å; F490-H494 AromaticContact CD2-CD2 3.98Å; F490-H494 AromaticContact CE2-CD2 3.76Å; F490-H494 AromaticContact CE2-NE2 3.97Å; F490-H494 AromaticContact CZ-CD2 3.89Å; F490-H494 PolarHBondContact O-CD2 3.27Å; F490-H494 VanDerWaalsContact O-CD2 3.3Å; F490-H494 PolarHBondContact O-N 3.21Å; F490-H494 VanDerWaalsContact O-N 3.14Å; L491-H494 CarbonylContact O-C 3.51Å; L491-H494 PolarHBondContact O-N 3.03Å; R492-H494 VanDerWaalsContact C-N 3.26Å; R492-H494 PolarHBondContact O-N 3.26Å; H494-K496 VanDerWaalsContact C-N 3.28Å; H494-K496 PolarHBondContact O-N 3.15Å; H494-S497 VanDerWaalsContact O-CB 3.3Å; H494-S497 WeakPolarHBondContact O-CB 3.47Å; H494-S497 PolarHBondContact O-N 3.45Å; H494-S497 PolarHBondContact O-OG 2.94Å; H494-V500 HydrophobicContact CB-CG2 4.29Å; H494-V500 VanDerWaalsContact O-CG2 3.23Å; H494-V500 WeakPolarHBondContact O-CG2 3.32Å
495	H	82.8	Confident	84.2	Confident	23 Å²	23	59 Å²	59	11%	0.106	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-40.8	-176.1	174.9	-101.9	0	0	0	113.1	L491 R492 E508 L530	L491-H495 WeakPolarHBondContact O-CA 3.45Å; L491-H495 WeakPolarHBondContact O-CB 3.43Å; L491-H495 PolarHBondContact O-N 3.18Å; R492-H495 WeakPolarHBondContact O-CB 3.46Å; R492-H495 PolarHBondContact O-N 2.97Å; H495-E508 IonicContact CD2-OE1 3.61Å; H495-E508 IonicContact CE1-OE1 3.98Å; H495-E508 IonicContact NE2-OE1 2.94Å; H495-E508 PolarHBondContact NE2-OE1 3.42Å; H495-L530 HydrophobicContact CB-CD2 4.23Å
496	K	79.8	Confident	84.1	Confident	145 Å²	145	57 Å²	57	63%	0.63	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	8.5	179.7	-63.8	175.9	-178.6	160.9	0	114.4	H494 E529	H494-K496 VanDerWaalsContact C-N 3.28Å; H494-K496 PolarHBondContact O-N 3.15Å; K496-E529 PolarHBondContact NZ-O 2.86Å
497	S	81.8	Confident	83.8	Confident	33 Å²	33	56.1 Å²	56.1	23%	0.231	26%	0.256	C	S	.	.	S	Bend	trans	-88	155.8	-175.9	74	0	0	0	0	111.9	H494 F499 V500 E501	H494-S497 VanDerWaalsContact O-CB 3.3Å; H494-S497 WeakPolarHBondContact O-CB 3.47Å; H494-S497 PolarHBondContact O-N 3.45Å; H494-S497 PolarHBondContact O-OG 2.94Å; S497-F499 PolarHBondContact O-N 3.01Å; S497-F499 WeakPolarHBondContact OG-CB 3.48Å; S497-F499 PolarHBondContact OG-N 3.19Å; S497-V500 PolarHBondContact O-N 3.46Å; S497-V500 VanDerWaalsContact O-N 3.17Å; S497-E501 PolarHBondContact O-N 3.38Å
498	K	74.9	Confident	83.7	Confident	189 Å²	189	56.3 Å²	56.3	82%	0.822	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-14.5	173.4	-66.9	-174.2	176.5	-176.2	0	113.7
499	F	71.4	Confident	83.5	Confident	44 Å²	44	56.2 Å²	56.2	19%	0.193	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-37.1	178.8	174.2	-93.3	0	0	0	111.9	I403 I405 F490 S497	I403-F499 HydrophobicContact CB-CE2 4.36Å; I403-F499 HydrophobicContact CG2-CE2 3.6Å; I403-F499 HydrophobicContact CG2-CZ 3.56Å; I403-F499 WeakPolarHBondContact O-CD2 3.42Å; I403-F499 WeakPolarHBondContact O-CE2 3.42Å; I403-F499 WeakPolarHBondContact O-CZ 3.42Å; I405-F499 HydrophobicContact CB-CD1 4.48Å; I405-F499 HydrophobicContact CB-CE1 3.77Å; I405-F499 HydrophobicContact CB-CZ 4.27Å; I405-F499 HydrophobicContact CD1-CE1 3.59Å; I405-F499 HydrophobicContact CD1-CZ 4.16Å; I405-F499 HydrophobicContact CG1-CE1 4.01Å; F490-F499 HydrophobicContact CE1-CE1 4.07Å; F490-F499 HydrophobicContact CE1-CZ 4.33Å; F490-F499 HydrophobicContact CZ-CE1 4.47Å; F490-F499 HydrophobicContact CZ-CZ 4.45Å; S497-F499 PolarHBondContact O-N 3.01Å; S497-F499 WeakPolarHBondContact OG-CB 3.48Å; S497-F499 PolarHBondContact OG-N 3.19Å
500	V	77.1	Confident	83.5	Confident	0 Å²	0	53 Å²	53	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-19.6	-175.8	-178.1	0	0	0	0	112.8	H494 S497 K502 H503 L504 V507	H494-V500 HydrophobicContact CB-CG2 4.29Å; H494-V500 VanDerWaalsContact O-CG2 3.23Å; H494-V500 WeakPolarHBondContact O-CG2 3.32Å; S497-V500 PolarHBondContact O-N 3.46Å; S497-V500 VanDerWaalsContact O-N 3.17Å; V500-K502 VanDerWaalsContact C-N 3.29Å; V500-K502 PolarHBondContact O-N 3.33Å; V500-H503 CarbonylContact O-C 3.59Å; V500-H503 VanDerWaalsContact O-C 3.27Å; V500-H503 WeakPolarHBondContact O-CA 3.37Å; V500-H503 PolarHBondContact O-N 3.35Å; V500-L504 HydrophobicContact CG1-CB 4.42Å; V500-L504 HydrophobicContact CG1-CD1 3.76Å; V500-L504 PolarHBondContact O-N 3.33Å; V500-V507 HydrophobicContact CB-CG2 4.48Å; V500-V507 HydrophobicContact CG1-CB 3.53Å; V500-V507 HydrophobicContact CG1-CG1 3.82Å; V500-V507 HydrophobicContact CG1-CG2 3.35Å; V500-V507 HydrophobicContact CG2-CG2 4.41Å
501	E	78.3	Confident	83.5	Confident	138 Å²	138	52.5 Å²	52.5	65%	0.645	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-45.9	-43.9	-169.4	-169.6	178.8	177.2	0	0	114.8	S497 H503	S497-E501 PolarHBondContact O-N 3.38Å; E501-H503 VanDerWaalsContact C-N 3.31Å; E501-H503 PolarHBondContact O-N 3.02Å
502	K	80.2	Confident	83.4	Confident	180 Å²	180	52.7 Å²	52.7	78%	0.783	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-71.7	-23.5	179.9	-66	-175.4	-179.2	179.2	0	114.4	V500	V500-K502 VanDerWaalsContact C-N 3.29Å; V500-K502 PolarHBondContact O-N 3.33Å
503	H	84.1	Confident	83.5	Confident	28 Å²	28	50.4 Å²	50.4	13%	0.13	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-125.9	25.9	-170.7	-64.5	-46.1	0	0	0	111.4	D404 I405 R406 V500 E501 H505 F506 V507	D404-H503 IonicContact OD1-CD2 3.74Å; D404-H503 IonicContact OD1-NE2 3.7Å; I405-H503 HydrophobicContact CG2-CB 3.71Å; R406-H503 PolarHBondContact NE-CE1 3.17Å; R406-H503 PolarHBondContact NE-NE2 2.91Å; R406-H503 PolarHBondContact NH2-CE1 3.45Å; R406-H503 PolarHBondContact NH2-NE2 3.21Å; V500-H503 CarbonylContact O-C 3.59Å; V500-H503 VanDerWaalsContact O-C 3.27Å; V500-H503 WeakPolarHBondContact O-CA 3.37Å; V500-H503 PolarHBondContact O-N 3.35Å; E501-H503 VanDerWaalsContact C-N 3.31Å; E501-H503 PolarHBondContact O-N 3.02Å; H503-H505 PolarHBondContact O-N 3.48Å; H503-F506 HydrophobicContact CB-CD2 4.08Å; H503-F506 PolarHBondContact O-N 2.93Å; H503-F506 VanDerWaalsContact O-N 3.13Å; H503-V507 PolarHBondContact O-N 2.81Å
504	L	86.6	Confident	83.6	Confident	30 Å²	30	44.9 Å²	44.9	16%	0.157	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-36.2	-175.5	-171.8	60.2	0	0	0	112	V500 F506 V507 E508 H567	V500-L504 HydrophobicContact CG1-CB 4.42Å; V500-L504 HydrophobicContact CG1-CD1 3.76Å; V500-L504 PolarHBondContact O-N 3.33Å; L504-F506 PolarHBondContact O-N 3.3Å; L504-V507 PolarHBondContact O-N 3.42Å; L504-V507 VanDerWaalsContact O-N 3.12Å; L504-E508 HydrophobicContact CD1-CG 3.99Å; L504-E508 HydrophobicContact CG-CG 4.12Å; L504-E508 WeakPolarHBondContact O-CG 2.97Å; L504-E508 PolarHBondContact O-N 2.92Å; L504-H567 VanDerWaalsContact CD2-ND1 3.3Å; L504-H567 WeakPolarHBondContact CD2-ND1 3.41Å; L504-H567 HydrophobicContact CG-CB 4.44Å
505	H	85.7	Confident	83.7	Confident	69 Å²	69	43.5 Å²	43.5	32%	0.319	20%	0.199	S	C	.	.	H	α-helix	trans	-60.9	-42.2	176.7	61.2	-83.1	0	0	0	113.6	H503 V507 T509 H567	H503-H505 PolarHBondContact O-N 3.48Å; H505-V507 VanDerWaalsContact C-N 3.33Å; H505-V507 PolarHBondContact O-N 2.93Å; H505-T509 VanDerWaalsContact O-CB 3.24Å; H505-T509 WeakPolarHBondContact O-CB 3.32Å; H505-T509 PolarHBondContact O-N 3.28Å; H505-T509 VanDerWaalsContact O-N 3.15Å; H505-T509 PolarHBondContact O-OG1 3.01Å; H505-H567 WeakPolarHBondContact CA-O 3.32Å; H505-H567 HydrophobicContact CB-CB 4.27Å; H505-H567 VanDerWaalsContact CB-O 3.24Å; H505-H567 WeakPolarHBondContact CB-O 3.38Å
506	F	86.8	Confident	83.7	Confident	23 Å²	23	42.6 Å²	42.6	10%	0.101	20%	0.195	C	C	.	.	H	α-helix	trans	-66.5	-37.4	174.5	-63.2	-53.1	0	0	0	111.7	R406 L409 L416 P417 H503 L504 A510	R406-F506 HydrophobicContact CG-CD2 4.29Å; L409-F506 HydrophobicContact CD1-CB 3.89Å; L416-F506 HydrophobicContact CD2-CD1 4.36Å; L416-F506 HydrophobicContact CD2-CG 4.36Å; P417-F506 HydrophobicContact CG-CD1 3.92Å; P417-F506 HydrophobicContact CG-CE1 3.75Å; H503-F506 HydrophobicContact CB-CD2 4.08Å; H503-F506 PolarHBondContact O-N 2.93Å; H503-F506 VanDerWaalsContact O-N 3.13Å; L504-F506 PolarHBondContact O-N 3.3Å; F506-A510 WeakPolarHBondContact O-CB 3.48Å; F506-A510 PolarHBondContact O-N 3.13Å
507	V	86.9	Confident	84	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-71	-46.1	-178.7	169.1	0	0	0	0	112.2	I405 L409 L491 V500 H503 L504 H505 T509 A510 L511	I405-V507 HydrophobicContact CG1-CG2 3.77Å; I405-V507 HydrophobicContact CG2-CG2 4.05Å; L409-V507 HydrophobicContact CD1-CG2 4.43Å; L491-V507 HydrophobicContact CB-CG1 4.07Å; L491-V507 HydrophobicContact CD1-CG1 4.32Å; L491-V507 HydrophobicContact CD2-CB 4.49Å; L491-V507 HydrophobicContact CD2-CG1 3.87Å; L491-V507 HydrophobicContact CD2-CG2 3.94Å; L491-V507 HydrophobicContact CG-CG1 4.29Å; V500-V507 HydrophobicContact CB-CG2 4.48Å; V500-V507 HydrophobicContact CG1-CB 3.53Å; V500-V507 HydrophobicContact CG1-CG1 3.82Å; V500-V507 HydrophobicContact CG1-CG2 3.35Å; V500-V507 HydrophobicContact CG2-CG2 4.41Å; H503-V507 PolarHBondContact O-N 2.81Å; L504-V507 PolarHBondContact O-N 3.42Å; L504-V507 VanDerWaalsContact O-N 3.12Å; H505-V507 VanDerWaalsContact C-N 3.33Å; H505-V507 PolarHBondContact O-N 2.93Å; V507-T509 VanDerWaalsContact C-N 3.35Å; V507-A510 PolarHBondContact O-N 3.38Å; V507-L511 HydrophobicContact CG1-CD1 4.24Å; V507-L511 HydrophobicContact CG1-CG 4.46Å; V507-L511 WeakPolarHBondContact O-CG 3.37Å; V507-L511 PolarHBondContact O-N 3.24Å
508	E	88.7	Confident	84.1	Confident	3 Å²	3	35.8 Å²	35.8	1%	0.014	16%	0.161	C	C	.	.	H	α-helix	trans	-64.9	-41.4	178.7	-65	-168.5	177.7	0	0	111.3	H495 L504 A510 L511 V512 L565 I566 H567 I568	H495-E508 IonicContact CD2-OE1 3.61Å; H495-E508 IonicContact CE1-OE1 3.98Å; H495-E508 IonicContact NE2-OE1 2.94Å; H495-E508 PolarHBondContact NE2-OE1 3.42Å; L504-E508 HydrophobicContact CD1-CG 3.99Å; L504-E508 HydrophobicContact CG-CG 4.12Å; L504-E508 WeakPolarHBondContact O-CG 2.97Å; L504-E508 PolarHBondContact O-N 2.92Å; E508-A510 PolarHBondContact O-N 3.39Å; E508-L511 WeakPolarHBondContact O-CB 3.4Å; E508-L511 PolarHBondContact O-N 3.27Å; E508-V512 PolarHBondContact O-N 3.11Å; E508-V512 VanDerWaalsContact O-N 3.15Å; E508-L565 HydrophobicContact CB-CD2 3.97Å; E508-L565 HydrophobicContact CG-CD2 3.7Å; E508-I566 PolarHBondContact OE2-N 3.42Å; E508-H567 IonicContact OE1-ND1 3.41Å; E508-H567 WeakPolarHBondContact OE2-CA 3.22Å; E508-H567 PolarHBondContact OE2-N 3.49Å; E508-I568 HydrophobicContact CB-CG1 4.45Å
509	T	87.4	Confident	84.3	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-59.7	-46.1	171.9	-55.6	0	0	0	0	111.3	H505 V507 L511 V512 K513 D569 D572 L573	H505-T509 VanDerWaalsContact O-CB 3.24Å; H505-T509 WeakPolarHBondContact O-CB 3.32Å; H505-T509 PolarHBondContact O-N 3.28Å; H505-T509 VanDerWaalsContact O-N 3.15Å; H505-T509 PolarHBondContact O-OG1 3.01Å; V507-T509 VanDerWaalsContact C-N 3.35Å; T509-L511 VanDerWaalsContact C-N 3.34Å; T509-L511 PolarHBondContact O-N 3.48Å; T509-V512 PolarHBondContact O-N 3.22Å; T509-K513 WeakPolarHBondContact O-CG 3.35Å; T509-K513 PolarHBondContact O-N 3.19Å; T509-D569 HydrophobicContact CG2-CB 4.26Å; T509-D569 WeakPolarHBondContact OG1-CB 3.46Å; T509-D569 PolarHBondContact OG1-N 2.92Å; T509-D572 HydrophobicContact CG2-CB 4.41Å; T509-L573 HydrophobicContact CG2-CD2 3.77Å; T509-L573 HydrophobicContact CG2-CG 3.89Å
510	A	88.2	Confident	84.8	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.7	-35.4	176.9	0	0	0	0	0	112.8	L409 L415 L491 F506 V507 E508 K513 L514	L409-A510 HydrophobicContact CD2-CB 3.76Å; L415-A510 HydrophobicContact CD2-CB 4.5Å; L491-A510 HydrophobicContact CD1-CB 4.14Å; F506-A510 WeakPolarHBondContact O-CB 3.48Å; F506-A510 PolarHBondContact O-N 3.13Å; V507-A510 PolarHBondContact O-N 3.38Å; E508-A510 PolarHBondContact O-N 3.39Å; A510-K513 PolarHBondContact O-N 3.08Å; A510-L514 VanDerWaalsContact O-CB 3.32Å; A510-L514 WeakPolarHBondContact O-CB 3.3Å; A510-L514 VanDerWaalsContact O-CG 3.26Å; A510-L514 WeakPolarHBondContact O-CG 3.43Å; A510-L514 PolarHBondContact O-N 2.86Å
511	L	89.2	Confident	84.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.3	-44	174.8	-79.9	171.3	0	0	0	111.3	F488 L491 V507 E508 T509 L514 Y515 L565	F488-L511 HydrophobicContact CD2-CD2 3.89Å; F488-L511 HydrophobicContact CE2-CD2 3.96Å; L491-L511 HydrophobicContact CB-CD2 3.7Å; L491-L511 HydrophobicContact CB-CG 4.11Å; L491-L511 HydrophobicContact CD1-CD2 4.47Å; L491-L511 HydrophobicContact CD1-CG 4.47Å; V507-L511 HydrophobicContact CG1-CD1 4.24Å; V507-L511 HydrophobicContact CG1-CG 4.46Å; V507-L511 WeakPolarHBondContact O-CG 3.37Å; V507-L511 PolarHBondContact O-N 3.24Å; E508-L511 WeakPolarHBondContact O-CB 3.4Å; E508-L511 PolarHBondContact O-N 3.27Å; T509-L511 VanDerWaalsContact C-N 3.34Å; T509-L511 PolarHBondContact O-N 3.48Å; L511-L514 PolarHBondContact O-N 2.84Å; L511-Y515 VanDerWaalsContact O-CB 3.3Å; L511-Y515 WeakPolarHBondContact O-CB 3.44Å; L511-Y515 PolarHBondContact O-N 3.35Å; L511-L565 HydrophobicContact CD1-CD2 4.38Å
512	V	85.9	Confident	84.5	Confident	4 Å²	4	30.9 Å²	30.9	2%	0.024	17%	0.169	C	C	.	.	H	α-helix	trans	-64.2	-46.7	175.5	-178.1	0	0	0	0	110.9	E508 T509 L514 Y515 V516 L565 I568 L573 I589	E508-V512 PolarHBondContact O-N 3.11Å; E508-V512 VanDerWaalsContact O-N 3.15Å; T509-V512 PolarHBondContact O-N 3.22Å; V512-L514 VanDerWaalsContact C-N 3.35Å; V512-L514 PolarHBondContact O-N 3.39Å; V512-Y515 PolarHBondContact O-N 3.04Å; V512-V516 WeakPolarHBondContact O-CG2 3.28Å; V512-V516 PolarHBondContact O-N 2.84Å; V512-L565 HydrophobicContact CG2-CD1 3.62Å; V512-I568 HydrophobicContact CG2-CD1 4.34Å; V512-L573 HydrophobicContact CB-CD1 4.09Å; V512-L573 HydrophobicContact CB-CD2 4.22Å; V512-L573 HydrophobicContact CG1-CD1 4.03Å; V512-L573 HydrophobicContact CG1-CD2 4.26Å; V512-L573 HydrophobicContact CG2-CD1 4.31Å; V512-I589 HydrophobicContact CG1-CD1 4.38Å
513	K	89.2	Confident	84.2	Confident	2 Å²	2	24.7 Å²	24.7	1%	0.009	14%	0.144	C	C	.	.	H	α-helix	trans	-58.3	-45.2	177.6	-69.2	-179	171.6	-178.3	0	112.2	D414 L415 T509 A510 R517 D572 L573 Y576	D414-K513 WeakPolarHBondContact O-CD 3.16Å; D414-K513 PolarHBondContact O-NZ 3.4Å; L415-K513 HydrophobicContact CD2-CB 3.98Å; L415-K513 HydrophobicContact CD2-CD 4.38Å; T509-K513 WeakPolarHBondContact O-CG 3.35Å; T509-K513 PolarHBondContact O-N 3.19Å; A510-K513 PolarHBondContact O-N 3.08Å; K513-R517 WeakPolarHBondContact O-CG 3.39Å; K513-R517 PolarHBondContact O-N 3.24Å; K513-R517 VanDerWaalsContact O-N 3.08Å; K513-D572 WeakPolarHBondContact CE-OD2 3.3Å; K513-D572 IonicContact NZ-OD1 3.88Å; K513-D572 PolarHBondContact NZ-OD1 3.36Å; K513-D572 IonicContact NZ-OD2 2.62Å; K513-D572 PolarHBondContact NZ-OD2 3.21Å; K513-L573 HydrophobicContact CD-CD2 4.41Å; K513-L573 HydrophobicContact CG-CD2 3.65Å; K513-Y576 HydrophobicContact CB-CD1 4.38Å; K513-Y576 HydrophobicContact CB-CE1 3.98Å; K513-Y576 HydrophobicContact CD-CD1 4.28Å; K513-Y576 HydrophobicContact CD-CD2 4.07Å; K513-Y576 HydrophobicContact CD-CE2 4.32Å; K513-Y576 HydrophobicContact CD-CG 4.05Å; K513-Y576 HydrophobicContact CG-CD1 3.72Å; K513-Y576 HydrophobicContact CG-CD2 4.35Å; K513-Y576 HydrophobicContact CG-CE1 3.83Å; K513-Y576 HydrophobicContact CG-CE2 4.44Å; K513-Y576 HydrophobicContact CG-CG 4Å
514	L	86.9	Confident	83.4	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67.4	-40.7	178	-74	169.5	0	0	0	112.1	L415 Q484 L487 F488 L491 A510 L511 V512 V516 R517 L518	L415-L514 HydrophobicContact CD1-CD1 4.28Å; L415-L514 HydrophobicContact CD1-CD2 4.16Å; L415-L514 HydrophobicContact CD1-CG 4.25Å; L415-L514 HydrophobicContact CD2-CD2 4.19Å; L415-L514 HydrophobicContact CD2-CG 4.07Å; Q484-L514 HydrophobicContact CB-CD2 4.11Å; Q484-L514 HydrophobicContact CG-CD2 4.06Å; L487-L514 HydrophobicContact CB-CD1 4.08Å; L487-L514 HydrophobicContact CD2-CD1 3.74Å; L487-L514 HydrophobicContact CG-CD1 3.71Å; F488-L514 HydrophobicContact CB-CB 4.39Å; F488-L514 HydrophobicContact CB-CD1 4.34Å; F488-L514 HydrophobicContact CD2-CB 3.99Å; L491-L514 HydrophobicContact CD1-CD1 4.09Å; A510-L514 VanDerWaalsContact O-CB 3.32Å; A510-L514 WeakPolarHBondContact O-CB 3.3Å; A510-L514 VanDerWaalsContact O-CG 3.26Å; A510-L514 WeakPolarHBondContact O-CG 3.43Å; A510-L514 PolarHBondContact O-N 2.86Å; L511-L514 PolarHBondContact O-N 2.84Å; V512-L514 VanDerWaalsContact C-N 3.35Å; V512-L514 PolarHBondContact O-N 3.39Å; L514-V516 VanDerWaalsContact C-N 3.35Å; L514-V516 PolarHBondContact O-N 2.97Å; L514-R517 PolarHBondContact O-N 3.11Å; L514-L518 WeakPolarHBondContact O-CG 3.48Å; L514-L518 PolarHBondContact O-N 3.33Å
515	Y	85.6	Confident	82.4	Confident	1 Å²	1	26.6 Å²	26.6	0%	0.004	15%	0.153	C	C	.	.	H	α-helix	trans	-58.9	-47.5	176.6	-172.4	-88.7	0	0	0	111.2	F488 L511 V512 R517 L518 Q519 P525 L527 S557 L558 L561	F488-Y515 HydrophobicContact CE2-CD2 4.09Å; F488-Y515 HydrophobicContact CZ-CD2 4.01Å; L511-Y515 VanDerWaalsContact O-CB 3.3Å; L511-Y515 WeakPolarHBondContact O-CB 3.44Å; L511-Y515 PolarHBondContact O-N 3.35Å; V512-Y515 PolarHBondContact O-N 3.04Å; Y515-R517 PolarHBondContact O-N 3.27Å; Y515-L518 PolarHBondContact O-N 3.26Å; Y515-Q519 WeakPolarHBondContact O-CB 3.42Å; Y515-Q519 PolarHBondContact O-N 2.83Å; Y515-P525 HydrophobicContact CD2-CB 4.07Å; Y515-P525 HydrophobicContact CD2-CG 3.59Å; Y515-P525 HydrophobicContact CE2-CB 4.11Å; Y515-P525 HydrophobicContact CE2-CG 3.72Å; Y515-P525 HydrophobicContact CG-CG 4.4Å; Y515-L527 HydrophobicContact CE2-CD1 4.4Å; Y515-L527 HydrophobicContact CE2-CD2 4.28Å; Y515-L527 HydrophobicContact CE2-CG 4.47Å; Y515-S557 VanDerWaalsContact OH-CB 3.32Å; Y515-S557 WeakPolarHBondContact OH-CB 3.47Å; Y515-S557 PolarHBondContact OH-OG 2.91Å; Y515-L558 HydrophobicContact CD1-CB 4.48Å; Y515-L558 HydrophobicContact CD1-CD1 3.97Å; Y515-L558 HydrophobicContact CD1-CG 4.08Å; Y515-L558 HydrophobicContact CE1-CB 3.7Å; Y515-L558 HydrophobicContact CE1-CD1 3.77Å; Y515-L558 HydrophobicContact CE1-CG 3.78Å; Y515-L561 HydrophobicContact CD1-CD2 4.2Å; Y515-L561 HydrophobicContact CD2-CD2 3.7Å; Y515-L561 HydrophobicContact CE2-CD2 4.4Å; Y515-L561 HydrophobicContact CG-CD2 3.58Å
516	V	83	Confident	81.6	Confident	5 Å²	5	32.5 Å²	32.5	3%	0.03	17%	0.174	C	C	.	.	H	α-helix	trans	-62	-42.5	177.2	173.7	0	0	0	0	111.3	V512 L514 Q519 Q520 L577 A582 A585	V512-V516 WeakPolarHBondContact O-CG2 3.28Å; V512-V516 PolarHBondContact O-N 2.84Å; L514-V516 VanDerWaalsContact C-N 3.35Å; L514-V516 PolarHBondContact O-N 2.97Å; V516-Q519 PolarHBondContact O-N 3Å; V516-Q520 HydrophobicContact CG1-CG 4.4Å; V516-Q520 WeakPolarHBondContact O-CB 3.29Å; V516-Q520 VanDerWaalsContact O-CG 3.3Å; V516-Q520 WeakPolarHBondContact O-CG 3.35Å; V516-Q520 PolarHBondContact O-N 2.95Å; V516-L577 HydrophobicContact CG1-CD2 4.23Å; V516-L577 HydrophobicContact CG2-CD2 3.99Å; V516-A582 HydrophobicContact CG1-CB 3.77Å; V516-A585 HydrophobicContact CG2-CB 4.16Å
517	R	85.8	Confident	80.3	Confident	32 Å²	32	32.1 Å²	32.1	12%	0.121	17%	0.173	C	C	.	.	H	α-helix	trans	-61.1	-45.4	176.1	-76	-178.9	172.7	175.9	-1.1	112.5	S413 D414 K513 L514 Y515 Q519 Q520 A521 Y576	S413-R517 VanDerWaalsContact O-CZ 3.31Å; S413-R517 PolarHBondContact O-NH1 2.88Å; S413-R517 PolarHBondContact O-NH2 2.95Å; D414-R517 IonicContact OD2-NH2 2.67Å; D414-R517 PolarHBondContact OD2-NH2 3.26Å; K513-R517 WeakPolarHBondContact O-CG 3.39Å; K513-R517 PolarHBondContact O-N 3.24Å; K513-R517 VanDerWaalsContact O-N 3.08Å; L514-R517 PolarHBondContact O-N 3.11Å; Y515-R517 PolarHBondContact O-N 3.27Å; R517-Q519 VanDerWaalsContact C-N 3.35Å; R517-Q520 PolarHBondContact O-N 3.42Å; R517-A521 PolarHBondContact O-N 2.75Å; R517-Y576 WeakPolarHBondContact CD-OH 3.46Å; R517-Y576 WeakPolarHBondContact CG-OH 3.49Å; R517-Y576 PolarHBondContact NE-OH 3.32Å
518	L	84	Confident	78.8	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-65.4	-39.7	178.4	-68.8	173.3	0	0	0	111.3	L481 Q484 E485 F488 L514 Y515 A521 G522 I523 P525	L481-L518 HydrophobicContact CD1-CD2 4.43Å; Q484-L518 HydrophobicContact CB-CD2 4.05Å; E485-L518 HydrophobicContact CG-CD1 4.48Å; E485-L518 HydrophobicContact CG-CD2 3.69Å; F488-L518 HydrophobicContact CB-CD1 3.98Å; F488-L518 HydrophobicContact CD1-CD1 4.4Å; F488-L518 HydrophobicContact CD2-CD1 4.42Å; F488-L518 HydrophobicContact CG-CD1 4.01Å; L514-L518 WeakPolarHBondContact O-CG 3.48Å; L514-L518 PolarHBondContact O-N 3.33Å; Y515-L518 PolarHBondContact O-N 3.26Å; L518-A521 CarbonylContact O-C 3.53Å; L518-A521 PolarHBondContact O-N 3.22Å; L518-G522 PolarHBondContact O-N 3.42Å; L518-I523 CarbonylContact C-O 3.53Å; L518-I523 VanDerWaalsContact C-O 3.29Å; L518-I523 PolarHBondContact O-N 3.36Å; L518-I523 VanDerWaalsContact O-O 3.09Å; L518-P525 HydrophobicContact CB-CG 3.87Å; L518-P525 HydrophobicContact CD1-CB 4.3Å; L518-P525 HydrophobicContact CD1-CG 3.8Å; L518-P525 HydrophobicContact CG-CG 4.5Å
519	Q	80.6	Confident	77.1	Confident	40 Å²	40	46.8 Å²	46.8	19%	0.187	24%	0.235	C	C	.	.	H	α-helix	trans	-64.9	-43.2	175.8	-172.9	175.8	3.1	0	0	112	Y515 V516 R517 A521 G522 I523	Y515-Q519 WeakPolarHBondContact O-CB 3.42Å; Y515-Q519 PolarHBondContact O-N 2.83Å; V516-Q519 PolarHBondContact O-N 3Å; R517-Q519 VanDerWaalsContact C-N 3.35Å; Q519-A521 PolarHBondContact O-N 3.35Å; Q519-G522 PolarHBondContact O-N 3.21Å; Q519-I523 WeakPolarHBondContact CA-O 3.3Å; Q519-I523 PolarHBondContact N-O 3.04Å
520	Q	80.1	Confident	75.5	Confident	104 Å²	104	47.3 Å²	47.3	49%	0.486	24%	0.237	S	C	.	.	H	α-helix	trans	-62.8	-30	174.4	-74.1	178.9	-14.9	0	0	112.4	V516 R517 G522 N580	V516-Q520 HydrophobicContact CG1-CG 4.4Å; V516-Q520 WeakPolarHBondContact O-CB 3.29Å; V516-Q520 VanDerWaalsContact O-CG 3.3Å; V516-Q520 WeakPolarHBondContact O-CG 3.35Å; V516-Q520 PolarHBondContact O-N 2.95Å; R517-Q520 PolarHBondContact O-N 3.42Å; Q520-G522 PolarHBondContact O-N 2.73Å; Q520-N580 PolarHBondContact NE2-O 2.97Å; Q520-N580 VanDerWaalsContact NE2-O 3.16Å
521	A	78.3	Confident	73.6	Confident	56 Å²	56	50.1 Å²	50.1	46%	0.463	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-0.9	172.5	0	0	0	0	0	114	L481 R517 L518 Q519	L481-A521 HydrophobicContact CD1-CB 3.37Å; R517-A521 PolarHBondContact O-N 2.75Å; L518-A521 CarbonylContact O-C 3.53Å; L518-A521 PolarHBondContact O-N 3.22Å; Q519-A521 PolarHBondContact O-N 3.35Å
522	G	71	Confident	71.4	Confident	67 Å²	67	56 Å²	56	69%	0.691	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	14	177.9	0	0	0	0	0	115	L518 Q519 Q520	L518-G522 PolarHBondContact O-N 3.42Å; Q519-G522 PolarHBondContact O-N 3.21Å; Q520-G522 PolarHBondContact O-N 2.73Å
523	I	74.6	Confident	68.8	Low	51 Å²	51	60.3 Å²	60.3	26%	0.262	31%	0.305	S	S	.	.			trans	-108	133.4	-179.3	-58.3	-172.1	0	0	0	110.1	L481 E485 L518 Q519 P525	L481-I523 HydrophobicContact CD1-CD1 3.69Å; L481-I523 HydrophobicContact CD1-CG1 4.42Å; L481-I523 HydrophobicContact CD2-CD1 3.19Å; L481-I523 HydrophobicContact CG-CD1 3.79Å; E485-I523 VanDerWaalsContact OE1-CD1 3.26Å; E485-I523 WeakPolarHBondContact OE1-CD1 3.5Å; L518-I523 CarbonylContact C-O 3.53Å; L518-I523 VanDerWaalsContact C-O 3.29Å; L518-I523 PolarHBondContact O-N 3.36Å; L518-I523 VanDerWaalsContact O-O 3.09Å; Q519-I523 WeakPolarHBondContact CA-O 3.3Å; Q519-I523 PolarHBondContact N-O 3.04Å; I523-P525 WeakPolarHBondContact O-CD 3.4Å
524	Q	66.7	Low	65.9	Low	82 Å²	82	66.6 Å²	66.6	38%	0.383	34%	0.344	S	S	.	.			trans	-96.6	106.1	175.8	-76.8	-95.4	-65.2	0	0	109.1	S554	Q524-S554 VanDerWaalsContact NE2-CA 3.31Å; Q524-S554 VanDerWaalsContact OE1-CA 3.26Å
525	P	66.8	Low	63.2	Low	15 Å²	15	71.4 Å²	71.4	10%	0.097	37%	0.373	C	S	.	.			trans	-70.8	135.2	179.6	-13.1	29.2	0	0	0	110.8	F488 Y515 L518 I523	F488-P525 HydrophobicContact CD1-CB 3.93Å; F488-P525 HydrophobicContact CE1-CB 3.37Å; F488-P525 HydrophobicContact CE1-CG 4.41Å; F488-P525 HydrophobicContact CE2-CB 4.48Å; F488-P525 HydrophobicContact CZ-CB 3.7Å; F488-P525 HydrophobicContact CZ-CG 4.41Å; Y515-P525 HydrophobicContact CD2-CB 4.07Å; Y515-P525 HydrophobicContact CD2-CG 3.59Å; Y515-P525 HydrophobicContact CE2-CB 4.11Å; Y515-P525 HydrophobicContact CE2-CG 3.72Å; Y515-P525 HydrophobicContact CG-CG 4.4Å; L518-P525 HydrophobicContact CB-CG 3.87Å; L518-P525 HydrophobicContact CD1-CB 4.3Å; L518-P525 HydrophobicContact CD1-CG 3.8Å; L518-P525 HydrophobicContact CG-CG 4.5Å; I523-P525 WeakPolarHBondContact O-CD 3.4Å
526	Y	68.6	Low	60.4	Low	194 Å²	194	77.2 Å²	77.2	76%	0.761	41%	0.414	S	S	*	.			trans	-70.9	133.8	173.9	-62.6	-79.1	0	0	0	111.2	R492	R492-Y526 PolarHBondContact NH1-O 3.26Å
527	L	58.9	Low	57.7	Low	14 Å²	14	81.3 Å²	81.3	7%	0.073	44%	0.443	C	S	.	.			trans	-104.6	1.5	-175.2	-69.6	169	0	0	0	115.4	F488 Y515 E529 L530 I531 S557 L561	F488-L527 HydrophobicContact CZ-CD2 4.26Å; Y515-L527 HydrophobicContact CE2-CD1 4.4Å; Y515-L527 HydrophobicContact CE2-CD2 4.28Å; Y515-L527 HydrophobicContact CE2-CG 4.47Å; L527-E529 PolarHBondContact O-N 2.97Å; L527-L530 HydrophobicContact CD2-CD1 4.19Å; L527-L530 PolarHBondContact O-N 2.95Å; L527-I531 HydrophobicContact CB-CD1 3.83Å; L527-I531 HydrophobicContact CB-CG1 4.48Å; L527-I531 HydrophobicContact CD1-CD1 4.37Å; L527-S557 VanDerWaalsContact CD1-CB 3.44Å; L527-S557 WeakPolarHBondContact CD1-O 3.3Å; L527-L561 HydrophobicContact CD1-CB 4.22Å; L527-L561 HydrophobicContact CD2-CB 3.99Å; L527-L561 HydrophobicContact CD2-CD1 3.69Å; L527-L561 HydrophobicContact CD2-CG 4.27Å
528	Y	55.3	Low	54.8	Low	183 Å²	183	85.3 Å²	85.3	72%	0.718	48%	0.476	S	S	*	.	B	Isolated β-bridge	trans	-54.8	133	178.1	-100.1	-90.4	0	0	0	110.9
529	E	53.9	Low	52.2	Low	129 Å²	129	92.1 Å²	92.1	60%	0.603	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.4	-28.4	-173	-59.9	-178	162	0	0	117.4	K496 L527	K496-E529 PolarHBondContact NZ-O 2.86Å; L527-E529 PolarHBondContact O-N 2.97Å
530	L	52.8	Low	49.6	Very low	11 Å²	11	94.8 Å²	94.8	6%	0.058	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-44.4	171.6	-76.5	165.9	0	0	0	110.6	R492 H495 L527 I532 L561	R492-L530 HydrophobicContact CG-CD1 3.89Å; R492-L530 HydrophobicContact CG-CG 3.95Å; H495-L530 HydrophobicContact CB-CD2 4.23Å; L527-L530 HydrophobicContact CD2-CD1 4.19Å; L527-L530 PolarHBondContact O-N 2.95Å; L530-I532 PolarHBondContact O-N 3.06Å; L530-L561 HydrophobicContact CD1-CD1 3.61Å
531	I	49.2	Very low	47.1	Very low	59 Å²	59	102.1 Å²	102.1	30%	0.303	56%	0.559	S	S	.	*	B	Isolated β-bridge	trans	-78.7	108.6	179.4	-53.8	167.2	0	0	0	107.7	L527 D533 D560	L527-I531 HydrophobicContact CB-CD1 3.83Å; L527-I531 HydrophobicContact CB-CG1 4.48Å; L527-I531 HydrophobicContact CD1-CD1 4.37Å; I531-D533 PolarHBondContact O-N 3.3Å; I531-D560 HydrophobicContact CD1-CB 3.69Å; I531-D560 HydrophobicContact CG1-CB 4.22Å
532	I	41.9	Very low	44.7	Very low	124 Å²	124	104.8 Å²	104.8	64%	0.636	57%	0.574	S	S	*	*			trans	-75.2	106.5	165	-62.1	171.1	0	0	0	105.2	L530 T534	L530-I532 PolarHBondContact O-N 3.06Å; I532-T534 VanDerWaalsContact C-N 3.31Å; I532-T534 PolarHBondContact O-N 3.17Å
533	D	30.9	Very low	42.5	Very low	94 Å²	94	104.9 Å²	104.9	50%	0.503	57%	0.574	S	S	.	*			trans	-57.7	98.6	165.8	-70.7	-27.4	0	0	0	108.1	I531 T535	I531-D533 PolarHBondContact O-N 3.3Å; D533-T535 PolarHBondContact O-N 3.14Å
534	T	30	Very low	40.1	Very low	134 Å²	134	112.2 Å²	112.2	82%	0.822	61%	0.608	S	S	*	*			trans	-69	0.1	164.2	33	0	0	0	0	112.3	I532 S536	I532-T534 VanDerWaalsContact C-N 3.31Å; I532-T534 PolarHBondContact O-N 3.17Å; T534-S536 PolarHBondContact O-N 3.47Å
535	T	28.2	Very low	38.1	Very low	101 Å²	101	113.1 Å²	113.1	62%	0.62	62%	0.623	S	S	*	*			trans	-95.2	79.6	167.7	53.2	0	0	0	0	109.7	D533 S537	D533-T535 PolarHBondContact O-N 3.14Å; T535-S537 PolarHBondContact O-N 3.35Å
536	S	28.8	Very low	36.1	Very low	123 Å²	123	116.1 Å²	116.1	86%	0.86	66%	0.657	S	S	*	*			trans	-63.5	82.3	157.4	57.5	0	0	0	0	109.3	T534	T534-S536 PolarHBondContact O-N 3.47Å
537	S	25.2	Very low	34.1	Very low	92 Å²	92	114.5 Å²	114.5	64%	0.643	66%	0.66	S	S	*	*			trans	-120	94.8	150.1	62.9	0	0	0	0	106.8	T535 D539	T535-S537 PolarHBondContact O-N 3.35Å; S537-D539 PolarHBondContact O-N 3.43Å
538	S	25.5	Very low	32.5	Very low	116 Å²	116	119.5 Å²	119.5	81%	0.811	69%	0.691	S	S	*	*			trans	-58.7	95.2	167.2	51.7	0	0	0	0	109.7
539	D	28.5	Very low	31.1	Very low	146 Å²	146	120.9 Å²	120.9	78%	0.781	70%	0.701	S	S	*	*			trans	-127.4	105.5	160.1	-87.4	-32.7	0	0	0	110.2	S537	S537-D539 PolarHBondContact O-N 3.43Å
540	S	26.8	Very low	29.9	Very low	96 Å²	96	117.3 Å²	117.3	67%	0.671	69%	0.69	S	S	*	*			trans	-8.3	125.1	158	49.7	0	0	0	0	118.8	S542	S540-S542 PolarHBondContact O-N 2.84Å; S540-S542 VanDerWaalsContact O-N 3.11Å
541	R	26.6	Very low	28.8	Very low	258 Å²	258	122.8 Å²	122.8	97%	0.974	73%	0.725	S	S	*	*				17.8	83.6	127.8	-67.4	179.5	176	178.4	-1.9	116
542	S	28.6	Very low	28.3	Very low	112 Å²	112	123.7 Å²	123.7	78%	0.783	74%	0.736	S	S	*	*			trans	-136.4	109.3	149.4	58.6	0	0	0	0	105.7	S540	S540-S542 PolarHBondContact O-N 2.84Å; S540-S542 VanDerWaalsContact O-N 3.11Å
543	G	24.8	Very low	28.5	Very low	68 Å²	68	122.3 Å²	122.3	70%	0.701	73%	0.73	S	S	*	*				110.8	104.8	84.6	0	0	0	0	0	106.6	S545	G543-S545 PolarHBondContact O-N 2.92Å
544	E	23.4	Very low	29.4	Very low	206 Å²	206	119 Å²	119	96%	0.963	71%	0.714	S	S	*	*			trans	-56.2	97.6	172.6	-62.6	167.8	153.1	0	0	109.6
545	S	25.7	Very low	30.4	Very low	101 Å²	101	114.6 Å²	114.6	71%	0.706	69%	0.686	S	S	*	*			trans	-156.2	101.5	165.9	63.1	0	0	0	0	111.2	G543 L547	G543-S545 PolarHBondContact O-N 2.92Å; S545-L547 PolarHBondContact O-N 3.34Å
546	G	24.4	Very low	31.9	Very low	78 Å²	78	115.2 Å²	115.2	80%	0.804	68%	0.681	S	S	*	*			trans	39.7	71.8	150.3	0	0	0	0	0	117.7	T548	G546-T548 PolarHBondContact O-N 3.48Å
547	L	26.4	Very low	33.8	Very low	159 Å²	159	110.1 Å²	110.1	83%	0.832	65%	0.646	S	S	*	*			trans	-79.6	104.4	155	-107.5	80.3	0	0	0	108.4	S545 K549	S545-L547 PolarHBondContact O-N 3.34Å; L547-K549 PolarHBondContact O-N 3.09Å
548	T	26.7	Very low	36	Very low	119 Å²	119	106 Å²	106	73%	0.73	62%	0.616	S	S	*	*			trans	-37.7	128.4	164.6	49.2	0	0	0	0	111.1	G546 S550	G546-T548 PolarHBondContact O-N 3.48Å; T548-S550 PolarHBondContact O-N 2.82Å
549	K	24.9	Very low	38.2	Very low	213 Å²	213	102.2 Å²	102.2	93%	0.926	59%	0.589	S	S	*	*			trans	-49.5	87.3	166.2	-69.7	175.6	174.9	-178.3	0	109.3	L547	L547-K549 PolarHBondContact O-N 3.09Å
550	S	27.9	Very low	40.2	Very low	53 Å²	53	97.4 Å²	97.4	37%	0.371	56%	0.563	S	S	.	*			trans	-90	116.6	165.9	47.6	0	0	0	0	105.9	T548 S552 N553	T548-S550 PolarHBondContact O-N 2.82Å; S550-S552 PolarHBondContact O-N 3.42Å; S550-N553 PolarHBondContact O-N 2.7Å
551	T	31.4	Very low	42.6	Very low	127 Å²	127	92.9 Å²	92.9	78%	0.779	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-6.7	-176.1	-42.1	0	0	0	0	113.3	S554	T551-S554 PolarHBondContact O-OG 3.47Å
552	S	37.2	Very low	45.1	Very low	77 Å²	77	80.8 Å²	80.8	54%	0.538	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-14.1	178.7	52.4	0	0	0	0	115.1	S550	S550-S552 PolarHBondContact O-N 3.42Å
553	N	47.1	Very low	47.3	Very low	96 Å²	96	79.3 Å²	79.3	51%	0.513	48%	0.475	S	S	.	.	H	α-helix	trans	-79.2	-17.5	-174.6	-74.5	-3.4	0	0	0	113.9	S550 D555 S557	S550-N553 PolarHBondContact O-N 2.7Å; N553-D555 VanDerWaalsContact C-N 3.27Å; N553-D555 PolarHBondContact O-N 2.79Å; N553-S557 PolarHBondContact O-OG 2.91Å
554	S	49.5	Very low	49.8	Very low	23 Å²	23	77.6 Å²	77.6	16%	0.161	45%	0.452	C	S	.	.	H	α-helix	trans	-67.8	-27.8	179.1	51	0	0	0	0	114.2	Q524 T551 S557	Q524-S554 VanDerWaalsContact NE2-CA 3.31Å; Q524-S554 VanDerWaalsContact OE1-CA 3.26Å; T551-S554 PolarHBondContact O-OG 3.47Å; S554-S557 WeakPolarHBondContact CA-OG 3.44Å; S554-S557 PolarHBondContact O-OG 3.42Å
555	D	51.6	Low	52.6	Low	43 Å²	43	67.9 Å²	67.9	23%	0.23	41%	0.407	C	S	.	.	H	α-helix	trans	-91.2	-43.1	-166.3	-54.6	-12	0	0	0	109.6	N553 S557 L558 V559	N553-D555 VanDerWaalsContact C-N 3.27Å; N553-D555 PolarHBondContact O-N 2.79Å; D555-S557 PolarHBondContact O-N 3.35Å; D555-L558 PolarHBondContact O-N 3.38Å; D555-V559 WeakPolarHBondContact O-CG2 3.43Å; D555-V559 PolarHBondContact O-N 3.02Å
556	Q	59.9	Low	55.2	Low	113 Å²	113	68.9 Å²	68.9	53%	0.528	40%	0.403	S	S	.	.	H	α-helix	trans	-59.1	-39	173.6	-162	61.4	39.9	0	0	110.5	L558 V559 D560	Q556-L558 PolarHBondContact O-N 3.35Å; Q556-V559 PolarHBondContact O-N 3.24Å; Q556-D560 PolarHBondContact NE2-OD1 3.14Å; Q556-D560 WeakPolarHBondContact O-CB 3.24Å; Q556-D560 PolarHBondContact O-N 2.89Å
557	S	67.6	Low	57.8	Low	16 Å²	16	69.6 Å²	69.6	11%	0.112	39%	0.385	C	S	.	.	H	α-helix	trans	-64.2	-42.4	179.4	44.2	0	0	0	0	113.8	Y515 L527 N553 S554 D555 D560 L561	Y515-S557 VanDerWaalsContact OH-CB 3.32Å; Y515-S557 WeakPolarHBondContact OH-CB 3.47Å; Y515-S557 PolarHBondContact OH-OG 2.91Å; L527-S557 VanDerWaalsContact CD1-CB 3.44Å; L527-S557 WeakPolarHBondContact CD1-O 3.3Å; N553-S557 PolarHBondContact O-OG 2.91Å; S554-S557 WeakPolarHBondContact CA-OG 3.44Å; S554-S557 PolarHBondContact O-OG 3.42Å; D555-S557 PolarHBondContact O-N 3.35Å; S557-D560 PolarHBondContact O-N 3.24Å; S557-L561 WeakPolarHBondContact O-CB 3.1Å; S557-L561 PolarHBondContact O-N 3.49Å
558	L	71.9	Confident	60.5	Low	6 Å²	6	62.7 Å²	62.7	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-67.8	-40.7	177.7	-166.2	156.2	0	0	0	111.2	Y515 D555 Q556 L561 I562 A585 L588	Y515-L558 HydrophobicContact CD1-CB 4.48Å; Y515-L558 HydrophobicContact CD1-CD1 3.97Å; Y515-L558 HydrophobicContact CD1-CG 4.08Å; Y515-L558 HydrophobicContact CE1-CB 3.7Å; Y515-L558 HydrophobicContact CE1-CD1 3.77Å; Y515-L558 HydrophobicContact CE1-CG 3.78Å; D555-L558 PolarHBondContact O-N 3.38Å; Q556-L558 PolarHBondContact O-N 3.35Å; L558-L561 PolarHBondContact O-N 3.41Å; L558-I562 HydrophobicContact CD2-CD1 3.39Å; L558-I562 HydrophobicContact CD2-CG1 4.09Å; L558-I562 WeakPolarHBondContact O-CG1 3.41Å; L558-I562 PolarHBondContact O-N 3.16Å; L558-A585 HydrophobicContact CD1-CB 4.22Å; L558-L588 HydrophobicContact CD2-CB 4.43Å; L558-L588 HydrophobicContact CD2-CD1 3.41Å; L558-L588 VanDerWaalsContact CD2-CD1 3.41Å
559	V	71.4	Confident	63.2	Low	37 Å²	37	59.4 Å²	59.4	22%	0.224	33%	0.327	C	S	.	.	H	α-helix	trans	-63.1	-43.8	175.6	176.6	0	0	0	0	111.1	D555 Q556 L561 I562 S563 L588	D555-V559 WeakPolarHBondContact O-CG2 3.43Å; D555-V559 PolarHBondContact O-N 3.02Å; Q556-V559 PolarHBondContact O-N 3.24Å; V559-L561 VanDerWaalsContact C-N 3.33Å; V559-L561 PolarHBondContact O-N 3.4Å; V559-I562 PolarHBondContact O-N 3.49Å; V559-S563 VanDerWaalsContact O-CB 3.32Å; V559-S563 WeakPolarHBondContact O-CB 3.41Å; V559-S563 PolarHBondContact O-N 2.82Å; V559-S563 PolarHBondContact O-OG 3.4Å; V559-L588 HydrophobicContact CG2-CD1 3.98Å; V559-L588 HydrophobicContact CG2-CD2 3.96Å
560	D	70.6	Confident	65.8	Low	44 Å²	44	50.4 Å²	50.4	24%	0.235	29%	0.29	C	S	.	.	H	α-helix	trans	-64.5	-39	177.2	-64.7	-14.3	0	0	0	110.9	I531 Q556 S557 S563 S564	I531-D560 HydrophobicContact CD1-CB 3.69Å; I531-D560 HydrophobicContact CG1-CB 4.22Å; Q556-D560 PolarHBondContact NE2-OD1 3.14Å; Q556-D560 WeakPolarHBondContact O-CB 3.24Å; Q556-D560 PolarHBondContact O-N 2.89Å; S557-D560 PolarHBondContact O-N 3.24Å; D560-S563 WeakPolarHBondContact CA-OG 3.24Å; D560-S563 PolarHBondContact O-OG 3.15Å; D560-S564 WeakPolarHBondContact O-CB 3.45Å; D560-S564 PolarHBondContact O-N 2.84Å; D560-S564 VanDerWaalsContact O-N 3.09Å; D560-S564 PolarHBondContact O-OG 3.21Å
561	L	77.8	Confident	68.2	Low	1 Å²	1	55.4 Å²	55.4	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-61	-56.8	173.7	177.2	67.9	0	0	0	110.5	Y515 L527 L530 S557 L558 V559 S563 S564 L565	Y515-L561 HydrophobicContact CD1-CD2 4.2Å; Y515-L561 HydrophobicContact CD2-CD2 3.7Å; Y515-L561 HydrophobicContact CE2-CD2 4.4Å; Y515-L561 HydrophobicContact CG-CD2 3.58Å; L527-L561 HydrophobicContact CD1-CB 4.22Å; L527-L561 HydrophobicContact CD2-CB 3.99Å; L527-L561 HydrophobicContact CD2-CD1 3.69Å; L527-L561 HydrophobicContact CD2-CG 4.27Å; L530-L561 HydrophobicContact CD1-CD1 3.61Å; S557-L561 WeakPolarHBondContact O-CB 3.1Å; S557-L561 PolarHBondContact O-N 3.49Å; L558-L561 PolarHBondContact O-N 3.41Å; V559-L561 VanDerWaalsContact C-N 3.33Å; V559-L561 PolarHBondContact O-N 3.4Å; L561-S563 VanDerWaalsContact C-N 3.3Å; L561-S563 PolarHBondContact O-N 3.06Å; L561-S564 PolarHBondContact O-N 3.41Å; L561-S564 VanDerWaalsContact O-N 3.08Å; L561-S564 PolarHBondContact O-OG 2.97Å; L561-L565 HydrophobicContact CD1-CD1 4.23Å; L561-L565 HydrophobicContact CG-CD1 4.15Å; L561-L565 VanDerWaalsContact O-CG 3.32Å; L561-L565 WeakPolarHBondContact O-CG 3.24Å; L561-L565 PolarHBondContact O-N 3.01Å
562	I	77.6	Confident	70.7	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-60.9	-41.5	-176.5	-67.5	177.5	0	0	0	111.1	L558 V559 S564 L565 I568 L588 I589 W592	L558-I562 HydrophobicContact CD2-CD1 3.39Å; L558-I562 HydrophobicContact CD2-CG1 4.09Å; L558-I562 WeakPolarHBondContact O-CG1 3.41Å; L558-I562 PolarHBondContact O-N 3.16Å; V559-I562 PolarHBondContact O-N 3.49Å; I562-S564 VanDerWaalsContact C-N 3.25Å; I562-S564 PolarHBondContact O-N 2.93Å; I562-L565 PolarHBondContact O-N 2.92Å; I562-I568 HydrophobicContact CG2-CD1 4.43Å; I562-L588 HydrophobicContact CD1-CB 3.84Å; I562-I589 HydrophobicContact CD1-CG1 3.94Å; I562-W592 HydrophobicContact CG2-CB 3.63Å; I562-W592 HydrophobicContact CG2-CD2 4.49Å; I562-W592 HydrophobicContact CG2-CG 3.66Å; I562-W592 PolarHBondContact O-NE1 3.39Å
563	S	75.2	Confident	72.9	Confident	80 Å²	80	46.5 Å²	46.5	56%	0.559	25%	0.249	S	C	*	.	H	α-helix	trans	-66.2	-25.1	178	62.1	0	0	0	0	113.8	V559 D560 L561 L565	V559-S563 VanDerWaalsContact O-CB 3.32Å; V559-S563 WeakPolarHBondContact O-CB 3.41Å; V559-S563 PolarHBondContact O-N 2.82Å; V559-S563 PolarHBondContact O-OG 3.4Å; D560-S563 WeakPolarHBondContact CA-OG 3.24Å; D560-S563 PolarHBondContact O-OG 3.15Å; L561-S563 VanDerWaalsContact C-N 3.3Å; L561-S563 PolarHBondContact O-N 3.06Å; S563-L565 VanDerWaalsContact C-N 3.33Å
564	S	78.5	Confident	74.6	Confident	32 Å²	32	43 Å²	43	22%	0.224	23%	0.231	C	C	.	.	H	α-helix	trans	-78.1	-14.5	175.8	75.5	0	0	0	0	114.4	D560 L561 I562	D560-S564 WeakPolarHBondContact O-CB 3.45Å; D560-S564 PolarHBondContact O-N 2.84Å; D560-S564 VanDerWaalsContact O-N 3.09Å; D560-S564 PolarHBondContact O-OG 3.21Å; L561-S564 PolarHBondContact O-N 3.41Å; L561-S564 VanDerWaalsContact O-N 3.08Å; L561-S564 PolarHBondContact O-OG 2.97Å; I562-S564 VanDerWaalsContact C-N 3.25Å; I562-S564 PolarHBondContact O-N 2.93Å
565	L	81.9	Confident	76.2	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.244	C	C	.	.			trans	-98.6	149.9	-175.3	-59.9	171.4	0	0	0	111.1	E508 L511 V512 L561 I562 S563 I568 W592	E508-L565 HydrophobicContact CB-CD2 3.97Å; E508-L565 HydrophobicContact CG-CD2 3.7Å; L511-L565 HydrophobicContact CD1-CD2 4.38Å; V512-L565 HydrophobicContact CG2-CD1 3.62Å; L561-L565 HydrophobicContact CD1-CD1 4.23Å; L561-L565 HydrophobicContact CG-CD1 4.15Å; L561-L565 VanDerWaalsContact O-CG 3.32Å; L561-L565 WeakPolarHBondContact O-CG 3.24Å; L561-L565 PolarHBondContact O-N 3.01Å; I562-L565 PolarHBondContact O-N 2.92Å; S563-L565 VanDerWaalsContact C-N 3.33Å; L565-I568 HydrophobicContact CB-CD1 3.78Å; L565-I568 HydrophobicContact CB-CG1 3.83Å; L565-I568 HydrophobicContact CD1-CD1 4.02Å; L565-I568 HydrophobicContact CD1-CG1 4.32Å; L565-W592 WeakPolarHBondContact O-CZ2 3.36Å; L565-W592 PolarHBondContact O-NE1 3.34Å
566	I	80	Confident	77.8	Confident	122 Å²	122	43.7 Å²	43.7	63%	0.626	24%	0.235	S	C	*	.	S	Bend	trans	-125.3	-36.7	-171	-61.1	173.5	0	0	0	112.4	E508 W592	E508-I566 PolarHBondContact OE2-N 3.42Å; I566-W592 WeakPolarHBondContact O-CH2 3.33Å
567	H	79.8	Confident	79	Confident	93 Å²	93	38.3 Å²	38.3	43%	0.431	21%	0.21	S	C	.	.			trans	-108.3	33.4	-168.8	-55.9	85.9	0	0	0	112.8	L504 H505 E508	L504-H567 VanDerWaalsContact CD2-ND1 3.3Å; L504-H567 WeakPolarHBondContact CD2-ND1 3.41Å; L504-H567 HydrophobicContact CG-CB 4.44Å; H505-H567 WeakPolarHBondContact CA-O 3.32Å; H505-H567 HydrophobicContact CB-CB 4.27Å; H505-H567 VanDerWaalsContact CB-O 3.24Å; H505-H567 WeakPolarHBondContact CB-O 3.38Å; E508-H567 IonicContact OE1-ND1 3.41Å; E508-H567 WeakPolarHBondContact OE2-CA 3.22Å; E508-H567 PolarHBondContact OE2-N 3.49Å
568	I	83	Confident	79.8	Confident	15 Å²	15	42.1 Å²	42.1	8%	0.077	23%	0.226	C	C	.	.			trans	-67.4	132.8	-178.6	-58.7	179.8	0	0	0	111.3	E508 V512 I562 L565 V570 L573 W592	E508-I568 HydrophobicContact CB-CG1 4.45Å; V512-I568 HydrophobicContact CG2-CD1 4.34Å; I562-I568 HydrophobicContact CG2-CD1 4.43Å; L565-I568 HydrophobicContact CB-CD1 3.78Å; L565-I568 HydrophobicContact CB-CG1 3.83Å; L565-I568 HydrophobicContact CD1-CD1 4.02Å; L565-I568 HydrophobicContact CD1-CG1 4.32Å; I568-V570 PolarHBondContact O-N 3.27Å; I568-L573 HydrophobicContact CG2-CD1 3.19Å; I568-L573 HydrophobicContact CG2-CG 4.18Å; I568-W592 HydrophobicContact CB-CH2 4.13Å; I568-W592 HydrophobicContact CB-CZ3 4.18Å; I568-W592 HydrophobicContact CD1-CZ2 4.45Å; I568-W592 HydrophobicContact CG1-CH2 4.39Å
569	D	82	Confident	80.4	Confident	49 Å²	49	46.8 Å²	46.8	26%	0.262	25%	0.251	S	S	.	.			trans	-81.8	104.5	168.3	-170.6	-21.9	0	0	0	110	T509 E571 D572 L573	T509-D569 HydrophobicContact CG2-CB 4.26Å; T509-D569 WeakPolarHBondContact OG1-CB 3.46Å; T509-D569 PolarHBondContact OG1-N 2.92Å; D569-E571 PolarHBondContact OD1-N 3.21Å; D569-D572 HydrophobicContact CB-CB 4.37Å; D569-D572 PolarHBondContact OD1-N 3.31Å; D569-L573 WeakPolarHBondContact O-CG 3.34Å; D569-L573 PolarHBondContact O-N 3.26Å
570	V	79.1	Confident	80.9	Confident	25 Å²	25	47.7 Å²	47.7	15%	0.152	25%	0.254	C	S	.	.	H	α-helix	trans	-69.9	-38	-175.3	179.8	0	0	0	0	111.7	I568 L573 T574 I589 W592	I568-V570 PolarHBondContact O-N 3.27Å; V570-L573 PolarHBondContact O-N 3.49Å; V570-T574 HydrophobicContact CG1-CG2 3.99Å; V570-T574 WeakPolarHBondContact O-CG2 3.26Å; V570-T574 PolarHBondContact O-N 3.33Å; V570-T574 PolarHBondContact O-OG1 2.93Å; V570-I589 HydrophobicContact CG1-CG2 4.33Å; V570-I589 HydrophobicContact CG2-CG2 4.4Å; V570-W592 HydrophobicContact CG2-CZ3 4.4Å
571	E	79.9	Confident	81.6	Confident	157 Å²	157	50 Å²	50	73%	0.734	27%	0.267	S	S	*	.	H	α-helix	trans	-69.1	-39.8	-174.7	-64.9	-178.8	-177	0	0	111.7	D569 T574 V575	D569-E571 PolarHBondContact OD1-N 3.21Å; E571-T574 PolarHBondContact O-OG1 3.3Å; E571-V575 WeakPolarHBondContact O-CG2 3.27Å; E571-V575 PolarHBondContact O-N 2.79Å
572	D	82.2	Confident	81.8	Confident	17 Å²	17	50.1 Å²	50.1	9%	0.091	27%	0.268	C	S	.	.	H	α-helix	trans	-69.1	-38.6	175.5	-175.4	31.8	0	0	0	111.6	P417 T509 K513 D569 Y576	P417-D572 WeakPolarHBondContact CA-OD1 3.35Å; P417-D572 HydrophobicContact CB-CB 4.04Å; P417-D572 HydrophobicContact CG-CB 4.16Å; P417-D572 WeakPolarHBondContact CG-OD2 3.46Å; T509-D572 HydrophobicContact CG2-CB 4.41Å; K513-D572 WeakPolarHBondContact CE-OD2 3.3Å; K513-D572 IonicContact NZ-OD1 3.88Å; K513-D572 PolarHBondContact NZ-OD1 3.36Å; K513-D572 IonicContact NZ-OD2 2.62Å; K513-D572 PolarHBondContact NZ-OD2 3.21Å; D569-D572 HydrophobicContact CB-CB 4.37Å; D569-D572 PolarHBondContact OD1-N 3.31Å; D572-Y576 VanDerWaalsContact O-CB 3.24Å; D572-Y576 WeakPolarHBondContact O-CB 3.23Å; D572-Y576 PolarHBondContact O-N 3.43Å
573	L	84	Confident	82.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68.8	-38.3	175.8	-72.6	-173.8	0	0	0	113.2	T509 V512 K513 I568 D569 V570 V575 Y576 L577 I589	T509-L573 HydrophobicContact CG2-CD2 3.77Å; T509-L573 HydrophobicContact CG2-CG 3.89Å; V512-L573 HydrophobicContact CB-CD1 4.09Å; V512-L573 HydrophobicContact CB-CD2 4.22Å; V512-L573 HydrophobicContact CG1-CD1 4.03Å; V512-L573 HydrophobicContact CG1-CD2 4.26Å; V512-L573 HydrophobicContact CG2-CD1 4.31Å; K513-L573 HydrophobicContact CD-CD2 4.41Å; K513-L573 HydrophobicContact CG-CD2 3.65Å; I568-L573 HydrophobicContact CG2-CD1 3.19Å; I568-L573 HydrophobicContact CG2-CG 4.18Å; D569-L573 WeakPolarHBondContact O-CG 3.34Å; D569-L573 PolarHBondContact O-N 3.26Å; V570-L573 PolarHBondContact O-N 3.49Å; L573-V575 PolarHBondContact O-N 2.81Å; L573-Y576 PolarHBondContact O-N 2.83Å; L573-L577 HydrophobicContact CB-CD1 4.35Å; L573-L577 WeakPolarHBondContact O-CB 3.23Å; L573-L577 VanDerWaalsContact O-CG 3.22Å; L573-L577 WeakPolarHBondContact O-CG 3.44Å; L573-L577 PolarHBondContact O-N 3.33Å; L573-I589 HydrophobicContact CB-CD1 4.05Å; L573-I589 HydrophobicContact CD1-CD1 3.54Å; L573-I589 HydrophobicContact CD1-CG1 4.35Å; L573-I589 HydrophobicContact CG-CD1 4.38Å
574	T	83.3	Confident	82.7	Confident	23 Å²	23	48 Å²	48	14%	0.141	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-48.9	178.6	52.9	0	0	0	0	110.3	V570 E571 Y576 L577 E578 L586 Y590	V570-T574 HydrophobicContact CG1-CG2 3.99Å; V570-T574 WeakPolarHBondContact O-CG2 3.26Å; V570-T574 PolarHBondContact O-N 3.33Å; V570-T574 PolarHBondContact O-OG1 2.93Å; E571-T574 PolarHBondContact O-OG1 3.3Å; T574-Y576 VanDerWaalsContact C-N 3.33Å; T574-Y576 PolarHBondContact O-N 3.39Å; T574-L577 PolarHBondContact O-N 3.33Å; T574-E578 WeakPolarHBondContact O-CB 3.41Å; T574-E578 VanDerWaalsContact O-CG 3.28Å; T574-E578 WeakPolarHBondContact O-CG 3.32Å; T574-E578 PolarHBondContact O-N 2.9Å; T574-E578 VanDerWaalsContact O-N 3.15Å; T574-L586 HydrophobicContact CG2-CD1 3.76Å; T574-Y590 HydrophobicContact CG2-CE1 3.72Å
575	V	83.5	Confident	82.8	Confident	69 Å²	69	46.6 Å²	46.6	42%	0.418	24%	0.238	S	C	.	.	H	α-helix	trans	-63.7	-40.3	178.2	176.7	0	0	0	0	111	E571 L573 N579	E571-V575 WeakPolarHBondContact O-CG2 3.27Å; E571-V575 PolarHBondContact O-N 2.79Å; L573-V575 PolarHBondContact O-N 2.81Å; V575-N579 VanDerWaalsContact O-CG 3.25Å; V575-N579 PolarHBondContact O-N 3.42Å; V575-N579 PolarHBondContact O-ND2 2.93Å
576	Y	83.9	Confident	83	Confident	11 Å²	11	46.6 Å²	46.6	4%	0.043	24%	0.238	C	C	.	.	H	α-helix	trans	-69.3	-44.1	-179	178.2	-92.2	0	0	0	113.1	D414 K513 R517 D572 L573 T574 N579 N580	D414-Y576 HydrophobicContact CB-CD2 4.11Å; D414-Y576 HydrophobicContact CB-CE2 3.96Å; K513-Y576 HydrophobicContact CB-CD1 4.38Å; K513-Y576 HydrophobicContact CB-CE1 3.98Å; K513-Y576 HydrophobicContact CD-CD1 4.28Å; K513-Y576 HydrophobicContact CD-CD2 4.07Å; K513-Y576 HydrophobicContact CD-CE2 4.32Å; K513-Y576 HydrophobicContact CD-CG 4.05Å; K513-Y576 HydrophobicContact CG-CD1 3.72Å; K513-Y576 HydrophobicContact CG-CD2 4.35Å; K513-Y576 HydrophobicContact CG-CE1 3.83Å; K513-Y576 HydrophobicContact CG-CE2 4.44Å; K513-Y576 HydrophobicContact CG-CG 4Å; R517-Y576 WeakPolarHBondContact CD-OH 3.46Å; R517-Y576 WeakPolarHBondContact CG-OH 3.49Å; R517-Y576 PolarHBondContact NE-OH 3.32Å; D572-Y576 VanDerWaalsContact O-CB 3.24Å; D572-Y576 WeakPolarHBondContact O-CB 3.23Å; D572-Y576 PolarHBondContact O-N 3.43Å; L573-Y576 PolarHBondContact O-N 2.83Å; T574-Y576 VanDerWaalsContact C-N 3.33Å; T574-Y576 PolarHBondContact O-N 3.39Å; Y576-N579 PolarHBondContact O-N 3.15Å; Y576-N580 VanDerWaalsContact CE1-ND2 3.27Å; Y576-N580 WeakPolarHBondContact CE1-ND2 3.46Å; Y576-N580 WeakPolarHBondContact CE2-ND2 3.41Å; Y576-N580 PolarHBondContact O-N 3.2Å; Y576-N580 PolarHBondContact O-ND2 3.2Å; Y576-N580 PolarHBondContact OH-ND2 3.25Å
577	L	85.6	Confident	83.2	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-74.2	-36.2	-174.8	-67.5	171.1	0	0	0	112.4	V516 L573 T574 N579 N580 N581 A582 A585 L586 I589	V516-L577 HydrophobicContact CG1-CD2 4.23Å; V516-L577 HydrophobicContact CG2-CD2 3.99Å; L573-L577 HydrophobicContact CB-CD1 4.35Å; L573-L577 WeakPolarHBondContact O-CB 3.23Å; L573-L577 VanDerWaalsContact O-CG 3.22Å; L573-L577 WeakPolarHBondContact O-CG 3.44Å; L573-L577 PolarHBondContact O-N 3.33Å; T574-L577 PolarHBondContact O-N 3.33Å; L577-N579 VanDerWaalsContact C-N 3.35Å; L577-N580 CarbonylContact O-C 3.53Å; L577-N580 PolarHBondContact O-N 2.98Å; L577-N581 PolarHBondContact O-N 3.07Å; L577-N581 VanDerWaalsContact O-N 3.09Å; L577-A582 HydrophobicContact CB-CB 4.47Å; L577-A582 HydrophobicContact CD2-CB 3.73Å; L577-A582 PolarHBondContact O-N 3.33Å; L577-A585 HydrophobicContact CD1-CB 4.35Å; L577-A585 HydrophobicContact CD2-CB 4.23Å; L577-L586 HydrophobicContact CB-CB 4.19Å; L577-L586 HydrophobicContact CD1-CB 4.07Å; L577-L586 HydrophobicContact CD1-CD1 4.31Å; L577-I589 HydrophobicContact CD1-CD1 3.29Å
578	E	84.8	Confident	83.4	Confident	96 Å²	96	36.7 Å²	36.7	45%	0.449	19%	0.189	S	C	.	.	H	α-helix	trans	-60.7	-44.5	172.4	-72.6	179	168.6	0	0	111.2	T574 N580 N581 L586	T574-E578 WeakPolarHBondContact O-CB 3.41Å; T574-E578 VanDerWaalsContact O-CG 3.28Å; T574-E578 WeakPolarHBondContact O-CG 3.32Å; T574-E578 PolarHBondContact O-N 2.9Å; T574-E578 VanDerWaalsContact O-N 3.15Å; E578-N580 PolarHBondContact O-N 3.04Å; E578-N581 PolarHBondContact O-N 3.42Å; E578-L586 HydrophobicContact CG-CD2 3.86Å
579	N	85.4	Confident	83.3	Confident	104 Å²	104	36 Å²	36	56%	0.556	19%	0.185	S	C	*	.	H	α-helix	trans	-64.8	-26.2	177.9	-74.5	-39.5	0	0	0	113.3	V575 Y576 L577	V575-N579 VanDerWaalsContact O-CG 3.25Å; V575-N579 PolarHBondContact O-N 3.42Å; V575-N579 PolarHBondContact O-ND2 2.93Å; Y576-N579 PolarHBondContact O-N 3.15Å; L577-N579 VanDerWaalsContact C-N 3.35Å
580	N	81.4	Confident	83.4	Confident	56 Å²	56	35.7 Å²	35.7	30%	0.299	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	9.2	-179.7	-68.2	-57.3	0	0	0	113.7	Q520 Y576 L577 E578 A582	Q520-N580 PolarHBondContact NE2-O 2.97Å; Q520-N580 VanDerWaalsContact NE2-O 3.16Å; Y576-N580 VanDerWaalsContact CE1-ND2 3.27Å; Y576-N580 WeakPolarHBondContact CE1-ND2 3.46Å; Y576-N580 WeakPolarHBondContact CE2-ND2 3.41Å; Y576-N580 PolarHBondContact O-N 3.2Å; Y576-N580 PolarHBondContact O-ND2 3.2Å; Y576-N580 PolarHBondContact OH-ND2 3.25Å; L577-N580 CarbonylContact O-C 3.53Å; L577-N580 PolarHBondContact O-N 2.98Å; E578-N580 PolarHBondContact O-N 3.04Å; N580-A582 PolarHBondContact O-N 2.92Å; N580-A582 VanDerWaalsContact O-N 3.16Å
581	N	84.3	Confident	83.6	Confident	93 Å²	93	39.8 Å²	39.8	50%	0.497	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	28.2	-176.6	-61.1	-52.7	0	0	0	114.6	L577 E578 Y583	L577-N581 PolarHBondContact O-N 3.07Å; L577-N581 VanDerWaalsContact O-N 3.09Å; E578-N581 PolarHBondContact O-N 3.42Å; N581-Y583 VanDerWaalsContact C-N 3.34Å; N581-Y583 HydrophobicContact CB-CD2 4.43Å; N581-Y583 HydrophobicContact CB-CE2 3.87Å; N581-Y583 WeakPolarHBondContact O-CD2 3.2Å; N581-Y583 PolarHBondContact O-N 3.2Å; N581-Y583 PolarHBondContact OD1-OH 3.33Å
582	A	82.8	Confident	83.7	Confident	3 Å²	3	36.7 Å²	36.7	3%	0.025	18%	0.175	C	C	.	.			trans	-94	61.7	179.3	0	0	0	0	0	110.8	V516 L577 N580 L586 D613	V516-A582 HydrophobicContact CG1-CB 3.77Å; L577-A582 HydrophobicContact CB-CB 4.47Å; L577-A582 HydrophobicContact CD2-CB 3.73Å; L577-A582 PolarHBondContact O-N 3.33Å; N580-A582 PolarHBondContact O-N 2.92Å; N580-A582 VanDerWaalsContact O-N 3.16Å; A582-L586 PolarHBondContact O-N 3.09Å; A582-D613 VanDerWaalsContact C-OD2 3.31Å
583	Y	85.8	Confident	83.8	Confident	38 Å²	38	40.7 Å²	40.7	15%	0.149	19%	0.194	C	C	.	.	H	α-helix	trans	-70	-31.3	-173.5	-62.9	-72	0	0	0	113.8	N581 L586 A587 I602 L611 D613	N581-Y583 VanDerWaalsContact C-N 3.34Å; N581-Y583 HydrophobicContact CB-CD2 4.43Å; N581-Y583 HydrophobicContact CB-CE2 3.87Å; N581-Y583 WeakPolarHBondContact O-CD2 3.2Å; N581-Y583 PolarHBondContact O-N 3.2Å; N581-Y583 PolarHBondContact OD1-OH 3.33Å; Y583-L586 WeakPolarHBondContact O-CB 3.33Å; Y583-L586 PolarHBondContact O-N 3.35Å; Y583-A587 PolarHBondContact O-N 2.97Å; Y583-I602 WeakPolarHBondContact O-CG2 3.14Å; Y583-L611 HydrophobicContact CD1-CD1 3.87Å; Y583-L611 HydrophobicContact CD2-CB 4.17Å; Y583-L611 HydrophobicContact CD2-CD1 4.37Å; Y583-L611 HydrophobicContact CE1-CD1 4.09Å; Y583-L611 HydrophobicContact CE1-CD2 4.22Å; Y583-L611 HydrophobicContact CE2-CB 4.38Å; Y583-L611 HydrophobicContact CE2-CD2 4.06Å; Y583-L611 HydrophobicContact CG-CD1 4.01Å; Y583-D613 PolarHBondContact N-OD2 3.46Å
584	H	84.7	Confident	83.5	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.019	22%	0.218	C	C	.	.	H	α-helix	trans	-65.6	-44.2	176.8	177.4	65.2	0	0	0	111.1	L586 A587 L588 W603 L606 D613 F616 P617 F621	H584-L586 VanDerWaalsContact C-N 3.32Å; H584-L586 PolarHBondContact O-N 2.68Å; H584-A587 PolarHBondContact O-N 3.47Å; H584-L588 WeakPolarHBondContact NE2-CD1 3.26Å; H584-L588 WeakPolarHBondContact O-CG 3.37Å; H584-L588 PolarHBondContact O-N 3.2Å; H584-L588 VanDerWaalsContact O-N 3.07Å; H584-W603 AromaticContact CE1-NE1 3.9Å; H584-W603 AromaticContact ND1-CD1 3.97Å; H584-W603 AromaticContact ND1-NE1 3.26Å; H584-W603 PolarHBondContact ND1-NE1 2.98Å; H584-L606 HydrophobicContact CB-CD1 4.45Å; H584-D613 WeakPolarHBondContact CB-OD2 3.38Å; H584-D613 PolarHBondContact N-OD2 3.08Å; H584-F616 HydrophobicContact CB-CB 4.46Å; H584-F616 AromaticContact ND1-CD2 3.84Å; H584-P617 VanDerWaalsContact CE1-CD 3.46Å; H584-P617 WeakPolarHBondContact CE1-CD 3.35Å; H584-F621 AromaticContact CE1-CE1 3.49Å; H584-F621 VanDerWaalsContact CE1-CE1 3.49Å; H584-F621 WeakPolarHBondContact CE1-CE1 3.16Å; H584-F621 AromaticContact CE1-CZ 3.76Å
585	A	82.4	Confident	83.6	Confident	2 Å²	2	44.8 Å²	44.8	2%	0.017	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-39.9	173.2	0	0	0	0	0	111.7	V516 L558 L577 L588 I589	V516-A585 HydrophobicContact CG2-CB 4.16Å; L558-A585 HydrophobicContact CD1-CB 4.22Å; L577-A585 HydrophobicContact CD1-CB 4.35Å; L577-A585 HydrophobicContact CD2-CB 4.23Å; A585-L588 PolarHBondContact O-N 2.75Å; A585-I589 WeakPolarHBondContact O-CG1 3.42Å; A585-I589 PolarHBondContact O-N 2.88Å
586	L	85.6	Confident	83.5	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-45.2	175.6	179.9	60.6	0	0	0	112.1	T574 L577 E578 A582 Y583 H584 L588 I589 Y590 I602	T574-L586 HydrophobicContact CG2-CD1 3.76Å; L577-L586 HydrophobicContact CB-CB 4.19Å; L577-L586 HydrophobicContact CD1-CB 4.07Å; L577-L586 HydrophobicContact CD1-CD1 4.31Å; E578-L586 HydrophobicContact CG-CD2 3.86Å; A582-L586 PolarHBondContact O-N 3.09Å; Y583-L586 WeakPolarHBondContact O-CB 3.33Å; Y583-L586 PolarHBondContact O-N 3.35Å; H584-L586 VanDerWaalsContact C-N 3.32Å; H584-L586 PolarHBondContact O-N 2.68Å; L586-L588 VanDerWaalsContact C-N 3.3Å; L586-L588 PolarHBondContact O-N 3.27Å; L586-I589 PolarHBondContact O-N 3.5Å; L586-Y590 HydrophobicContact CD1-CE1 4.34Å; L586-Y590 HydrophobicContact CD1-CE2 4.34Å; L586-Y590 HydrophobicContact CG-CE2 4.22Å; L586-Y590 PolarHBondContact O-N 3.24Å; L586-I602 HydrophobicContact CB-CD1 4.46Å; L586-I602 HydrophobicContact CD2-CD1 3.71Å; L586-I602 HydrophobicContact CG-CD1 3.76Å
587	A	83.9	Confident	83.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63	-36.7	176.6	0	0	0	0	0	112.2	Y583 H584 Y590 R591 A599 I602 W603	Y583-A587 PolarHBondContact O-N 2.97Å; H584-A587 PolarHBondContact O-N 3.47Å; A587-Y590 PolarHBondContact O-N 3.31Å; A587-R591 PolarHBondContact O-N 3.45Å; A587-A599 HydrophobicContact CB-CB 4.4Å; A587-A599 VanDerWaalsContact O-CB 3.22Å; A587-A599 WeakPolarHBondContact O-CB 3.49Å; A587-I602 HydrophobicContact CB-CB 4.08Å; A587-I602 HydrophobicContact CB-CG2 4Å; A587-W603 HydrophobicContact CB-CD2 3.98Å; A587-W603 VanDerWaalsContact CB-CE2 3.46Å; A587-W603 HydrophobicContact CB-CG 4.19Å; A587-W603 HydrophobicContact CB-CZ2 3.87Å; A587-W603 VanDerWaalsContact CB-NE1 3.3Å
588	L	83.1	Confident	83.4	Confident	7 Å²	7	45.7 Å²	45.7	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-66.6	-35.9	174.5	-73.1	171.6	0	0	0	112.8	L558 V559 I562 H584 A585 L586 R591 W592 W603 F621	L558-L588 HydrophobicContact CD2-CB 4.43Å; L558-L588 HydrophobicContact CD2-CD1 3.41Å; L558-L588 VanDerWaalsContact CD2-CD1 3.41Å; V559-L588 HydrophobicContact CG2-CD1 3.98Å; V559-L588 HydrophobicContact CG2-CD2 3.96Å; I562-L588 HydrophobicContact CD1-CB 3.84Å; H584-L588 WeakPolarHBondContact NE2-CD1 3.26Å; H584-L588 WeakPolarHBondContact O-CG 3.37Å; H584-L588 PolarHBondContact O-N 3.2Å; H584-L588 VanDerWaalsContact O-N 3.07Å; A585-L588 PolarHBondContact O-N 2.75Å; L586-L588 VanDerWaalsContact C-N 3.3Å; L586-L588 PolarHBondContact O-N 3.27Å; L588-R591 PolarHBondContact O-N 3.33Å; L588-W592 WeakPolarHBondContact O-CB 3.43Å; L588-W592 PolarHBondContact O-N 2.61Å; L588-W603 HydrophobicContact CD2-CH2 4.33Å; L588-W603 HydrophobicContact CD2-CZ2 3.83Å; L588-W603 HydrophobicContact CG-CZ2 4.14Å; L588-F621 HydrophobicContact CD2-CZ 4.46Å
589	I	81.9	Confident	83.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.9	-42.6	172.9	-66.3	160	0	0	0	110.9	V512 I562 V570 L573 L577 A585 L586 R591 W592 Q593	V512-I589 HydrophobicContact CG1-CD1 4.38Å; I562-I589 HydrophobicContact CD1-CG1 3.94Å; V570-I589 HydrophobicContact CG1-CG2 4.33Å; V570-I589 HydrophobicContact CG2-CG2 4.4Å; L573-I589 HydrophobicContact CB-CD1 4.05Å; L573-I589 HydrophobicContact CD1-CD1 3.54Å; L573-I589 HydrophobicContact CD1-CG1 4.35Å; L573-I589 HydrophobicContact CG-CD1 4.38Å; L577-I589 HydrophobicContact CD1-CD1 3.29Å; A585-I589 WeakPolarHBondContact O-CG1 3.42Å; A585-I589 PolarHBondContact O-N 2.88Å; L586-I589 PolarHBondContact O-N 3.5Å; I589-R591 VanDerWaalsContact C-N 3.3Å; I589-R591 PolarHBondContact O-N 2.86Å; I589-W592 CarbonylContact O-C 3.58Å; I589-W592 WeakPolarHBondContact O-CB 3.46Å; I589-W592 PolarHBondContact O-N 2.81Å; I589-W592 VanDerWaalsContact O-N 3.14Å; I589-Q593 WeakPolarHBondContact O-CB 3.49Å; I589-Q593 PolarHBondContact O-N 2.67Å
590	Y	84.3	Confident	83.5	Confident	44 Å²	44	36.2 Å²	36.2	17%	0.173	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-37.6	174.3	-75.7	-19.5	0	0	0	112.5	T574 L586 A587 Q593 G594 N595 I602	T574-Y590 HydrophobicContact CG2-CE1 3.72Å; L586-Y590 HydrophobicContact CD1-CE1 4.34Å; L586-Y590 HydrophobicContact CD1-CE2 4.34Å; L586-Y590 HydrophobicContact CG-CE2 4.22Å; L586-Y590 PolarHBondContact O-N 3.24Å; A587-Y590 PolarHBondContact O-N 3.31Å; Y590-Q593 PolarHBondContact O-N 2.85Å; Y590-G594 PolarHBondContact O-N 2.81Å; Y590-G594 VanDerWaalsContact O-N 3.17Å; Y590-N595 CarbonylContact O-C 3.46Å; Y590-N595 WeakPolarHBondContact O-CA 3.16Å; Y590-N595 PolarHBondContact O-N 3.26Å; Y590-I602 HydrophobicContact CD2-CD1 3.66Å; Y590-I602 HydrophobicContact CE2-CD1 3.56Å
591	R	83.6	Confident	83.7	Confident	111 Å²	111	36.6 Å²	36.6	42%	0.419	19%	0.191	S	C	.	.	H	α-helix	trans	-61.6	-45.6	170.7	179.4	179.5	172.9	-150.7	3.2	111.5	A587 L588 I589 Q593 G594 L596 A599 W603	A587-R591 PolarHBondContact O-N 3.45Å; L588-R591 PolarHBondContact O-N 3.33Å; I589-R591 VanDerWaalsContact C-N 3.3Å; I589-R591 PolarHBondContact O-N 2.86Å; R591-Q593 VanDerWaalsContact C-N 3.33Å; R591-Q593 PolarHBondContact O-N 3.22Å; R591-G594 PolarHBondContact O-N 3Å; R591-L596 HydrophobicContact CG-CD2 4.15Å; R591-A599 HydrophobicContact CB-CB 4.31Å; R591-W603 HydrophobicContact CB-CH2 4.41Å
592	W	81.9	Confident	83.8	Confident	91 Å²	91	33 Å²	33	35%	0.345	17%	0.172	S	C	.	.	H	α-helix	trans	-62.3	-38	177.2	175.8	93.3	0	0	0	112.5	I562 L565 I566 I568 V570 L588 I589 G594	I562-W592 HydrophobicContact CG2-CB 3.63Å; I562-W592 HydrophobicContact CG2-CD2 4.49Å; I562-W592 HydrophobicContact CG2-CG 3.66Å; I562-W592 PolarHBondContact O-NE1 3.39Å; L565-W592 WeakPolarHBondContact O-CZ2 3.36Å; L565-W592 PolarHBondContact O-NE1 3.34Å; I566-W592 WeakPolarHBondContact O-CH2 3.33Å; I568-W592 HydrophobicContact CB-CH2 4.13Å; I568-W592 HydrophobicContact CB-CZ3 4.18Å; I568-W592 HydrophobicContact CD1-CZ2 4.45Å; I568-W592 HydrophobicContact CG1-CH2 4.39Å; V570-W592 HydrophobicContact CG2-CZ3 4.4Å; L588-W592 WeakPolarHBondContact O-CB 3.43Å; L588-W592 PolarHBondContact O-N 2.61Å; I589-W592 CarbonylContact O-C 3.58Å; I589-W592 WeakPolarHBondContact O-CB 3.46Å; I589-W592 PolarHBondContact O-N 2.81Å; I589-W592 VanDerWaalsContact O-N 3.14Å; W592-G594 PolarHBondContact O-N 3.16Å
593	Q	83.5	Confident	83.9	Confident	102 Å²	102	32.9 Å²	32.9	48%	0.477	17%	0.171	S	C	.	.	H	α-helix	trans	-67.4	-19.2	174.4	-169.2	-175.9	9.3	0	0	112.7	I589 Y590 R591	I589-Q593 WeakPolarHBondContact O-CB 3.49Å; I589-Q593 PolarHBondContact O-N 2.67Å; Y590-Q593 PolarHBondContact O-N 2.85Å; R591-Q593 VanDerWaalsContact C-N 3.33Å; R591-Q593 PolarHBondContact O-N 3.22Å
594	G	78.7	Confident	83.9	Confident	50 Å²	50	31.7 Å²	31.7	52%	0.515	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.4	1.2	-172.2	0	0	0	0	0	114.3	Y590 R591 W592 L596	Y590-G594 PolarHBondContact O-N 2.81Å; Y590-G594 VanDerWaalsContact O-N 3.17Å; R591-G594 PolarHBondContact O-N 3Å; W592-G594 PolarHBondContact O-N 3.16Å; G594-L596 PolarHBondContact O-N 3.09Å
595	N	84.7	Confident	83.9	Confident	59 Å²	59	34.9 Å²	34.9	32%	0.316	18%	0.179	S	C	.	.			trans	-79.9	70.5	171.9	-173.2	-1.7	0	0	0	110.8	Y590 S597 G598 A599	Y590-N595 CarbonylContact O-C 3.46Å; Y590-N595 WeakPolarHBondContact O-CA 3.16Å; Y590-N595 PolarHBondContact O-N 3.26Å; N595-S597 VanDerWaalsContact C-N 3.31Å; N595-S597 PolarHBondContact O-N 3.23Å; N595-S597 PolarHBondContact OD1-OG 3.03Å; N595-G598 PolarHBondContact O-N 3.18Å; N595-G598 PolarHBondContact OD1-N 3.26Å; N595-A599 PolarHBondContact O-N 2.88Å; N595-A599 VanDerWaalsContact O-N 3.14Å
596	L	81.4	Confident	84	Confident	19 Å²	19	35.1 Å²	35.1	10%	0.099	18%	0.181	C	C	.	.	H	α-helix	trans	-63.5	-35.5	179.5	-79	157.4	0	0	0	112.6	R591 G594 G598 A599 L600 L629 Y661	R591-L596 HydrophobicContact CG-CD2 4.15Å; G594-L596 PolarHBondContact O-N 3.09Å; L596-G598 PolarHBondContact O-N 3.47Å; L596-A599 PolarHBondContact O-N 3.16Å; L596-L600 WeakPolarHBondContact O-CB 3.24Å; L596-L600 VanDerWaalsContact O-CG 3.3Å; L596-L600 WeakPolarHBondContact O-CG 3.48Å; L596-L600 PolarHBondContact O-N 2.91Å; L596-L629 HydrophobicContact CD1-CD2 4.3Å; L596-L629 HydrophobicContact CD2-CD1 4.47Å; L596-L629 HydrophobicContact CD2-CD2 4.23Å; L596-Y661 HydrophobicContact CB-CE1 4.45Å; L596-Y661 HydrophobicContact CD1-CD1 4.09Å; L596-Y661 HydrophobicContact CD1-CD2 4.49Å; L596-Y661 HydrophobicContact CD1-CE1 3.37Å; L596-Y661 HydrophobicContact CD1-CE2 3.85Å; L596-Y661 VanDerWaalsContact CD1-OH 3.3Å; L596-Y661 WeakPolarHBondContact CD1-OH 3.37Å
597	S	82.5	Confident	83.8	Confident	63 Å²	63	35.6 Å²	35.6	44%	0.441	18%	0.183	S	C	.	.	H	α-helix	trans	-59.8	-45.2	175.8	42.3	0	0	0	0	112.5	N595 E601	N595-S597 VanDerWaalsContact C-N 3.31Å; N595-S597 PolarHBondContact O-N 3.23Å; N595-S597 PolarHBondContact OD1-OG 3.03Å; S597-E601 WeakPolarHBondContact O-CB 3.29Å; S597-E601 PolarHBondContact O-N 3.49Å; S597-E601 VanDerWaalsContact O-N 3.09Å
598	G	84.5	Confident	83.8	Confident	17 Å²	17	36.6 Å²	36.6	18%	0.175	19%	0.187	C	C	.	.	H	α-helix	trans	-68.1	-39.3	177.8	0	0	0	0	0	112.4	N595 L596 E601 I602	N595-G598 PolarHBondContact O-N 3.18Å; N595-G598 PolarHBondContact OD1-N 3.26Å; L596-G598 PolarHBondContact O-N 3.47Å; G598-E601 PolarHBondContact O-N 3.46Å; G598-I602 WeakPolarHBondContact O-CG1 3.44Å; G598-I602 PolarHBondContact O-N 3.4Å; G598-I602 VanDerWaalsContact O-N 3.15Å
599	A	86.8	Confident	83.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-49.7	176.9	0	0	0	0	0	112.3	A587 R591 N595 L596 E601 I602 W603	A587-A599 HydrophobicContact CB-CB 4.4Å; A587-A599 VanDerWaalsContact O-CB 3.22Å; A587-A599 WeakPolarHBondContact O-CB 3.49Å; R591-A599 HydrophobicContact CB-CB 4.31Å; N595-A599 PolarHBondContact O-N 2.88Å; N595-A599 VanDerWaalsContact O-N 3.14Å; L596-A599 PolarHBondContact O-N 3.16Å; A599-E601 VanDerWaalsContact C-N 3.3Å; A599-E601 PolarHBondContact O-N 3.35Å; A599-I602 PolarHBondContact O-N 3.31Å; A599-W603 HydrophobicContact CB-CE3 4.44Å; A599-W603 HydrophobicContact CB-CH2 4.38Å; A599-W603 HydrophobicContact CB-CZ3 4.07Å; A599-W603 PolarHBondContact O-N 2.73Å
600	L	85.1	Confident	83.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.9	-37.1	178.6	-71.1	173.4	0	0	0	111.8	L596 W603 R604 Y622 I625 L626 L629 L664 H668	L596-L600 WeakPolarHBondContact O-CB 3.24Å; L596-L600 VanDerWaalsContact O-CG 3.3Å; L596-L600 WeakPolarHBondContact O-CG 3.48Å; L596-L600 PolarHBondContact O-N 2.91Å; L600-W603 HydrophobicContact CD2-CE3 4.12Å; L600-W603 HydrophobicContact CD2-CZ3 4.4Å; L600-W603 PolarHBondContact O-N 3.4Å; L600-R604 VanDerWaalsContact O-CB 3.28Å; L600-R604 WeakPolarHBondContact O-CB 3.29Å; L600-R604 PolarHBondContact O-N 2.92Å; L600-Y622 HydrophobicContact CD2-CE2 4.32Å; L600-I625 HydrophobicContact CD2-CG2 4.07Å; L600-L626 HydrophobicContact CD1-CD2 4.22Å; L600-L626 HydrophobicContact CD2-CD2 3.76Å; L600-L626 HydrophobicContact CD2-CG 4.37Å; L600-L629 HydrophobicContact CD1-CD1 3.9Å; L600-L629 HydrophobicContact CD2-CD1 4.19Å; L600-L629 HydrophobicContact CG-CD1 4.46Å; L600-L664 HydrophobicContact CD1-CB 4.41Å; L600-L664 HydrophobicContact CD1-CD1 4.46Å; L600-H668 WeakPolarHBondContact CB-NE2 3.29Å
601	E	85.8	Confident	83.6	Confident	64 Å²	64	47.2 Å²	47.2	30%	0.299	24%	0.243	S	C	.	.	H	α-helix	trans	-65	-39.1	176.6	-179.4	58.2	-165.4	0	0	112	S597 G598 A599 R604 K605	S597-E601 WeakPolarHBondContact O-CB 3.29Å; S597-E601 PolarHBondContact O-N 3.49Å; S597-E601 VanDerWaalsContact O-N 3.09Å; G598-E601 PolarHBondContact O-N 3.46Å; A599-E601 VanDerWaalsContact C-N 3.3Å; A599-E601 PolarHBondContact O-N 3.35Å; E601-R604 PolarHBondContact O-N 3.25Å; E601-R604 IonicContact OE1-CZ 3.05Å; E601-R604 IonicContact OE1-NE 3.91Å; E601-R604 PolarHBondContact OE1-NE 3.19Å; E601-R604 IonicContact OE1-NH2 2.97Å; E601-R604 PolarHBondContact OE1-NH2 2.85Å; E601-R604 IonicContact OE2-CZ 3.68Å; E601-R604 IonicContact OE2-NE 3.89Å; E601-R604 PolarHBondContact OE2-NE 3.46Å; E601-R604 IonicContact OE2-NH2 3.32Å; E601-K605 VanDerWaalsContact O-CG 3.31Å; E601-K605 WeakPolarHBondContact O-CG 3.24Å; E601-K605 PolarHBondContact O-N 3.32Å; E601-K605 VanDerWaalsContact OE1-CE 3.29Å; E601-K605 WeakPolarHBondContact OE1-CE 3.37Å
602	I	86.4	Confident	83.4	Confident	19 Å²	19	47.9 Å²	47.9	10%	0.097	26%	0.255	C	S	.	.	H	α-helix	trans	-66.7	-46.8	174.3	-67.8	172.5	0	0	0	111.1	Y583 L586 A587 Y590 G598 A599 R604 K605 L606	Y583-I602 WeakPolarHBondContact O-CG2 3.14Å; L586-I602 HydrophobicContact CB-CD1 4.46Å; L586-I602 HydrophobicContact CD2-CD1 3.71Å; L586-I602 HydrophobicContact CG-CD1 3.76Å; A587-I602 HydrophobicContact CB-CB 4.08Å; A587-I602 HydrophobicContact CB-CG2 4Å; Y590-I602 HydrophobicContact CD2-CD1 3.66Å; Y590-I602 HydrophobicContact CE2-CD1 3.56Å; G598-I602 WeakPolarHBondContact O-CG1 3.44Å; G598-I602 PolarHBondContact O-N 3.4Å; G598-I602 VanDerWaalsContact O-N 3.15Å; A599-I602 PolarHBondContact O-N 3.31Å; I602-R604 VanDerWaalsContact C-N 3.29Å; I602-R604 PolarHBondContact O-N 3.21Å; I602-K605 WeakPolarHBondContact O-CB 3.28Å; I602-K605 PolarHBondContact O-N 3.45Å; I602-K605 VanDerWaalsContact O-N 3.16Å; I602-L606 HydrophobicContact CG2-CD1 4.21Å; I602-L606 PolarHBondContact O-N 2.9Å
603	W	85.9	Confident	83.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-35.7	177.2	-70.2	-39.3	0	0	0	112.3	H584 A587 L588 R591 A599 L600 K605 L606 V607 F616 F621 Y622 I625	H584-W603 AromaticContact CE1-NE1 3.9Å; H584-W603 AromaticContact ND1-CD1 3.97Å; H584-W603 AromaticContact ND1-NE1 3.26Å; H584-W603 PolarHBondContact ND1-NE1 2.98Å; A587-W603 HydrophobicContact CB-CD2 3.98Å; A587-W603 VanDerWaalsContact CB-CE2 3.46Å; A587-W603 HydrophobicContact CB-CG 4.19Å; A587-W603 HydrophobicContact CB-CZ2 3.87Å; A587-W603 VanDerWaalsContact CB-NE1 3.3Å; L588-W603 HydrophobicContact CD2-CH2 4.33Å; L588-W603 HydrophobicContact CD2-CZ2 3.83Å; L588-W603 HydrophobicContact CG-CZ2 4.14Å; R591-W603 HydrophobicContact CB-CH2 4.41Å; A599-W603 HydrophobicContact CB-CE3 4.44Å; A599-W603 HydrophobicContact CB-CH2 4.38Å; A599-W603 HydrophobicContact CB-CZ3 4.07Å; A599-W603 PolarHBondContact O-N 2.73Å; L600-W603 HydrophobicContact CD2-CE3 4.12Å; L600-W603 HydrophobicContact CD2-CZ3 4.4Å; L600-W603 PolarHBondContact O-N 3.4Å; W603-K605 PolarHBondContact O-N 2.95Å; W603-L606 WeakPolarHBondContact O-CB 3.33Å; W603-L606 PolarHBondContact O-N 3.35Å; W603-V607 VanDerWaalsContact O-CG2 3.28Å; W603-V607 WeakPolarHBondContact O-CG2 3.36Å; W603-V607 PolarHBondContact O-N 3.39Å; W603-F616 AromaticContact CD1-CE2 3.84Å; W603-F616 HydrophobicContact CG-CE2 4.39Å; W603-F621 HydrophobicContact CD2-CE1 4.37Å; W603-F621 AromaticContact CE2-CE1 3.74Å; W603-F621 HydrophobicContact CH2-CE1 4.41Å; W603-F621 AromaticContact CZ2-CE1 3.76Å; W603-F621 HydrophobicContact CZ2-CE1 3.76Å; W603-F621 HydrophobicContact CZ2-CZ 4.15Å; W603-F621 AromaticContact NE1-CE1 3.95Å; W603-Y622 HydrophobicContact CB-CD2 3.62Å; W603-Y622 HydrophobicContact CB-CE2 4.18Å; W603-I625 HydrophobicContact CD2-CD1 4.24Å; W603-I625 HydrophobicContact CE3-CD1 3.81Å; W603-I625 HydrophobicContact CH2-CD1 3.51Å; W603-I625 HydrophobicContact CZ2-CD1 3.96Å; W603-I625 HydrophobicContact CZ3-CD1 3.45Å; W603-I625 VanDerWaalsContact CZ3-CD1 3.45Å; W603-I625 HydrophobicContact CZ3-CG1 4.45Å; W603-I625 HydrophobicContact CZ3-CG2 3.98Å
604	R	84.3	Confident	82.9	Confident	12 Å²	12	46.1 Å²	46.1	5%	0.045	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-49	171.5	-175.5	-161.5	67.9	70.6	-2.2	110.8	L600 E601 I602 L606 V607 Y608 E610 Y622	L600-R604 VanDerWaalsContact O-CB 3.28Å; L600-R604 WeakPolarHBondContact O-CB 3.29Å; L600-R604 PolarHBondContact O-N 2.92Å; E601-R604 PolarHBondContact O-N 3.25Å; E601-R604 IonicContact OE1-CZ 3.05Å; E601-R604 IonicContact OE1-NE 3.91Å; E601-R604 PolarHBondContact OE1-NE 3.19Å; E601-R604 IonicContact OE1-NH2 2.97Å; E601-R604 PolarHBondContact OE1-NH2 2.85Å; E601-R604 IonicContact OE2-CZ 3.68Å; E601-R604 IonicContact OE2-NE 3.89Å; E601-R604 PolarHBondContact OE2-NE 3.46Å; E601-R604 IonicContact OE2-NH2 3.32Å; I602-R604 VanDerWaalsContact C-N 3.29Å; I602-R604 PolarHBondContact O-N 3.21Å; R604-L606 VanDerWaalsContact C-N 3.29Å; R604-L606 PolarHBondContact O-N 2.66Å; R604-V607 PolarHBondContact O-N 3.39Å; R604-Y608 HydrophobicContact CG-CD2 4.15Å; R604-Y608 HydrophobicContact CG-CE1 4.41Å; R604-Y608 HydrophobicContact CG-CE2 3.81Å; R604-Y608 PolarHBondContact O-N 3.39Å; R604-E610 IonicContact CZ-OE1 3.39Å; R604-E610 IonicContact NH1-OE1 2.95Å; R604-E610 PolarHBondContact NH1-OE1 3.35Å; R604-E610 IonicContact NH2-OE1 2.72Å; R604-E610 IonicContact NH2-OE2 3.14Å; R604-Y622 HydrophobicContact CB-CE2 4.47Å
605	K	85.7	Confident	82.7	Confident	71 Å²	71	44.9 Å²	44.9	31%	0.309	25%	0.25	S	C	.	.	H	α-helix	trans	-60.9	-36.9	177.6	-71.4	-177	178.9	177.5	0	112.5	E601 I602 W603 N609 E610 L611	E601-K605 VanDerWaalsContact O-CG 3.31Å; E601-K605 WeakPolarHBondContact O-CG 3.24Å; E601-K605 PolarHBondContact O-N 3.32Å; E601-K605 VanDerWaalsContact OE1-CE 3.29Å; E601-K605 WeakPolarHBondContact OE1-CE 3.37Å; I602-K605 WeakPolarHBondContact O-CB 3.28Å; I602-K605 PolarHBondContact O-N 3.45Å; I602-K605 VanDerWaalsContact O-N 3.16Å; W603-K605 PolarHBondContact O-N 2.95Å; K605-N609 PolarHBondContact O-N 3.26Å; K605-E610 HydrophobicContact CB-CB 4.1Å; K605-E610 HydrophobicContact CG-CB 4.41Å; K605-E610 WeakPolarHBondContact CG-OE2 3.45Å; K605-E610 WeakPolarHBondContact O-CA 3.35Å; K605-E610 WeakPolarHBondContact O-CB 3.42Å; K605-E610 PolarHBondContact O-N 3.5Å; K605-L611 HydrophobicContact CB-CB 4.42Å; K605-L611 HydrophobicContact CB-CD1 3.71Å; K605-L611 HydrophobicContact CB-CG 3.91Å; K605-L611 HydrophobicContact CD-CD1 3.97Å; K605-L611 HydrophobicContact CD-CG 4.44Å; K605-L611 HydrophobicContact CG-CD1 4.5Å; K605-L611 PolarHBondContact O-N 3.15Å; K605-L611 VanDerWaalsContact O-N 3.15Å
606	L	84.8	Confident	82.5	Confident	8 Å²	8	43.7 Å²	43.7	4%	0.042	24%	0.242	C	C	.	.	H	α-helix	trans	-66.3	-44.2	173.8	-72.2	167.9	0	0	0	112	H584 I602 W603 R604 N609 L611 D613 F616	H584-L606 HydrophobicContact CB-CD1 4.45Å; I602-L606 HydrophobicContact CG2-CD1 4.21Å; I602-L606 PolarHBondContact O-N 2.9Å; W603-L606 WeakPolarHBondContact O-CB 3.33Å; W603-L606 PolarHBondContact O-N 3.35Å; R604-L606 VanDerWaalsContact C-N 3.29Å; R604-L606 PolarHBondContact O-N 2.66Å; L606-N609 PolarHBondContact O-N 3.26Å; L606-L611 HydrophobicContact CD2-CB 3.81Å; L606-L611 HydrophobicContact CG-CB 4.32Å; L606-D613 HydrophobicContact CD2-CB 3.59Å; L606-F616 HydrophobicContact CB-CD1 4.07Å; L606-F616 HydrophobicContact CB-CD2 4.47Å; L606-F616 HydrophobicContact CB-CE1 4.2Å; L606-F616 HydrophobicContact CB-CG 4.22Å; L606-F616 HydrophobicContact CB-CZ 4.48Å; L606-F616 HydrophobicContact CD1-CB 4.33Å; L606-F616 HydrophobicContact CD1-CD2 4Å; L606-F616 HydrophobicContact CD1-CG 4.13Å
607	V	81.9	Confident	82	Confident	10 Å²	10	45.2 Å²	45.2	6%	0.061	25%	0.253	C	S	.	.	H	α-helix	trans	-67	-36.9	179.9	171.5	0	0	0	0	112.4	W603 R604 N609 F616 V619 Y622 I680	W603-V607 VanDerWaalsContact O-CG2 3.28Å; W603-V607 WeakPolarHBondContact O-CG2 3.36Å; W603-V607 PolarHBondContact O-N 3.39Å; R604-V607 PolarHBondContact O-N 3.39Å; V607-N609 PolarHBondContact O-N 3.29Å; V607-F616 HydrophobicContact CG2-CE1 3.72Å; V607-F616 HydrophobicContact CG2-CZ 3.49Å; V607-F616 VanDerWaalsContact CG2-CZ 3.49Å; V607-V619 HydrophobicContact CG1-CG1 4Å; V607-V619 HydrophobicContact CG1-CG2 4.09Å; V607-Y622 HydrophobicContact CG2-CD1 3.96Å; V607-Y622 HydrophobicContact CG2-CG 3.9Å; V607-I680 HydrophobicContact CG1-CD1 3.33Å
608	Y	82.3	Confident	81.8	Confident	21 Å²	21	43.3 Å²	43.3	8%	0.082	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	4.4	177.8	-67.5	2	0	0	0	113	R604 E610 A672 T675 H677 I680	R604-Y608 HydrophobicContact CG-CD2 4.15Å; R604-Y608 HydrophobicContact CG-CE1 4.41Å; R604-Y608 HydrophobicContact CG-CE2 3.81Å; R604-Y608 PolarHBondContact O-N 3.39Å; Y608-E610 PolarHBondContact O-N 2.98Å; Y608-A672 WeakPolarHBondContact OH-CA 3.46Å; Y608-A672 PolarHBondContact OH-N 2.9Å; Y608-T675 HydrophobicContact CE2-CG2 4.03Å; Y608-T675 WeakPolarHBondContact CE2-OG1 3.41Å; Y608-H677 AromaticContact CD1-CD2 3.92Å; Y608-H677 AromaticContact CD1-CE1 3.59Å; Y608-H677 AromaticContact CD1-ND1 3.82Å; Y608-H677 AromaticContact CD1-NE2 3.66Å; Y608-H677 AromaticContact CD2-CE1 3.98Å; Y608-H677 HydrophobicContact CE1-CB 4.34Å; Y608-H677 AromaticContact CE1-CE1 3.96Å; Y608-H677 AromaticContact CE1-CG 3.84Å; Y608-H677 AromaticContact CE1-ND1 3.7Å; Y608-H677 AromaticContact CG-CE1 3.64Å; Y608-H677 AromaticContact CG-NE2 3.95Å; Y608-H677 AromaticContact CZ-ND1 3.93Å; Y608-I680 HydrophobicContact CE1-CD1 4.32Å
609	N	78.6	Confident	81.5	Confident	127 Å²	127	45.4 Å²	45.4	68%	0.679	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	27.7	-175	-51.4	-55.7	0	0	0	113.8	K605 L606 V607	K605-N609 PolarHBondContact O-N 3.26Å; L606-N609 PolarHBondContact O-N 3.26Å; V607-N609 PolarHBondContact O-N 3.29Å
610	E	85	Confident	81.1	Confident	107 Å²	107	50.1 Å²	50.1	50%	0.5	27%	0.274	S	S	.	.	S	Bend	trans	-75.6	-33.2	169.7	-64.4	177.1	-147.6	0	0	110.8	R604 K605 Y608	R604-E610 IonicContact CZ-OE1 3.39Å; R604-E610 IonicContact NH1-OE1 2.95Å; R604-E610 PolarHBondContact NH1-OE1 3.35Å; R604-E610 IonicContact NH2-OE1 2.72Å; R604-E610 IonicContact NH2-OE2 3.14Å; K605-E610 HydrophobicContact CB-CB 4.1Å; K605-E610 HydrophobicContact CG-CB 4.41Å; K605-E610 WeakPolarHBondContact CG-OE2 3.45Å; K605-E610 WeakPolarHBondContact O-CA 3.35Å; K605-E610 WeakPolarHBondContact O-CB 3.42Å; K605-E610 PolarHBondContact O-N 3.5Å; Y608-E610 PolarHBondContact O-N 2.98Å
611	L	83.1	Confident	81	Confident	40 Å²	40	52.2 Å²	52.2	21%	0.209	28%	0.283	C	S	.	.	S	Bend	trans	-121.5	151.3	174.3	-64.3	175	0	0	0	109.3	Y583 K605 L606	Y583-L611 HydrophobicContact CD1-CD1 3.87Å; Y583-L611 HydrophobicContact CD2-CB 4.17Å; Y583-L611 HydrophobicContact CD2-CD1 4.37Å; Y583-L611 HydrophobicContact CE1-CD1 4.09Å; Y583-L611 HydrophobicContact CE1-CD2 4.22Å; Y583-L611 HydrophobicContact CE2-CB 4.38Å; Y583-L611 HydrophobicContact CE2-CD2 4.06Å; Y583-L611 HydrophobicContact CG-CD1 4.01Å; K605-L611 HydrophobicContact CB-CB 4.42Å; K605-L611 HydrophobicContact CB-CD1 3.71Å; K605-L611 HydrophobicContact CB-CG 3.91Å; K605-L611 HydrophobicContact CD-CD1 3.97Å; K605-L611 HydrophobicContact CD-CG 4.44Å; K605-L611 HydrophobicContact CG-CD1 4.5Å; K605-L611 PolarHBondContact O-N 3.15Å; K605-L611 VanDerWaalsContact O-N 3.15Å; L606-L611 HydrophobicContact CD2-CB 3.81Å; L606-L611 HydrophobicContact CG-CB 4.32Å
612	N	77.5	Confident	80.8	Confident	126 Å²	126	49.2 Å²	49.2	67%	0.674	27%	0.269	S	S	*	.			trans	-119	124.9	177.5	-66	-32.2	0	0	0	109.7
613	D	80.4	Confident	80.3	Confident	28 Å²	28	48.5 Å²	48.5	15%	0.15	27%	0.265	C	S	.	.			trans	-140.4	121.9	171.8	-171.5	-22.9	0	0	0	108.6	A582 Y583 H584 L606 S615 F616	A582-D613 VanDerWaalsContact C-OD2 3.31Å; Y583-D613 PolarHBondContact N-OD2 3.46Å; H584-D613 WeakPolarHBondContact CB-OD2 3.38Å; H584-D613 PolarHBondContact N-OD2 3.08Å; L606-D613 HydrophobicContact CD2-CB 3.59Å; D613-S615 PolarHBondContact O-N 2.88Å; D613-S615 WeakPolarHBondContact OD1-CB 3.35Å; D613-S615 PolarHBondContact OD1-N 3.34Å; D613-S615 PolarHBondContact OD1-OG 3.03Å; D613-S615 PolarHBondContact OD2-OG 3.41Å; D613-F616 HydrophobicContact CB-CB 4.38Å; D613-F616 WeakPolarHBondContact O-CB 3.39Å; D613-F616 PolarHBondContact O-N 3.29Å
614	S	75.2	Confident	79.9	Confident	127 Å²	127	50.5 Å²	50.5	89%	0.888	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.5	179.6	54.2	0	0	0	0	113.2	F616	S614-F616 VanDerWaalsContact C-N 3.35Å
615	S	75.3	Confident	79.6	Confident	25 Å²	25	50.4 Å²	50.4	18%	0.175	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-5.5	176.7	70.4	0	0	0	0	113.4	D613 P617	D613-S615 PolarHBondContact O-N 2.88Å; D613-S615 WeakPolarHBondContact OD1-CB 3.35Å; D613-S615 PolarHBondContact OD1-N 3.34Å; D613-S615 PolarHBondContact OD1-OG 3.03Å; D613-S615 PolarHBondContact OD2-OG 3.41Å; S615-P617 WeakPolarHBondContact O-CD 3.35Å
616	F	80.3	Confident	79.3	Confident	34 Å²	34	47 Å²	47	15%	0.149	27%	0.265	C	S	.	.			trans	-70.9	122.5	179.3	179.1	-123.3	0	0	0	111.2	H584 W603 L606 V607 D613 S614 G618 F621	H584-F616 HydrophobicContact CB-CB 4.46Å; H584-F616 AromaticContact ND1-CD2 3.84Å; W603-F616 AromaticContact CD1-CE2 3.84Å; W603-F616 HydrophobicContact CG-CE2 4.39Å; L606-F616 HydrophobicContact CB-CD1 4.07Å; L606-F616 HydrophobicContact CB-CD2 4.47Å; L606-F616 HydrophobicContact CB-CE1 4.2Å; L606-F616 HydrophobicContact CB-CG 4.22Å; L606-F616 HydrophobicContact CB-CZ 4.48Å; L606-F616 HydrophobicContact CD1-CB 4.33Å; L606-F616 HydrophobicContact CD1-CD2 4Å; L606-F616 HydrophobicContact CD1-CG 4.13Å; V607-F616 HydrophobicContact CG2-CE1 3.72Å; V607-F616 HydrophobicContact CG2-CZ 3.49Å; V607-F616 VanDerWaalsContact CG2-CZ 3.49Å; D613-F616 HydrophobicContact CB-CB 4.38Å; D613-F616 WeakPolarHBondContact O-CB 3.39Å; D613-F616 PolarHBondContact O-N 3.29Å; S614-F616 VanDerWaalsContact C-N 3.35Å; F616-G618 VanDerWaalsContact CE1-C 3.47Å; F616-G618 VanDerWaalsContact CE1-CA 3.48Å; F616-G618 WeakPolarHBondContact CZ-O 3.44Å; F616-G618 PolarHBondContact O-N 2.76Å; F616-F621 HydrophobicContact CE2-CD1 4.16Å
617	P	71.3	Confident	78.8	Confident	51 Å²	51	47.9 Å²	47.9	33%	0.331	27%	0.269	S	S	.	.			trans	-66.1	-11.7	-175.6	-22.7	33.4	0	0	0	114.9	H584 S615 F621	H584-P617 VanDerWaalsContact CE1-CD 3.46Å; H584-P617 WeakPolarHBondContact CE1-CD 3.35Å; S615-P617 WeakPolarHBondContact O-CD 3.35Å; P617-F621 HydrophobicContact CB-CB 3.81Å; P617-F621 HydrophobicContact CB-CD2 4.47Å; P617-F621 HydrophobicContact CB-CG 4.12Å; P617-F621 HydrophobicContact CG-CB 4.26Å; P617-F621 HydrophobicContact CG-CD1 4.32Å; P617-F621 HydrophobicContact CG-CD2 4.21Å; P617-F621 HydrophobicContact CG-CG 4.02Å
618	G	78.5	Confident	78.5	Confident	22 Å²	22	52.4 Å²	52.4	23%	0.227	29%	0.293	C	S	.	.			trans	105.6	-175.3	177.7	0	0	0	0	0	113.9	F616 E620 F621	F616-G618 VanDerWaalsContact CE1-C 3.47Å; F616-G618 VanDerWaalsContact CE1-CA 3.48Å; F616-G618 WeakPolarHBondContact CZ-O 3.44Å; F616-G618 PolarHBondContact O-N 2.76Å; G618-E620 VanDerWaalsContact C-N 3.27Å; G618-E620 PolarHBondContact O-N 3.5Å; G618-F621 PolarHBondContact O-N 2.84Å
619	V	78.2	Confident	78	Confident	61 Å²	61	52.5 Å²	52.5	37%	0.37	30%	0.295	S	S	.	.	H	α-helix	trans	-61.7	-33.6	-169.9	-171.4	0	0	0	0	112.8	V607 F621 Y622 I623 I680	V607-V619 HydrophobicContact CG1-CG1 4Å; V607-V619 HydrophobicContact CG1-CG2 4.09Å; V619-F621 VanDerWaalsContact C-N 3.32Å; V619-F621 PolarHBondContact O-N 3.48Å; V619-Y622 PolarHBondContact O-N 3.39Å; V619-I623 HydrophobicContact CG1-CD1 3.93Å; V619-I623 HydrophobicContact CG1-CG1 4.42Å; V619-I623 WeakPolarHBondContact O-CG1 2.78Å; V619-I623 PolarHBondContact O-N 3.01Å; V619-I680 HydrophobicContact CG1-CD1 3.93Å; V619-I680 HydrophobicContact CG1-CG1 3.83Å
620	E	78.5	Confident	77.6	Confident	100 Å²	100	46.8 Å²	46.8	47%	0.467	27%	0.265	S	S	.	.	H	α-helix	trans	-64.3	-35.7	-178.9	-170	64.7	-167.7	0	0	112.5	G618 I623 S624 R687	G618-E620 VanDerWaalsContact C-N 3.27Å; G618-E620 PolarHBondContact O-N 3.5Å; E620-I623 PolarHBondContact O-N 3.15Å; E620-S624 WeakPolarHBondContact O-CB 3.46Å; E620-S624 PolarHBondContact O-N 2.82Å; E620-R687 IonicContact OE1-CZ 3.27Å; E620-R687 IonicContact OE1-NH1 3.45Å; E620-R687 PolarHBondContact OE1-NH1 3.46Å; E620-R687 IonicContact OE1-NH2 3.14Å; E620-R687 PolarHBondContact OE1-NH2 3.49Å; E620-R687 VanDerWaalsContact OE1-NH2 3.08Å; E620-R687 IonicContact OE2-NH2 3.1Å
621	F	81.4	Confident	76.5	Confident	43 Å²	43	43.8 Å²	43.8	19%	0.189	26%	0.259	C	S	.	.	H	α-helix	trans	-67.1	-40.1	176.8	173.4	-96.3	0	0	0	112	H584 L588 W603 F616 P617 G618 V619 I623 S624 I625	H584-F621 AromaticContact CE1-CE1 3.49Å; H584-F621 VanDerWaalsContact CE1-CE1 3.49Å; H584-F621 WeakPolarHBondContact CE1-CE1 3.16Å; H584-F621 AromaticContact CE1-CZ 3.76Å; L588-F621 HydrophobicContact CD2-CZ 4.46Å; W603-F621 HydrophobicContact CD2-CE1 4.37Å; W603-F621 AromaticContact CE2-CE1 3.74Å; W603-F621 HydrophobicContact CH2-CE1 4.41Å; W603-F621 AromaticContact CZ2-CE1 3.76Å; W603-F621 HydrophobicContact CZ2-CE1 3.76Å; W603-F621 HydrophobicContact CZ2-CZ 4.15Å; W603-F621 AromaticContact NE1-CE1 3.95Å; F616-F621 HydrophobicContact CE2-CD1 4.16Å; P617-F621 HydrophobicContact CB-CB 3.81Å; P617-F621 HydrophobicContact CB-CD2 4.47Å; P617-F621 HydrophobicContact CB-CG 4.12Å; P617-F621 HydrophobicContact CG-CB 4.26Å; P617-F621 HydrophobicContact CG-CD1 4.32Å; P617-F621 HydrophobicContact CG-CD2 4.21Å; P617-F621 HydrophobicContact CG-CG 4.02Å; G618-F621 PolarHBondContact O-N 2.84Å; V619-F621 VanDerWaalsContact C-N 3.32Å; V619-F621 PolarHBondContact O-N 3.48Å; F621-I623 VanDerWaalsContact C-N 3.35Å; F621-S624 PolarHBondContact O-N 3.25Å; F621-S624 PolarHBondContact O-OG 3.12Å; F621-I625 HydrophobicContact CD1-CD1 3.64Å; F621-I625 HydrophobicContact CD2-CD1 4.41Å; F621-I625 HydrophobicContact CE1-CD1 3.14Å; F621-I625 HydrophobicContact CE1-CG1 4.39Å; F621-I625 HydrophobicContact CE2-CD1 4Å; F621-I625 HydrophobicContact CG-CD1 4.25Å; F621-I625 HydrophobicContact CZ-CD1 3.36Å; F621-I625 HydrophobicContact CZ-CG1 4.31Å; F621-I625 WeakPolarHBondContact O-CD1 3.49Å; F621-I625 WeakPolarHBondContact O-CG1 3.19Å; F621-I625 PolarHBondContact O-N 3.49Å; F621-I625 VanDerWaalsContact O-N 3.08Å
622	Y	82	Confident	74.9	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-41.1	174.7	171.1	-107.1	0	0	0	111.7	L600 W603 R604 V607 V619 I625 L626 H668	L600-Y622 HydrophobicContact CD2-CE2 4.32Å; W603-Y622 HydrophobicContact CB-CD2 3.62Å; W603-Y622 HydrophobicContact CB-CE2 4.18Å; R604-Y622 HydrophobicContact CB-CE2 4.47Å; V607-Y622 HydrophobicContact CG2-CD1 3.96Å; V607-Y622 HydrophobicContact CG2-CG 3.9Å; V619-Y622 PolarHBondContact O-N 3.39Å; Y622-I625 PolarHBondContact O-N 3.17Å; Y622-L626 HydrophobicContact CD1-CD1 4.1Å; Y622-L626 HydrophobicContact CE1-CD1 3.52Å; Y622-L626 HydrophobicContact CE2-CD1 4.03Å; Y622-L626 HydrophobicContact CE2-CG 4.31Å; Y622-L626 WeakPolarHBondContact O-CG 3.23Å; Y622-L626 PolarHBondContact O-N 2.9Å; Y622-L626 VanDerWaalsContact O-N 3.11Å; Y622-H668 AromaticContact CZ-ND1 3.92Å; Y622-H668 PolarHBondContact OH-ND1 2.92Å
623	I	76.4	Confident	73.2	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-64.3	-43.5	175.1	-68.8	169.3	0	0	0	110.6	V619 E620 F621 I625 L626 L627 I680 Q683 L684	V619-I623 HydrophobicContact CG1-CD1 3.93Å; V619-I623 HydrophobicContact CG1-CG1 4.42Å; V619-I623 WeakPolarHBondContact O-CG1 2.78Å; V619-I623 PolarHBondContact O-N 3.01Å; E620-I623 PolarHBondContact O-N 3.15Å; F621-I623 VanDerWaalsContact C-N 3.35Å; I623-I625 VanDerWaalsContact C-N 3.33Å; I623-I625 PolarHBondContact O-N 2.86Å; I623-L626 PolarHBondContact O-N 3.45Å; I623-L627 HydrophobicContact CG2-CD1 3.67Å; I623-L627 HydrophobicContact CG2-CG 4.22Å; I623-L627 WeakPolarHBondContact O-CB 3.44Å; I623-L627 VanDerWaalsContact O-CG 3.25Å; I623-L627 WeakPolarHBondContact O-CG 3.41Å; I623-L627 PolarHBondContact O-N 3.3Å; I623-I680 HydrophobicContact CD1-CG2 4.47Å; I623-I680 HydrophobicContact CG1-CG2 4.44Å; I623-Q683 HydrophobicContact CD1-CB 3.83Å; I623-Q683 HydrophobicContact CD1-CG 4.44Å; I623-L684 HydrophobicContact CB-CD2 4.44Å; I623-L684 HydrophobicContact CG1-CD2 4.35Å; I623-L684 HydrophobicContact CG1-CG 4.44Å; I623-L684 HydrophobicContact CG2-CD2 4.02Å
624	S	77	Confident	71.1	Confident	42 Å²	42	50.2 Å²	50.2	29%	0.294	30%	0.296	S	S	.	.	H	α-helix	trans	-61.4	-42.2	179.5	70.3	0	0	0	0	111.6	E620 F621 L627 D628	E620-S624 WeakPolarHBondContact O-CB 3.46Å; E620-S624 PolarHBondContact O-N 2.82Å; F621-S624 PolarHBondContact O-N 3.25Å; F621-S624 PolarHBondContact O-OG 3.12Å; S624-L627 PolarHBondContact O-N 3.05Å; S624-D628 WeakPolarHBondContact O-CB 3.31Å; S624-D628 PolarHBondContact O-N 2.85Å
625	I	78.4	Confident	69.3	Low	10 Å²	10	48.8 Å²	48.8	5%	0.051	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-44.9	176.5	-68.7	159.1	0	0	0	111.7	L600 W603 F621 Y622 I623 L627 D628 L629	L600-I625 HydrophobicContact CD2-CG2 4.07Å; W603-I625 HydrophobicContact CD2-CD1 4.24Å; W603-I625 HydrophobicContact CE3-CD1 3.81Å; W603-I625 HydrophobicContact CH2-CD1 3.51Å; W603-I625 HydrophobicContact CZ2-CD1 3.96Å; W603-I625 HydrophobicContact CZ3-CD1 3.45Å; W603-I625 VanDerWaalsContact CZ3-CD1 3.45Å; W603-I625 HydrophobicContact CZ3-CG1 4.45Å; W603-I625 HydrophobicContact CZ3-CG2 3.98Å; F621-I625 HydrophobicContact CD1-CD1 3.64Å; F621-I625 HydrophobicContact CD2-CD1 4.41Å; F621-I625 HydrophobicContact CE1-CD1 3.14Å; F621-I625 HydrophobicContact CE1-CG1 4.39Å; F621-I625 HydrophobicContact CE2-CD1 4Å; F621-I625 HydrophobicContact CG-CD1 4.25Å; F621-I625 HydrophobicContact CZ-CD1 3.36Å; F621-I625 HydrophobicContact CZ-CG1 4.31Å; F621-I625 WeakPolarHBondContact O-CD1 3.49Å; F621-I625 WeakPolarHBondContact O-CG1 3.19Å; F621-I625 PolarHBondContact O-N 3.49Å; F621-I625 VanDerWaalsContact O-N 3.08Å; Y622-I625 PolarHBondContact O-N 3.17Å; I623-I625 VanDerWaalsContact C-N 3.33Å; I623-I625 PolarHBondContact O-N 2.86Å; I625-L627 PolarHBondContact O-N 3.25Å; I625-D628 PolarHBondContact O-N 3.46Å; I625-L629 HydrophobicContact CG2-CD1 3.99Å; I625-L629 HydrophobicContact CG2-CG 4.4Å; I625-L629 WeakPolarHBondContact O-CB 3.24Å; I625-L629 VanDerWaalsContact O-CG 3.26Å; I625-L629 WeakPolarHBondContact O-CG 3.49Å; I625-L629 PolarHBondContact O-N 3.25Å
626	L	79.9	Confident	67.2	Low	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62	-36.4	177.2	-74.4	176.6	0	0	0	111.7	L600 Y622 I623 S630 V665 H668 L684	L600-L626 HydrophobicContact CD1-CD2 4.22Å; L600-L626 HydrophobicContact CD2-CD2 3.76Å; L600-L626 HydrophobicContact CD2-CG 4.37Å; Y622-L626 HydrophobicContact CD1-CD1 4.1Å; Y622-L626 HydrophobicContact CE1-CD1 3.52Å; Y622-L626 HydrophobicContact CE2-CD1 4.03Å; Y622-L626 HydrophobicContact CE2-CG 4.31Å; Y622-L626 WeakPolarHBondContact O-CG 3.23Å; Y622-L626 PolarHBondContact O-N 2.9Å; Y622-L626 VanDerWaalsContact O-N 3.11Å; I623-L626 PolarHBondContact O-N 3.45Å; L626-S630 WeakPolarHBondContact O-CB 3.32Å; L626-S630 PolarHBondContact O-N 3.47Å; L626-V665 HydrophobicContact CD2-CG2 4.21Å; L626-H668 HydrophobicContact CD1-CB 4.31Å; L626-H668 HydrophobicContact CD2-CB 4.3Å; L626-L684 HydrophobicContact CB-CD2 3.85Å; L626-L684 HydrophobicContact CD1-CD1 3.87Å; L626-L684 HydrophobicContact CD1-CD2 3.86Å
627	L	74.2	Confident	64.9	Low	25 Å²	25	58.2 Å²	58.2	13%	0.131	34%	0.339	C	S	.	.	H	α-helix	trans	-70.6	-41.9	176	-70	171.2	0	0	0	112	I623 S624 I625 L629 S630 A631 R687 F688	I623-L627 HydrophobicContact CG2-CD1 3.67Å; I623-L627 HydrophobicContact CG2-CG 4.22Å; I623-L627 WeakPolarHBondContact O-CB 3.44Å; I623-L627 VanDerWaalsContact O-CG 3.25Å; I623-L627 WeakPolarHBondContact O-CG 3.41Å; I623-L627 PolarHBondContact O-N 3.3Å; S624-L627 PolarHBondContact O-N 3.05Å; I625-L627 PolarHBondContact O-N 3.25Å; L627-L629 VanDerWaalsContact C-N 3.27Å; L627-L629 PolarHBondContact O-N 3.15Å; L627-S630 WeakPolarHBondContact CA-OG 3.48Å; L627-S630 CarbonylContact O-C 3.53Å; L627-S630 WeakPolarHBondContact O-CA 3.19Å; L627-S630 WeakPolarHBondContact O-CB 3.47Å; L627-S630 PolarHBondContact O-N 3.27Å; L627-S630 PolarHBondContact O-OG 2.98Å; L627-A631 WeakPolarHBondContact O-CB 3.38Å; L627-A631 PolarHBondContact O-N 3.2Å; L627-R687 HydrophobicContact CD1-CB 3.65Å; L627-R687 HydrophobicContact CD1-CG 4.3Å; L627-R687 HydrophobicContact CD2-CB 3.67Å; L627-R687 HydrophobicContact CG-CB 4.33Å; L627-F688 HydrophobicContact CD2-CD1 4.2Å
628	D	75.2	Confident	63	Low	106 Å²	106	64.2 Å²	64.2	57%	0.567	36%	0.363	S	S	*	.	H	α-helix	trans	-60.2	-40.1	174.4	-69	-18.3	0	0	0	110.9	S624 I625 S630 A631	S624-D628 WeakPolarHBondContact O-CB 3.31Å; S624-D628 PolarHBondContact O-N 2.85Å; I625-D628 PolarHBondContact O-N 3.46Å; D628-S630 VanDerWaalsContact C-N 3.28Å; D628-S630 PolarHBondContact O-N 2.63Å; D628-A631 PolarHBondContact O-N 2.88Å
629	L	72.7	Confident	60.5	Low	22 Å²	22	72.5 Å²	72.5	12%	0.115	39%	0.392	C	S	.	.	H	α-helix	trans	-69.9	-24.2	174.4	-68.4	171.6	0	0	0	113.1	L596 L600 I625 L627 S659 Y661 V665	L596-L629 HydrophobicContact CD1-CD2 4.3Å; L596-L629 HydrophobicContact CD2-CD1 4.47Å; L596-L629 HydrophobicContact CD2-CD2 4.23Å; L600-L629 HydrophobicContact CD1-CD1 3.9Å; L600-L629 HydrophobicContact CD2-CD1 4.19Å; L600-L629 HydrophobicContact CG-CD1 4.46Å; I625-L629 HydrophobicContact CG2-CD1 3.99Å; I625-L629 HydrophobicContact CG2-CG 4.4Å; I625-L629 WeakPolarHBondContact O-CB 3.24Å; I625-L629 VanDerWaalsContact O-CG 3.26Å; I625-L629 WeakPolarHBondContact O-CG 3.49Å; I625-L629 PolarHBondContact O-N 3.25Å; L627-L629 VanDerWaalsContact C-N 3.27Å; L627-L629 PolarHBondContact O-N 3.15Å; L629-S659 WeakPolarHBondContact O-CB 3.38Å; L629-S659 PolarHBondContact O-OG 3.48Å; L629-Y661 HydrophobicContact CD2-CD2 3.64Å; L629-Y661 HydrophobicContact CD2-CE2 4.14Å; L629-Y661 HydrophobicContact CD2-CG 4.02Å; L629-V665 HydrophobicContact CB-CG2 4.1Å
630	S	69.3	Low	58	Low	7 Å²	7	78.4 Å²	78.4	5%	0.049	42%	0.416	C	S	.	.	H	α-helix	trans	-83.7	-26.5	174.9	80.4	0	0	0	0	112.8	L626 L627 D628 P689	L626-S630 WeakPolarHBondContact O-CB 3.32Å; L626-S630 PolarHBondContact O-N 3.47Å; L627-S630 WeakPolarHBondContact CA-OG 3.48Å; L627-S630 CarbonylContact O-C 3.53Å; L627-S630 WeakPolarHBondContact O-CA 3.19Å; L627-S630 WeakPolarHBondContact O-CB 3.47Å; L627-S630 PolarHBondContact O-N 3.27Å; L627-S630 PolarHBondContact O-OG 2.98Å; D628-S630 VanDerWaalsContact C-N 3.28Å; D628-S630 PolarHBondContact O-N 2.63Å; S630-P689 WeakPolarHBondContact OG-CD 3.29Å
631	A	61.4	Low	55.3	Low	45 Å²	45	78.1 Å²	78.1	37%	0.372	43%	0.425	S	S	.	.	S	Bend	trans	-77.3	152.5	176.9	0	0	0	0	0	110.5	L627 D628	L627-A631 WeakPolarHBondContact O-CB 3.38Å; L627-A631 PolarHBondContact O-N 3.2Å; D628-A631 PolarHBondContact O-N 2.88Å
632	H	49.7	Very low	52.7	Low	102 Å²	102	81.9 Å²	81.9	47%	0.472	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-82.8	130.7	172.3	-128.7	-43.7	0	0	0	109.2	P634 E657	H632-P634 VanDerWaalsContact O-CD 3.29Å; H632-P634 WeakPolarHBondContact O-CD 3.27Å; H632-E657 PolarHBondContact CD2-O 3.38Å; H632-E657 PolarHBondContact CE1-O 3.47Å; H632-E657 VanDerWaalsContact CE1-O 3.27Å; H632-E657 PolarHBondContact NE2-O 3.32Å
633	D	41.2	Very low	50.1	Low	124 Å²	124	91.3 Å²	91.3	66%	0.663	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-60.8	119	165.5	-81.8	-38	0	0	0	109.5	T635	D633-T635 PolarHBondContact O-N 2.86Å; D633-T635 VanDerWaalsContact O-N 3.08Å
634	P	36.2	Very low	47.7	Very low	103 Å²	103	100.3 Å²	100.3	67%	0.669	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-72.4	2.7	176.4	28.5	-32.2	0	0	0	113	H632 D636 S637	H632-P634 VanDerWaalsContact O-CD 3.29Å; H632-P634 WeakPolarHBondContact O-CD 3.27Å; P634-D636 PolarHBondContact O-N 3.37Å; P634-S637 PolarHBondContact O-N 3.08Å; P634-S637 PolarHBondContact O-OG 3.14Å
635	T	37.9	Very low	45.1	Very low	96 Å²	96	101.7 Å²	101.7	59%	0.589	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-82.3	-6	-164.5	56.7	0	0	0	0	115.3	D633 S637	D633-T635 PolarHBondContact O-N 2.86Å; D633-T635 VanDerWaalsContact O-N 3.08Å; T635-S637 VanDerWaalsContact C-N 3.26Å; T635-S637 PolarHBondContact O-N 2.8Å
636	D	32.2	Very low	42.6	Very low	160 Å²	160	108.4 Å²	108.4	86%	0.856	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-79.7	-5.3	170	-91.7	-18.8	0	0	0	114.1	P634	P634-D636 PolarHBondContact O-N 3.37Å
637	S	32.2	Very low	40	Very low	98 Å²	98	112.3 Å²	112.3	69%	0.685	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-90.8	-3.2	179.2	64.7	0	0	0	0	115.7	P634 T635	P634-S637 PolarHBondContact O-N 3.08Å; P634-S637 PolarHBondContact O-OG 3.14Å; T635-S637 VanDerWaalsContact C-N 3.26Å; T635-S637 PolarHBondContact O-N 2.8Å
638	Q	30.5	Very low	37.7	Very low	177 Å²	177	118.9 Å²	118.9	83%	0.827	66%	0.658	S	S	*	*	S	Bend	trans	-120.3	7.1	-176.2	-69.5	-158.8	-0.4	0	0	117.3
639	K	26.9	Very low	35.3	Very low	195 Å²	195	123 Å²	123	85%	0.848	67%	0.673	S	S	*	*			trans	-104.5	12	173.9	-75.1	-172.3	-178.7	173.8	0	115.9	S641	K639-S641 PolarHBondContact O-N 3.43Å
640	Q	24.4	Very low	33.1	Very low	186 Å²	186	127 Å²	127	87%	0.869	70%	0.703	S	S	*	*	S	Bend	trans	-87.4	96	162.8	-71.4	-170.9	12.1	0	0	110
641	S	22.9	Very low	30.9	Very low	93 Å²	93	132.4 Å²	132.4	65%	0.65	74%	0.741	S	S	*	*			trans	-33.5	135.5	165.6	54.8	0	0	0	0	113.5	K639 Y643	K639-S641 PolarHBondContact O-N 3.43Å; S641-Y643 PolarHBondContact O-N 3.03Å
642	P	26.6	Very low	29.3	Very low	123 Å²	123	134.8 Å²	134.8	80%	0.799	76%	0.755	S	S	*	*	S	Bend	trans	-80.1	83.8	179.9	33.3	-32.9	0	0	0	110
643	Y	26.5	Very low	28.2	Very low	199 Å²	199	136.3 Å²	136.3	78%	0.78	77%	0.766	S	S	*	*			trans	-144.1	116.9	166.5	-89.3	-77	0	0	0	112	S641	S641-Y643 PolarHBondContact O-N 3.03Å
644	K	26.1	Very low	27.7	Very low	194 Å²	194	137.2 Å²	137.2	84%	0.843	78%	0.776	S	S	*	*			trans	63	105.1	155.3	-58.8	175.2	178.9	178.5	0	114.2
645	G	22.3	Very low	27.7	Very low	71 Å²	71	138 Å²	138	73%	0.732	78%	0.775	S	S	*	*				98.5	132.9	63.9	0	0	0	0	0	109.2
646	V	27.3	Very low	27.5	Very low	150 Å²	150	138 Å²	138	91%	0.909	77%	0.765	S	S	*	*			trans	95.9	112.3	172.5	-167.3	0	0	0	0	116
647	A	23.7	Very low	27.9	Very low	82 Å²	82	136.7 Å²	136.7	68%	0.678	75%	0.753	S	S	*	*			trans	-37.5	144.7	167.3	0	0	0	0	0	116.3
648	I	27.6	Very low	28.7	Very low	163 Å²	163	133.5 Å²	133.5	84%	0.836	73%	0.727	S	S	*	*				-160.6	130.1	128.3	-84.8	135.1	0	0	0	106.9
649	H	24	Very low	30	Very low	193 Å²	193	126.1 Å²	126.1	89%	0.894	70%	0.695	S	S	*	*			trans	-68.4	127.7	168.5	-71.2	-90.7	0	0	0	110
650	S	26	Very low	31.7	Very low	107 Å²	107	122.8 Å²	122.8	75%	0.748	69%	0.691	S	S	*	*			trans	-146.6	108.1	152.6	65.4	0	0	0	0	109.8
651	S	24.2	Very low	33.7	Very low	119 Å²	119	118.2 Å²	118.2	83%	0.832	67%	0.666	S	S	*	*			trans	-65.7	117.4	162.7	48.3	0	0	0	0	110.5
652	S	27.7	Very low	36	Very low	96 Å²	96	113.8 Å²	113.8	67%	0.671	64%	0.635	S	S	*	*			trans	168.1	129.7	148.3	48.8	0	0	0	0	110.2
653	D	27	Very low	38.2	Very low	133 Å²	133	112.6 Å²	112.6	71%	0.711	62%	0.619	S	S	*	*			trans	65.2	83	156	-54.5	-24.7	0	0	0	117.4	N655	D653-N655 PolarHBondContact O-N 2.93Å
654	V	30.6	Very low	40.5	Very low	144 Å²	144	105.3 Å²	105.3	87%	0.873	59%	0.593	S	S	*	*			trans	-66.4	84.6	146.3	-175.9	0	0	0	0	106	Y656	V654-Y656 PolarHBondContact O-N 3.3Å
655	N	34.5	Very low	43	Very low	119 Å²	119	96.1 Å²	96.1	64%	0.636	55%	0.553	S	S	*	*			trans	-58.3	102.6	168	-92.1	-14.7	0	0	0	107.3	D653 E657	D653-N655 PolarHBondContact O-N 2.93Å; N655-E657 VanDerWaalsContact C-N 3.31Å; N655-E657 HydrophobicContact CB-CG 4.37Å; N655-E657 PolarHBondContact O-N 2.85Å
656	Y	34.5	Very low	45.7	Very low	97 Å²	97	93.5 Å²	93.5	38%	0.38	52%	0.521	S	S	.	.			trans	-72.4	89.7	171.8	-165.6	-88.9	0	0	0	107.2	V654 F658	V654-Y656 PolarHBondContact O-N 3.3Å; Y656-F658 AromaticContact CD1-CD2 3.9Å; Y656-F658 HydrophobicContact CD1-CD2 3.9Å; Y656-F658 AromaticContact CD1-CE2 3.73Å; Y656-F658 HydrophobicContact CD1-CE2 3.73Å; Y656-F658 HydrophobicContact CD1-CZ 4.3Å; Y656-F658 HydrophobicContact CE1-CD2 4.23Å; Y656-F658 HydrophobicContact CE1-CE1 4.43Å; Y656-F658 HydrophobicContact CE1-CE2 4.03Å; Y656-F658 HydrophobicContact CE1-CZ 4.17Å; Y656-F658 PolarHBondContact O-N 3.49Å
657	E	39.7	Very low	48.2	Very low	132 Å²	132	90.6 Å²	90.6	62%	0.617	50%	0.501	S	S	*	.			trans	-81.7	107.3	-179.8	-70.8	-175.7	170.3	0	0	109.4	H632 N655	H632-E657 PolarHBondContact CD2-O 3.38Å; H632-E657 PolarHBondContact CE1-O 3.47Å; H632-E657 VanDerWaalsContact CE1-O 3.27Å; H632-E657 PolarHBondContact NE2-O 3.32Å; N655-E657 VanDerWaalsContact C-N 3.31Å; N655-E657 HydrophobicContact CB-CG 4.37Å; N655-E657 PolarHBondContact O-N 2.85Å
658	F	50	Low	50.9	Low	30 Å²	30	87.2 Å²	87.2	13%	0.132	47%	0.471	C	S	.	.			trans	-64.4	157	176.4	-70.8	-115.9	0	0	0	111.6	Y656 P691 S720 L723	Y656-F658 AromaticContact CD1-CD2 3.9Å; Y656-F658 HydrophobicContact CD1-CD2 3.9Å; Y656-F658 AromaticContact CD1-CE2 3.73Å; Y656-F658 HydrophobicContact CD1-CE2 3.73Å; Y656-F658 HydrophobicContact CD1-CZ 4.3Å; Y656-F658 HydrophobicContact CE1-CD2 4.23Å; Y656-F658 HydrophobicContact CE1-CE1 4.43Å; Y656-F658 HydrophobicContact CE1-CE2 4.03Å; Y656-F658 HydrophobicContact CE1-CZ 4.17Å; Y656-F658 PolarHBondContact O-N 3.49Å; F658-P691 HydrophobicContact CE1-CG 4.36Å; F658-P691 HydrophobicContact CE2-CG 4.36Å; F658-P691 HydrophobicContact CZ-CG 3.57Å; F658-S720 VanDerWaalsContact CD2-CB 3.46Å; F658-S720 WeakPolarHBondContact CD2-O 3.39Å; F658-S720 WeakPolarHBondContact CE2-O 3.47Å; F658-S720 WeakPolarHBondContact CZ-O 3.47Å; F658-L723 HydrophobicContact CD1-CB 4.21Å; F658-L723 HydrophobicContact CE1-CB 4Å
659	S	57	Low	53.5	Low	22 Å²	22	79.5 Å²	79.5	15%	0.154	43%	0.431	C	S	.	.			trans	-48	137.6	175.1	176.5	0	0	0	0	113	L629 Y661 A662	L629-S659 WeakPolarHBondContact O-CB 3.38Å; L629-S659 PolarHBondContact O-OG 3.48Å; S659-Y661 PolarHBondContact O-N 3.28Å; S659-Y661 WeakPolarHBondContact OG-CD2 3.48Å; S659-Y661 PolarHBondContact OG-N 3.39Å; S659-A662 VanDerWaalsContact O-CB 3.28Å; S659-A662 WeakPolarHBondContact O-CB 3.42Å; S659-A662 PolarHBondContact O-N 2.85Å
660	V	62.3	Low	56.1	Low	125 Å²	125	71.5 Å²	71.5	76%	0.758	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-22.8	173	-178.4	0	0	0	0	111.6
661	Y	67.7	Low	58.7	Low	90 Å²	90	69.5 Å²	69.5	35%	0.353	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	3.8	-179.6	-53	-65.2	0	0	0	114.3	L596 L629 S659 E663 L664 V665	L596-Y661 HydrophobicContact CB-CE1 4.45Å; L596-Y661 HydrophobicContact CD1-CD1 4.09Å; L596-Y661 HydrophobicContact CD1-CD2 4.49Å; L596-Y661 HydrophobicContact CD1-CE1 3.37Å; L596-Y661 HydrophobicContact CD1-CE2 3.85Å; L596-Y661 VanDerWaalsContact CD1-OH 3.3Å; L596-Y661 WeakPolarHBondContact CD1-OH 3.37Å; L629-Y661 HydrophobicContact CD2-CD2 3.64Å; L629-Y661 HydrophobicContact CD2-CE2 4.14Å; L629-Y661 HydrophobicContact CD2-CG 4.02Å; S659-Y661 PolarHBondContact O-N 3.28Å; S659-Y661 WeakPolarHBondContact OG-CD2 3.48Å; S659-Y661 PolarHBondContact OG-N 3.39Å; Y661-E663 VanDerWaalsContact C-N 3.27Å; Y661-E663 PolarHBondContact O-N 3.48Å; Y661-L664 HydrophobicContact CD1-CD1 3.91Å; Y661-L664 WeakPolarHBondContact O-CB 3.1Å; Y661-L664 PolarHBondContact O-N 2.9Å; Y661-V665 PolarHBondContact O-N 2.92Å
662	A	70.2	Confident	61.3	Low	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-56.3	-38.4	-179.3	0	0	0	0	0	113	S659 V665 W666 P719 L723	S659-A662 VanDerWaalsContact O-CB 3.28Å; S659-A662 WeakPolarHBondContact O-CB 3.42Å; S659-A662 PolarHBondContact O-N 2.85Å; A662-V665 PolarHBondContact O-N 3.26Å; A662-W666 WeakPolarHBondContact O-CB 3.31Å; A662-W666 PolarHBondContact O-N 2.95Å; A662-P719 HydrophobicContact CB-CB 4.37Å; A662-P719 WeakPolarHBondContact CB-O 3.39Å; A662-L723 HydrophobicContact CB-CD1 3.76Å; A662-L723 HydrophobicContact CB-CG 4.17Å
663	E	73	Confident	63.7	Low	98 Å²	98	59.7 Å²	59.7	46%	0.458	30%	0.304	S	S	.	.	H	α-helix	trans	-62.9	-40.6	174.4	-75.8	-179.4	-168.4	0	0	112.6	Y661 W666 N667 I722	Y661-E663 VanDerWaalsContact C-N 3.27Å; Y661-E663 PolarHBondContact O-N 3.48Å; E663-W666 PolarHBondContact O-N 2.71Å; E663-N667 WeakPolarHBondContact O-CB 3.24Å; E663-N667 PolarHBondContact O-N 2.96Å; E663-N667 PolarHBondContact O-ND2 3.46Å; E663-N667 VanDerWaalsContact O-ND2 3.15Å; E663-I722 HydrophobicContact CG-CD1 3.4Å
664	L	75.4	Confident	66.3	Low	47 Å²	47	62 Å²	62	25%	0.246	30%	0.303	C	S	.	.	H	α-helix	trans	-64.4	-49.1	176.3	-67.3	177.4	0	0	0	110.1	L600 Y661 W666 N667 H668	L600-L664 HydrophobicContact CD1-CB 4.41Å; L600-L664 HydrophobicContact CD1-CD1 4.46Å; Y661-L664 HydrophobicContact CD1-CD1 3.91Å; Y661-L664 WeakPolarHBondContact O-CB 3.1Å; Y661-L664 PolarHBondContact O-N 2.9Å; L664-W666 VanDerWaalsContact C-N 3.27Å; L664-W666 PolarHBondContact O-N 2.98Å; L664-N667 PolarHBondContact O-N 2.81Å; L664-N667 VanDerWaalsContact O-N 3.15Å; L664-H668 PolarHBondContact O-CD2 3.33Å; L664-H668 PolarHBondContact O-N 3.47Å
665	V	78.6	Confident	68.7	Low	0 Å²	0	58 Å²	58	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.7	-42.9	178	178.4	0	0	0	0	110.9	L626 L629 Y661 A662 H668 F669 F688 L723	L626-V665 HydrophobicContact CD2-CG2 4.21Å; L629-V665 HydrophobicContact CB-CG2 4.1Å; Y661-V665 PolarHBondContact O-N 2.92Å; A662-V665 PolarHBondContact O-N 3.26Å; V665-H668 PolarHBondContact O-N 2.6Å; V665-F669 WeakPolarHBondContact O-CB 3.42Å; V665-F669 PolarHBondContact O-N 3.03Å; V665-F688 HydrophobicContact CG1-CE1 3.52Å; V665-F688 HydrophobicContact CG1-CZ 3.93Å; V665-L723 HydrophobicContact CG1-CD2 4.22Å
666	W	78.9	Confident	70.7	Confident	16 Å²	16	58 Å²	58	6%	0.061	28%	0.279	C	S	.	.	H	α-helix	trans	-61	-45.9	175.5	-177.2	-113.4	0	0	0	112.9	A662 E663 L664 H668 F669 M670 I722 L723 H727 I728 S731	A662-W666 WeakPolarHBondContact O-CB 3.31Å; A662-W666 PolarHBondContact O-N 2.95Å; E663-W666 PolarHBondContact O-N 2.71Å; L664-W666 VanDerWaalsContact C-N 3.27Å; L664-W666 PolarHBondContact O-N 2.98Å; W666-H668 VanDerWaalsContact C-N 3.34Å; W666-H668 PolarHBondContact O-N 2.87Å; W666-F669 AromaticContact CE3-CD1 3.85Å; W666-F669 HydrophobicContact CE3-CD1 3.85Å; W666-F669 HydrophobicContact CE3-CE1 4.5Å; W666-F669 HydrophobicContact CH2-CD1 4.12Å; W666-F669 HydrophobicContact CH2-CE1 4.08Å; W666-F669 AromaticContact CZ3-CD1 3.52Å; W666-F669 HydrophobicContact CZ3-CD1 3.52Å; W666-F669 AromaticContact CZ3-CE1 3.73Å; W666-F669 HydrophobicContact CZ3-CE1 3.73Å; W666-F669 WeakPolarHBondContact O-CB 3.47Å; W666-F669 PolarHBondContact O-N 3.02Å; W666-M670 HydrophobicContact CD2-CG 4.06Å; W666-M670 HydrophobicContact CG-CG 4.44Å; W666-M670 HydrophobicContact CH2-CG 4.4Å; W666-M670 HydrophobicContact CH2-SD 3.93Å; W666-M670 HydrophobicContact CZ2-CG 3.8Å; W666-M670 HydrophobicContact CZ2-SD 3.61Å; W666-M670 WeakPolarHBondContact O-CB 3.27Å; W666-M670 WeakPolarHBondContact O-CG 3.48Å; W666-M670 PolarHBondContact O-N 3.42Å; W666-I722 HydrophobicContact CB-CG2 3.45Å; W666-I722 VanDerWaalsContact CB-CG2 3.45Å; W666-I722 HydrophobicContact CD2-CG2 3.57Å; W666-I722 HydrophobicContact CE3-CG2 4.15Å; W666-I722 HydrophobicContact CG-CG2 3.22Å; W666-L723 HydrophobicContact CE3-CD2 4.47Å; W666-H727 AromaticContact CE2-NE2 3.78Å; W666-H727 AromaticContact CH2-CD2 3.89Å; W666-H727 AromaticContact CZ2-CD2 3.66Å; W666-H727 AromaticContact CZ2-NE2 3.49Å; W666-H727 WeakPolarHBondContact CZ2-NE2 3.38Å; W666-I728 HydrophobicContact CH2-CG1 4.46Å; W666-I728 HydrophobicContact CZ3-CG1 3.92Å; W666-S731 VanDerWaalsContact CH2-OG 3.25Å; W666-S731 WeakPolarHBondContact CH2-OG 3.46Å
667	N	80.7	Confident	72.7	Confident	90 Å²	90	56.2 Å²	56.2	48%	0.481	27%	0.274	S	S	.	.	H	α-helix	trans	-61.2	-43.4	178	-72.1	-26.9	0	0	0	111.5	E663 L664 M670 Q671	E663-N667 WeakPolarHBondContact O-CB 3.24Å; E663-N667 PolarHBondContact O-N 2.96Å; E663-N667 PolarHBondContact O-ND2 3.46Å; E663-N667 VanDerWaalsContact O-ND2 3.15Å; L664-N667 PolarHBondContact O-N 2.81Å; L664-N667 VanDerWaalsContact O-N 3.15Å; N667-M670 PolarHBondContact O-N 3.13Å; N667-Q671 WeakPolarHBondContact O-CB 3.39Å; N667-Q671 PolarHBondContact O-N 3.42Å
668	H	80.4	Confident	74.3	Confident	11 Å²	11	55 Å²	55	5%	0.051	27%	0.268	C	S	.	.	H	α-helix	trans	-65.2	-37.8	176.3	-80.1	-88.7	0	0	0	112.2	L600 Y622 L626 L664 V665 W666 A672	L600-H668 WeakPolarHBondContact CB-NE2 3.29Å; Y622-H668 AromaticContact CZ-ND1 3.92Å; Y622-H668 PolarHBondContact OH-ND1 2.92Å; L626-H668 HydrophobicContact CD1-CB 4.31Å; L626-H668 HydrophobicContact CD2-CB 4.3Å; L664-H668 PolarHBondContact O-CD2 3.33Å; L664-H668 PolarHBondContact O-N 3.47Å; V665-H668 PolarHBondContact O-N 2.6Å; W666-H668 VanDerWaalsContact C-N 3.34Å; W666-H668 PolarHBondContact O-N 2.87Å; H668-A672 PolarHBondContact O-N 3.36Å
669	F	80.9	Confident	75.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-51.2	173.1	172.7	-107.1	0	0	0	112.3	V665 W666 Q671 A672 L673 A681 L684 M685 F688 L732	V665-F669 WeakPolarHBondContact O-CB 3.42Å; V665-F669 PolarHBondContact O-N 3.03Å; W666-F669 AromaticContact CE3-CD1 3.85Å; W666-F669 HydrophobicContact CE3-CD1 3.85Å; W666-F669 HydrophobicContact CE3-CE1 4.5Å; W666-F669 HydrophobicContact CH2-CD1 4.12Å; W666-F669 HydrophobicContact CH2-CE1 4.08Å; W666-F669 AromaticContact CZ3-CD1 3.52Å; W666-F669 HydrophobicContact CZ3-CD1 3.52Å; W666-F669 AromaticContact CZ3-CE1 3.73Å; W666-F669 HydrophobicContact CZ3-CE1 3.73Å; W666-F669 WeakPolarHBondContact O-CB 3.47Å; W666-F669 PolarHBondContact O-N 3.02Å; F669-Q671 VanDerWaalsContact C-N 3.27Å; F669-Q671 PolarHBondContact O-N 3.16Å; F669-A672 WeakPolarHBondContact O-CB 3.5Å; F669-A672 PolarHBondContact O-N 2.81Å; F669-L673 HydrophobicContact CD1-CD1 4.23Å; F669-L673 HydrophobicContact CE1-CD1 3.65Å; F669-L673 HydrophobicContact CE2-CD1 4.19Å; F669-L673 HydrophobicContact CZ-CD1 3.64Å; F669-L673 HydrophobicContact CZ-CG 4.41Å; F669-L673 PolarHBondContact O-N 3.48Å; F669-L673 VanDerWaalsContact O-N 3.17Å; F669-A681 HydrophobicContact CD2-CB 4.24Å; F669-A681 HydrophobicContact CE2-CB 3.95Å; F669-A681 WeakPolarHBondContact CE2-O 3.28Å; F669-L684 HydrophobicContact CD2-CB 4.41Å; F669-M685 HydrophobicContact CE2-CB 3.87Å; F669-M685 HydrophobicContact CE2-CG 4.46Å; F669-M685 HydrophobicContact CZ-CB 4.31Å; F669-M685 HydrophobicContact CZ-CG 4.42Å; F669-M685 HydrophobicContact CZ-SD 4.41Å; F669-F688 HydrophobicContact CB-CZ 4.35Å; F669-F688 HydrophobicContact CD2-CE2 4.17Å; F669-F688 HydrophobicContact CD2-CZ 4.42Å; F669-F688 HydrophobicContact CG-CE2 4.29Å; F669-F688 HydrophobicContact CG-CZ 4.43Å; F669-L732 HydrophobicContact CE1-CD2 4.23Å; F669-L732 HydrophobicContact CZ-CD1 4.26Å; F669-L732 HydrophobicContact CZ-CD2 4.19Å
670	M	79.1	Confident	76.7	Confident	25 Å²	25	59.4 Å²	59.4	12%	0.123	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-34.5	178.4	-71.3	-57.8	-67.9	0	0	112	W666 N667 L673 R674	W666-M670 HydrophobicContact CD2-CG 4.06Å; W666-M670 HydrophobicContact CG-CG 4.44Å; W666-M670 HydrophobicContact CH2-CG 4.4Å; W666-M670 HydrophobicContact CH2-SD 3.93Å; W666-M670 HydrophobicContact CZ2-CG 3.8Å; W666-M670 HydrophobicContact CZ2-SD 3.61Å; W666-M670 WeakPolarHBondContact O-CB 3.27Å; W666-M670 WeakPolarHBondContact O-CG 3.48Å; W666-M670 PolarHBondContact O-N 3.42Å; N667-M670 PolarHBondContact O-N 3.13Å; M670-L673 PolarHBondContact O-N 3.18Å; M670-L673 HydrophobicContact SD-CD1 4.21Å; M670-R674 VanDerWaalsContact O-CG 3.31Å; M670-R674 WeakPolarHBondContact O-CG 3.47Å; M670-R674 PolarHBondContact O-N 2.86Å
671	Q	79.8	Confident	77.5	Confident	66 Å²	66	53.5 Å²	53.5	31%	0.308	25%	0.254	S	S	.	.	H	α-helix	trans	-69.9	-38.3	175.6	-166.5	171.9	5.9	0	0	112.1	N667 F669 L673 R674 T675	N667-Q671 WeakPolarHBondContact O-CB 3.39Å; N667-Q671 PolarHBondContact O-N 3.42Å; F669-Q671 VanDerWaalsContact C-N 3.27Å; F669-Q671 PolarHBondContact O-N 3.16Å; Q671-L673 VanDerWaalsContact C-N 3.29Å; Q671-L673 PolarHBondContact O-N 3.14Å; Q671-R674 PolarHBondContact O-N 3.37Å; Q671-T675 HydrophobicContact CG-CG2 4.39Å; Q671-T675 WeakPolarHBondContact O-CG2 3.1Å; Q671-T675 PolarHBondContact O-N 3.41Å; Q671-T675 PolarHBondContact O-OG1 2.83Å
672	A	80.2	Confident	77.9	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-60.4	-38.4	173.9	0	0	0	0	0	112.4	Y608 H668 F669 T675 N676 H677 A681	Y608-A672 WeakPolarHBondContact OH-CA 3.46Å; Y608-A672 PolarHBondContact OH-N 2.9Å; H668-A672 PolarHBondContact O-N 3.36Å; F669-A672 WeakPolarHBondContact O-CB 3.5Å; F669-A672 PolarHBondContact O-N 2.81Å; A672-T675 PolarHBondContact O-OG1 3.48Å; A672-N676 PolarHBondContact O-N 3.05Å; A672-H677 PolarHBondContact O-N 2.99Å; A672-A681 HydrophobicContact CB-CB 4.25Å
673	L	78	Confident	78.2	Confident	7 Å²	7	55.5 Å²	55.5	4%	0.037	27%	0.266	C	S	.	.	H	α-helix	trans	-67.4	-43	173.3	-68.9	171.6	0	0	0	112.3	F669 M670 Q671 T675 N676 A681 L732 Y736 M739	F669-L673 HydrophobicContact CD1-CD1 4.23Å; F669-L673 HydrophobicContact CE1-CD1 3.65Å; F669-L673 HydrophobicContact CE2-CD1 4.19Å; F669-L673 HydrophobicContact CZ-CD1 3.64Å; F669-L673 HydrophobicContact CZ-CG 4.41Å; F669-L673 PolarHBondContact O-N 3.48Å; F669-L673 VanDerWaalsContact O-N 3.17Å; M670-L673 PolarHBondContact O-N 3.18Å; M670-L673 HydrophobicContact SD-CD1 4.21Å; Q671-L673 VanDerWaalsContact C-N 3.29Å; Q671-L673 PolarHBondContact O-N 3.14Å; L673-T675 VanDerWaalsContact C-N 3.33Å; L673-T675 PolarHBondContact O-N 2.99Å; L673-N676 PolarHBondContact O-N 3.03Å; L673-A681 HydrophobicContact CD2-CB 3.57Å; L673-A681 HydrophobicContact CG-CB 3.9Å; L673-L732 HydrophobicContact CD1-CD2 3.5Å; L673-L732 VanDerWaalsContact CD1-CD2 3.5Å; L673-Y736 HydrophobicContact CB-CD2 4.43Å; L673-Y736 HydrophobicContact CB-CE1 4.41Å; L673-Y736 HydrophobicContact CB-CE2 3.83Å; L673-Y736 HydrophobicContact CD1-CD2 4.11Å; L673-Y736 HydrophobicContact CD1-CE2 4.15Å; L673-Y736 HydrophobicContact CG-CE2 4.46Å; L673-Y736 PolarHBondContact O-OH 2.75Å; L673-M739 HydrophobicContact CD2-CE 4.43Å; L673-M739 HydrophobicContact CD2-CG 4.37Å
674	R	80.6	Confident	78.2	Confident	183 Å²	183	50.9 Å²	50.9	69%	0.691	25%	0.245	S	C	*	.	H	α-helix	trans	-65.3	-33.9	177.6	-73	174.8	-175.9	-178	4	112.8	M670 Q671 N676	M670-R674 VanDerWaalsContact O-CG 3.31Å; M670-R674 WeakPolarHBondContact O-CG 3.47Å; M670-R674 PolarHBondContact O-N 2.86Å; Q671-R674 PolarHBondContact O-N 3.37Å; R674-N676 VanDerWaalsContact C-N 3.34Å
675	T	81.2	Confident	78.4	Confident	58 Å²	58	48.7 Å²	48.7	36%	0.356	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	9.1	179.4	61.5	0	0	0	0	113.9	Y608 Q671 A672 L673 H677	Y608-T675 HydrophobicContact CE2-CG2 4.03Å; Y608-T675 WeakPolarHBondContact CE2-OG1 3.41Å; Q671-T675 HydrophobicContact CG-CG2 4.39Å; Q671-T675 WeakPolarHBondContact O-CG2 3.1Å; Q671-T675 PolarHBondContact O-N 3.41Å; Q671-T675 PolarHBondContact O-OG1 2.83Å; A672-T675 PolarHBondContact O-OG1 3.48Å; L673-T675 VanDerWaalsContact C-N 3.33Å; L673-T675 PolarHBondContact O-N 2.99Å; T675-H677 VanDerWaalsContact C-N 3.32Å; T675-H677 PolarHBondContact O-N 3.13Å; T675-H677 PolarHBondContact O-ND1 3.09Å; T675-H677 PolarHBondContact OG1-ND1 3.08Å
676	N	76	Confident	78.1	Confident	121 Å²	121	50.7 Å²	50.7	65%	0.647	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	64	27.4	176.6	-154	40.4	0	0	0	115.1	A672 L673 R674 E678	A672-N676 PolarHBondContact O-N 3.05Å; L673-N676 PolarHBondContact O-N 3.03Å; R674-N676 VanDerWaalsContact C-N 3.34Å; N676-E678 VanDerWaalsContact C-N 3.28Å; N676-E678 PolarHBondContact O-N 3.24Å
677	H	76.9	Confident	77.9	Confident	58 Å²	58	54.9 Å²	54.9	27%	0.269	26%	0.26	S	S	.	.			trans	-89.7	61.5	172.1	-66.3	87.5	0	0	0	110.5	Y608 A672 T675 I679 I680 A681	Y608-H677 AromaticContact CD1-CD2 3.92Å; Y608-H677 AromaticContact CD1-CE1 3.59Å; Y608-H677 AromaticContact CD1-ND1 3.82Å; Y608-H677 AromaticContact CD1-NE2 3.66Å; Y608-H677 AromaticContact CD2-CE1 3.98Å; Y608-H677 HydrophobicContact CE1-CB 4.34Å; Y608-H677 AromaticContact CE1-CE1 3.96Å; Y608-H677 AromaticContact CE1-CG 3.84Å; Y608-H677 AromaticContact CE1-ND1 3.7Å; Y608-H677 AromaticContact CG-CE1 3.64Å; Y608-H677 AromaticContact CG-NE2 3.95Å; Y608-H677 AromaticContact CZ-ND1 3.93Å; A672-H677 PolarHBondContact O-N 2.99Å; T675-H677 VanDerWaalsContact C-N 3.32Å; T675-H677 PolarHBondContact O-N 3.13Å; T675-H677 PolarHBondContact O-ND1 3.09Å; T675-H677 PolarHBondContact OG1-ND1 3.08Å; H677-I679 VanDerWaalsContact C-N 3.26Å; H677-I679 PolarHBondContact O-N 3.27Å; H677-I680 HydrophobicContact CB-CB 4.49Å; H677-I680 HydrophobicContact CB-CD1 4.08Å; H677-I680 HydrophobicContact CB-CG1 4.46Å; H677-I680 PolarHBondContact O-N 3.5Å; H677-I680 VanDerWaalsContact O-N 3.13Å; H677-A681 PolarHBondContact O-N 3.34Å
678	E	74.8	Confident	77.6	Confident	106 Å²	106	51 Å²	51	50%	0.495	24%	0.239	S	C	.	.	H	α-helix	trans	-56.3	-36.6	-171.7	-64.5	-173.9	157.4	0	0	113.1	N676 I680 A681 E682	N676-E678 VanDerWaalsContact C-N 3.28Å; N676-E678 PolarHBondContact O-N 3.24Å; E678-I680 VanDerWaalsContact C-N 3.34Å; E678-I680 PolarHBondContact O-N 2.98Å; E678-A681 PolarHBondContact O-N 3.03Å; E678-E682 WeakPolarHBondContact O-CB 3.5Å; E678-E682 PolarHBondContact O-N 2.66Å
679	I	78.4	Confident	77	Confident	132 Å²	132	52.3 Å²	52.3	68%	0.677	25%	0.248	S	C	*	.	H	α-helix	trans	-61.9	-41.1	-179.4	-59.2	171.1	0	0	0	111.6	H677 Q683	H677-I679 VanDerWaalsContact C-N 3.26Å; H677-I679 PolarHBondContact O-N 3.27Å; I679-Q683 WeakPolarHBondContact O-CG 3.23Å; I679-Q683 PolarHBondContact O-N 2.8Å
680	I	78.2	Confident	76.3	Confident	14 Å²	14	54.6 Å²	54.6	7%	0.072	26%	0.26	C	S	.	.	H	α-helix	trans	-71.5	-44.9	-179.2	-60.8	174.3	0	0	0	109.6	V607 Y608 V619 I623 H677 E678 E682 Q683 L684	V607-I680 HydrophobicContact CG1-CD1 3.33Å; Y608-I680 HydrophobicContact CE1-CD1 4.32Å; V619-I680 HydrophobicContact CG1-CD1 3.93Å; V619-I680 HydrophobicContact CG1-CG1 3.83Å; I623-I680 HydrophobicContact CD1-CG2 4.47Å; I623-I680 HydrophobicContact CG1-CG2 4.44Å; H677-I680 HydrophobicContact CB-CB 4.49Å; H677-I680 HydrophobicContact CB-CD1 4.08Å; H677-I680 HydrophobicContact CB-CG1 4.46Å; H677-I680 PolarHBondContact O-N 3.5Å; H677-I680 VanDerWaalsContact O-N 3.13Å; E678-I680 VanDerWaalsContact C-N 3.34Å; E678-I680 PolarHBondContact O-N 2.98Å; I680-E682 VanDerWaalsContact C-N 3.28Å; I680-E682 PolarHBondContact O-N 3.05Å; I680-Q683 PolarHBondContact O-N 3.38Å; I680-L684 HydrophobicContact CG2-CD1 4.08Å; I680-L684 WeakPolarHBondContact O-CG 3.46Å; I680-L684 PolarHBondContact O-N 3.41Å
681	A	78.2	Confident	75.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-42	176	0	0	0	0	0	111	F669 A672 L673 H677 E678 L684 M685 M739	F669-A681 HydrophobicContact CD2-CB 4.24Å; F669-A681 HydrophobicContact CE2-CB 3.95Å; F669-A681 WeakPolarHBondContact CE2-O 3.28Å; A672-A681 HydrophobicContact CB-CB 4.25Å; L673-A681 HydrophobicContact CD2-CB 3.57Å; L673-A681 HydrophobicContact CG-CB 3.9Å; H677-A681 PolarHBondContact O-N 3.34Å; E678-A681 PolarHBondContact O-N 3.03Å; A681-L684 PolarHBondContact O-N 3.02Å; A681-M685 WeakPolarHBondContact O-CB 3.49Å; A681-M685 PolarHBondContact O-N 3Å; A681-M739 HydrophobicContact CB-CE 4.08Å
682	E	76.5	Confident	74.4	Confident	67 Å²	67	54.8 Å²	54.8	31%	0.313	27%	0.271	S	S	.	.	H	α-helix	trans	-62.6	-47.7	175.8	-171	178.2	-175.7	0	0	112.3	E678 I680 L684 M685 L686 M739	E678-E682 WeakPolarHBondContact O-CB 3.5Å; E678-E682 PolarHBondContact O-N 2.66Å; I680-E682 VanDerWaalsContact C-N 3.28Å; I680-E682 PolarHBondContact O-N 3.05Å; E682-L684 PolarHBondContact O-N 3.11Å; E682-M685 PolarHBondContact O-N 2.89Å; E682-L686 HydrophobicContact CG-CD1 3.75Å; E682-L686 HydrophobicContact CG-CG 4.23Å; E682-L686 WeakPolarHBondContact O-CB 3.23Å; E682-L686 WeakPolarHBondContact O-CG 3.47Å; E682-L686 PolarHBondContact O-N 3.14Å; E682-M739 HydrophobicContact CB-CE 3.72Å; E682-M739 HydrophobicContact CB-SD 4.3Å; E682-M739 HydrophobicContact CG-CE 4.4Å
683	Q	75.8	Confident	73.2	Confident	65 Å²	65	58.3 Å²	58.3	30%	0.304	30%	0.296	S	S	.	.	H	α-helix	trans	-62	-41.5	178	-71.9	-64.3	-42.4	0	0	112.7	I623 I679 I680 R687	I623-Q683 HydrophobicContact CD1-CB 3.83Å; I623-Q683 HydrophobicContact CD1-CG 4.44Å; I679-Q683 WeakPolarHBondContact O-CG 3.23Å; I679-Q683 PolarHBondContact O-N 2.8Å; I680-Q683 PolarHBondContact O-N 3.38Å; Q683-R687 WeakPolarHBondContact O-CB 3.39Å; Q683-R687 VanDerWaalsContact O-CG 3.23Å; Q683-R687 WeakPolarHBondContact O-CG 3.49Å; Q683-R687 PolarHBondContact O-N 3.24Å; Q683-R687 VanDerWaalsContact OE1-NH2 3.12Å
684	L	74.9	Confident	72.3	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-50.2	175.8	-74.4	170	0	0	0	111.2	I623 L626 F669 I680 A681 E682 L686 R687 F688	I623-L684 HydrophobicContact CB-CD2 4.44Å; I623-L684 HydrophobicContact CG1-CD2 4.35Å; I623-L684 HydrophobicContact CG1-CG 4.44Å; I623-L684 HydrophobicContact CG2-CD2 4.02Å; L626-L684 HydrophobicContact CB-CD2 3.85Å; L626-L684 HydrophobicContact CD1-CD1 3.87Å; L626-L684 HydrophobicContact CD1-CD2 3.86Å; F669-L684 HydrophobicContact CD2-CB 4.41Å; I680-L684 HydrophobicContact CG2-CD1 4.08Å; I680-L684 WeakPolarHBondContact O-CG 3.46Å; I680-L684 PolarHBondContact O-N 3.41Å; A681-L684 PolarHBondContact O-N 3.02Å; E682-L684 PolarHBondContact O-N 3.11Å; L684-L686 VanDerWaalsContact C-N 3.34Å; L684-L686 PolarHBondContact O-N 3.01Å; L684-R687 PolarHBondContact O-N 3.43Å; L684-R687 VanDerWaalsContact O-N 3.1Å; L684-F688 HydrophobicContact CB-CE1 4.31Å; L684-F688 HydrophobicContact CB-CE2 4.36Å; L684-F688 HydrophobicContact CB-CZ 3.91Å; L684-F688 WeakPolarHBondContact O-CD2 3.49Å; L684-F688 VanDerWaalsContact O-CG 3.3Å; L684-F688 WeakPolarHBondContact O-CG 3.45Å; L684-F688 PolarHBondContact O-N 2.62Å
685	M	78.8	Confident	70.9	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-60.5	-40.7	-177.4	-175.4	-175.2	73	0	0	112.9	F669 A681 E682 R687 L732 M739 T742 Y743	F669-M685 HydrophobicContact CE2-CB 3.87Å; F669-M685 HydrophobicContact CE2-CG 4.46Å; F669-M685 HydrophobicContact CZ-CB 4.31Å; F669-M685 HydrophobicContact CZ-CG 4.42Å; F669-M685 HydrophobicContact CZ-SD 4.41Å; A681-M685 WeakPolarHBondContact O-CB 3.49Å; A681-M685 PolarHBondContact O-N 3Å; E682-M685 PolarHBondContact O-N 2.89Å; M685-R687 VanDerWaalsContact C-N 3.31Å; M685-L732 HydrophobicContact SD-CD1 3.76Å; M685-M739 HydrophobicContact CE-CE 3.78Å; M685-M739 HydrophobicContact CE-SD 4.45Å; M685-M739 HydrophobicContact SD-CE 4.06Å; M685-T742 WeakPolarHBondContact CE-OG1 3.46Å; M685-Y743 HydrophobicContact CE-CD2 4.25Å; M685-Y743 HydrophobicContact CE-CG 4.32Å; M685-Y743 HydrophobicContact CG-CD2 3.42Å; M685-Y743 VanDerWaalsContact CG-CD2 3.42Å; M685-Y743 HydrophobicContact CG-CE2 3.94Å; M685-Y743 HydrophobicContact CG-CG 3.92Å; M685-Y743 WeakPolarHBondContact O-CE2 3.43Å; M685-Y743 HydrophobicContact SD-CD2 4.03Å; M685-Y743 HydrophobicContact SD-CG 3.96Å
686	L	72	Confident	69.3	Low	43 Å²	43	58 Å²	58	23%	0.225	30%	0.304	C	S	.	.	H	α-helix	trans	-72.4	-24.7	178.4	-67.2	176	0	0	0	112.8	E682 L684 H746	E682-L686 HydrophobicContact CG-CD1 3.75Å; E682-L686 HydrophobicContact CG-CG 4.23Å; E682-L686 WeakPolarHBondContact O-CB 3.23Å; E682-L686 WeakPolarHBondContact O-CG 3.47Å; E682-L686 PolarHBondContact O-N 3.14Å; L684-L686 VanDerWaalsContact C-N 3.34Å; L684-L686 PolarHBondContact O-N 3.01Å; L686-H746 HydrophobicContact CD2-CB 3.35Å; L686-H746 VanDerWaalsContact CD2-CG 3.49Å; L686-H746 PolarHBondContact O-CE1 3.19Å; L686-H746 PolarHBondContact O-NE2 3.27Å
687	R	74.6	Confident	67.8	Low	103 Å²	103	54.6 Å²	54.6	39%	0.389	29%	0.289	S	S	.	.	H	α-helix	trans	-101.4	-4.7	-176.4	-65.5	-179.8	-173.7	-163.6	14.8	114.1	E620 L627 Q683 L684 M685	E620-R687 IonicContact OE1-CZ 3.27Å; E620-R687 IonicContact OE1-NH1 3.45Å; E620-R687 PolarHBondContact OE1-NH1 3.46Å; E620-R687 IonicContact OE1-NH2 3.14Å; E620-R687 PolarHBondContact OE1-NH2 3.49Å; E620-R687 VanDerWaalsContact OE1-NH2 3.08Å; E620-R687 IonicContact OE2-NH2 3.1Å; L627-R687 HydrophobicContact CD1-CB 3.65Å; L627-R687 HydrophobicContact CD1-CG 4.3Å; L627-R687 HydrophobicContact CD2-CB 3.67Å; L627-R687 HydrophobicContact CG-CB 4.33Å; Q683-R687 WeakPolarHBondContact O-CB 3.39Å; Q683-R687 VanDerWaalsContact O-CG 3.23Å; Q683-R687 WeakPolarHBondContact O-CG 3.49Å; Q683-R687 PolarHBondContact O-N 3.24Å; Q683-R687 VanDerWaalsContact OE1-NH2 3.12Å; L684-R687 PolarHBondContact O-N 3.43Å; L684-R687 VanDerWaalsContact O-N 3.1Å; M685-R687 VanDerWaalsContact C-N 3.31Å
688	F	75.3	Confident	66.1	Low	8 Å²	8	56.2 Å²	56.2	4%	0.035	31%	0.307	C	S	.	.	S	Bend	trans	-59.4	139.4	176	-74.1	-39.8	0	0	0	112	L627 V665 F669 L684 I690 L723 I728	L627-F688 HydrophobicContact CD2-CD1 4.2Å; V665-F688 HydrophobicContact CG1-CE1 3.52Å; V665-F688 HydrophobicContact CG1-CZ 3.93Å; F669-F688 HydrophobicContact CB-CZ 4.35Å; F669-F688 HydrophobicContact CD2-CE2 4.17Å; F669-F688 HydrophobicContact CD2-CZ 4.42Å; F669-F688 HydrophobicContact CG-CE2 4.29Å; F669-F688 HydrophobicContact CG-CZ 4.43Å; L684-F688 HydrophobicContact CB-CE1 4.31Å; L684-F688 HydrophobicContact CB-CE2 4.36Å; L684-F688 HydrophobicContact CB-CZ 3.91Å; L684-F688 WeakPolarHBondContact O-CD2 3.49Å; L684-F688 VanDerWaalsContact O-CG 3.3Å; L684-F688 WeakPolarHBondContact O-CG 3.45Å; L684-F688 PolarHBondContact O-N 2.62Å; F688-I690 PolarHBondContact O-N 2.99Å; F688-L723 HydrophobicContact CD1-CD2 4.47Å; F688-L723 HydrophobicContact CE1-CD2 4.22Å; F688-L723 HydrophobicContact CE2-CD2 4.41Å; F688-L723 HydrophobicContact CZ-CD2 4.19Å; F688-I728 HydrophobicContact CD2-CD1 4.09Å
689	P	68	Low	64.6	Low	40 Å²	40	52.4 Å²	52.4	26%	0.26	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-65.1	127.5	179.9	25.2	-32	0	0	0	110.7	S630 P691	S630-P689 WeakPolarHBondContact OG-CD 3.29Å; P689-P691 WeakPolarHBondContact O-CD 3.19Å
690	I	65.4	Low	62.5	Low	47 Å²	47	54.8 Å²	54.8	24%	0.241	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-90.3	117.2	175.9	-55	168.9	0	0	0	108.2	F688 Y694 P725 L747 L751	F688-I690 PolarHBondContact O-N 2.99Å; I690-Y694 HydrophobicContact CG2-CD1 4.21Å; I690-Y694 HydrophobicContact CG2-CG 4.43Å; I690-P725 HydrophobicContact CG2-CG 4.33Å; I690-L747 HydrophobicContact CD1-CD2 3.7Å; I690-L747 HydrophobicContact CG1-CD2 4.2Å; I690-L751 HydrophobicContact CD1-CG 4.41Å; I690-L751 HydrophobicContact CG2-CD1 4.2Å; I690-L751 HydrophobicContact CG2-CD2 4.17Å
691	P	61.4	Low	60.5	Low	7 Å²	7	57.5 Å²	57.5	5%	0.045	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-62	140.7	179.9	-22.5	33.9	0	0	0	111.7	F658 P689 S693 Y694	F658-P691 HydrophobicContact CE1-CG 4.36Å; F658-P691 HydrophobicContact CE2-CG 4.36Å; F658-P691 HydrophobicContact CZ-CG 3.57Å; P689-P691 WeakPolarHBondContact O-CD 3.19Å; P691-S693 WeakPolarHBondContact CB-OG 3.32Å; P691-S693 PolarHBondContact O-N 3.14Å; P691-Y694 WeakPolarHBondContact O-CB 3.45Å; P691-Y694 PolarHBondContact O-N 3.02Å
692	S	57.1	Low	58.2	Low	89 Å²	89	61.9 Å²	61.9	62%	0.622	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-60.4	-30.6	173.4	53.7	0	0	0	0	112.5	Y694 I695	S692-Y694 PolarHBondContact O-N 3.03Å; S692-I695 WeakPolarHBondContact O-CB 3.49Å; S692-I695 WeakPolarHBondContact O-CG1 3.45Å; S692-I695 PolarHBondContact O-N 3.07Å
693	S	56.2	Low	56	Low	75 Å²	75	66 Å²	66	52%	0.524	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-62.4	-22.7	174.7	57.3	0	0	0	0	113.4	P691 I695 N696 S697	P691-S693 WeakPolarHBondContact CB-OG 3.32Å; P691-S693 PolarHBondContact O-N 3.14Å; S693-I695 PolarHBondContact O-N 3.26Å; S693-N696 PolarHBondContact O-N 2.91Å; S693-N696 VanDerWaalsContact O-N 3.11Å; S693-S697 WeakPolarHBondContact O-CB 3.49Å; S693-S697 PolarHBondContact O-N 3.41Å; S693-S697 VanDerWaalsContact O-N 3.09Å
694	Y	58.4	Low	54	Low	13 Å²	13	69.1 Å²	69.1	5%	0.051	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-60.1	-29.3	176.1	-169.7	-109.7	0	0	0	112.5	I690 P691 S692 N696 S697 P725 N726 L751 N758	I690-Y694 HydrophobicContact CG2-CD1 4.21Å; I690-Y694 HydrophobicContact CG2-CG 4.43Å; P691-Y694 WeakPolarHBondContact O-CB 3.45Å; P691-Y694 PolarHBondContact O-N 3.02Å; S692-Y694 PolarHBondContact O-N 3.03Å; Y694-N696 PolarHBondContact O-N 3.43Å; Y694-N696 VanDerWaalsContact O-N 3.14Å; Y694-S697 PolarHBondContact O-N 2.86Å; Y694-P725 HydrophobicContact CD1-CG 4.5Å; Y694-P725 HydrophobicContact CD2-CB 4.05Å; Y694-P725 HydrophobicContact CD2-CG 3.88Å; Y694-P725 HydrophobicContact CE1-CB 4.41Å; Y694-P725 HydrophobicContact CE2-CB 3.65Å; Y694-P725 HydrophobicContact CE2-CG 4.02Å; Y694-P725 HydrophobicContact CG-CG 4.13Å; Y694-N726 WeakPolarHBondContact CE2-OD1 3.41Å; Y694-L751 HydrophobicContact CD1-CD1 3.75Å; Y694-L751 HydrophobicContact CE1-CD1 3.89Å; Y694-N758 PolarHBondContact OH-ND2 3.43Å; Y694-N758 PolarHBondContact OH-OD1 3.3Å
695	I	51.4	Low	51.7	Low	84 Å²	84	72.8 Å²	72.8	43%	0.431	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-60.8	-26.1	179.7	-58.3	172.8	0	0	0	111.2	S692 S693	S692-I695 WeakPolarHBondContact O-CB 3.49Å; S692-I695 WeakPolarHBondContact O-CG1 3.45Å; S692-I695 PolarHBondContact O-N 3.07Å; S693-I695 PolarHBondContact O-N 3.26Å
696	N	47.4	Very low	49.4	Very low	144 Å²	144	81 Å²	81	77%	0.77	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.9	-0.1	-176.9	-65.9	-17.6	0	0	0	114.4	S693 Y694 S698	S693-N696 PolarHBondContact O-N 2.91Å; S693-N696 VanDerWaalsContact O-N 3.11Å; Y694-N696 PolarHBondContact O-N 3.43Å; Y694-N696 VanDerWaalsContact O-N 3.14Å; N696-S698 PolarHBondContact O-N 3.37Å
697	S	44.5	Very low	47.2	Very low	49 Å²	49	83 Å²	83	34%	0.343	47%	0.473	S	S	.	.			trans	-87.5	95.1	-177.5	159.3	0	0	0	0	110.5	S693 Y694 C699	S693-S697 WeakPolarHBondContact O-CB 3.49Å; S693-S697 PolarHBondContact O-N 3.41Å; S693-S697 VanDerWaalsContact O-N 3.09Å; Y694-S697 PolarHBondContact O-N 2.86Å; S697-C699 PolarHBondContact O-N 3.09Å
698	S	41	Very low	44.9	Very low	92 Å²	92	84.9 Å²	84.9	64%	0.643	50%	0.496	S	S	*	.			trans	-57.8	126	167.7	44.9	0	0	0	0	111.1	N696	N696-S698 PolarHBondContact O-N 3.37Å
699	C	43.7	Very low	42.8	Very low	26 Å²	26	89 Å²	89	18%	0.176	52%	0.522	C	S	.	.			trans	-105.7	101.7	174	-153.1	0	0	0	0	108.7	S697 L701 N726 E757	S697-C699 PolarHBondContact O-N 3.09Å; C699-L701 PolarHBondContact O-N 3.06Å; C699-N726 PolarHBondContact SG-ND2 3.26Å; C699-E757 VanDerWaalsContact O-OE1 3.05Å
700	E	34.4	Very low	41.1	Very low	183 Å²	183	95.5 Å²	95.5	86%	0.855	55%	0.549	S	S	*	.			trans	-63.3	88.3	159.2	-77.3	-172.7	164.6	0	0	107.6	S702	E700-S702 PolarHBondContact O-N 3.07Å
701	L	35.2	Very low	39.6	Very low	70 Å²	70	99.7 Å²	99.7	37%	0.366	58%	0.577	S	S	.	*			trans	-69.6	78	162.6	-77.9	166	0	0	0	106.1	C699 I703	C699-L701 PolarHBondContact O-N 3.06Å; L701-I703 PolarHBondContact O-N 2.97Å
702	S	30.6	Very low	38.8	Very low	93 Å²	93	102.8 Å²	102.8	65%	0.65	60%	0.599	S	S	*	*			trans	-57.1	103.2	171.3	56.9	0	0	0	0	107.7	E700 I704	E700-S702 PolarHBondContact O-N 3.07Å; S702-I704 PolarHBondContact O-N 3.37Å; S702-I704 VanDerWaalsContact O-N 3.08Å
703	I	31	Very low	38.1	Very low	154 Å²	154	103.7 Å²	103.7	79%	0.79	60%	0.596	S	S	*	*			trans	14	91.1	146.7	-52.4	168.3	0	0	0	111.1	L701 S705	L701-I703 PolarHBondContact O-N 2.97Å; I703-S705 PolarHBondContact O-N 3.1Å
704	I	31.7	Very low	37.5	Very low	129 Å²	129	106.6 Å²	106.6	66%	0.662	60%	0.601	S	S	*	*			trans	-69.6	88.3	166.3	-60.9	173.8	0	0	0	105.7	S702	S702-I704 PolarHBondContact O-N 3.37Å; S702-I704 VanDerWaalsContact O-N 3.08Å
705	S	27.9	Very low	37.1	Very low	79 Å²	79	111.3 Å²	111.3	55%	0.552	64%	0.636	S	S	*	*			trans	-65.5	135.8	151.3	51.7	0	0	0	0	107.8	I703 S707	I703-S705 PolarHBondContact O-N 3.1Å; S705-S707 PolarHBondContact O-N 3.28Å
706	D	29.4	Very low	37.2	Very low	172 Å²	172	111.5 Å²	111.5	92%	0.92	65%	0.645	S	S	*	*	S	Bend	trans	-46.4	94.6	177.6	-57.1	-53.1	0	0	0	112.5
707	S	27	Very low	37.5	Very low	87 Å²	87	106.8 Å²	106.8	61%	0.608	62%	0.619	S	S	*	*			trans	-141.5	93.8	168.4	66.4	0	0	0	0	110.4	S705 T709	S705-S707 PolarHBondContact O-N 3.28Å; S707-T709 PolarHBondContact O-N 3.23Å
708	T	25.2	Very low	38.1	Very low	141 Å²	141	106.3 Å²	106.3	87%	0.865	62%	0.619	S	S	*	*			trans	-49.6	96.1	166.9	49.9	0	0	0	0	111.7
709	T	30.8	Very low	38.6	Very low	95 Å²	95	104.4 Å²	104.4	58%	0.583	60%	0.604	S	S	*	*			trans	-148.2	70	163	48.5	0	0	0	0	109.9	S707 T711	S707-T709 PolarHBondContact O-N 3.23Å; T709-T711 PolarHBondContact O-N 3.05Å
710	E	33.1	Very low	39.3	Very low	177 Å²	177	105 Å²	105	83%	0.827	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	8.1	-178.9	-72.1	-167.3	154.4	0	0	115.2
711	T	34.5	Very low	40.7	Very low	135 Å²	135	100.9 Å²	100.9	83%	0.828	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.9	5.6	-165.8	47.2	0	0	0	0	116.6	T709	T709-T711 PolarHBondContact O-N 3.05Å
712	S	43.2	Very low	42.2	Very low	72 Å²	72	98.2 Å²	98.2	50%	0.503	58%	0.575	S	S	.	*	S	Bend	trans	-124.5	-14.3	-175.9	64.4	0	0	0	0	117.3	S715	S712-S715 PolarHBondContact O-OG 3.2Å
713	L	43	Very low	43.9	Very low	108 Å²	108	94 Å²	94	57%	0.565	55%	0.545	S	S	*	.	S	Bend	trans	-84.9	-30.7	-177.6	-135	82.4	0	0	0	113.3	S715 S716	L713-S715 PolarHBondContact O-N 2.99Å; L713-S716 PolarHBondContact O-N 3.36Å; L713-S716 PolarHBondContact O-OG 3.38Å; L713-S716 VanDerWaalsContact O-OG 3.08Å
714	E	44.2	Very low	45.8	Very low	136 Å²	136	87.9 Å²	87.9	64%	0.636	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-62.1	-27.7	-176.5	-69.9	-173.7	162.9	0	0	113	S716	E714-S716 VanDerWaalsContact C-N 3.26Å; E714-S716 PolarHBondContact O-N 3.27Å
715	S	50.6	Low	47.4	Very low	111 Å²	111	81.8 Å²	81.8	78%	0.776	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-79	0.9	-175.5	56	0	0	0	0	115.2	S712 L713	S712-S715 PolarHBondContact O-OG 3.2Å; L713-S715 PolarHBondContact O-N 2.99Å
716	S	52.1	Low	49.4	Very low	89 Å²	89	79.5 Å²	79.5	62%	0.622	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-120.7	-8.8	-171.2	68	0	0	0	0	115.7	L713 E714	L713-S716 PolarHBondContact O-N 3.36Å; L713-S716 PolarHBondContact O-OG 3.38Å; L713-S716 VanDerWaalsContact O-OG 3.08Å; E714-S716 VanDerWaalsContact C-N 3.26Å; E714-S716 PolarHBondContact O-N 3.27Å
717	L	54.3	Low	51.4	Low	44 Å²	44	72.6 Å²	72.6	23%	0.23	43%	0.429	C	S	.	.			trans	-80.4	132.2	-179.5	-67.1	169	0	0	0	109.5	Q721 I722 H727	L717-Q721 HydrophobicContact CB-CB 4.28Å; L717-Q721 HydrophobicContact CD2-CB 3.99Å; L717-I722 HydrophobicContact CB-CG1 4.24Å; L717-H727 WeakPolarHBondContact CD1-CE1 3.5Å; L717-H727 VanDerWaalsContact CD1-ND1 3.32Å; L717-H727 WeakPolarHBondContact CD1-ND1 3.36Å
718	A	56.7	Low	53.6	Low	40 Å²	40	68.4 Å²	68.4	33%	0.331	40%	0.4	S	S	.	.			trans	-61.2	152.4	167.7	0	0	0	0	0	109.3	S720 Q721	A718-S720 WeakPolarHBondContact CB-OG 3.49Å; A718-S720 PolarHBondContact O-N 2.91Å; A718-Q721 PolarHBondContact O-N 3.01Å
719	P	53	Low	55.7	Low	51 Å²	51	61.9 Å²	61.9	33%	0.331	36%	0.359	S	S	.	.	H	α-helix	trans	-51	-29	173.8	-25.8	32.8	0	0	0	112.7	A662 Q721	A662-P719 HydrophobicContact CB-CB 4.37Å; A662-P719 WeakPolarHBondContact CB-O 3.39Å; P719-Q721 VanDerWaalsContact C-N 3.28Å; P719-Q721 PolarHBondContact O-N 3.2Å
720	S	57.3	Low	57.7	Low	39 Å²	39	61.6 Å²	61.6	27%	0.273	35%	0.351	S	S	.	.	H	α-helix	trans	-67.3	-14.5	174.4	57.6	0	0	0	0	116.7	F658 A718	F658-S720 VanDerWaalsContact CD2-CB 3.46Å; F658-S720 WeakPolarHBondContact CD2-O 3.39Å; F658-S720 WeakPolarHBondContact CE2-O 3.47Å; F658-S720 WeakPolarHBondContact CZ-O 3.47Å; A718-S720 WeakPolarHBondContact CB-OG 3.49Å; A718-S720 PolarHBondContact O-N 2.91Å
721	Q	64.6	Low	59.6	Low	97 Å²	97	54.6 Å²	54.6	45%	0.453	32%	0.322	S	S	.	.	H	α-helix	trans	-106.6	-15.3	-178.5	-64.9	-177.7	-15.3	0	0	112.8	L717 A718 P719 S724 H727	L717-Q721 HydrophobicContact CB-CB 4.28Å; L717-Q721 HydrophobicContact CD2-CB 3.99Å; A718-Q721 PolarHBondContact O-N 3.01Å; P719-Q721 VanDerWaalsContact C-N 3.28Å; P719-Q721 PolarHBondContact O-N 3.2Å; Q721-S724 VanDerWaalsContact O-CB 3.27Å; Q721-S724 WeakPolarHBondContact O-CB 3.19Å; Q721-S724 PolarHBondContact O-N 2.89Å; Q721-S724 PolarHBondContact O-OG 2.88Å; Q721-H727 WeakPolarHBondContact O-CB 3.41Å
722	I	67.3	Low	61.5	Low	14 Å²	14	48.2 Å²	48.2	7%	0.072	28%	0.283	C	S	.	.	H	α-helix	trans	-69.4	-45.1	-174.3	-60	175.2	0	0	0	111.4	E663 W666 L717 S724 H727	E663-I722 HydrophobicContact CG-CD1 3.4Å; W666-I722 HydrophobicContact CB-CG2 3.45Å; W666-I722 VanDerWaalsContact CB-CG2 3.45Å; W666-I722 HydrophobicContact CD2-CG2 3.57Å; W666-I722 HydrophobicContact CE3-CG2 4.15Å; W666-I722 HydrophobicContact CG-CG2 3.22Å; L717-I722 HydrophobicContact CB-CG1 4.24Å; I722-S724 PolarHBondContact O-N 2.68Å; I722-H727 PolarHBondContact O-CD2 3.16Å
723	L	66.2	Low	63.1	Low	3 Å²	3	47 Å²	47	2%	0.016	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	6.9	176.8	-66.5	173.2	0	0	0	113.2	F658 A662 V665 W666 F688	F658-L723 HydrophobicContact CD1-CB 4.21Å; F658-L723 HydrophobicContact CE1-CB 4Å; A662-L723 HydrophobicContact CB-CD1 3.76Å; A662-L723 HydrophobicContact CB-CG 4.17Å; V665-L723 HydrophobicContact CG1-CD2 4.22Å; W666-L723 HydrophobicContact CE3-CD2 4.47Å; F688-L723 HydrophobicContact CD1-CD2 4.47Å; F688-L723 HydrophobicContact CE1-CD2 4.22Å; F688-L723 HydrophobicContact CE2-CD2 4.41Å; F688-L723 HydrophobicContact CZ-CD2 4.19Å
724	S	70.1	Confident	64.6	Low	26 Å²	26	46.8 Å²	46.8	18%	0.182	28%	0.277	C	S	.	.	S	Bend	trans	-67.9	141	179	73.5	0	0	0	0	110.9	Q721 I722 N726 H727 I728	Q721-S724 VanDerWaalsContact O-CB 3.27Å; Q721-S724 WeakPolarHBondContact O-CB 3.19Å; Q721-S724 PolarHBondContact O-N 2.89Å; Q721-S724 PolarHBondContact O-OG 2.88Å; I722-S724 PolarHBondContact O-N 2.68Å; S724-N726 PolarHBondContact O-N 3.22Å; S724-N726 VanDerWaalsContact O-N 3.09Å; S724-H727 PolarHBondContact O-N 3.14Å; S724-H727 PolarHBondContact OG-N 3.16Å; S724-I728 WeakPolarHBondContact O-CG1 3.46Å; S724-I728 PolarHBondContact O-N 3.45Å; S724-I728 VanDerWaalsContact O-N 3.1Å
725	P	65.8	Low	66.2	Low	2 Å²	2	43.1 Å²	43.1	1%	0.013	27%	0.267	C	S	.	.	H	α-helix	trans	-54.6	-33.6	179.6	-26.9	33.5	0	0	0	113.2	I690 Y694 I728 I729 Y743 L747	I690-P725 HydrophobicContact CG2-CG 4.33Å; Y694-P725 HydrophobicContact CD1-CG 4.5Å; Y694-P725 HydrophobicContact CD2-CB 4.05Å; Y694-P725 HydrophobicContact CD2-CG 3.88Å; Y694-P725 HydrophobicContact CE1-CB 4.41Å; Y694-P725 HydrophobicContact CE2-CB 3.65Å; Y694-P725 HydrophobicContact CE2-CG 4.02Å; Y694-P725 HydrophobicContact CG-CG 4.13Å; P725-I728 PolarHBondContact O-N 2.81Å; P725-I729 WeakPolarHBondContact O-CB 3.31Å; P725-I729 VanDerWaalsContact O-CD1 3.3Å; P725-I729 WeakPolarHBondContact O-CD1 3.11Å; P725-I729 WeakPolarHBondContact O-CG1 3.43Å; P725-I729 PolarHBondContact O-N 3.41Å; P725-Y743 WeakPolarHBondContact CA-OH 3.21Å; P725-Y743 HydrophobicContact CB-CE1 4.19Å; P725-Y743 WeakPolarHBondContact CB-OH 3.35Å; P725-L747 HydrophobicContact CB-CD1 4.27Å
726	N	69.8	Low	67.5	Low	30 Å²	30	40.9 Å²	40.9	16%	0.16	24%	0.242	C	C	.	.	H	α-helix	trans	-65.1	-43.4	177.8	-70.7	-21.8	0	0	0	112.3	Y694 C699 S724 I729 Q730	Y694-N726 WeakPolarHBondContact CE2-OD1 3.41Å; C699-N726 PolarHBondContact SG-ND2 3.26Å; S724-N726 PolarHBondContact O-N 3.22Å; S724-N726 VanDerWaalsContact O-N 3.09Å; N726-I729 PolarHBondContact O-N 3.16Å; N726-Q730 WeakPolarHBondContact O-CB 3.47Å; N726-Q730 PolarHBondContact O-N 2.68Å
727	H	71.4	Confident	68.6	Low	27 Å²	27	39.2 Å²	39.2	13%	0.125	23%	0.229	C	C	.	.	H	α-helix	trans	-66.7	-43.2	177.2	-174.2	69.2	0	0	0	111.7	W666 L717 Q721 I722 S724 I729 Q730 S731	W666-H727 AromaticContact CE2-NE2 3.78Å; W666-H727 AromaticContact CH2-CD2 3.89Å; W666-H727 AromaticContact CZ2-CD2 3.66Å; W666-H727 AromaticContact CZ2-NE2 3.49Å; W666-H727 WeakPolarHBondContact CZ2-NE2 3.38Å; L717-H727 WeakPolarHBondContact CD1-CE1 3.5Å; L717-H727 VanDerWaalsContact CD1-ND1 3.32Å; L717-H727 WeakPolarHBondContact CD1-ND1 3.36Å; Q721-H727 WeakPolarHBondContact O-CB 3.41Å; I722-H727 PolarHBondContact O-CD2 3.16Å; S724-H727 PolarHBondContact O-N 3.14Å; S724-H727 PolarHBondContact OG-N 3.16Å; H727-I729 VanDerWaalsContact C-N 3.3Å; H727-I729 PolarHBondContact O-N 3.22Å; H727-Q730 PolarHBondContact O-N 3.41Å; H727-S731 PolarHBondContact O-N 2.95Å; H727-S731 PolarHBondContact O-OG 3.36Å; H727-S731 VanDerWaalsContact O-OG 3.09Å
728	I	72.9	Confident	69.7	Low	0 Å²	0	42 Å²	42	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-46.1	175.4	-62.2	171	0	0	0	110.1	W666 F688 S724 P725 S731 L732 Y743	W666-I728 HydrophobicContact CH2-CG1 4.46Å; W666-I728 HydrophobicContact CZ3-CG1 3.92Å; F688-I728 HydrophobicContact CD2-CD1 4.09Å; S724-I728 WeakPolarHBondContact O-CG1 3.46Å; S724-I728 PolarHBondContact O-N 3.45Å; S724-I728 VanDerWaalsContact O-N 3.1Å; P725-I728 PolarHBondContact O-N 2.81Å; I728-S731 PolarHBondContact O-OG 3.4Å; I728-L732 HydrophobicContact CG2-CD1 3.55Å; I728-L732 HydrophobicContact CG2-CG 4.28Å; I728-L732 VanDerWaalsContact O-CB 3.26Å; I728-L732 WeakPolarHBondContact O-CB 3.42Å; I728-L732 WeakPolarHBondContact O-CG 3.49Å; I728-L732 PolarHBondContact O-N 2.89Å; I728-L732 VanDerWaalsContact O-N 3.07Å; I728-Y743 HydrophobicContact CB-CE1 4.1Å; I728-Y743 HydrophobicContact CG2-CD1 3.99Å; I728-Y743 HydrophobicContact CG2-CE1 3.81Å
729	I	68.9	Low	70.7	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.015	23%	0.232	C	C	.	.	H	α-helix	trans	-62.4	-49.3	177.2	-71	163.1	0	0	0	110.4	P725 N726 H727 S731 L732 I733 Y743 L744 L747 L761	P725-I729 WeakPolarHBondContact O-CB 3.31Å; P725-I729 VanDerWaalsContact O-CD1 3.3Å; P725-I729 WeakPolarHBondContact O-CD1 3.11Å; P725-I729 WeakPolarHBondContact O-CG1 3.43Å; P725-I729 PolarHBondContact O-N 3.41Å; N726-I729 PolarHBondContact O-N 3.16Å; H727-I729 VanDerWaalsContact C-N 3.3Å; H727-I729 PolarHBondContact O-N 3.22Å; I729-S731 PolarHBondContact O-N 2.99Å; I729-L732 PolarHBondContact O-N 3.16Å; I729-I733 HydrophobicContact CG2-CD1 3.41Å; I729-I733 VanDerWaalsContact CG2-CD1 3.41Å; I729-I733 HydrophobicContact CG2-CG1 3.99Å; I729-I733 WeakPolarHBondContact O-CB 3.41Å; I729-I733 WeakPolarHBondContact O-CD1 3.15Å; I729-I733 WeakPolarHBondContact O-CG1 3.43Å; I729-I733 PolarHBondContact O-N 2.99Å; I729-Y743 HydrophobicContact CD1-CE1 4.44Å; I729-Y743 HydrophobicContact CG1-CD1 3.95Å; I729-Y743 HydrophobicContact CG1-CE1 4.05Å; I729-L744 HydrophobicContact CD1-CD2 3.77Å; I729-L744 HydrophobicContact CG1-CD2 4.18Å; I729-L747 HydrophobicContact CD1-CD1 4.02Å; I729-L761 HydrophobicContact CG2-CD2 3.44Å; I729-L761 VanDerWaalsContact CG2-CD2 3.44Å
730	Q	72.4	Confident	71.9	Confident	90 Å²	90	38.3 Å²	38.3	42%	0.421	22%	0.216	S	C	.	.	H	α-helix	trans	-62	-41	-176.8	-172.2	176.1	1.3	0	0	113	N726 H727	N726-Q730 WeakPolarHBondContact O-CB 3.47Å; N726-Q730 PolarHBondContact O-N 2.68Å; H727-Q730 PolarHBondContact O-N 3.41Å
731	S	72.8	Confident	72.9	Confident	29 Å²	29	36.9 Å²	36.9	20%	0.203	21%	0.205	C	C	.	.	H	α-helix	trans	-75.1	-33.6	-179.9	64.1	0	0	0	0	112.9	W666 H727 I728 I729 S735	W666-S731 VanDerWaalsContact CH2-OG 3.25Å; W666-S731 WeakPolarHBondContact CH2-OG 3.46Å; H727-S731 PolarHBondContact O-N 2.95Å; H727-S731 PolarHBondContact O-OG 3.36Å; H727-S731 VanDerWaalsContact O-OG 3.09Å; I728-S731 PolarHBondContact O-OG 3.4Å; I729-S731 PolarHBondContact O-N 2.99Å; S731-S735 PolarHBondContact O-OG 2.93Å
732	L	76	Confident	73.6	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-81.5	-30.5	179.9	-65.6	177.5	0	0	0	113.7	F669 L673 M685 I728 I729 S734 S735 Y736 T740	F669-L732 HydrophobicContact CE1-CD2 4.23Å; F669-L732 HydrophobicContact CZ-CD1 4.26Å; F669-L732 HydrophobicContact CZ-CD2 4.19Å; L673-L732 HydrophobicContact CD1-CD2 3.5Å; L673-L732 VanDerWaalsContact CD1-CD2 3.5Å; M685-L732 HydrophobicContact SD-CD1 3.76Å; I728-L732 HydrophobicContact CG2-CD1 3.55Å; I728-L732 HydrophobicContact CG2-CG 4.28Å; I728-L732 VanDerWaalsContact O-CB 3.26Å; I728-L732 WeakPolarHBondContact O-CB 3.42Å; I728-L732 WeakPolarHBondContact O-CG 3.49Å; I728-L732 PolarHBondContact O-N 2.89Å; I728-L732 VanDerWaalsContact O-N 3.07Å; I729-L732 PolarHBondContact O-N 3.16Å; L732-S734 VanDerWaalsContact C-N 3.26Å; L732-S734 PolarHBondContact O-N 2.95Å; L732-S735 PolarHBondContact O-N 3.48Å; L732-Y736 HydrophobicContact CD2-CD2 4.02Å; L732-Y736 CarbonylContact O-C 3.57Å; L732-Y736 VanDerWaalsContact O-C 3.25Å; L732-Y736 WeakPolarHBondContact O-CA 3.38Å; L732-Y736 PolarHBondContact O-N 3.32Å; L732-T740 VanDerWaalsContact CB-OG1 3.23Å; L732-T740 WeakPolarHBondContact CB-OG1 3.46Å; L732-T740 PolarHBondContact O-OG1 3.21Å
733	I	75.2	Confident	74.1	Confident	48 Å²	48	33.7 Å²	33.7	25%	0.246	19%	0.193	C	C	.	.	H	α-helix	trans	-54.9	-43.3	-177.1	-78.2	159.9	0	0	0	111.5	I729 T740 L761	I729-I733 HydrophobicContact CG2-CD1 3.41Å; I729-I733 VanDerWaalsContact CG2-CD1 3.41Å; I729-I733 HydrophobicContact CG2-CG1 3.99Å; I729-I733 WeakPolarHBondContact O-CB 3.41Å; I729-I733 WeakPolarHBondContact O-CD1 3.15Å; I729-I733 WeakPolarHBondContact O-CG1 3.43Å; I729-I733 PolarHBondContact O-N 2.99Å; I733-T740 HydrophobicContact CG1-CG2 3.77Å; I733-T740 PolarHBondContact N-OG1 3.03Å; I733-L761 HydrophobicContact CD1-CD1 4.12Å; I733-L761 HydrophobicContact CD1-CD2 3.76Å; I733-L761 HydrophobicContact CG1-CD2 4.32Å
734	S	76.2	Confident	74.6	Confident	102 Å²	102	33.6 Å²	33.6	71%	0.713	19%	0.192	S	C	*	.	H	α-helix	trans	-74.2	-41.6	-174.1	-169.3	0	0	0	0	112.2	L732	L732-S734 VanDerWaalsContact C-N 3.26Å; L732-S734 PolarHBondContact O-N 2.95Å
735	S	76.7	Confident	75	Confident	60 Å²	60	35.2 Å²	35.2	42%	0.42	20%	0.196	S	C	.	.	H	α-helix	trans	-100.9	-37.2	-168.4	51	0	0	0	0	114.1	S731 L732	S731-S735 PolarHBondContact O-OG 2.93Å; L732-S735 PolarHBondContact O-N 3.48Å
736	Y	78.8	Confident	75.6	Confident	63 Å²	63	37.6 Å²	37.6	25%	0.247	21%	0.206	C	C	.	.			trans	-135.9	75.6	-170.7	-55.6	-77	0	0	0	112.3	L673 L732 N738 M739 T740	L673-Y736 HydrophobicContact CB-CD2 4.43Å; L673-Y736 HydrophobicContact CB-CE1 4.41Å; L673-Y736 HydrophobicContact CB-CE2 3.83Å; L673-Y736 HydrophobicContact CD1-CD2 4.11Å; L673-Y736 HydrophobicContact CD1-CE2 4.15Å; L673-Y736 HydrophobicContact CG-CE2 4.46Å; L673-Y736 PolarHBondContact O-OH 2.75Å; L732-Y736 HydrophobicContact CD2-CD2 4.02Å; L732-Y736 CarbonylContact O-C 3.57Å; L732-Y736 VanDerWaalsContact O-C 3.25Å; L732-Y736 WeakPolarHBondContact O-CA 3.38Å; L732-Y736 PolarHBondContact O-N 3.32Å; Y736-N738 PolarHBondContact O-N 3.47Å; Y736-M739 PolarHBondContact O-N 3.32Å; Y736-T740 PolarHBondContact O-N 3.06Å; Y736-T740 VanDerWaalsContact O-N 3.07Å; Y736-T740 PolarHBondContact O-OG1 2.91Å
737	P	74.2	Confident	75.7	Confident	55 Å²	55	36.1 Å²	36.1	36%	0.357	20%	0.199	S	C	.	.	H	α-helix	trans	-65.5	-33.1	-173.8	24.5	-34.3	0	0	0	114	T740 M741	P737-T740 WeakPolarHBondContact O-CB 3.37Å; P737-T740 PolarHBondContact O-N 2.78Å; P737-M741 WeakPolarHBondContact O-CG 3.49Å; P737-M741 PolarHBondContact O-N 3.13Å
738	N	77.3	Confident	75.7	Confident	103 Å²	103	36.1 Å²	36.1	55%	0.551	20%	0.201	S	C	*	.	H	α-helix	trans	-67.9	-41	178.4	-68.8	-21.6	0	0	0	111.8	Y736 T740 M741 T742	Y736-N738 PolarHBondContact O-N 3.47Å; N738-T740 VanDerWaalsContact C-N 3.35Å; N738-M741 WeakPolarHBondContact O-CB 3.22Å; N738-M741 PolarHBondContact O-N 3.5Å; N738-T742 PolarHBondContact O-N 2.85Å
739	M	77	Confident	75.7	Confident	13 Å²	13	46.2 Å²	46.2	6%	0.064	24%	0.241	C	C	.	.	H	α-helix	trans	-67.8	-37.1	175.5	-74.9	-61.2	-81.3	0	0	111.8	L673 A681 E682 M685 Y736 M741 T742 Y743	L673-M739 HydrophobicContact CD2-CE 4.43Å; L673-M739 HydrophobicContact CD2-CG 4.37Å; A681-M739 HydrophobicContact CB-CE 4.08Å; E682-M739 HydrophobicContact CB-CE 3.72Å; E682-M739 HydrophobicContact CB-SD 4.3Å; E682-M739 HydrophobicContact CG-CE 4.4Å; M685-M739 HydrophobicContact CE-CE 3.78Å; M685-M739 HydrophobicContact CE-SD 4.45Å; M685-M739 HydrophobicContact SD-CE 4.06Å; Y736-M739 PolarHBondContact O-N 3.32Å; M739-M741 VanDerWaalsContact C-N 3.26Å; M739-M741 PolarHBondContact O-N 3.26Å; M739-T742 WeakPolarHBondContact CA-OG1 3.18Å; M739-T742 PolarHBondContact O-N 2.95Å; M739-T742 PolarHBondContact O-OG1 2.91Å; M739-Y743 WeakPolarHBondContact O-CB 3.45Å; M739-Y743 PolarHBondContact O-N 2.72Å
740	T	80	Confident	75.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.1	-41.3	171.8	-50.9	0	0	0	0	111.1	L732 I733 Y736 P737 N738 L744 L765	L732-T740 VanDerWaalsContact CB-OG1 3.23Å; L732-T740 WeakPolarHBondContact CB-OG1 3.46Å; L732-T740 PolarHBondContact O-OG1 3.21Å; I733-T740 HydrophobicContact CG1-CG2 3.77Å; I733-T740 PolarHBondContact N-OG1 3.03Å; Y736-T740 PolarHBondContact O-N 3.06Å; Y736-T740 VanDerWaalsContact O-N 3.07Å; Y736-T740 PolarHBondContact O-OG1 2.91Å; P737-T740 WeakPolarHBondContact O-CB 3.37Å; P737-T740 PolarHBondContact O-N 2.78Å; N738-T740 VanDerWaalsContact C-N 3.35Å; T740-L744 HydrophobicContact CG2-CD1 3.93Å; T740-L744 HydrophobicContact CG2-CG 4.42Å; T740-L744 WeakPolarHBondContact O-CB 3.22Å; T740-L744 VanDerWaalsContact O-CG 3.3Å; T740-L744 WeakPolarHBondContact O-CG 3.44Å; T740-L744 PolarHBondContact O-N 2.97Å; T740-L765 HydrophobicContact CG2-CD1 3.57Å
741	M	77.9	Confident	75.6	Confident	9 Å²	9	45.5 Å²	45.5	4%	0.044	24%	0.244	C	C	.	.	H	α-helix	trans	-63.9	-46	175.9	-74.7	176.9	47.8	0	0	112.3	P737 N738 M739 Y743 L744 K745 L762 L765 Y766 T769 L792	P737-M741 WeakPolarHBondContact O-CG 3.49Å; P737-M741 PolarHBondContact O-N 3.13Å; N738-M741 WeakPolarHBondContact O-CB 3.22Å; N738-M741 PolarHBondContact O-N 3.5Å; M739-M741 VanDerWaalsContact C-N 3.26Å; M739-M741 PolarHBondContact O-N 3.26Å; M741-Y743 VanDerWaalsContact C-N 3.32Å; M741-Y743 PolarHBondContact O-N 3.33Å; M741-L744 PolarHBondContact O-N 3.28Å; M741-K745 WeakPolarHBondContact O-CB 3.37Å; M741-K745 VanDerWaalsContact O-CG 3.24Å; M741-K745 WeakPolarHBondContact O-CG 2.94Å; M741-K745 PolarHBondContact O-N 3.22Å; M741-L762 HydrophobicContact CB-CD1 4.41Å; M741-L762 HydrophobicContact CG-CD1 4.4Å; M741-L765 HydrophobicContact CG-CB 3.78Å; M741-L765 HydrophobicContact CG-CD1 4.17Å; M741-L765 HydrophobicContact SD-CB 4.29Å; M741-Y766 HydrophobicContact CE-CD1 3.53Å; M741-Y766 HydrophobicContact CE-CD2 4.5Å; M741-Y766 HydrophobicContact CE-CE1 3.43Å; M741-Y766 VanDerWaalsContact CE-CE1 3.43Å; M741-Y766 HydrophobicContact CE-CE2 4.43Å; M741-Y766 HydrophobicContact CE-CG 4.09Å; M741-T769 HydrophobicContact SD-CG2 3.78Å; M741-L792 HydrophobicContact CE-CD2 4.04Å
742	T	78.2	Confident	75.1	Confident	40 Å²	40	50.2 Å²	50.2	25%	0.245	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-39.2	179.2	53.7	0	0	0	0	111.4	M685 N738 M739 K745 H746	M685-T742 WeakPolarHBondContact CE-OG1 3.46Å; N738-T742 PolarHBondContact O-N 2.85Å; M739-T742 WeakPolarHBondContact CA-OG1 3.18Å; M739-T742 PolarHBondContact O-N 2.95Å; M739-T742 PolarHBondContact O-OG1 2.91Å; T742-K745 PolarHBondContact O-N 3.04Å; T742-H746 PolarHBondContact O-N 3.46Å
743	Y	79	Confident	74.6	Confident	4 Å²	4	56.1 Å²	56.1	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-64	-49.6	174.7	-169	-127.6	0	0	0	113.1	M685 P725 I728 I729 M739 M741 K745 H746 L747	M685-Y743 HydrophobicContact CE-CD2 4.25Å; M685-Y743 HydrophobicContact CE-CG 4.32Å; M685-Y743 HydrophobicContact CG-CD2 3.42Å; M685-Y743 VanDerWaalsContact CG-CD2 3.42Å; M685-Y743 HydrophobicContact CG-CE2 3.94Å; M685-Y743 HydrophobicContact CG-CG 3.92Å; M685-Y743 WeakPolarHBondContact O-CE2 3.43Å; M685-Y743 HydrophobicContact SD-CD2 4.03Å; M685-Y743 HydrophobicContact SD-CG 3.96Å; P725-Y743 WeakPolarHBondContact CA-OH 3.21Å; P725-Y743 HydrophobicContact CB-CE1 4.19Å; P725-Y743 WeakPolarHBondContact CB-OH 3.35Å; I728-Y743 HydrophobicContact CB-CE1 4.1Å; I728-Y743 HydrophobicContact CG2-CD1 3.99Å; I728-Y743 HydrophobicContact CG2-CE1 3.81Å; I729-Y743 HydrophobicContact CD1-CE1 4.44Å; I729-Y743 HydrophobicContact CG1-CD1 3.95Å; I729-Y743 HydrophobicContact CG1-CE1 4.05Å; M739-Y743 WeakPolarHBondContact O-CB 3.45Å; M739-Y743 PolarHBondContact O-N 2.72Å; M741-Y743 VanDerWaalsContact C-N 3.32Å; M741-Y743 PolarHBondContact O-N 3.33Å; Y743-K745 VanDerWaalsContact C-N 3.27Å; Y743-K745 PolarHBondContact O-N 2.99Å; Y743-H746 WeakPolarHBondContact O-CA 3.45Å; Y743-H746 WeakPolarHBondContact O-CB 3.42Å; Y743-H746 PolarHBondContact O-N 2.84Å; Y743-L747 HydrophobicContact CD1-CD1 3.86Å; Y743-L747 HydrophobicContact CD1-CG 4.33Å; Y743-L747 HydrophobicContact CE1-CD1 3.52Å; Y743-L747 HydrophobicContact CE1-CD2 4.42Å; Y743-L747 HydrophobicContact CE1-CG 4.07Å; Y743-L747 HydrophobicContact CE2-CD2 4.25Å; Y743-L747 HydrophobicContact CE2-CG 4.29Å; Y743-L747 WeakPolarHBondContact O-CG 3.45Å; Y743-L747 PolarHBondContact O-N 2.86Å
744	L	76.5	Confident	74.3	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.9	-35.7	179.3	-75.6	170.6	0	0	0	111.8	I729 T740 M741 L747 C748 N758 L761 L762 L765	I729-L744 HydrophobicContact CD1-CD2 3.77Å; I729-L744 HydrophobicContact CG1-CD2 4.18Å; T740-L744 HydrophobicContact CG2-CD1 3.93Å; T740-L744 HydrophobicContact CG2-CG 4.42Å; T740-L744 WeakPolarHBondContact O-CB 3.22Å; T740-L744 VanDerWaalsContact O-CG 3.3Å; T740-L744 WeakPolarHBondContact O-CG 3.44Å; T740-L744 PolarHBondContact O-N 2.97Å; M741-L744 PolarHBondContact O-N 3.28Å; L744-L747 HydrophobicContact CD2-CD1 4.45Å; L744-L747 PolarHBondContact O-N 3.26Å; L744-C748 WeakPolarHBondContact O-CB 3.43Å; L744-C748 PolarHBondContact O-N 3Å; L744-C748 PolarHBondContact O-SG 3.41Å; L744-N758 HydrophobicContact CD2-CB 3.96Å; L744-L761 HydrophobicContact CD1-CB 4.34Å; L744-L761 HydrophobicContact CD1-CD2 3.77Å; L744-L761 HydrophobicContact CD1-CG 3.89Å; L744-L761 HydrophobicContact CD2-CD2 4.34Å; L744-L762 HydrophobicContact CB-CB 4.12Å; L744-L762 HydrophobicContact CB-CD1 3.91Å; L744-L762 HydrophobicContact CB-CD2 4.35Å; L744-L762 HydrophobicContact CB-CG 4.33Å; L744-L762 HydrophobicContact CD1-CB 4.13Å; L744-L762 HydrophobicContact CD1-CD1 4.49Å; L744-L765 HydrophobicContact CD1-CD1 3.81Å
745	K	77.8	Confident	74	Confident	61 Å²	61	51.5 Å²	51.5	27%	0.265	27%	0.272	S	S	.	.	H	α-helix	trans	-59	-48.9	171.1	-73.9	-179.5	-154.2	-149.6	0	110.7	M741 T742 Y743 C748 Y749 L762 Y766 E795	M741-K745 WeakPolarHBondContact O-CB 3.37Å; M741-K745 VanDerWaalsContact O-CG 3.24Å; M741-K745 WeakPolarHBondContact O-CG 2.94Å; M741-K745 PolarHBondContact O-N 3.22Å; T742-K745 PolarHBondContact O-N 3.04Å; Y743-K745 VanDerWaalsContact C-N 3.27Å; Y743-K745 PolarHBondContact O-N 2.99Å; K745-C748 PolarHBondContact O-N 3.32Å; K745-Y749 WeakPolarHBondContact O-CB 3.42Å; K745-Y749 PolarHBondContact O-N 3.35Å; K745-L762 HydrophobicContact CG-CD1 4.32Å; K745-L762 HydrophobicContact CG-CD2 4.35Å; K745-Y766 WeakPolarHBondContact CE-OH 3.2Å; K745-Y766 PolarHBondContact NZ-OH 3.48Å; K745-E795 IonicContact NZ-OE1 3.8Å; K745-E795 PolarHBondContact NZ-OE1 3.44Å; K745-E795 IonicContact NZ-OE2 3.94Å; K745-E795 PolarHBondContact NZ-OE2 3Å
746	H	77.8	Confident	73.5	Confident	51 Å²	51	50.9 Å²	50.9	24%	0.236	27%	0.267	C	S	.	.	H	α-helix	trans	-60.3	-46.3	177.9	177.1	-106.5	0	0	0	111.7	L686 T742 Y743 C748 Y749 S750	L686-H746 HydrophobicContact CD2-CB 3.35Å; L686-H746 VanDerWaalsContact CD2-CG 3.49Å; L686-H746 PolarHBondContact O-CE1 3.19Å; L686-H746 PolarHBondContact O-NE2 3.27Å; T742-H746 PolarHBondContact O-N 3.46Å; Y743-H746 WeakPolarHBondContact O-CA 3.45Å; Y743-H746 WeakPolarHBondContact O-CB 3.42Å; Y743-H746 PolarHBondContact O-N 2.84Å; H746-C748 PolarHBondContact O-N 3.26Å; H746-Y749 PolarHBondContact O-N 2.91Å; H746-S750 PolarHBondContact CD2-OG 3.25Å; H746-S750 VanDerWaalsContact CD2-OG 3.27Å; H746-S750 PolarHBondContact NE2-OG 2.95Å; H746-S750 VanDerWaalsContact O-CB 3.25Å; H746-S750 WeakPolarHBondContact O-CB 3.5Å; H746-S750 PolarHBondContact O-N 3Å; H746-S750 PolarHBondContact O-OG 3.38Å; H746-S750 VanDerWaalsContact O-OG 3.07Å
747	L	71.9	Confident	73.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.3	-45	176.7	-69.9	-179.7	0	0	0	112.4	I690 P725 I729 Y743 L744 Y749 L751	I690-L747 HydrophobicContact CD1-CD2 3.7Å; I690-L747 HydrophobicContact CG1-CD2 4.2Å; P725-L747 HydrophobicContact CB-CD1 4.27Å; I729-L747 HydrophobicContact CD1-CD1 4.02Å; Y743-L747 HydrophobicContact CD1-CD1 3.86Å; Y743-L747 HydrophobicContact CD1-CG 4.33Å; Y743-L747 HydrophobicContact CE1-CD1 3.52Å; Y743-L747 HydrophobicContact CE1-CD2 4.42Å; Y743-L747 HydrophobicContact CE1-CG 4.07Å; Y743-L747 HydrophobicContact CE2-CD2 4.25Å; Y743-L747 HydrophobicContact CE2-CG 4.29Å; Y743-L747 WeakPolarHBondContact O-CG 3.45Å; Y743-L747 PolarHBondContact O-N 2.86Å; L744-L747 HydrophobicContact CD2-CD1 4.45Å; L744-L747 PolarHBondContact O-N 3.26Å; L747-Y749 VanDerWaalsContact C-N 3.29Å; L747-Y749 PolarHBondContact O-N 3.36Å; L747-L751 HydrophobicContact CD2-CD1 4.21Å; L747-L751 VanDerWaalsContact O-CB 3.32Å; L747-L751 WeakPolarHBondContact O-CB 3.47Å; L747-L751 PolarHBondContact O-N 3.23Å; L747-L751 VanDerWaalsContact O-N 3.08Å
748	C	72.5	Confident	73.2	Confident	26 Å²	26	48.5 Å²	48.5	18%	0.176	25%	0.253	C	S	.	.	H	α-helix	trans	-68.3	-28.5	179.3	-63.3	0	0	0	0	112.9	L744 K745 H746	L744-C748 WeakPolarHBondContact O-CB 3.43Å; L744-C748 PolarHBondContact O-N 3Å; L744-C748 PolarHBondContact O-SG 3.41Å; K745-C748 PolarHBondContact O-N 3.32Å; H746-C748 PolarHBondContact O-N 3.26Å
749	Y	72.2	Confident	73.1	Confident	212 Å²	212	44.4 Å²	44.4	83%	0.831	23%	0.23	S	C	*	.	H	α-helix	trans	-82.9	-41.2	177.9	-175.1	-96.6	0	0	0	112.5	K745 H746 L747	K745-Y749 WeakPolarHBondContact O-CB 3.42Å; K745-Y749 PolarHBondContact O-N 3.35Å; H746-Y749 PolarHBondContact O-N 2.91Å; L747-Y749 VanDerWaalsContact C-N 3.29Å; L747-Y749 PolarHBondContact O-N 3.36Å
750	S	70.9	Confident	73.1	Confident	54 Å²	54	44.8 Å²	44.8	38%	0.378	23%	0.233	S	C	.	.	H	α-helix	trans	-80.7	-26.8	-174.3	-61.2	0	0	0	0	113.2	H746	H746-S750 PolarHBondContact CD2-OG 3.25Å; H746-S750 VanDerWaalsContact CD2-OG 3.27Å; H746-S750 PolarHBondContact NE2-OG 2.95Å; H746-S750 VanDerWaalsContact O-CB 3.25Å; H746-S750 WeakPolarHBondContact O-CB 3.5Å; H746-S750 PolarHBondContact O-N 3Å; H746-S750 PolarHBondContact O-OG 3.38Å; H746-S750 VanDerWaalsContact O-OG 3.07Å
751	L	69.5	Low	73	Confident	24 Å²	24	46.1 Å²	46.1	13%	0.126	24%	0.24	C	C	.	.			trans	-103.9	117.3	-179.6	-65.2	165	0	0	0	111.5	I690 Y694 L747 N753 C754	I690-L751 HydrophobicContact CD1-CG 4.41Å; I690-L751 HydrophobicContact CG2-CD1 4.2Å; I690-L751 HydrophobicContact CG2-CD2 4.17Å; Y694-L751 HydrophobicContact CD1-CD1 3.75Å; Y694-L751 HydrophobicContact CE1-CD1 3.89Å; L747-L751 HydrophobicContact CD2-CD1 4.21Å; L747-L751 VanDerWaalsContact O-CB 3.32Å; L747-L751 WeakPolarHBondContact O-CB 3.47Å; L747-L751 PolarHBondContact O-N 3.23Å; L747-L751 VanDerWaalsContact O-N 3.08Å; L751-N753 PolarHBondContact O-N 3.22Å; L751-C754 HydrophobicContact CB-CB 4.01Å; L751-C754 PolarHBondContact O-N 3.18Å
752	P	62.1	Low	73.1	Confident	129 Å²	129	45.8 Å²	45.8	84%	0.838	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-34.7	178.2	-22.3	31	0	0	0	113.4
753	N	64.9	Low	73.1	Confident	124 Å²	124	43.9 Å²	43.9	66%	0.663	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.8	49.6	-179.6	-68.2	-11.9	0	0	0	110.9	L751 H755	L751-N753 PolarHBondContact O-N 3.22Å; N753-H755 PolarHBondContact O-N 2.65Å
754	C	68.7	Low	73.2	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.02	24%	0.244	C	C	.	.			trans	-59.7	136.8	174.7	-178.8	0	0	0	0	110.8	L751 N758 H759 L805	L751-C754 HydrophobicContact CB-CB 4.01Å; L751-C754 PolarHBondContact O-N 3.18Å; C754-N758 PolarHBondContact SG-ND2 2.76Å; C754-H759 PolarHBondContact O-CE1 3.34Å; C754-L805 WeakPolarHBondContact O-CD1 3.28Å
755	H	69.2	Low	73.4	Confident	50 Å²	50	48.5 Å²	48.5	23%	0.231	25%	0.248	C	C	.	.			trans	-58	144	-175	-161.2	-101.8	0	0	0	112.2	N753 E757 N758 H759	N753-H755 PolarHBondContact O-N 2.65Å; H755-E757 VanDerWaalsContact CE1-CD 3.47Å; H755-E757 IonicContact CE1-OE2 2.59Å; H755-E757 PolarHBondContact CE1-OE2 3.17Å; H755-E757 WeakPolarHBondContact ND1-CB 3.31Å; H755-E757 PolarHBondContact ND1-N 2.94Å; H755-E757 IonicContact ND1-OE2 2.77Å; H755-E757 PolarHBondContact ND1-OE2 3.49Å; H755-E757 PolarHBondContact O-N 3.24Å; H755-N758 PolarHBondContact O-N 2.59Å; H755-H759 PolarHBondContact O-ND1 2.77Å; H755-H759 VanDerWaalsContact O-ND1 3.13Å
756	P	67.8	Low	73.6	Confident	48 Å²	48	46 Å²	46	31%	0.312	24%	0.236	S	C	.	.	H	α-helix	trans	-57.6	-32.7	178.4	20.4	-34.1	0	0	0	113.9	N758 H759 N760 L805	P756-N758 VanDerWaalsContact C-N 3.29Å; P756-N758 PolarHBondContact O-N 3.38Å; P756-H759 WeakPolarHBondContact O-CB 3.48Å; P756-H759 PolarHBondContact O-N 3.5Å; P756-N760 PolarHBondContact O-N 2.69Å; P756-N760 PolarHBondContact O-ND2 3.08Å; P756-N760 VanDerWaalsContact O-ND2 3.14Å; P756-L805 HydrophobicContact CB-CB 4.05Å; P756-L805 HydrophobicContact CB-CD2 4.37Å; P756-L805 WeakPolarHBondContact CB-O 3.32Å
757	E	71.7	Confident	73.7	Confident	63 Å²	63	43.6 Å²	43.6	29%	0.294	23%	0.225	S	C	.	.	H	α-helix	trans	-63.6	-33.6	179.2	-70.1	170.5	154.2	0	0	113.3	C699 H755 N760 L761	C699-E757 VanDerWaalsContact O-OE1 3.05Å; H755-E757 VanDerWaalsContact CE1-CD 3.47Å; H755-E757 IonicContact CE1-OE2 2.59Å; H755-E757 PolarHBondContact CE1-OE2 3.17Å; H755-E757 WeakPolarHBondContact ND1-CB 3.31Å; H755-E757 PolarHBondContact ND1-N 2.94Å; H755-E757 IonicContact ND1-OE2 2.77Å; H755-E757 PolarHBondContact ND1-OE2 3.49Å; H755-E757 PolarHBondContact O-N 3.24Å; E757-N760 PolarHBondContact O-N 3.4Å; E757-L761 VanDerWaalsContact O-CB 3.24Å; E757-L761 WeakPolarHBondContact O-CB 3.36Å; E757-L761 PolarHBondContact O-N 2.91Å
758	N	74.7	Confident	74.2	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-67	-41.9	176.8	-64.7	-23.7	0	0	0	111.2	Y694 L744 C754 H755 P756 N760 L761 L762	Y694-N758 PolarHBondContact OH-ND2 3.43Å; Y694-N758 PolarHBondContact OH-OD1 3.3Å; L744-N758 HydrophobicContact CD2-CB 3.96Å; C754-N758 PolarHBondContact SG-ND2 2.76Å; H755-N758 PolarHBondContact O-N 2.59Å; P756-N758 VanDerWaalsContact C-N 3.29Å; P756-N758 PolarHBondContact O-N 3.38Å; N758-N760 VanDerWaalsContact C-N 3.3Å; N758-N760 PolarHBondContact O-N 3.03Å; N758-L761 PolarHBondContact O-N 3.4Å; N758-L762 WeakPolarHBondContact O-CB 3.45Å; N758-L762 PolarHBondContact O-N 3Å
759	H	74.7	Confident	74.6	Confident	17 Å²	17	45.5 Å²	45.5	8%	0.079	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-40.3	174.4	-67.5	88	0	0	0	111.1	C754 H755 P756 G763 L805 I806	C754-H759 PolarHBondContact O-CE1 3.34Å; H755-H759 PolarHBondContact O-ND1 2.77Å; H755-H759 VanDerWaalsContact O-ND1 3.13Å; P756-H759 WeakPolarHBondContact O-CB 3.48Å; P756-H759 PolarHBondContact O-N 3.5Å; H759-G763 PolarHBondContact O-N 2.7Å; H759-L805 HydrophobicContact CB-CB 4.46Å; H759-L805 VanDerWaalsContact CE1-CD1 3.45Å; H759-L805 WeakPolarHBondContact CE1-CD1 3.3Å; H759-I806 HydrophobicContact CB-CG1 3.77Å
760	N	76.1	Confident	75.1	Confident	22 Å²	22	35.4 Å²	35.4	12%	0.118	20%	0.195	C	C	.	.	H	α-helix	trans	-67.6	-43.9	177.8	-66.9	-25.1	0	0	0	112.1	P756 E757 N758 G763 K764 I806 S807	P756-N760 PolarHBondContact O-N 2.69Å; P756-N760 PolarHBondContact O-ND2 3.08Å; P756-N760 VanDerWaalsContact O-ND2 3.14Å; E757-N760 PolarHBondContact O-N 3.4Å; N758-N760 VanDerWaalsContact C-N 3.3Å; N758-N760 PolarHBondContact O-N 3.03Å; N760-G763 PolarHBondContact O-N 3.45Å; N760-K764 WeakPolarHBondContact O-CB 3.26Å; N760-K764 VanDerWaalsContact O-CG 3.29Å; N760-K764 WeakPolarHBondContact O-CG 3.35Å; N760-K764 PolarHBondContact O-N 3.22Å; N760-I806 VanDerWaalsContact OD1-CA 3.23Å; N760-I806 WeakPolarHBondContact OD1-CA 3.5Å; N760-S807 PolarHBondContact ND2-OG 3.3Å; N760-S807 PolarHBondContact OD1-N 3.09Å; N760-S807 PolarHBondContact OD1-OG 3.29Å
761	L	79.2	Confident	75.7	Confident	27 Å²	27	33.1 Å²	33.1	14%	0.141	18%	0.178	C	C	.	.	H	α-helix	trans	-64.8	-45.4	176.9	-179	66.9	0	0	0	110.8	I729 I733 L744 E757 N758 G763 K764 L765	I729-L761 HydrophobicContact CG2-CD2 3.44Å; I729-L761 VanDerWaalsContact CG2-CD2 3.44Å; I733-L761 HydrophobicContact CD1-CD1 4.12Å; I733-L761 HydrophobicContact CD1-CD2 3.76Å; I733-L761 HydrophobicContact CG1-CD2 4.32Å; L744-L761 HydrophobicContact CD1-CB 4.34Å; L744-L761 HydrophobicContact CD1-CD2 3.77Å; L744-L761 HydrophobicContact CD1-CG 3.89Å; L744-L761 HydrophobicContact CD2-CD2 4.34Å; E757-L761 VanDerWaalsContact O-CB 3.24Å; E757-L761 WeakPolarHBondContact O-CB 3.36Å; E757-L761 PolarHBondContact O-N 2.91Å; N758-L761 PolarHBondContact O-N 3.4Å; L761-G763 VanDerWaalsContact C-N 3.33Å; L761-G763 PolarHBondContact O-N 3Å; L761-K764 WeakPolarHBondContact O-CB 3.49Å; L761-K764 PolarHBondContact O-N 3.25Å; L761-L765 HydrophobicContact CG-CD1 4.37Å; L761-L765 WeakPolarHBondContact O-CG 3.27Å; L761-L765 PolarHBondContact O-N 2.99Å
762	L	79.9	Confident	76.2	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-58.9	-46.4	174.9	-178.6	56.7	0	0	0	110.7	M741 L744 K745 N758 K764 L765 Y766 L799	M741-L762 HydrophobicContact CB-CD1 4.41Å; M741-L762 HydrophobicContact CG-CD1 4.4Å; L744-L762 HydrophobicContact CB-CB 4.12Å; L744-L762 HydrophobicContact CB-CD1 3.91Å; L744-L762 HydrophobicContact CB-CD2 4.35Å; L744-L762 HydrophobicContact CB-CG 4.33Å; L744-L762 HydrophobicContact CD1-CB 4.13Å; L744-L762 HydrophobicContact CD1-CD1 4.49Å; K745-L762 HydrophobicContact CG-CD1 4.32Å; K745-L762 HydrophobicContact CG-CD2 4.35Å; N758-L762 WeakPolarHBondContact O-CB 3.45Å; N758-L762 PolarHBondContact O-N 3Å; L762-K764 VanDerWaalsContact C-N 3.35Å; L762-K764 PolarHBondContact O-N 3.33Å; L762-L765 PolarHBondContact O-N 3.37Å; L762-Y766 HydrophobicContact CD1-CD2 3.75Å; L762-Y766 HydrophobicContact CD1-CE2 3.48Å; L762-Y766 VanDerWaalsContact CD1-CE2 3.48Å; L762-Y766 HydrophobicContact CD2-CE2 4.22Å; L762-Y766 HydrophobicContact CG-CD2 3.84Å; L762-Y766 HydrophobicContact CG-CE2 3.69Å; L762-Y766 VanDerWaalsContact O-CD2 3.27Å; L762-Y766 WeakPolarHBondContact O-CD2 3.42Å; L762-Y766 PolarHBondContact O-N 3.29Å; L762-L799 HydrophobicContact CB-CD2 4.36Å; L762-L799 HydrophobicContact CD2-CD1 3.77Å; L762-L799 HydrophobicContact CD2-CD2 3.94Å; L762-L799 HydrophobicContact CG-CD2 3.79Å
763	G	77	Confident	77	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59	-43.1	174.9	0	0	0	0	0	112.8	H759 N760 L761 L767	H759-G763 PolarHBondContact O-N 2.7Å; N760-G763 PolarHBondContact O-N 3.45Å; L761-G763 VanDerWaalsContact C-N 3.33Å; L761-G763 PolarHBondContact O-N 3Å; G763-L767 WeakPolarHBondContact O-CB 3.45Å; G763-L767 PolarHBondContact O-N 3.2Å
764	K	81.6	Confident	77.5	Confident	86 Å²	86	30 Å²	30	37%	0.374	15%	0.149	S	C	.	.	H	α-helix	trans	-63	-43.3	174.8	-74.8	172	-177.6	177.5	0	111.6	N760 L761 L762 L767 N768 L811	N760-K764 WeakPolarHBondContact O-CB 3.26Å; N760-K764 VanDerWaalsContact O-CG 3.29Å; N760-K764 WeakPolarHBondContact O-CG 3.35Å; N760-K764 PolarHBondContact O-N 3.22Å; L761-K764 WeakPolarHBondContact O-CB 3.49Å; L761-K764 PolarHBondContact O-N 3.25Å; L762-K764 VanDerWaalsContact C-N 3.35Å; L762-K764 PolarHBondContact O-N 3.33Å; K764-L767 PolarHBondContact O-N 3.47Å; K764-N768 WeakPolarHBondContact O-CB 3.5Å; K764-N768 PolarHBondContact O-N 3.2Å; K764-N768 PolarHBondContact O-ND2 3.32Å; K764-N768 PolarHBondContact O-OD1 3.07Å; K764-L811 HydrophobicContact CG-CD2 3.99Å
765	L	80.6	Confident	77.8	Confident	16 Å²	16	35.3 Å²	35.3	8%	0.084	17%	0.172	C	C	.	.	H	α-helix	trans	-66.5	-42.1	179.3	-71.6	174.7	0	0	0	112.2	T740 M741 L744 L761 L762 N768 T769	T740-L765 HydrophobicContact CG2-CD1 3.57Å; M741-L765 HydrophobicContact CG-CB 3.78Å; M741-L765 HydrophobicContact CG-CD1 4.17Å; M741-L765 HydrophobicContact SD-CB 4.29Å; L744-L765 HydrophobicContact CD1-CD1 3.81Å; L761-L765 HydrophobicContact CG-CD1 4.37Å; L761-L765 WeakPolarHBondContact O-CG 3.27Å; L761-L765 PolarHBondContact O-N 2.99Å; L762-L765 PolarHBondContact O-N 3.37Å; L765-N768 PolarHBondContact O-N 3.24Å; L765-T769 WeakPolarHBondContact O-CB 3.45Å; L765-T769 WeakPolarHBondContact O-CG2 3.5Å; L765-T769 PolarHBondContact O-N 3.4Å; L765-T769 PolarHBondContact O-OG1 3.19Å
766	Y	82.2	Confident	77.8	Confident	8 Å²	8	36 Å²	36	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-59.5	-46.5	171.9	-87.7	-69.3	0	0	0	112	M741 K745 L762 N768 T769 L770 L792 E795 F796 L799	M741-Y766 HydrophobicContact CE-CD1 3.53Å; M741-Y766 HydrophobicContact CE-CD2 4.5Å; M741-Y766 HydrophobicContact CE-CE1 3.43Å; M741-Y766 VanDerWaalsContact CE-CE1 3.43Å; M741-Y766 HydrophobicContact CE-CE2 4.43Å; M741-Y766 HydrophobicContact CE-CG 4.09Å; K745-Y766 WeakPolarHBondContact CE-OH 3.2Å; K745-Y766 PolarHBondContact NZ-OH 3.48Å; L762-Y766 HydrophobicContact CD1-CD2 3.75Å; L762-Y766 HydrophobicContact CD1-CE2 3.48Å; L762-Y766 VanDerWaalsContact CD1-CE2 3.48Å; L762-Y766 HydrophobicContact CD2-CE2 4.22Å; L762-Y766 HydrophobicContact CG-CD2 3.84Å; L762-Y766 HydrophobicContact CG-CE2 3.69Å; L762-Y766 VanDerWaalsContact O-CD2 3.27Å; L762-Y766 WeakPolarHBondContact O-CD2 3.42Å; L762-Y766 PolarHBondContact O-N 3.29Å; Y766-N768 VanDerWaalsContact C-N 3.32Å; Y766-N768 PolarHBondContact O-N 3.24Å; Y766-T769 WeakPolarHBondContact CA-OG1 3.5Å; Y766-T769 PolarHBondContact O-N 3.49Å; Y766-T769 PolarHBondContact O-OG1 2.83Å; Y766-L770 VanDerWaalsContact O-CB 3.3Å; Y766-L770 WeakPolarHBondContact O-CB 3.32Å; Y766-L770 VanDerWaalsContact O-CG 3.25Å; Y766-L770 WeakPolarHBondContact O-CG 2.95Å; Y766-L770 PolarHBondContact O-N 3.36Å; Y766-L792 HydrophobicContact CD1-CD2 4.17Å; Y766-L792 HydrophobicContact CE1-CD2 3.91Å; Y766-E795 HydrophobicContact CE1-CB 3.96Å; Y766-E795 WeakPolarHBondContact CE1-OE2 3.46Å; Y766-E795 PolarHBondContact OH-OE2 3.36Å; Y766-F796 HydrophobicContact CD1-CB 4.24Å; Y766-F796 HydrophobicContact CD2-CD2 4.23Å; Y766-F796 HydrophobicContact CG-CB 4.26Å; Y766-F796 AromaticContact CG-CD2 3.93Å; Y766-F796 HydrophobicContact CG-CD2 3.93Å; Y766-F796 HydrophobicContact CG-CG 4.46Å; Y766-L799 HydrophobicContact CD2-CD2 3.91Å; Y766-L799 HydrophobicContact CE2-CD2 4.04Å
767	L	79.8	Confident	77.5	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-61.9	-42.9	178.7	-179.6	58.8	0	0	0	111.1	G763 K764 L770 L771 F796 L811 R814 L815 L826	G763-L767 WeakPolarHBondContact O-CB 3.45Å; G763-L767 PolarHBondContact O-N 3.2Å; K764-L767 PolarHBondContact O-N 3.47Å; L767-L770 PolarHBondContact O-N 3.05Å; L767-L771 HydrophobicContact CD1-CD1 4.06Å; L767-L771 HydrophobicContact CD1-CG 4.12Å; L767-L771 HydrophobicContact CG-CD1 3.97Å; L767-L771 HydrophobicContact CG-CG 4.45Å; L767-L771 WeakPolarHBondContact O-CB 3.16Å; L767-L771 WeakPolarHBondContact O-CG 2.92Å; L767-L771 PolarHBondContact O-N 3.43Å; L767-F796 HydrophobicContact CB-CZ 4.35Å; L767-L811 HydrophobicContact CD2-CD2 4.16Å; L767-R814 HydrophobicContact CD2-CB 4.13Å; L767-R814 HydrophobicContact CD2-CG 4.01Å; L767-L815 HydrophobicContact CD1-CD1 4.45Å; L767-L815 HydrophobicContact CD1-CD2 3.58Å; L767-L815 HydrophobicContact CD1-CG 4.01Å; L767-L815 HydrophobicContact CD2-CG 4.1Å; L767-L826 HydrophobicContact CD1-CD1 4.36Å
768	N	82.9	Confident	76.9	Confident	46 Å²	46	37.9 Å²	37.9	25%	0.246	19%	0.193	C	C	.	.	H	α-helix	trans	-66.4	-44.8	-179.9	-63.5	-4.3	0	0	0	112.1	K764 L765 Y766 L770 L771 M772 R814	K764-N768 WeakPolarHBondContact O-CB 3.5Å; K764-N768 PolarHBondContact O-N 3.2Å; K764-N768 PolarHBondContact O-ND2 3.32Å; K764-N768 PolarHBondContact O-OD1 3.07Å; L765-N768 PolarHBondContact O-N 3.24Å; Y766-N768 VanDerWaalsContact C-N 3.32Å; Y766-N768 PolarHBondContact O-N 3.24Å; N768-L770 VanDerWaalsContact C-N 3.34Å; N768-L771 PolarHBondContact O-N 2.82Å; N768-M772 WeakPolarHBondContact O-CB 3.19Å; N768-M772 VanDerWaalsContact O-CG 3.3Å; N768-M772 WeakPolarHBondContact O-CG 3.21Å; N768-M772 PolarHBondContact O-N 3.09Å; N768-R814 PolarHBondContact ND2-NH1 3.39Å; N768-R814 PolarHBondContact OD1-NE 3.4Å; N768-R814 PolarHBondContact OD1-NH1 3.1Å; N768-R814 PolarHBondContact OD1-NH2 3.28Å
769	T	82.1	Confident	76	Confident	19 Å²	19	44.6 Å²	44.6	12%	0.117	23%	0.229	C	C	.	.	H	α-helix	trans	-65.1	-39	177.7	50.6	0	0	0	0	111.4	M741 L765 Y766 K773	M741-T769 HydrophobicContact SD-CG2 3.78Å; L765-T769 WeakPolarHBondContact O-CB 3.45Å; L765-T769 WeakPolarHBondContact O-CG2 3.5Å; L765-T769 PolarHBondContact O-N 3.4Å; L765-T769 PolarHBondContact O-OG1 3.19Å; Y766-T769 WeakPolarHBondContact CA-OG1 3.5Å; Y766-T769 PolarHBondContact O-N 3.49Å; Y766-T769 PolarHBondContact O-OG1 2.83Å; T769-K773 WeakPolarHBondContact O-CB 3.39Å; T769-K773 VanDerWaalsContact O-CG 3.28Å; T769-K773 WeakPolarHBondContact O-CG 3.49Å; T769-K773 PolarHBondContact O-N 2.87Å
770	L	82.3	Confident	75.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.1	-46.9	172.9	-75.8	172.4	0	0	0	112	Y766 L767 N768 K773 L774 I789 L792 R793 F796	Y766-L770 VanDerWaalsContact O-CB 3.3Å; Y766-L770 WeakPolarHBondContact O-CB 3.32Å; Y766-L770 VanDerWaalsContact O-CG 3.25Å; Y766-L770 WeakPolarHBondContact O-CG 2.95Å; Y766-L770 PolarHBondContact O-N 3.36Å; L767-L770 PolarHBondContact O-N 3.05Å; N768-L770 VanDerWaalsContact C-N 3.34Å; L770-K773 PolarHBondContact O-N 2.87Å; L770-L774 VanDerWaalsContact O-CB 3.3Å; L770-L774 WeakPolarHBondContact O-CB 3.31Å; L770-L774 WeakPolarHBondContact O-CG 3.48Å; L770-L774 PolarHBondContact O-N 3.28Å; L770-I789 HydrophobicContact CD2-CG2 4.48Å; L770-L792 HydrophobicContact CD2-CB 3.79Å; L770-R793 HydrophobicContact CD1-CG 4.27Å; L770-R793 HydrophobicContact CD2-CG 3.64Å; L770-F796 HydrophobicContact CD1-CB 4.18Å; L770-F796 HydrophobicContact CD1-CD1 3.9Å; L770-F796 HydrophobicContact CD1-CG 4.2Å
771	L	82	Confident	74.2	Confident	7 Å²	7	59.2 Å²	59.2	4%	0.037	30%	0.298	C	S	.	.	H	α-helix	trans	-62.4	-44	178.4	-72.3	171.6	0	0	0	111.8	L767 N768 L774 K775 E818 V822 L826	L767-L771 HydrophobicContact CD1-CD1 4.06Å; L767-L771 HydrophobicContact CD1-CG 4.12Å; L767-L771 HydrophobicContact CG-CD1 3.97Å; L767-L771 HydrophobicContact CG-CG 4.45Å; L767-L771 WeakPolarHBondContact O-CB 3.16Å; L767-L771 WeakPolarHBondContact O-CG 2.92Å; L767-L771 PolarHBondContact O-N 3.43Å; N768-L771 PolarHBondContact O-N 2.82Å; L771-L774 PolarHBondContact O-N 2.84Å; L771-K775 WeakPolarHBondContact O-CB 3.4Å; L771-K775 VanDerWaalsContact O-CG 3.29Å; L771-K775 WeakPolarHBondContact O-CG 3.33Å; L771-K775 PolarHBondContact O-N 3.04Å; L771-E818 HydrophobicContact CD1-CG 4.19Å; L771-E818 HydrophobicContact CD2-CG 4.06Å; L771-V822 HydrophobicContact CD2-CG1 3.51Å; L771-L826 HydrophobicContact CD2-CD1 4.06Å
772	M	81.1	Confident	73.8	Confident	139 Å²	139	61.7 Å²	61.7	69%	0.685	31%	0.311	S	S	*	.	H	α-helix	trans	-62	-48.1	175.8	-76.6	-71.3	-79.5	0	0	111.5	N768 L774 K775 S776	N768-M772 WeakPolarHBondContact O-CB 3.19Å; N768-M772 VanDerWaalsContact O-CG 3.3Å; N768-M772 WeakPolarHBondContact O-CG 3.21Å; N768-M772 PolarHBondContact O-N 3.09Å; M772-L774 PolarHBondContact O-N 3.47Å; M772-K775 PolarHBondContact O-N 2.97Å; M772-S776 PolarHBondContact O-N 3.11Å
773	K	78.1	Confident	73.5	Confident	53 Å²	53	67.2 Å²	67.2	23%	0.23	34%	0.341	C	S	.	.	H	α-helix	trans	-64.2	-40.9	178.3	-73.7	-176.1	-179.8	-169.3	0	111.7	T769 L770 S776 T777 M785 I789 L792	T769-K773 WeakPolarHBondContact O-CB 3.39Å; T769-K773 VanDerWaalsContact O-CG 3.28Å; T769-K773 WeakPolarHBondContact O-CG 3.49Å; T769-K773 PolarHBondContact O-N 2.87Å; L770-K773 PolarHBondContact O-N 2.87Å; K773-S776 WeakPolarHBondContact CA-OG 3.5Å; K773-S776 PolarHBondContact O-N 2.94Å; K773-S776 PolarHBondContact O-OG 3.37Å; K773-T777 WeakPolarHBondContact O-CG2 3.43Å; K773-T777 PolarHBondContact O-N 3.36Å; K773-M785 HydrophobicContact CG-CE 4.46Å; K773-I789 HydrophobicContact CB-CD1 4.21Å; K773-I789 HydrophobicContact CB-CG1 4.13Å; K773-I789 HydrophobicContact CD-CG1 4.34Å; K773-L792 HydrophobicContact CD-CD1 3.81Å
774	L	76.9	Confident	73.5	Confident	18 Å²	18	70.6 Å²	70.6	9%	0.094	36%	0.359	C	S	.	.	H	α-helix	trans	-63.1	-42.7	176.2	-75.5	171.7	0	0	0	112.3	L770 L771 M772 S776 T777 K825 L826	L770-L774 VanDerWaalsContact O-CB 3.3Å; L770-L774 WeakPolarHBondContact O-CB 3.31Å; L770-L774 WeakPolarHBondContact O-CG 3.48Å; L770-L774 PolarHBondContact O-N 3.28Å; L771-L774 PolarHBondContact O-N 2.84Å; M772-L774 PolarHBondContact O-N 3.47Å; L774-S776 VanDerWaalsContact C-N 3.26Å; L774-S776 PolarHBondContact O-N 3.32Å; L774-T777 PolarHBondContact O-N 3.26Å; L774-T777 PolarHBondContact O-OG1 3.19Å; L774-K825 HydrophobicContact CD2-CD 4.41Å; L774-L826 HydrophobicContact CD1-CD1 4.2Å; L774-L826 HydrophobicContact CD1-CD2 3.89Å; L774-L826 HydrophobicContact CD1-CG 4.01Å
775	K	74	Confident	73.1	Confident	116 Å²	116	69 Å²	69	50%	0.504	35%	0.353	S	S	.	.	H	α-helix	trans	-61.5	-34.1	174.7	-72.4	172.6	-175.1	175.1	0	111.8	L771 M772 E818	L771-K775 WeakPolarHBondContact O-CB 3.4Å; L771-K775 VanDerWaalsContact O-CG 3.29Å; L771-K775 WeakPolarHBondContact O-CG 3.33Å; L771-K775 PolarHBondContact O-N 3.04Å; M772-K775 PolarHBondContact O-N 2.97Å; K775-E818 IonicContact NZ-OE1 3.29Å; K775-E818 PolarHBondContact NZ-OE1 2.91Å; K775-E818 IonicContact NZ-OE2 2.76Å; K775-E818 PolarHBondContact NZ-OE2 3.46Å
776	S	69.6	Low	72.9	Confident	64 Å²	64	72.3 Å²	72.3	45%	0.448	37%	0.367	S	S	.	.	H	α-helix	trans	-74.8	-29.1	175.2	71.1	0	0	0	0	114.7	M772 K773 L774 D778	M772-S776 PolarHBondContact O-N 3.11Å; K773-S776 WeakPolarHBondContact CA-OG 3.5Å; K773-S776 PolarHBondContact O-N 2.94Å; K773-S776 PolarHBondContact O-OG 3.37Å; L774-S776 VanDerWaalsContact C-N 3.26Å; L774-S776 PolarHBondContact O-N 3.32Å; S776-D778 VanDerWaalsContact C-N 3.25Å; S776-D778 PolarHBondContact O-N 3.46Å
777	T	61.9	Low	72.8	Confident	42 Å²	42	77.3 Å²	77.3	26%	0.258	39%	0.389	S	S	.	.	H	α-helix	trans	-72.1	-14	-173.8	57.6	0	0	0	0	115	K773 L774 N779 I789	K773-T777 WeakPolarHBondContact O-CG2 3.43Å; K773-T777 PolarHBondContact O-N 3.36Å; L774-T777 PolarHBondContact O-N 3.26Å; L774-T777 PolarHBondContact O-OG1 3.19Å; T777-N779 PolarHBondContact O-N 3.02Å; T777-I789 HydrophobicContact CG2-CD1 3.24Å
778	D	57.9	Low	72.7	Confident	108 Å²	108	83.2 Å²	83.2	58%	0.578	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-12.6	-177.5	-74.7	-21	0	0	0	112.3	S776 K825	S776-D778 VanDerWaalsContact C-N 3.25Å; S776-D778 PolarHBondContact O-N 3.46Å; D778-K825 IonicContact OD1-NZ 3.92Å; D778-K825 PolarHBondContact OD1-NZ 3.39Å; D778-K825 VanDerWaalsContact OD1-NZ 3.14Å
779	N	55.9	Low	72.6	Confident	146 Å²	146	81.7 Å²	81.7	78%	0.781	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.7	2.4	-175.6	-68.5	-29.1	0	0	0	118.3	T777	T777-N779 PolarHBondContact O-N 3.02Å
780	L	55.6	Low	72.6	Confident	139 Å²	139	88.7 Å²	88.7	73%	0.728	43%	0.427	S	S	*	.			trans	-139.2	130.2	-174.4	-78.5	162.8	0	0	0	115.4	D782	L780-D782 PolarHBondContact O-N 2.99Å
781	F	58.3	Low	72.7	Confident	207 Å²	207	93 Å²	93	91%	0.908	45%	0.447	S	S	*	.			trans	-78.3	44.6	178.8	-77.7	-92.8	0	0	0	113.5
782	D	69.4	Low	72.6	Confident	78 Å²	78	93.6 Å²	93.6	42%	0.417	45%	0.451	S	S	.	.			trans	-96.1	109.8	-179.4	-168.3	11.1	0	0	0	111.4	L780 D784 M785 K786	L780-D782 PolarHBondContact O-N 2.99Å; D782-D784 PolarHBondContact O-N 3.23Å; D782-D784 PolarHBondContact OD1-N 2.74Å; D782-M785 HydrophobicContact CB-CB 4.11Å; D782-M785 HydrophobicContact CB-CG 4.17Å; D782-M785 PolarHBondContact O-N 2.9Å; D782-M785 WeakPolarHBondContact OD2-CG 3.33Å; D782-K786 PolarHBondContact O-N 3.43Å
783	D	75.4	Confident	72.8	Confident	119 Å²	119	89.7 Å²	89.7	64%	0.636	43%	0.428	S	S	*	.	H	α-helix	trans	-65.5	-28.5	178.1	-84.6	-22.4	0	0	0	112	K786 K787	D783-K786 PolarHBondContact O-N 2.92Å; D783-K786 IonicContact OD1-NZ 3.16Å; D783-K787 PolarHBondContact O-N 3.3Å
784	D	76	Confident	73	Confident	70 Å²	70	90.9 Å²	90.9	37%	0.374	44%	0.44	S	S	.	.	H	α-helix	trans	-69.4	-40.1	177.8	-159.3	48.5	0	0	0	111	D782 K787 R788	D782-D784 PolarHBondContact O-N 3.23Å; D782-D784 PolarHBondContact OD1-N 2.74Å; D784-K787 WeakPolarHBondContact O-CB 3.47Å; D784-K787 PolarHBondContact O-N 2.98Å; D784-R788 WeakPolarHBondContact O-CG 3.46Å; D784-R788 PolarHBondContact O-N 2.95Å; D784-R788 IonicContact OD2-CZ 3.76Å; D784-R788 IonicContact OD2-NE 2.75Å; D784-R788 PolarHBondContact OD2-NE 3.16Å; D784-R788 IonicContact OD2-NH2 2.85Å; D784-R788 PolarHBondContact OD2-NH2 2.75Å
785	M	73.1	Confident	73.2	Confident	52 Å²	52	93 Å²	93	26%	0.256	45%	0.45	S	S	.	.	H	α-helix	trans	-63.7	-42	173.9	-79.2	-65.1	-69.9	0	0	112.6	K773 D782 K787 R788 I789	K773-M785 HydrophobicContact CG-CE 4.46Å; D782-M785 HydrophobicContact CB-CB 4.11Å; D782-M785 HydrophobicContact CB-CG 4.17Å; D782-M785 PolarHBondContact O-N 2.9Å; D782-M785 WeakPolarHBondContact OD2-CG 3.33Å; M785-K787 VanDerWaalsContact C-N 3.28Å; M785-K787 PolarHBondContact O-N 3.23Å; M785-R788 PolarHBondContact O-N 2.94Å; M785-I789 VanDerWaalsContact O-CG1 3.28Å; M785-I789 WeakPolarHBondContact O-CG1 3.31Å; M785-I789 PolarHBondContact O-N 2.82Å
786	K	76.6	Confident	73.7	Confident	86 Å²	86	87.6 Å²	87.6	37%	0.374	43%	0.426	S	S	.	.	H	α-helix	trans	-61.2	-38.9	174.4	-71.9	176.8	-173.2	163.5	0	111.6	D782 D783 I789 R790	D782-K786 PolarHBondContact O-N 3.43Å; D783-K786 PolarHBondContact O-N 2.92Å; D783-K786 IonicContact OD1-NZ 3.16Å; K786-I789 PolarHBondContact O-N 3.14Å; K786-R790 WeakPolarHBondContact O-CG 3.27Å; K786-R790 PolarHBondContact O-N 2.78Å
787	K	79.1	Confident	74.3	Confident	113 Å²	113	85.5 Å²	85.5	49%	0.491	41%	0.411	S	S	.	.	H	α-helix	trans	-63.9	-49.1	176.2	-169.6	-175	173.5	-166.9	0	111.3	D783 D784 M785 I789 R790 E791	D783-K787 PolarHBondContact O-N 3.3Å; D784-K787 WeakPolarHBondContact O-CB 3.47Å; D784-K787 PolarHBondContact O-N 2.98Å; M785-K787 VanDerWaalsContact C-N 3.28Å; M785-K787 PolarHBondContact O-N 3.23Å; K787-I789 VanDerWaalsContact C-N 3.3Å; K787-I789 PolarHBondContact O-N 3.18Å; K787-R790 WeakPolarHBondContact O-CB 3.3Å; K787-R790 PolarHBondContact O-N 3.43Å; K787-R790 VanDerWaalsContact O-N 3.09Å; K787-E791 VanDerWaalsContact CE-OE1 3.3Å; K787-E791 WeakPolarHBondContact CE-OE1 3.37Å; K787-E791 WeakPolarHBondContact O-CG 3.45Å; K787-E791 PolarHBondContact O-N 3.32Å
788	R	78.6	Confident	75.1	Confident	125 Å²	125	88.8 Å²	88.8	47%	0.472	42%	0.423	S	S	.	.	H	α-helix	trans	-59.9	-36.7	175.8	-68.5	-179	-161.2	-167.7	5.7	113	D784 M785 L792	D784-R788 WeakPolarHBondContact O-CG 3.46Å; D784-R788 PolarHBondContact O-N 2.95Å; D784-R788 IonicContact OD2-CZ 3.76Å; D784-R788 IonicContact OD2-NE 2.75Å; D784-R788 PolarHBondContact OD2-NE 3.16Å; D784-R788 IonicContact OD2-NH2 2.85Å; D784-R788 PolarHBondContact OD2-NH2 2.75Å; M785-R788 PolarHBondContact O-N 2.94Å; R788-L792 WeakPolarHBondContact O-CB 3.42Å; R788-L792 WeakPolarHBondContact O-CG 3.46Å; R788-L792 PolarHBondContact O-N 3.31Å
789	I	81.3	Confident	76.1	Confident	14 Å²	14	84.9 Å²	84.9	7%	0.072	40%	0.403	C	S	.	.	H	α-helix	trans	-67	-42.9	174.9	-69.5	166	0	0	0	110.7	L770 K773 T777 M785 K786 K787 E791 L792 R793	L770-I789 HydrophobicContact CD2-CG2 4.48Å; K773-I789 HydrophobicContact CB-CD1 4.21Å; K773-I789 HydrophobicContact CB-CG1 4.13Å; K773-I789 HydrophobicContact CD-CG1 4.34Å; T777-I789 HydrophobicContact CG2-CD1 3.24Å; M785-I789 VanDerWaalsContact O-CG1 3.28Å; M785-I789 WeakPolarHBondContact O-CG1 3.31Å; M785-I789 PolarHBondContact O-N 2.82Å; K786-I789 PolarHBondContact O-N 3.14Å; K787-I789 VanDerWaalsContact C-N 3.3Å; K787-I789 PolarHBondContact O-N 3.18Å; I789-E791 VanDerWaalsContact C-N 3.34Å; I789-E791 PolarHBondContact O-N 3.16Å; I789-L792 PolarHBondContact O-N 2.83Å; I789-R793 HydrophobicContact CG2-CG 4.32Å; I789-R793 WeakPolarHBondContact O-CB 3.43Å; I789-R793 WeakPolarHBondContact O-CG 3.48Å; I789-R793 PolarHBondContact O-N 3.28Å
790	R	82.6	Confident	77.2	Confident	166 Å²	166	78 Å²	78	63%	0.626	37%	0.365	S	S	*	.	H	α-helix	trans	-61.1	-43.9	175.7	-71.6	172.2	-170.1	153.9	2.5	111.4	K786 K787 R793 T794	K786-R790 WeakPolarHBondContact O-CG 3.27Å; K786-R790 PolarHBondContact O-N 2.78Å; K787-R790 WeakPolarHBondContact O-CB 3.3Å; K787-R790 PolarHBondContact O-N 3.43Å; K787-R790 VanDerWaalsContact O-N 3.09Å; R790-R793 PolarHBondContact O-N 2.84Å; R790-T794 WeakPolarHBondContact O-CG2 3.45Å; R790-T794 PolarHBondContact O-N 3.37Å; R790-T794 PolarHBondContact O-OG1 3.27Å
791	E	82.8	Confident	77.9	Confident	90 Å²	90	75.1 Å²	75.1	42%	0.421	35%	0.345	S	S	.	.	H	α-helix	trans	-59.2	-52.4	176.3	-71.9	166.3	-178.9	0	0	110.9	K787 I789 R793 T794 E795	K787-E791 VanDerWaalsContact CE-OE1 3.3Å; K787-E791 WeakPolarHBondContact CE-OE1 3.37Å; K787-E791 WeakPolarHBondContact O-CG 3.45Å; K787-E791 PolarHBondContact O-N 3.32Å; I789-E791 VanDerWaalsContact C-N 3.34Å; I789-E791 PolarHBondContact O-N 3.16Å; E791-R793 VanDerWaalsContact C-N 3.3Å; E791-R793 PolarHBondContact O-N 3.41Å; E791-T794 WeakPolarHBondContact CA-OG1 3.44Å; E791-T794 PolarHBondContact O-N 3.34Å; E791-T794 VanDerWaalsContact O-N 3.08Å; E791-T794 PolarHBondContact O-OG1 2.95Å; E791-E795 WeakPolarHBondContact O-CG 3.39Å; E791-E795 PolarHBondContact O-N 3.34Å
792	L	80.5	Confident	78.5	Confident	21 Å²	21	73.4 Å²	73.4	11%	0.11	33%	0.334	C	S	.	.	H	α-helix	trans	-58.2	-39	176.8	-76.5	175	0	0	0	113.3	M741 Y766 L770 K773 R788 I789 E795 F796	M741-L792 HydrophobicContact CE-CD2 4.04Å; Y766-L792 HydrophobicContact CD1-CD2 4.17Å; Y766-L792 HydrophobicContact CE1-CD2 3.91Å; L770-L792 HydrophobicContact CD2-CB 3.79Å; K773-L792 HydrophobicContact CD-CD1 3.81Å; R788-L792 WeakPolarHBondContact O-CB 3.42Å; R788-L792 WeakPolarHBondContact O-CG 3.46Å; R788-L792 PolarHBondContact O-N 3.31Å; I789-L792 PolarHBondContact O-N 2.83Å; L792-E795 PolarHBondContact O-N 2.84Å; L792-F796 VanDerWaalsContact O-CB 3.29Å; L792-F796 WeakPolarHBondContact O-CB 3.36Å; L792-F796 PolarHBondContact O-N 3.44Å
793	R	85.8	Confident	78.5	Confident	56 Å²	56	70.3 Å²	70.3	21%	0.211	32%	0.318	C	S	.	.	H	α-helix	trans	-66	-41.6	176	-73.6	-178.6	69.6	173.1	12.5	112	L770 I789 R790 E791 F796 C797 K825 E829	L770-R793 HydrophobicContact CD1-CG 4.27Å; L770-R793 HydrophobicContact CD2-CG 3.64Å; I789-R793 HydrophobicContact CG2-CG 4.32Å; I789-R793 WeakPolarHBondContact O-CB 3.43Å; I789-R793 WeakPolarHBondContact O-CG 3.48Å; I789-R793 PolarHBondContact O-N 3.28Å; R790-R793 PolarHBondContact O-N 2.84Å; E791-R793 VanDerWaalsContact C-N 3.3Å; E791-R793 PolarHBondContact O-N 3.41Å; R793-F796 PolarHBondContact O-N 2.99Å; R793-C797 WeakPolarHBondContact O-CB 3.22Å; R793-C797 PolarHBondContact O-N 3.44Å; R793-C797 PolarHBondContact O-SG 2.94Å; R793-K825 VanDerWaalsContact CZ-O 3.28Å; R793-K825 PolarHBondContact NH1-O 3.11Å; R793-K825 PolarHBondContact NH2-O 3.43Å; R793-E829 WeakPolarHBondContact CB-OE1 3.22Å; R793-E829 WeakPolarHBondContact CG-OE1 3.34Å; R793-E829 IonicContact CZ-OE1 3.67Å; R793-E829 IonicContact CZ-OE2 2.65Å; R793-E829 IonicContact NE-OE1 3.18Å; R793-E829 PolarHBondContact NE-OE1 3.19Å; R793-E829 IonicContact NE-OE2 3.22Å; R793-E829 IonicContact NH2-OE1 3.71Å; R793-E829 PolarHBondContact NH2-OE1 3.29Å; R793-E829 IonicContact NH2-OE2 3.86Å; R793-E829 PolarHBondContact NH2-OE2 3.32Å
794	T	81.8	Confident	78	Confident	78 Å²	78	71.4 Å²	71.4	48%	0.479	32%	0.323	S	S	.	.	H	α-helix	trans	-64.7	-42.6	176.3	53.3	0	0	0	0	111.7	R790 E791 C797 Q798	R790-T794 WeakPolarHBondContact O-CG2 3.45Å; R790-T794 PolarHBondContact O-N 3.37Å; R790-T794 PolarHBondContact O-OG1 3.27Å; E791-T794 WeakPolarHBondContact CA-OG1 3.44Å; E791-T794 PolarHBondContact O-N 3.34Å; E791-T794 VanDerWaalsContact O-N 3.08Å; E791-T794 PolarHBondContact O-OG1 2.95Å; T794-C797 PolarHBondContact O-N 2.73Å; T794-Q798 WeakPolarHBondContact O-CB 3.31Å; T794-Q798 VanDerWaalsContact O-CG 3.24Å; T794-Q798 WeakPolarHBondContact O-CG 3.36Å; T794-Q798 PolarHBondContact O-N 3.36Å
795	E	81.5	Confident	77.5	Confident	64 Å²	64	71.5 Å²	71.5	30%	0.299	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-44.9	175.4	-68.5	-176.3	147.2	0	0	111.7	K745 Y766 E791 L792 Q798 L799	K745-E795 IonicContact NZ-OE1 3.8Å; K745-E795 PolarHBondContact NZ-OE1 3.44Å; K745-E795 IonicContact NZ-OE2 3.94Å; K745-E795 PolarHBondContact NZ-OE2 3Å; Y766-E795 HydrophobicContact CE1-CB 3.96Å; Y766-E795 WeakPolarHBondContact CE1-OE2 3.46Å; Y766-E795 PolarHBondContact OH-OE2 3.36Å; E791-E795 WeakPolarHBondContact O-CG 3.39Å; E791-E795 PolarHBondContact O-N 3.34Å; L792-E795 PolarHBondContact O-N 2.84Å; E795-Q798 WeakPolarHBondContact O-CB 3.44Å; E795-Q798 PolarHBondContact O-N 2.71Å; E795-L799 PolarHBondContact O-N 2.63Å
796	F	85	Confident	77.4	Confident	1 Å²	1	69.3 Å²	69.3	0%	0.004	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-43	178.3	-177.9	-124	0	0	0	112.1	Y766 L767 L770 L792 R793 Q798 L799 I800 E829	Y766-F796 HydrophobicContact CD1-CB 4.24Å; Y766-F796 HydrophobicContact CD2-CD2 4.23Å; Y766-F796 HydrophobicContact CG-CB 4.26Å; Y766-F796 AromaticContact CG-CD2 3.93Å; Y766-F796 HydrophobicContact CG-CD2 3.93Å; Y766-F796 HydrophobicContact CG-CG 4.46Å; L767-F796 HydrophobicContact CB-CZ 4.35Å; L770-F796 HydrophobicContact CD1-CB 4.18Å; L770-F796 HydrophobicContact CD1-CD1 3.9Å; L770-F796 HydrophobicContact CD1-CG 4.2Å; L792-F796 VanDerWaalsContact O-CB 3.29Å; L792-F796 WeakPolarHBondContact O-CB 3.36Å; L792-F796 PolarHBondContact O-N 3.44Å; R793-F796 PolarHBondContact O-N 2.99Å; F796-Q798 VanDerWaalsContact C-N 3.29Å; F796-Q798 PolarHBondContact O-N 3.33Å; F796-L799 PolarHBondContact O-N 3.49Å; F796-I800 HydrophobicContact CD1-CD1 3.8Å; F796-I800 HydrophobicContact CD2-CD1 4.13Å; F796-I800 HydrophobicContact CD2-CG1 4.33Å; F796-I800 HydrophobicContact CE1-CD1 3.43Å; F796-I800 VanDerWaalsContact CE1-CD1 3.43Å; F796-I800 HydrophobicContact CE2-CD1 3.79Å; F796-I800 HydrophobicContact CE2-CG1 4.04Å; F796-I800 HydrophobicContact CG-CD1 4.15Å; F796-I800 HydrophobicContact CZ-CD1 3.44Å; F796-I800 VanDerWaalsContact CZ-CD1 3.44Å; F796-I800 HydrophobicContact CZ-CG1 4.16Å; F796-I800 WeakPolarHBondContact O-CG1 3.2Å; F796-I800 PolarHBondContact O-N 3.03Å; F796-E829 HydrophobicContact CD1-CB 4.21Å; F796-E829 HydrophobicContact CD1-CG 3.54Å; F796-E829 HydrophobicContact CE1-CB 3.95Å; F796-E829 HydrophobicContact CE1-CG 3.78Å
797	C	81	Confident	77	Confident	20 Å²	20	67 Å²	67	14%	0.135	31%	0.308	C	S	.	.	H	α-helix	trans	-62	-36.9	174.1	-72.7	0	0	0	0	112.2	R793 T794 R801 I832	R793-C797 WeakPolarHBondContact O-CB 3.22Å; R793-C797 PolarHBondContact O-N 3.44Å; R793-C797 PolarHBondContact O-SG 2.94Å; T794-C797 PolarHBondContact O-N 2.73Å; C797-R801 WeakPolarHBondContact O-CB 3.45Å; C797-R801 PolarHBondContact O-N 2.73Å; C797-R801 VanDerWaalsContact O-N 3.12Å; C797-I832 HydrophobicContact CB-CD1 4.01Å
798	Q	78.7	Confident	76.5	Confident	111 Å²	111	63.2 Å²	63.2	52%	0.519	29%	0.292	S	S	.	.	H	α-helix	trans	-65.9	-45.4	174.6	-75	172.6	0.3	0	0	111.2	T794 E795 F796 I800 R801 Y802	T794-Q798 WeakPolarHBondContact O-CB 3.31Å; T794-Q798 VanDerWaalsContact O-CG 3.24Å; T794-Q798 WeakPolarHBondContact O-CG 3.36Å; T794-Q798 PolarHBondContact O-N 3.36Å; E795-Q798 WeakPolarHBondContact O-CB 3.44Å; E795-Q798 PolarHBondContact O-N 2.71Å; F796-Q798 VanDerWaalsContact C-N 3.29Å; F796-Q798 PolarHBondContact O-N 3.33Å; Q798-I800 PolarHBondContact O-N 3.09Å; Q798-R801 PolarHBondContact O-N 3.28Å; Q798-Y802 HydrophobicContact CB-CD2 4.41Å; Q798-Y802 WeakPolarHBondContact O-CD2 3.45Å; Q798-Y802 PolarHBondContact O-N 3.24Å
799	L	79	Confident	76.3	Confident	27 Å²	27	65.3 Å²	65.3	14%	0.141	30%	0.304	C	S	.	.	H	α-helix	trans	-56.8	-52.6	177.7	-177.9	73.2	0	0	0	111.4	L762 Y766 E795 F796 R801 Y802 S803 I806	L762-L799 HydrophobicContact CB-CD2 4.36Å; L762-L799 HydrophobicContact CD2-CD1 3.77Å; L762-L799 HydrophobicContact CD2-CD2 3.94Å; L762-L799 HydrophobicContact CG-CD2 3.79Å; Y766-L799 HydrophobicContact CD2-CD2 3.91Å; Y766-L799 HydrophobicContact CE2-CD2 4.04Å; E795-L799 PolarHBondContact O-N 2.63Å; F796-L799 PolarHBondContact O-N 3.49Å; L799-R801 PolarHBondContact O-N 2.89Å; L799-Y802 PolarHBondContact O-N 2.94Å; L799-S803 WeakPolarHBondContact O-CB 3.39Å; L799-S803 PolarHBondContact O-N 2.62Å; L799-S803 PolarHBondContact O-OG 3.13Å; L799-I806 HydrophobicContact CD2-CD1 4.09Å; L799-I806 HydrophobicContact CG-CD1 3.9Å
800	I	78.3	Confident	76	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.9	-35.1	179.8	-59.3	161.6	0	0	0	111.2	F796 Q798 I832 L833 K836	F796-I800 HydrophobicContact CD1-CD1 3.8Å; F796-I800 HydrophobicContact CD2-CD1 4.13Å; F796-I800 HydrophobicContact CD2-CG1 4.33Å; F796-I800 HydrophobicContact CE1-CD1 3.43Å; F796-I800 VanDerWaalsContact CE1-CD1 3.43Å; F796-I800 HydrophobicContact CE2-CD1 3.79Å; F796-I800 HydrophobicContact CE2-CG1 4.04Å; F796-I800 HydrophobicContact CG-CD1 4.15Å; F796-I800 HydrophobicContact CZ-CD1 3.44Å; F796-I800 VanDerWaalsContact CZ-CD1 3.44Å; F796-I800 HydrophobicContact CZ-CG1 4.16Å; F796-I800 WeakPolarHBondContact O-CG1 3.2Å; F796-I800 PolarHBondContact O-N 3.03Å; Q798-I800 PolarHBondContact O-N 3.09Å; I800-I832 HydrophobicContact CB-CG2 4.16Å; I800-I832 HydrophobicContact CG2-CB 4.3Å; I800-I832 HydrophobicContact CG2-CG2 3.6Å; I800-L833 HydrophobicContact CD1-CD1 4.3Å; I800-L833 HydrophobicContact CD1-CD2 4.03Å; I800-L833 HydrophobicContact CD1-CG 3.94Å; I800-L833 HydrophobicContact CG1-CD2 4.11Å; I800-L833 HydrophobicContact CG2-CD2 3.59Å; I800-L833 HydrophobicContact CG2-CG 4.01Å; I800-K836 VanDerWaalsContact O-CE 3.31Å; I800-K836 WeakPolarHBondContact O-CE 3.13Å
801	R	72.1	Confident	75.9	Confident	80 Å²	80	59.5 Å²	59.5	30%	0.302	29%	0.288	S	S	.	.	H	α-helix	trans	-69.8	-44.9	-176.6	-173.1	175.1	-64.4	-164.2	-1.5	112.6	C797 Q798 L799 K836 Q867	C797-R801 WeakPolarHBondContact O-CB 3.45Å; C797-R801 PolarHBondContact O-N 2.73Å; C797-R801 VanDerWaalsContact O-N 3.12Å; Q798-R801 PolarHBondContact O-N 3.28Å; L799-R801 PolarHBondContact O-N 2.89Å; R801-K836 WeakPolarHBondContact O-CE 3.39Å; R801-K836 PolarHBondContact O-NZ 3.19Å; R801-K836 VanDerWaalsContact O-NZ 3.14Å; R801-Q867 PolarHBondContact O-NE2 3.07Å
802	Y	69.5	Low	75.5	Confident	171 Å²	171	55.8 Å²	55.8	67%	0.671	27%	0.271	S	S	*	.	H	α-helix	trans	-95.2	-30.4	-170.6	-66.9	-64.6	0	0	0	114.2	Q798 L799 L804	Q798-Y802 HydrophobicContact CB-CD2 4.41Å; Q798-Y802 WeakPolarHBondContact O-CD2 3.45Å; Q798-Y802 PolarHBondContact O-N 3.24Å; L799-Y802 PolarHBondContact O-N 2.94Å; Y802-L804 PolarHBondContact O-N 3.44Å
803	S	70.4	Confident	75.4	Confident	13 Å²	13	59.5 Å²	59.5	9%	0.091	29%	0.29	C	S	.	.			trans	-72.3	129.5	176.6	63	0	0	0	0	110.7	L799 I806	L799-S803 WeakPolarHBondContact O-CB 3.39Å; L799-S803 PolarHBondContact O-N 2.62Å; L799-S803 PolarHBondContact O-OG 3.13Å; S803-I806 WeakPolarHBondContact OG-CD1 3.29Å; S803-I806 WeakPolarHBondContact OG-CG1 3.15Å
804	L	63.5	Low	75.1	Confident	141 Å²	141	61.9 Å²	61.9	74%	0.738	30%	0.299	S	S	*	.	S	Bend	trans	-90.3	-8.2	174.1	-63.9	174	0	0	0	112.2	Y802	Y802-L804 PolarHBondContact O-N 3.44Å
805	L	66.4	Low	74.9	Confident	73 Å²	73	58.2 Å²	58.2	38%	0.382	28%	0.277	S	S	.	.			trans	-101.5	-3	-167.4	-65.3	166.5	0	0	0	113.6	C754 P756 H759	C754-L805 WeakPolarHBondContact O-CD1 3.28Å; P756-L805 HydrophobicContact CB-CB 4.05Å; P756-L805 HydrophobicContact CB-CD2 4.37Å; P756-L805 WeakPolarHBondContact CB-O 3.32Å; H759-L805 HydrophobicContact CB-CB 4.46Å; H759-L805 VanDerWaalsContact CE1-CD1 3.45Å; H759-L805 WeakPolarHBondContact CE1-CD1 3.3Å
806	I	70.2	Confident	74.8	Confident	5 Å²	5	58.8 Å²	58.8	3%	0.026	28%	0.279	C	S	.	.			trans	-73.9	131.3	-179.1	-71.3	-178.3	0	0	0	111.3	H759 N760 L799 S803 H808 L811	H759-I806 HydrophobicContact CB-CG1 3.77Å; N760-I806 VanDerWaalsContact OD1-CA 3.23Å; N760-I806 WeakPolarHBondContact OD1-CA 3.5Å; L799-I806 HydrophobicContact CD2-CD1 4.09Å; L799-I806 HydrophobicContact CG-CD1 3.9Å; S803-I806 WeakPolarHBondContact OG-CD1 3.29Å; S803-I806 WeakPolarHBondContact OG-CG1 3.15Å; I806-H808 PolarHBondContact O-CE1 2.89Å; I806-H808 PolarHBondContact O-N 3.34Å; I806-H808 VanDerWaalsContact O-N 3.08Å; I806-H808 PolarHBondContact O-ND1 3.12Å; I806-H808 VanDerWaalsContact O-ND1 3.08Å; I806-L811 HydrophobicContact CG2-CD1 3.62Å
807	S	69.2	Low	74.5	Confident	39 Å²	39	65.7 Å²	65.7	27%	0.273	32%	0.317	S	S	.	.			trans	-77.5	87.5	170.2	63	0	0	0	0	110.1	N760 K809 T810	N760-S807 PolarHBondContact ND2-OG 3.3Å; N760-S807 PolarHBondContact OD1-N 3.09Å; N760-S807 PolarHBondContact OD1-OG 3.29Å; S807-K809 PolarHBondContact O-N 3.48Å; S807-K809 VanDerWaalsContact O-N 3.11Å; S807-T810 PolarHBondContact O-N 3.37Å; S807-T810 PolarHBondContact O-OG1 2.95Å; S807-T810 VanDerWaalsContact O-OG1 3.06Å; S807-T810 PolarHBondContact OG-OG1 2.96Å
808	H	69.4	Low	74.4	Confident	33 Å²	33	66.9 Å²	66.9	15%	0.153	32%	0.32	C	S	.	.	H	α-helix	trans	-51.3	-36.6	-179.7	-50.9	93.7	0	0	0	113.1	I806 T810 L811 L812 K836	I806-H808 PolarHBondContact O-CE1 2.89Å; I806-H808 PolarHBondContact O-N 3.34Å; I806-H808 VanDerWaalsContact O-N 3.08Å; I806-H808 PolarHBondContact O-ND1 3.12Å; I806-H808 VanDerWaalsContact O-ND1 3.08Å; H808-T810 PolarHBondContact O-N 3.19Å; H808-L811 PolarHBondContact O-N 3.02Å; H808-L812 WeakPolarHBondContact O-CB 3.37Å; H808-L812 WeakPolarHBondContact O-CG 3.33Å; H808-L812 PolarHBondContact O-N 3.46Å; H808-K836 WeakPolarHBondContact CD2-CB 3.36Å; H808-K836 WeakPolarHBondContact NE2-CB 3.45Å; H808-K836 VanDerWaalsContact NE2-CG 3.34Å; H808-K836 WeakPolarHBondContact NE2-CG 3.31Å
809	K	73.4	Confident	74.3	Confident	169 Å²	169	64.8 Å²	64.8	74%	0.735	32%	0.318	S	S	*	.	H	α-helix	trans	-55.5	-51.1	-179.4	-63.1	-177.3	-179.9	178.9	0	112.6	S807 L811 L812 D813	S807-K809 PolarHBondContact O-N 3.48Å; S807-K809 VanDerWaalsContact O-N 3.11Å; K809-L811 VanDerWaalsContact C-N 3.31Å; K809-L811 PolarHBondContact O-N 3.32Å; K809-L812 PolarHBondContact O-N 3.47Å; K809-D813 PolarHBondContact O-N 3.04Å
810	T	76.1	Confident	74.1	Confident	57 Å²	57	68 Å²	68	35%	0.35	34%	0.338	S	S	.	.	H	α-helix	trans	-67.5	-30.4	-175.2	60.8	0	0	0	0	113.8	S807 H808 R814	S807-T810 PolarHBondContact O-N 3.37Å; S807-T810 PolarHBondContact O-OG1 2.95Å; S807-T810 VanDerWaalsContact O-OG1 3.06Å; S807-T810 PolarHBondContact OG-OG1 2.96Å; H808-T810 PolarHBondContact O-N 3.19Å; T810-R814 PolarHBondContact O-N 2.87Å
811	L	79.1	Confident	74	Confident	0 Å²	0	71 Å²	71	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-79.4	-38.7	178.5	-66.1	176.3	0	0	0	110.9	K764 L767 I806 H808 K809 R814 L815 L833	K764-L811 HydrophobicContact CG-CD2 3.99Å; L767-L811 HydrophobicContact CD2-CD2 4.16Å; I806-L811 HydrophobicContact CG2-CD1 3.62Å; H808-L811 PolarHBondContact O-N 3.02Å; K809-L811 VanDerWaalsContact C-N 3.31Å; K809-L811 PolarHBondContact O-N 3.32Å; L811-R814 PolarHBondContact O-N 3.02Å; L811-L815 PolarHBondContact O-N 3.48Å; L811-L833 HydrophobicContact CB-CD1 4.05Å; L811-L833 HydrophobicContact CB-CD2 4.24Å; L811-L833 HydrophobicContact CD1-CD2 3.98Å
812	L	75.1	Confident	74.3	Confident	12 Å²	12	68.1 Å²	68.1	6%	0.063	36%	0.355	C	S	.	.	H	α-helix	trans	-63.6	-46.2	174.3	-73.9	171.4	0	0	0	111.4	H808 K809 R814 L815 H816 L833 E834 A837	H808-L812 WeakPolarHBondContact O-CB 3.37Å; H808-L812 WeakPolarHBondContact O-CG 3.33Å; H808-L812 PolarHBondContact O-N 3.46Å; K809-L812 PolarHBondContact O-N 3.47Å; L812-R814 PolarHBondContact O-N 3.05Å; L812-L815 PolarHBondContact O-N 2.72Å; L812-L815 VanDerWaalsContact O-N 3.08Å; L812-H816 WeakPolarHBondContact O-CB 3.18Å; L812-H816 PolarHBondContact O-CD2 3.44Å; L812-H816 PolarHBondContact O-N 3.03Å; L812-L833 HydrophobicContact CD1-CB 4.47Å; L812-L833 HydrophobicContact CD2-CB 3.67Å; L812-L833 HydrophobicContact CD2-CD1 4.31Å; L812-L833 HydrophobicContact CG-CB 4Å; L812-E834 HydrophobicContact CD2-CG 3.97Å; L812-A837 HydrophobicContact CD1-CB 4.22Å
813	D	78	Confident	74.5	Confident	99 Å²	99	61.3 Å²	61.3	53%	0.529	33%	0.329	S	S	.	.	H	α-helix	trans	-57.3	-40	177.9	-66.6	-23.5	0	0	0	111.7	K809 N817	K809-D813 PolarHBondContact O-N 3.04Å; D813-N817 VanDerWaalsContact O-CG 3.28Å; D813-N817 PolarHBondContact O-N 2.87Å; D813-N817 PolarHBondContact O-ND2 3.03Å
814	R	80.1	Confident	74.7	Confident	106 Å²	106	66.1 Å²	66.1	40%	0.4	35%	0.348	S	S	.	.	H	α-helix	trans	-68.8	-39.2	176.5	-173.4	169.5	-175.1	147.9	6	112.8	L767 N768 T810 L811 L812	L767-R814 HydrophobicContact CD2-CB 4.13Å; L767-R814 HydrophobicContact CD2-CG 4.01Å; N768-R814 PolarHBondContact ND2-NH1 3.39Å; N768-R814 PolarHBondContact OD1-NE 3.4Å; N768-R814 PolarHBondContact OD1-NH1 3.1Å; N768-R814 PolarHBondContact OD1-NH2 3.28Å; T810-R814 PolarHBondContact O-N 2.87Å; L811-R814 PolarHBondContact O-N 3.02Å; L812-R814 PolarHBondContact O-N 3.05Å
815	L	77.8	Confident	75.6	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-70.7	-36.8	177.7	-80.1	166.7	0	0	0	112.2	L767 L811 L812 N817 E818 Q823 L826 I830 L833	L767-L815 HydrophobicContact CD1-CD1 4.45Å; L767-L815 HydrophobicContact CD1-CD2 3.58Å; L767-L815 HydrophobicContact CD1-CG 4.01Å; L767-L815 HydrophobicContact CD2-CG 4.1Å; L811-L815 PolarHBondContact O-N 3.48Å; L812-L815 PolarHBondContact O-N 2.72Å; L812-L815 VanDerWaalsContact O-N 3.08Å; L815-N817 VanDerWaalsContact C-N 3.29Å; L815-N817 PolarHBondContact O-N 3.1Å; L815-E818 PolarHBondContact O-N 3.32Å; L815-Q823 PolarHBondContact O-NE2 3.46Å; L815-L826 HydrophobicContact CD2-CD1 3.77Å; L815-I830 HydrophobicContact CD1-CG1 4Å; L815-L833 HydrophobicContact CD1-CD1 3.62Å
816	H	78.2	Confident	76.3	Confident	76 Å²	76	60.2 Å²	60.2	35%	0.352	31%	0.313	S	S	.	.	H	α-helix	trans	-66.8	-29.8	176.4	-73	-49.8	0	0	0	112.7	L812 E818 Q823 E834	L812-H816 WeakPolarHBondContact O-CB 3.18Å; L812-H816 PolarHBondContact O-CD2 3.44Å; L812-H816 PolarHBondContact O-N 3.03Å; H816-E818 VanDerWaalsContact C-N 3.31Å; H816-Q823 PolarHBondContact O-NE2 2.89Å; H816-E834 IonicContact NE2-OE1 2.99Å
817	N	79	Confident	76.8	Confident	147 Å²	147	60 Å²	60	79%	0.786	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-15.6	175	-72.4	-17.8	0	0	0	114.1	D813 L815	D813-N817 VanDerWaalsContact O-CG 3.28Å; D813-N817 PolarHBondContact O-N 2.87Å; D813-N817 PolarHBondContact O-ND2 3.03Å; L815-N817 VanDerWaalsContact C-N 3.29Å; L815-N817 PolarHBondContact O-N 3.1Å
818	E	79.1	Confident	77.4	Confident	44 Å²	44	62.1 Å²	62.1	21%	0.206	32%	0.315	C	S	.	.	S	Bend	trans	-85	158.5	176.5	-73.8	-78.3	178.3	0	0	111.6	L771 K775 L815 H816 V822 Q823	L771-E818 HydrophobicContact CD1-CG 4.19Å; L771-E818 HydrophobicContact CD2-CG 4.06Å; K775-E818 IonicContact NZ-OE1 3.29Å; K775-E818 PolarHBondContact NZ-OE1 2.91Å; K775-E818 IonicContact NZ-OE2 2.76Å; K775-E818 PolarHBondContact NZ-OE2 3.46Å; L815-E818 PolarHBondContact O-N 3.32Å; H816-E818 VanDerWaalsContact C-N 3.31Å; E818-V822 HydrophobicContact CB-CB 4.48Å; E818-V822 HydrophobicContact CB-CG1 4.4Å; E818-Q823 PolarHBondContact O-NE2 2.89Å
819	S	76.5	Confident	78.2	Confident	67 Å²	67	60.6 Å²	60.6	47%	0.469	31%	0.308	S	S	.	.			trans	-59.7	150.3	-176.1	70.4	0	0	0	0	113.6	A821 V822 Q823	S819-A821 PolarHBondContact O-N 3.22Å; S819-A821 VanDerWaalsContact O-N 3.08Å; S819-V822 PolarHBondContact O-N 3.11Å; S819-V822 WeakPolarHBondContact OG-CG2 3.42Å; S819-Q823 PolarHBondContact O-N 3.45Å
820	V	74.8	Confident	78.6	Confident	95 Å²	95	52.6 Å²	52.6	58%	0.576	27%	0.273	S	S	*	.	H	α-helix	trans	-53.5	-33.8	178.7	-179.7	0	0	0	0	112.4	Q823 K824	V820-Q823 PolarHBondContact O-N 3.43Å; V820-K824 WeakPolarHBondContact O-CG 3.33Å; V820-K824 PolarHBondContact O-N 3.29Å
821	A	75.9	Confident	78.8	Confident	63 Å²	63	50 Å²	50	52%	0.521	26%	0.257	S	S	.	.	H	α-helix	trans	-65.3	-38.7	177.2	0	0	0	0	0	112.8	S819 K825	S819-A821 PolarHBondContact O-N 3.22Å; S819-A821 VanDerWaalsContact O-N 3.08Å; A821-K825 WeakPolarHBondContact O-CG 3.4Å; A821-K825 PolarHBondContact O-N 2.95Å
822	V	78.3	Confident	78.9	Confident	20 Å²	20	50.4 Å²	50.4	12%	0.121	26%	0.26	C	S	.	.	H	α-helix	trans	-72.1	-40	176.4	176.5	0	0	0	0	110.4	L771 E818 S819 K824 K825 L826	L771-V822 HydrophobicContact CD2-CG1 3.51Å; E818-V822 HydrophobicContact CB-CB 4.48Å; E818-V822 HydrophobicContact CB-CG1 4.4Å; S819-V822 PolarHBondContact O-N 3.11Å; S819-V822 WeakPolarHBondContact OG-CG2 3.42Å; V822-K824 VanDerWaalsContact C-N 3.3Å; V822-K824 PolarHBondContact O-N 3.43Å; V822-K825 PolarHBondContact O-N 3.44Å; V822-K825 VanDerWaalsContact O-N 3.09Å; V822-L826 HydrophobicContact CG1-CD1 4Å; V822-L826 PolarHBondContact O-N 3.38Å
823	Q	74.3	Confident	79.2	Confident	28 Å²	28	49.9 Å²	49.9	13%	0.131	26%	0.257	C	S	.	.	H	α-helix	trans	-56.9	-45	174.7	-65.5	177.9	14	0	0	111.2	L815 H816 E818 S819 V820 K825 L826 A827 I830	L815-Q823 PolarHBondContact O-NE2 3.46Å; H816-Q823 PolarHBondContact O-NE2 2.89Å; E818-Q823 PolarHBondContact O-NE2 2.89Å; S819-Q823 PolarHBondContact O-N 3.45Å; V820-Q823 PolarHBondContact O-N 3.43Å; Q823-K825 PolarHBondContact O-N 3.23Å; Q823-L826 CarbonylContact O-C 3.58Å; Q823-L826 PolarHBondContact O-N 2.97Å; Q823-A827 PolarHBondContact O-N 3.09Å; Q823-A827 VanDerWaalsContact O-N 3.16Å; Q823-I830 HydrophobicContact CB-CD1 3.88Å; Q823-I830 HydrophobicContact CG-CD1 4.32Å; Q823-I830 WeakPolarHBondContact O-CD1 3.4Å
824	K	75.6	Confident	79.3	Confident	113 Å²	113	45.3 Å²	45.3	49%	0.491	23%	0.232	S	C	.	.	H	α-helix	trans	-63.5	-37.7	175.2	-72.2	-174.7	176.8	-165.7	0	113.1	V820 V822 L826 A827 D850	V820-K824 WeakPolarHBondContact O-CG 3.33Å; V820-K824 PolarHBondContact O-N 3.29Å; V822-K824 VanDerWaalsContact C-N 3.3Å; V822-K824 PolarHBondContact O-N 3.43Å; K824-L826 VanDerWaalsContact C-N 3.32Å; K824-L826 PolarHBondContact O-N 3.16Å; K824-A827 WeakPolarHBondContact O-CB 3.44Å; K824-D850 IonicContact NZ-OD1 3.03Å
825	K	80.5	Confident	79.2	Confident	90 Å²	90	40.3 Å²	40.3	39%	0.391	21%	0.213	S	C	.	.	H	α-helix	trans	-65.2	-33.4	175.1	-73.5	-179.7	-179.6	179.4	0	112.1	L774 D778 R793 A821 V822 Q823	L774-K825 HydrophobicContact CD2-CD 4.41Å; D778-K825 IonicContact OD1-NZ 3.92Å; D778-K825 PolarHBondContact OD1-NZ 3.39Å; D778-K825 VanDerWaalsContact OD1-NZ 3.14Å; R793-K825 VanDerWaalsContact CZ-O 3.28Å; R793-K825 PolarHBondContact NH1-O 3.11Å; R793-K825 PolarHBondContact NH2-O 3.43Å; A821-K825 WeakPolarHBondContact O-CG 3.4Å; A821-K825 PolarHBondContact O-N 2.95Å; V822-K825 PolarHBondContact O-N 3.44Å; V822-K825 VanDerWaalsContact O-N 3.09Å; Q823-K825 PolarHBondContact O-N 3.23Å
826	L	81.5	Confident	79	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	27.2	-177.9	-65.6	174.8	0	0	0	113.7	L767 L771 L774 L815 V822 Q823 K824 Y828 E829 I830	L767-L826 HydrophobicContact CD1-CD1 4.36Å; L771-L826 HydrophobicContact CD2-CD1 4.06Å; L774-L826 HydrophobicContact CD1-CD1 4.2Å; L774-L826 HydrophobicContact CD1-CD2 3.89Å; L774-L826 HydrophobicContact CD1-CG 4.01Å; L815-L826 HydrophobicContact CD2-CD1 3.77Å; V822-L826 HydrophobicContact CG1-CD1 4Å; V822-L826 PolarHBondContact O-N 3.38Å; Q823-L826 CarbonylContact O-C 3.58Å; Q823-L826 PolarHBondContact O-N 2.97Å; K824-L826 VanDerWaalsContact C-N 3.32Å; K824-L826 PolarHBondContact O-N 3.16Å; L826-Y828 VanDerWaalsContact C-N 3.34Å; L826-Y828 PolarHBondContact O-N 3.46Å; L826-E829 VanDerWaalsContact CA-OE2 3.28Å; L826-E829 WeakPolarHBondContact CA-OE2 3.26Å; L826-E829 HydrophobicContact CD2-CG 4.46Å; L826-E829 WeakPolarHBondContact O-CB 3.44Å; L826-E829 PolarHBondContact O-N 3.03Å; L826-E829 VanDerWaalsContact O-OE2 3.14Å; L826-I830 WeakPolarHBondContact O-CG1 3.45Å; L826-I830 PolarHBondContact O-N 3.04Å; L826-I830 VanDerWaalsContact O-N 3.11Å
827	A	81	Confident	78.9	Confident	1 Å²	1	40 Å²	40	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-71.7	-23.7	-169.1	0	0	0	0	0	114.3	Q823 K824 A831 I851	Q823-A827 PolarHBondContact O-N 3.09Å; Q823-A827 VanDerWaalsContact O-N 3.16Å; K824-A827 WeakPolarHBondContact O-CB 3.44Å; A827-A831 WeakPolarHBondContact O-CB 3.28Å; A827-A831 PolarHBondContact O-N 2.8Å; A827-I851 HydrophobicContact CB-CD1 3.23Å; A827-I851 HydrophobicContact CB-CG1 3.4Å
828	Y	82.7	Confident	78.7	Confident	82 Å²	82	39 Å²	39	32%	0.322	21%	0.213	S	C	.	.	H	α-helix	trans	-66.6	-42.9	171.2	-63.7	-66.6	0	0	0	111.6	L826 A831 I832 L847 I851 D853 A856	L826-Y828 VanDerWaalsContact C-N 3.34Å; L826-Y828 PolarHBondContact O-N 3.46Å; Y828-A831 PolarHBondContact O-N 3.44Å; Y828-I832 WeakPolarHBondContact O-CG1 3.31Å; Y828-I832 PolarHBondContact O-N 2.95Å; Y828-L847 HydrophobicContact CD1-CD2 3.77Å; Y828-L847 HydrophobicContact CE1-CD2 4.19Å; Y828-I851 HydrophobicContact CD1-CD1 4.08Å; Y828-I851 HydrophobicContact CD2-CD1 4.48Å; Y828-I851 HydrophobicContact CE1-CD1 3.99Å; Y828-I851 HydrophobicContact CE2-CD1 4.4Å; Y828-I851 HydrophobicContact CG-CD1 4.32Å; Y828-D853 HydrophobicContact CE1-CB 4.47Å; Y828-D853 PolarHBondContact OH-OD2 2.84Å; Y828-A856 HydrophobicContact CD1-CB 4.17Å; Y828-A856 HydrophobicContact CE1-CB 3.61Å
829	E	85.1	Confident	78.9	Confident	1 Å²	1	40 Å²	40	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-63.6	-45.2	178.6	-63.9	75.9	177.4	0	0	110.9	R793 F796 L826 I832 L833	R793-E829 WeakPolarHBondContact CB-OE1 3.22Å; R793-E829 WeakPolarHBondContact CG-OE1 3.34Å; R793-E829 IonicContact CZ-OE1 3.67Å; R793-E829 IonicContact CZ-OE2 2.65Å; R793-E829 IonicContact NE-OE1 3.18Å; R793-E829 PolarHBondContact NE-OE1 3.19Å; R793-E829 IonicContact NE-OE2 3.22Å; R793-E829 IonicContact NH2-OE1 3.71Å; R793-E829 PolarHBondContact NH2-OE1 3.29Å; R793-E829 IonicContact NH2-OE2 3.86Å; R793-E829 PolarHBondContact NH2-OE2 3.32Å; F796-E829 HydrophobicContact CD1-CB 4.21Å; F796-E829 HydrophobicContact CD1-CG 3.54Å; F796-E829 HydrophobicContact CE1-CB 3.95Å; F796-E829 HydrophobicContact CE1-CG 3.78Å; L826-E829 VanDerWaalsContact CA-OE2 3.28Å; L826-E829 WeakPolarHBondContact CA-OE2 3.26Å; L826-E829 HydrophobicContact CD2-CG 4.46Å; L826-E829 WeakPolarHBondContact O-CB 3.44Å; L826-E829 PolarHBondContact O-N 3.03Å; L826-E829 VanDerWaalsContact O-OE2 3.14Å; E829-I832 PolarHBondContact O-N 3.27Å; E829-L833 WeakPolarHBondContact O-CG 3.35Å; E829-L833 PolarHBondContact O-N 3.42Å; E829-L833 VanDerWaalsContact O-N 3.09Å
830	I	81.1	Confident	79	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-60.8	-45.7	176	-66.5	169.3	0	0	0	111	L815 Q823 L826 I832 L833 E834 Y846	L815-I830 HydrophobicContact CD1-CG1 4Å; Q823-I830 HydrophobicContact CB-CD1 3.88Å; Q823-I830 HydrophobicContact CG-CD1 4.32Å; Q823-I830 WeakPolarHBondContact O-CD1 3.4Å; L826-I830 WeakPolarHBondContact O-CG1 3.45Å; L826-I830 PolarHBondContact O-N 3.04Å; L826-I830 VanDerWaalsContact O-N 3.11Å; I830-I832 VanDerWaalsContact C-N 3.33Å; I830-I832 PolarHBondContact O-N 3.05Å; I830-L833 PolarHBondContact O-N 3.18Å; I830-E834 HydrophobicContact CG2-CG 4.19Å; I830-E834 WeakPolarHBondContact O-CB 3.14Å; I830-E834 PolarHBondContact O-N 3.35Å; I830-Y846 HydrophobicContact CG2-CD1 4.46Å; I830-Y846 HydrophobicContact CG2-CD2 3.67Å; I830-Y846 HydrophobicContact CG2-CE1 4.43Å; I830-Y846 HydrophobicContact CG2-CE2 3.63Å; I830-Y846 HydrophobicContact CG2-CG 4.11Å
831	A	81.4	Confident	79.3	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-61.4	-40.1	-179	0	0	0	0	0	112.5	A827 Y828 G835 A843 L847 Y860	A827-A831 WeakPolarHBondContact O-CB 3.28Å; A827-A831 PolarHBondContact O-N 2.8Å; Y828-A831 PolarHBondContact O-N 3.44Å; A831-G835 PolarHBondContact O-N 3.11Å; A831-A843 HydrophobicContact CB-CB 4.3Å; A831-A843 WeakPolarHBondContact O-CB 3.28Å; A831-L847 HydrophobicContact CB-CD1 3.86Å; A831-L847 HydrophobicContact CB-CD2 3.73Å; A831-L847 HydrophobicContact CB-CG 3.59Å; A831-Y860 WeakPolarHBondContact O-CE2 3.48Å
832	I	81.1	Confident	79.6	Confident	10 Å²	10	41.4 Å²	41.4	5%	0.051	20%	0.201	C	C	.	.	H	α-helix	trans	-69.4	-42.2	177.8	-59.2	167.8	0	0	0	110.6	C797 I800 Y828 E829 I830 G835 K836	C797-I832 HydrophobicContact CB-CD1 4.01Å; I800-I832 HydrophobicContact CB-CG2 4.16Å; I800-I832 HydrophobicContact CG2-CB 4.3Å; I800-I832 HydrophobicContact CG2-CG2 3.6Å; Y828-I832 WeakPolarHBondContact O-CG1 3.31Å; Y828-I832 PolarHBondContact O-N 2.95Å; E829-I832 PolarHBondContact O-N 3.27Å; I830-I832 VanDerWaalsContact C-N 3.33Å; I830-I832 PolarHBondContact O-N 3.05Å; I832-G835 PolarHBondContact O-N 3.42Å; I832-K836 PolarHBondContact O-N 2.74Å
833	L	80.8	Confident	79.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.2	-46.3	177.5	-73.8	169.8	0	0	0	112.4	I800 L811 L812 L815 E829 I830 G835 K836 A837	I800-L833 HydrophobicContact CD1-CD1 4.3Å; I800-L833 HydrophobicContact CD1-CD2 4.03Å; I800-L833 HydrophobicContact CD1-CG 3.94Å; I800-L833 HydrophobicContact CG1-CD2 4.11Å; I800-L833 HydrophobicContact CG2-CD2 3.59Å; I800-L833 HydrophobicContact CG2-CG 4.01Å; L811-L833 HydrophobicContact CB-CD1 4.05Å; L811-L833 HydrophobicContact CB-CD2 4.24Å; L811-L833 HydrophobicContact CD1-CD2 3.98Å; L812-L833 HydrophobicContact CD1-CB 4.47Å; L812-L833 HydrophobicContact CD2-CB 3.67Å; L812-L833 HydrophobicContact CD2-CD1 4.31Å; L812-L833 HydrophobicContact CG-CB 4Å; L815-L833 HydrophobicContact CD1-CD1 3.62Å; E829-L833 WeakPolarHBondContact O-CG 3.35Å; E829-L833 PolarHBondContact O-N 3.42Å; E829-L833 VanDerWaalsContact O-N 3.09Å; I830-L833 PolarHBondContact O-N 3.18Å; L833-G835 VanDerWaalsContact C-N 3.3Å; L833-G835 PolarHBondContact O-N 2.89Å; L833-K836 PolarHBondContact O-N 3.29Å; L833-A837 PolarHBondContact O-N 2.95Å
834	E	81.3	Confident	80.2	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.019	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-36.3	175.4	-77.2	-77.5	-154.3	0	0	111.6	L812 H816 I830 K836 A837 N838 N839 A843	L812-E834 HydrophobicContact CD2-CG 3.97Å; H816-E834 IonicContact NE2-OE1 2.99Å; I830-E834 HydrophobicContact CG2-CG 4.19Å; I830-E834 WeakPolarHBondContact O-CB 3.14Å; I830-E834 PolarHBondContact O-N 3.35Å; E834-K836 PolarHBondContact O-N 3.08Å; E834-A837 CarbonylContact O-C 3.38Å; E834-A837 WeakPolarHBondContact O-CA 3.24Å; E834-A837 WeakPolarHBondContact O-CB 3.36Å; E834-A837 PolarHBondContact O-N 2.91Å; E834-A837 VanDerWaalsContact O-N 3.14Å; E834-N838 PolarHBondContact O-N 3.2Å; E834-N839 HydrophobicContact CB-CB 4.41Å; E834-N839 PolarHBondContact O-N 2.7Å; E834-N839 WeakPolarHBondContact OE2-CB 3.35Å; E834-N839 PolarHBondContact OE2-ND2 2.63Å; E834-A843 HydrophobicContact CB-CB 4.01Å
835	G	76.7	Confident	80.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-40.5	175.5	0	0	0	0	0	113.3	A831 I832 L833 A837 N838 H840 Y860 F864	A831-G835 PolarHBondContact O-N 3.11Å; I832-G835 PolarHBondContact O-N 3.42Å; L833-G835 VanDerWaalsContact C-N 3.3Å; L833-G835 PolarHBondContact O-N 2.89Å; G835-A837 VanDerWaalsContact C-N 3.29Å; G835-N838 PolarHBondContact O-N 2.66Å; G835-N838 VanDerWaalsContact O-N 3.12Å; G835-H840 PolarHBondContact O-CE1 3.19Å; G835-Y860 WeakPolarHBondContact CA-OH 3.14Å; G835-F864 WeakPolarHBondContact O-CE1 3.17Å
836	K	74.9	Confident	80.6	Confident	32 Å²	32	35.6 Å²	35.6	14%	0.139	17%	0.173	C	C	.	.	H	α-helix	trans	-70.4	-25.4	172.8	-71.8	-77.2	-169.9	-177.7	0	113.2	I800 R801 H808 I832 L833 E834 N838 F864	I800-K836 VanDerWaalsContact O-CE 3.31Å; I800-K836 WeakPolarHBondContact O-CE 3.13Å; R801-K836 WeakPolarHBondContact O-CE 3.39Å; R801-K836 PolarHBondContact O-NZ 3.19Å; R801-K836 VanDerWaalsContact O-NZ 3.14Å; H808-K836 WeakPolarHBondContact CD2-CB 3.36Å; H808-K836 WeakPolarHBondContact NE2-CB 3.45Å; H808-K836 VanDerWaalsContact NE2-CG 3.34Å; H808-K836 WeakPolarHBondContact NE2-CG 3.31Å; I832-K836 PolarHBondContact O-N 2.74Å; L833-K836 PolarHBondContact O-N 3.29Å; E834-K836 PolarHBondContact O-N 3.08Å; K836-N838 PolarHBondContact O-N 2.73Å; K836-F864 HydrophobicContact CD-CE1 4.19Å; K836-F864 HydrophobicContact CD-CZ 4.48Å; K836-F864 HydrophobicContact CG-CE1 4.16Å; K836-F864 HydrophobicContact CG-CZ 4.09Å
837	A	76.3	Confident	80.5	Confident	38 Å²	38	35.8 Å²	35.8	31%	0.314	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	9.9	169.5	0	0	0	0	0	113.1	L812 L833 E834 G835 N839	L812-A837 HydrophobicContact CD1-CB 4.22Å; L833-A837 PolarHBondContact O-N 2.95Å; E834-A837 CarbonylContact O-C 3.38Å; E834-A837 WeakPolarHBondContact O-CA 3.24Å; E834-A837 WeakPolarHBondContact O-CB 3.36Å; E834-A837 PolarHBondContact O-N 2.91Å; E834-A837 VanDerWaalsContact O-N 3.14Å; G835-A837 VanDerWaalsContact C-N 3.29Å; A837-N839 PolarHBondContact O-N 2.85Å; A837-N839 VanDerWaalsContact O-N 3.12Å
838	N	74.5	Confident	80.5	Confident	127 Å²	127	35.8 Å²	35.8	68%	0.679	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.6	12.2	-173.1	-72.7	-18.8	0	0	0	114.8	E834 G835 K836 H840	E834-N838 PolarHBondContact O-N 3.2Å; G835-N838 PolarHBondContact O-N 2.66Å; G835-N838 VanDerWaalsContact O-N 3.12Å; K836-N838 PolarHBondContact O-N 2.73Å; N838-H840 PolarHBondContact O-N 3.37Å
839	N	82.4	Confident	80.2	Confident	65 Å²	65	35.1 Å²	35.1	35%	0.348	17%	0.173	S	C	.	.			trans	-87	54.8	176.4	-68.8	-28.2	0	0	0	111	E834 A837 M841 K842 A843	E834-N839 HydrophobicContact CB-CB 4.41Å; E834-N839 PolarHBondContact O-N 2.7Å; E834-N839 WeakPolarHBondContact OE2-CB 3.35Å; E834-N839 PolarHBondContact OE2-ND2 2.63Å; A837-N839 PolarHBondContact O-N 2.85Å; A837-N839 VanDerWaalsContact O-N 3.12Å; N839-M841 PolarHBondContact O-N 3.39Å; N839-M841 VanDerWaalsContact O-N 3.16Å; N839-K842 HydrophobicContact CB-CB 4.38Å; N839-K842 HydrophobicContact CB-CD 4.27Å; N839-K842 HydrophobicContact CB-CG 4.48Å; N839-K842 PolarHBondContact O-N 3Å; N839-A843 PolarHBondContact O-N 2.79Å; N839-A843 VanDerWaalsContact O-N 3.16Å
840	H	79.5	Confident	79.8	Confident	33 Å²	33	38.5 Å²	38.5	15%	0.153	19%	0.192	C	C	.	.	H	α-helix	trans	-59.9	-31.9	-172.4	-58.8	-55.6	0	0	0	113.9	G835 N838 A843 L844 Y860 F864 L916	G835-H840 PolarHBondContact O-CE1 3.19Å; N838-H840 PolarHBondContact O-N 3.37Å; H840-A843 PolarHBondContact O-N 2.79Å; H840-L844 WeakPolarHBondContact O-CB 3.5Å; H840-L844 WeakPolarHBondContact O-CG 3.45Å; H840-L844 PolarHBondContact O-N 3.19Å; H840-Y860 AromaticContact ND1-CZ 3.99Å; H840-Y860 PolarHBondContact ND1-OH 2.79Å; H840-F864 AromaticContact CE1-CD1 3.86Å; H840-L916 HydrophobicContact CB-CD2 3.6Å
841	M	80.7	Confident	79.6	Confident	111 Å²	111	40.7 Å²	40.7	55%	0.547	20%	0.203	S	C	.	.	H	α-helix	trans	-62.6	-43.8	175.7	-70.4	-172.4	69.8	0	0	112.2	N839 K845 T919	N839-M841 PolarHBondContact O-N 3.39Å; N839-M841 VanDerWaalsContact O-N 3.16Å; M841-K845 WeakPolarHBondContact O-CG 3.16Å; M841-K845 PolarHBondContact O-N 3.33Å; M841-T919 HydrophobicContact CG-CG2 4.47Å
842	K	81.4	Confident	79.4	Confident	110 Å²	110	44.5 Å²	44.5	48%	0.478	22%	0.223	S	C	.	.	H	α-helix	trans	-66.7	-44.4	178.1	-67.3	-176.2	-177.3	174.2	0	110.9	N839 L844 K845 Y846	N839-K842 HydrophobicContact CB-CB 4.38Å; N839-K842 HydrophobicContact CB-CD 4.27Å; N839-K842 HydrophobicContact CB-CG 4.48Å; N839-K842 PolarHBondContact O-N 3Å; K842-L844 VanDerWaalsContact C-N 3.33Å; K842-L844 PolarHBondContact O-N 3.35Å; K842-K845 PolarHBondContact O-N 3.16Å; K842-Y846 WeakPolarHBondContact O-CD2 3.33Å; K842-Y846 PolarHBondContact O-N 3.39Å
843	A	83.1	Confident	79.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56.7	-45.8	177.5	0	0	0	0	0	112.5	A831 E834 N839 H840 Y846 L847 Y860	A831-A843 HydrophobicContact CB-CB 4.3Å; A831-A843 WeakPolarHBondContact O-CB 3.28Å; E834-A843 HydrophobicContact CB-CB 4.01Å; N839-A843 PolarHBondContact O-N 2.79Å; N839-A843 VanDerWaalsContact O-N 3.16Å; H840-A843 PolarHBondContact O-N 2.79Å; A843-Y846 PolarHBondContact O-N 3Å; A843-L847 PolarHBondContact O-N 3.05Å; A843-Y860 HydrophobicContact CB-CE1 4.31Å; A843-Y860 HydrophobicContact CB-CE2 3.96Å; A843-Y860 VanDerWaalsContact CB-OH 3.31Å; A843-Y860 WeakPolarHBondContact CB-OH 3.47Å
844	L	82.6	Confident	79.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66.7	-38.4	177.3	-73	174.6	0	0	0	112.3	H840 K842 L847 I848 A857 Y860 T919 F920 I923	H840-L844 WeakPolarHBondContact O-CB 3.5Å; H840-L844 WeakPolarHBondContact O-CG 3.45Å; H840-L844 PolarHBondContact O-N 3.19Å; K842-L844 VanDerWaalsContact C-N 3.33Å; K842-L844 PolarHBondContact O-N 3.35Å; L844-L847 PolarHBondContact O-N 3.03Å; L844-I848 HydrophobicContact CB-CD1 4.3Å; L844-I848 WeakPolarHBondContact O-CB 3.27Å; L844-I848 VanDerWaalsContact O-CG1 3.27Å; L844-I848 WeakPolarHBondContact O-CG1 3.37Å; L844-I848 PolarHBondContact O-N 2.85Å; L844-A857 HydrophobicContact CD2-CB 4.22Å; L844-Y860 HydrophobicContact CD2-CD1 3.67Å; L844-Y860 HydrophobicContact CD2-CE1 4Å; L844-Y860 HydrophobicContact CG-CD1 4.26Å; L844-Y860 HydrophobicContact CG-CE1 4.07Å; L844-T919 WeakPolarHBondContact CD1-OG1 3.23Å; L844-F920 HydrophobicContact CD1-CB 4.29Å; L844-F920 HydrophobicContact CD2-CD2 4.22Å; L844-I923 HydrophobicContact CB-CD1 3.69Å; L844-I923 HydrophobicContact CD1-CD1 4.47Å
845	K	82.5	Confident	79.3	Confident	87 Å²	87	55 Å²	55	38%	0.378	27%	0.27	S	S	.	.	H	α-helix	trans	-61.6	-43	173.7	-75.1	-174.2	172.8	-167.5	0	112.4	M841 K842 L847 I848 E849 D850 I923	M841-K845 WeakPolarHBondContact O-CG 3.16Å; M841-K845 PolarHBondContact O-N 3.33Å; K842-K845 PolarHBondContact O-N 3.16Å; K845-L847 VanDerWaalsContact C-N 3.33Å; K845-L847 PolarHBondContact O-N 3.4Å; K845-I848 PolarHBondContact O-N 3.49Å; K845-E849 WeakPolarHBondContact O-CA 3.27Å; K845-E849 VanDerWaalsContact O-CB 3.24Å; K845-E849 WeakPolarHBondContact O-CB 3.44Å; K845-E849 PolarHBondContact O-N 2.86Å; K845-D850 PolarHBondContact O-N 2.78Å; K845-I923 HydrophobicContact CG-CD1 4.07Å
846	Y	82.1	Confident	79.4	Confident	43 Å²	43	55.9 Å²	55.9	17%	0.169	28%	0.277	C	S	.	.	I	π-helix	trans	-59.1	-42.2	174.8	-79.5	-64.8	0	0	0	112.4	I830 K842 A843 D850 I851	I830-Y846 HydrophobicContact CG2-CD1 4.46Å; I830-Y846 HydrophobicContact CG2-CD2 3.67Å; I830-Y846 HydrophobicContact CG2-CE1 4.43Å; I830-Y846 HydrophobicContact CG2-CE2 3.63Å; I830-Y846 HydrophobicContact CG2-CG 4.11Å; K842-Y846 WeakPolarHBondContact O-CD2 3.33Å; K842-Y846 PolarHBondContact O-N 3.39Å; A843-Y846 PolarHBondContact O-N 3Å; Y846-D850 WeakPolarHBondContact CD1-OD2 3.41Å; Y846-D850 WeakPolarHBondContact O-CB 3.42Å; Y846-D850 PolarHBondContact O-N 3.45Å; Y846-I851 PolarHBondContact O-N 2.91Å; Y846-I851 VanDerWaalsContact O-N 3.16Å
847	L	80.6	Confident	79.7	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.026	27%	0.271	C	S	.	.	I	π-helix	trans	-73.1	-40.2	-179.8	-64.7	174.8	0	0	0	113.1	Y828 A831 A843 L844 K845 I851 N852 D853 A856 A857 Y860	Y828-L847 HydrophobicContact CD1-CD2 3.77Å; Y828-L847 HydrophobicContact CE1-CD2 4.19Å; A831-L847 HydrophobicContact CB-CD1 3.86Å; A831-L847 HydrophobicContact CB-CD2 3.73Å; A831-L847 HydrophobicContact CB-CG 3.59Å; A843-L847 PolarHBondContact O-N 3.05Å; L844-L847 PolarHBondContact O-N 3.03Å; K845-L847 VanDerWaalsContact C-N 3.33Å; K845-L847 PolarHBondContact O-N 3.4Å; L847-I851 HydrophobicContact CD2-CD1 3.85Å; L847-N852 PolarHBondContact O-N 3.43Å; L847-N852 VanDerWaalsContact O-N 3.08Å; L847-D853 PolarHBondContact O-N 2.71Å; L847-A856 HydrophobicContact CD2-CB 4.43Å; L847-A857 HydrophobicContact CB-CB 3.91Å; L847-A857 HydrophobicContact CD1-CB 4.12Å; L847-Y860 HydrophobicContact CD1-CD2 4.45Å; L847-Y860 HydrophobicContact CD1-CG 4.14Å
848	I	79.3	Confident	79.8	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.264	C	S	.	.	I	π-helix	trans	-89.2	-50.3	-173	-60.4	166.6	0	0	0	111.5	L844 K845 N852 Y854 A857 F920 I923 R927	L844-I848 HydrophobicContact CB-CD1 4.3Å; L844-I848 WeakPolarHBondContact O-CB 3.27Å; L844-I848 VanDerWaalsContact O-CG1 3.27Å; L844-I848 WeakPolarHBondContact O-CG1 3.37Å; L844-I848 PolarHBondContact O-N 2.85Å; K845-I848 PolarHBondContact O-N 3.49Å; I848-N852 VanDerWaalsContact O-CA 3.31Å; I848-N852 WeakPolarHBondContact O-CA 3.18Å; I848-N852 PolarHBondContact O-N 2.93Å; I848-Y854 HydrophobicContact CG2-CD1 4.23Å; I848-Y854 HydrophobicContact CG2-CE1 3.74Å; I848-A857 HydrophobicContact CD1-CB 4.31Å; I848-A857 HydrophobicContact CG1-CB 3.84Å; I848-F920 HydrophobicContact CD1-CD2 3.63Å; I848-F920 HydrophobicContact CD1-CE2 3.76Å; I848-F920 HydrophobicContact CG1-CD2 4.47Å; I848-F920 HydrophobicContact CG1-CE2 4.2Å; I848-I923 HydrophobicContact CB-CG2 4.14Å; I848-I923 HydrophobicContact CD1-CB 4.14Å; I848-I923 HydrophobicContact CD1-CG2 3.88Å; I848-I923 HydrophobicContact CG2-CG2 3.97Å; I848-R927 PolarHBondContact O-NH1 2.67Å; I848-R927 VanDerWaalsContact O-NH1 3.11Å
849	E	78	Confident	79.9	Confident	68 Å²	68	55.6 Å²	55.6	32%	0.318	26%	0.261	S	S	.	.	I	π-helix	trans	-78.9	-47.5	-176.5	-61.1	177	-179	0	0	111.3	K845 I923 R927	K845-E849 WeakPolarHBondContact O-CA 3.27Å; K845-E849 VanDerWaalsContact O-CB 3.24Å; K845-E849 WeakPolarHBondContact O-CB 3.44Å; K845-E849 PolarHBondContact O-N 2.86Å; E849-I923 HydrophobicContact CG-CG2 4.39Å; E849-R927 PolarHBondContact O-NH1 3.48Å; E849-R927 PolarHBondContact O-NH2 3.46Å
850	D	76.6	Confident	79.9	Confident	72 Å²	72	52.8 Å²	52.8	39%	0.385	25%	0.246	S	C	.	.	I	π-helix	trans	-83.9	-47	-175.2	-75.9	-44.5	0	0	0	114.1	K824 K845 Y846	K824-D850 IonicContact NZ-OD1 3.03Å; K845-D850 PolarHBondContact O-N 2.78Å; Y846-D850 WeakPolarHBondContact CD1-OD2 3.41Å; Y846-D850 WeakPolarHBondContact O-CB 3.42Å; Y846-D850 PolarHBondContact O-N 3.45Å
851	I	76.4	Confident	79.8	Confident	49 Å²	49	51.2 Å²	51.2	25%	0.251	24%	0.239	S	C	.	.	S	Bend	trans	-90.5	-27.5	-178.1	-50.1	173.8	0	0	0	112.6	A827 Y828 Y846 L847 D853	A827-I851 HydrophobicContact CB-CD1 3.23Å; A827-I851 HydrophobicContact CB-CG1 3.4Å; Y828-I851 HydrophobicContact CD1-CD1 4.08Å; Y828-I851 HydrophobicContact CD2-CD1 4.48Å; Y828-I851 HydrophobicContact CE1-CD1 3.99Å; Y828-I851 HydrophobicContact CE2-CD1 4.4Å; Y828-I851 HydrophobicContact CG-CD1 4.32Å; Y846-I851 PolarHBondContact O-N 2.91Å; Y846-I851 VanDerWaalsContact O-N 3.16Å; L847-I851 HydrophobicContact CD2-CD1 3.85Å; I851-D853 HydrophobicContact CG2-CB 3.95Å; I851-D853 PolarHBondContact O-N 3.37Å
852	N	76.9	Confident	79.6	Confident	81 Å²	81	49.1 Å²	49.1	43%	0.433	23%	0.229	S	C	.	.			trans	60	29.3	-171.2	-157.5	53.2	0	0	0	113.4	L847 I848 Y854 R927	L847-N852 PolarHBondContact O-N 3.43Å; L847-N852 VanDerWaalsContact O-N 3.08Å; I848-N852 VanDerWaalsContact O-CA 3.31Å; I848-N852 WeakPolarHBondContact O-CA 3.18Å; I848-N852 PolarHBondContact O-N 2.93Å; N852-Y854 WeakPolarHBondContact OD1-CE2 3.48Å; N852-Y854 PolarHBondContact OD1-OH 2.8Å; N852-R927 PolarHBondContact OD1-NH1 3.28Å
853	D	82.6	Confident	79.1	Confident	48 Å²	48	45.6 Å²	45.6	26%	0.257	22%	0.217	S	C	.	.			trans	-99	86.7	174.3	-170.7	-12.1	0	0	0	111.2	Y828 L847 I851 K855 A856 A857	Y828-D853 HydrophobicContact CE1-CB 4.47Å; Y828-D853 PolarHBondContact OH-OD2 2.84Å; L847-D853 PolarHBondContact O-N 2.71Å; I851-D853 HydrophobicContact CG2-CB 3.95Å; I851-D853 PolarHBondContact O-N 3.37Å; D853-K855 VanDerWaalsContact C-N 3.26Å; D853-K855 PolarHBondContact O-N 2.94Å; D853-K855 WeakPolarHBondContact OD1-CB 3.27Å; D853-K855 PolarHBondContact OD1-N 3.48Å; D853-A856 HydrophobicContact CB-CB 4.02Å; D853-A856 VanDerWaalsContact CG-CB 3.48Å; D853-A856 PolarHBondContact O-N 3.09Å; D853-A856 PolarHBondContact OD1-N 3.32Å; D853-A856 WeakPolarHBondContact OD2-CB 3Å; D853-A857 PolarHBondContact O-N 2.94Å
854	Y	79.4	Confident	78.6	Confident	27 Å²	27	46.6 Å²	46.6	11%	0.106	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-28.9	178.1	-57.2	-83.9	0	0	0	113.5	I848 N852 A857 L858 I939 M942	I848-Y854 HydrophobicContact CG2-CD1 4.23Å; I848-Y854 HydrophobicContact CG2-CE1 3.74Å; N852-Y854 WeakPolarHBondContact OD1-CE2 3.48Å; N852-Y854 PolarHBondContact OD1-OH 2.8Å; Y854-A857 PolarHBondContact O-N 2.8Å; Y854-L858 WeakPolarHBondContact O-CG 3.47Å; Y854-L858 PolarHBondContact O-N 3.32Å; Y854-I939 HydrophobicContact CE2-CG1 4.34Å; Y854-I939 WeakPolarHBondContact OH-CD1 3.21Å; Y854-M942 WeakPolarHBondContact CB-SD 3.39Å; Y854-M942 HydrophobicContact CD1-CE 3.24Å; Y854-M942 HydrophobicContact CD1-SD 4.24Å; Y854-M942 HydrophobicContact CD2-CE 4.28Å; Y854-M942 HydrophobicContact CE1-CE 3.92Å; Y854-M942 HydrophobicContact CG-CE 3.44Å; Y854-M942 VanDerWaalsContact CG-CE 3.44Å; Y854-M942 HydrophobicContact CG-SD 3.84Å
855	K	80	Confident	77.9	Confident	158 Å²	158	47.5 Å²	47.5	69%	0.687	23%	0.228	S	C	*	.	H	α-helix	trans	-69.6	-45.4	178.4	-69.8	178.7	180	174.3	0	109.8	D853 A857 L858 Y859	D853-K855 VanDerWaalsContact C-N 3.26Å; D853-K855 PolarHBondContact O-N 2.94Å; D853-K855 WeakPolarHBondContact OD1-CB 3.27Å; D853-K855 PolarHBondContact OD1-N 3.48Å; K855-A857 VanDerWaalsContact C-N 3.3Å; K855-A857 PolarHBondContact O-N 3.25Å; K855-L858 PolarHBondContact O-N 2.87Å; K855-Y859 WeakPolarHBondContact O-CD2 3.25Å; K855-Y859 PolarHBondContact O-N 3.23Å
856	A	78.1	Confident	76.8	Confident	19 Å²	19	53.3 Å²	53.3	16%	0.157	25%	0.247	C	C	.	.	H	α-helix	trans	-60.1	-40.7	175.7	0	0	0	0	0	112.3	Y828 L847 D853 Y859 Y860	Y828-A856 HydrophobicContact CD1-CB 4.17Å; Y828-A856 HydrophobicContact CE1-CB 3.61Å; L847-A856 HydrophobicContact CD2-CB 4.43Å; D853-A856 HydrophobicContact CB-CB 4.02Å; D853-A856 VanDerWaalsContact CG-CB 3.48Å; D853-A856 PolarHBondContact O-N 3.09Å; D853-A856 PolarHBondContact OD1-N 3.32Å; D853-A856 WeakPolarHBondContact OD2-CB 3Å; A856-Y859 PolarHBondContact O-N 3.18Å; A856-Y860 WeakPolarHBondContact O-CB 3.09Å; A856-Y860 PolarHBondContact O-N 3.33Å
857	A	81	Confident	75.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.4	-37.9	175.6	0	0	0	0	0	113.2	L844 L847 I848 D853 Y854 K855 Y860 C861 F920	L844-A857 HydrophobicContact CD2-CB 4.22Å; L847-A857 HydrophobicContact CB-CB 3.91Å; L847-A857 HydrophobicContact CD1-CB 4.12Å; I848-A857 HydrophobicContact CD1-CB 4.31Å; I848-A857 HydrophobicContact CG1-CB 3.84Å; D853-A857 PolarHBondContact O-N 2.94Å; Y854-A857 PolarHBondContact O-N 2.8Å; K855-A857 VanDerWaalsContact C-N 3.3Å; K855-A857 PolarHBondContact O-N 3.25Å; A857-Y860 WeakPolarHBondContact O-CB 3.38Å; A857-Y860 PolarHBondContact O-N 2.89Å; A857-C861 PolarHBondContact O-N 2.97Å; A857-C861 PolarHBondContact O-SG 2.77Å; A857-F920 HydrophobicContact CB-CD2 3.92Å; A857-F920 HydrophobicContact CB-CE2 3.53Å
858	L	78.8	Confident	73.7	Confident	34 Å²	34	62 Å²	62	18%	0.178	29%	0.29	C	S	.	.	H	α-helix	trans	-65.4	-44.3	171.8	-76.3	168.7	0	0	0	112.4	Y854 K855 Y860 C861 L862 F917 F920 L946	Y854-L858 WeakPolarHBondContact O-CG 3.47Å; Y854-L858 PolarHBondContact O-N 3.32Å; K855-L858 PolarHBondContact O-N 2.87Å; L858-Y860 VanDerWaalsContact C-N 3.26Å; L858-Y860 PolarHBondContact O-N 2.81Å; L858-C861 PolarHBondContact O-N 2.96Å; L858-L862 WeakPolarHBondContact O-CG 3.32Å; L858-L862 PolarHBondContact O-N 3.33Å; L858-F917 HydrophobicContact CD2-CE1 4.34Å; L858-F920 HydrophobicContact CD2-CD1 4.27Å; L858-F920 HydrophobicContact CD2-CE1 3.89Å; L858-F920 HydrophobicContact CD2-CE2 4.45Å; L858-F920 HydrophobicContact CD2-CZ 3.98Å; L858-F920 HydrophobicContact CG-CE1 4.28Å; L858-F920 HydrophobicContact CG-CE2 4.24Å; L858-F920 HydrophobicContact CG-CZ 3.86Å; L858-L946 HydrophobicContact CD1-CD1 4.27Å; L858-L946 HydrophobicContact CD1-CD2 4.22Å; L858-L946 HydrophobicContact CD2-CD1 3.78Å; L858-L946 HydrophobicContact CD2-CD2 3.54Å; L858-L946 HydrophobicContact CD2-CG 4.32Å
859	Y	77	Confident	71.8	Confident	157 Å²	157	65.9 Å²	65.9	62%	0.616	31%	0.314	S	S	*	.	H	α-helix	trans	-61.5	-36.4	174.1	-81.5	-66.3	0	0	0	112.2	K855 A856 L862 T863	K855-Y859 WeakPolarHBondContact O-CD2 3.25Å; K855-Y859 PolarHBondContact O-N 3.23Å; A856-Y859 PolarHBondContact O-N 3.18Å; Y859-L862 PolarHBondContact O-N 3.27Å; Y859-T863 WeakPolarHBondContact O-CB 3.39Å; Y859-T863 WeakPolarHBondContact O-CG2 3.15Å; Y859-T863 PolarHBondContact O-N 2.89Å; Y859-T863 PolarHBondContact O-OG1 2.78Å
860	Y	81.9	Confident	69.7	Low	7 Å²	7	69.5 Å²	69.5	3%	0.027	33%	0.334	C	S	.	.	H	α-helix	trans	-61.1	-48.1	172.5	171.1	-86.6	0	0	0	111.4	A831 G835 H840 A843 L844 L847 A856 A857 L858 L862 T863 F864 L916	A831-Y860 WeakPolarHBondContact O-CE2 3.48Å; G835-Y860 WeakPolarHBondContact CA-OH 3.14Å; H840-Y860 AromaticContact ND1-CZ 3.99Å; H840-Y860 PolarHBondContact ND1-OH 2.79Å; A843-Y860 HydrophobicContact CB-CE1 4.31Å; A843-Y860 HydrophobicContact CB-CE2 3.96Å; A843-Y860 VanDerWaalsContact CB-OH 3.31Å; A843-Y860 WeakPolarHBondContact CB-OH 3.47Å; L844-Y860 HydrophobicContact CD2-CD1 3.67Å; L844-Y860 HydrophobicContact CD2-CE1 4Å; L844-Y860 HydrophobicContact CG-CD1 4.26Å; L844-Y860 HydrophobicContact CG-CE1 4.07Å; L847-Y860 HydrophobicContact CD1-CD2 4.45Å; L847-Y860 HydrophobicContact CD1-CG 4.14Å; A856-Y860 WeakPolarHBondContact O-CB 3.09Å; A856-Y860 PolarHBondContact O-N 3.33Å; A857-Y860 WeakPolarHBondContact O-CB 3.38Å; A857-Y860 PolarHBondContact O-N 2.89Å; L858-Y860 VanDerWaalsContact C-N 3.26Å; L858-Y860 PolarHBondContact O-N 2.81Å; Y860-L862 VanDerWaalsContact C-N 3.33Å; Y860-L862 PolarHBondContact O-N 3.27Å; Y860-T863 WeakPolarHBondContact CA-OG1 3.19Å; Y860-T863 PolarHBondContact O-N 2.72Å; Y860-T863 PolarHBondContact O-OG1 3.08Å; Y860-F864 HydrophobicContact CD1-CD2 4.47Å; Y860-F864 AromaticContact CD2-CD2 3.59Å; Y860-F864 HydrophobicContact CD2-CD2 3.59Å; Y860-F864 AromaticContact CD2-CE2 3.51Å; Y860-F864 HydrophobicContact CD2-CE2 3.51Å; Y860-F864 HydrophobicContact CE1-CD2 4.27Å; Y860-F864 AromaticContact CE2-CD2 3.33Å; Y860-F864 HydrophobicContact CE2-CD2 3.33Å; Y860-F864 AromaticContact CE2-CE2 3.11Å; Y860-F864 HydrophobicContact CE2-CE2 3.11Å; Y860-F864 HydrophobicContact CE2-CG 4.32Å; Y860-F864 AromaticContact CE2-CZ 3.95Å; Y860-F864 HydrophobicContact CE2-CZ 3.95Å; Y860-F864 HydrophobicContact CG-CD2 4.16Å; Y860-F864 HydrophobicContact CG-CE2 4.49Å; Y860-F864 AromaticContact CZ-CD2 3.69Å; Y860-F864 AromaticContact CZ-CE2 3.85Å; Y860-F864 PolarHBondContact O-N 3.48Å; Y860-L916 HydrophobicContact CE1-CD2 4.24Å
861	C	77.8	Confident	67.3	Low	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-59.7	-43.3	176.4	-64.1	0	0	0	0	111.9	A857 L858 T863 S865 F917	A857-C861 PolarHBondContact O-N 2.97Å; A857-C861 PolarHBondContact O-SG 2.77Å; L858-C861 PolarHBondContact O-N 2.96Å; C861-T863 VanDerWaalsContact C-N 3.34Å; C861-T863 PolarHBondContact O-N 2.69Å; C861-S865 WeakPolarHBondContact O-CB 3.38Å; C861-S865 PolarHBondContact O-N 3.3Å; C861-S865 VanDerWaalsContact O-N 3.09Å; C861-S865 PolarHBondContact O-OG 3.41Å; C861-F917 HydrophobicContact CB-CD1 4.18Å; C861-F917 HydrophobicContact CB-CE1 3.77Å; C861-F917 HydrophobicContact CB-CE2 4.28Å; C861-F917 HydrophobicContact CB-CZ 3.81Å
862	L	74.9	Confident	64.9	Low	67 Å²	67	81.5 Å²	81.5	35%	0.351	38%	0.379	S	S	.	.	H	α-helix	trans	-66.5	-32.4	177.8	-72.1	168.1	0	0	0	113.3	L858 Y859 Y860 S865 R866 F917	L858-L862 WeakPolarHBondContact O-CG 3.32Å; L858-L862 PolarHBondContact O-N 3.33Å; Y859-L862 PolarHBondContact O-N 3.27Å; Y860-L862 VanDerWaalsContact C-N 3.33Å; Y860-L862 PolarHBondContact O-N 3.27Å; L862-S865 WeakPolarHBondContact CA-OG 3.33Å; L862-S865 PolarHBondContact O-OG 2.86Å; L862-R866 WeakPolarHBondContact O-CG 3.34Å; L862-F917 HydrophobicContact CD2-CZ 3.84Å; L862-F917 HydrophobicContact CG-CZ 4.1Å
863	T	71.3	Confident	62.5	Low	35 Å²	35	81.4 Å²	81.4	22%	0.215	39%	0.385	C	S	.	.	H	α-helix	trans	-79.2	-48.7	-178.5	41.2	0	0	0	0	112.3	Y859 Y860 C861 S865 R866 Q867	Y859-T863 WeakPolarHBondContact O-CB 3.39Å; Y859-T863 WeakPolarHBondContact O-CG2 3.15Å; Y859-T863 PolarHBondContact O-N 2.89Å; Y859-T863 PolarHBondContact O-OG1 2.78Å; Y860-T863 WeakPolarHBondContact CA-OG1 3.19Å; Y860-T863 PolarHBondContact O-N 2.72Å; Y860-T863 PolarHBondContact O-OG1 3.08Å; C861-T863 VanDerWaalsContact C-N 3.34Å; C861-T863 PolarHBondContact O-N 2.69Å; T863-S865 VanDerWaalsContact C-N 3.29Å; T863-S865 PolarHBondContact O-N 2.81Å; T863-R866 PolarHBondContact O-N 2.86Å; T863-Q867 PolarHBondContact O-N 3.19Å
864	F	72.3	Confident	59.8	Low	21 Å²	21	83.2 Å²	83.2	9%	0.092	41%	0.407	C	S	.	.	H	α-helix	trans	-69.3	-27.9	177.9	-83.1	-88	0	0	0	112.8	G835 K836 H840 Y860 R866 Q867 L916	G835-F864 WeakPolarHBondContact O-CE1 3.17Å; K836-F864 HydrophobicContact CD-CE1 4.19Å; K836-F864 HydrophobicContact CD-CZ 4.48Å; K836-F864 HydrophobicContact CG-CE1 4.16Å; K836-F864 HydrophobicContact CG-CZ 4.09Å; H840-F864 AromaticContact CE1-CD1 3.86Å; Y860-F864 HydrophobicContact CD1-CD2 4.47Å; Y860-F864 AromaticContact CD2-CD2 3.59Å; Y860-F864 HydrophobicContact CD2-CD2 3.59Å; Y860-F864 AromaticContact CD2-CE2 3.51Å; Y860-F864 HydrophobicContact CD2-CE2 3.51Å; Y860-F864 HydrophobicContact CE1-CD2 4.27Å; Y860-F864 AromaticContact CE2-CD2 3.33Å; Y860-F864 HydrophobicContact CE2-CD2 3.33Å; Y860-F864 AromaticContact CE2-CE2 3.11Å; Y860-F864 HydrophobicContact CE2-CE2 3.11Å; Y860-F864 HydrophobicContact CE2-CG 4.32Å; Y860-F864 AromaticContact CE2-CZ 3.95Å; Y860-F864 HydrophobicContact CE2-CZ 3.95Å; Y860-F864 HydrophobicContact CG-CD2 4.16Å; Y860-F864 HydrophobicContact CG-CE2 4.49Å; Y860-F864 AromaticContact CZ-CD2 3.69Å; Y860-F864 AromaticContact CZ-CE2 3.85Å; Y860-F864 PolarHBondContact O-N 3.48Å; F864-R866 VanDerWaalsContact C-N 3.33Å; F864-R866 PolarHBondContact O-N 2.89Å; F864-Q867 PolarHBondContact O-N 2.78Å; F864-L916 HydrophobicContact CB-CD1 4.04Å
865	S	68.4	Low	57.2	Low	20 Å²	20	92 Å²	92	14%	0.14	44%	0.44	C	S	.	.	H	α-helix	trans	-72.9	-24.6	176	67.4	0	0	0	0	114.2	C861 L862 T863 F913	C861-S865 WeakPolarHBondContact O-CB 3.38Å; C861-S865 PolarHBondContact O-N 3.3Å; C861-S865 VanDerWaalsContact O-N 3.09Å; C861-S865 PolarHBondContact O-OG 3.41Å; L862-S865 WeakPolarHBondContact CA-OG 3.33Å; L862-S865 PolarHBondContact O-OG 2.86Å; T863-S865 VanDerWaalsContact C-N 3.29Å; T863-S865 PolarHBondContact O-N 2.81Å; S865-F913 WeakPolarHBondContact OG-CD2 3.25Å
866	R	59.3	Low	54.7	Low	208 Å²	208	93.7 Å²	93.7	79%	0.785	45%	0.447	S	S	*	.	H	α-helix	trans	-83.1	-24.5	172.4	-73.8	179.2	177.9	177.1	0.6	113.2	L862 T863 F864 Q868	L862-R866 WeakPolarHBondContact O-CG 3.34Å; T863-R866 PolarHBondContact O-N 2.86Å; F864-R866 VanDerWaalsContact C-N 3.33Å; F864-R866 PolarHBondContact O-N 2.89Å; R866-Q868 PolarHBondContact O-N 2.9Å
867	Q	55.4	Low	52.2	Low	70 Å²	70	98.8 Å²	98.8	33%	0.327	47%	0.472	S	S	.	.	S	Bend	trans	-72.9	84.2	170.7	-68.1	-173.5	6.1	0	0	107.6	R801 T863 F864 P869	R801-Q867 PolarHBondContact O-NE2 3.07Å; T863-Q867 PolarHBondContact O-N 3.19Å; F864-Q867 PolarHBondContact O-N 2.78Å; Q867-P869 WeakPolarHBondContact O-CD 3.31Å
868	Q	41.8	Very low	49.6	Very low	162 Å²	162	105.4 Å²	105.4	76%	0.757	51%	0.507	S	S	*	.			trans	-57.5	127.6	167.7	-77.5	-175.3	-13.1	0	0	107.5	R866 I870	R866-Q868 PolarHBondContact O-N 2.9Å; Q868-I870 PolarHBondContact O-N 3.39Å
869	P	40.3	Very low	47.1	Very low	80 Å²	80	109.6 Å²	109.6	52%	0.519	53%	0.534	S	S	.	.			trans	-58.2	113.6	161.2	2.8	6.3	0	0	0	104.7	Q867 H871 I912	Q867-P869 WeakPolarHBondContact O-CD 3.31Å; P869-H871 PolarHBondContact O-N 2.78Å; P869-I912 HydrophobicContact CG-CD1 3.52Å
870	I	32.7	Very low	44.6	Very low	144 Å²	144	109.6 Å²	109.6	74%	0.738	54%	0.544	S	S	*	.			trans	-69.2	81.7	170	-59.5	168.6	0	0	0	104.8	Q868 Y872	Q868-I870 PolarHBondContact O-N 3.39Å; I870-Y872 PolarHBondContact O-N 2.78Å
871	H	27	Very low	42	Very low	153 Å²	153	115.7 Å²	115.7	71%	0.708	58%	0.582	S	S	*	*			trans	-63.2	115.9	162.6	-127	-84.8	0	0	0	104.4	P869 S873	P869-H871 PolarHBondContact O-N 2.78Å; H871-S873 PolarHBondContact O-N 3.32Å
872	Y	26.8	Very low	39.3	Very low	220 Å²	220	124.5 Å²	124.5	86%	0.863	62%	0.623	S	S	*	*			trans	-62.9	67.3	155.7	-81.1	-87.2	0	0	0	107.8	I870 A874	I870-Y872 PolarHBondContact O-N 2.78Å; Y872-A874 PolarHBondContact O-N 2.85Å
873	S	26.7	Very low	36.8	Very low	79 Å²	79	126.7 Å²	126.7	55%	0.552	64%	0.643	S	S	*	*			trans	-77.4	88.7	162	55.7	0	0	0	0	104.5	H871 R875	H871-S873 PolarHBondContact O-N 3.32Å; S873-R875 PolarHBondContact O-N 3.1Å
874	A	25	Very low	34.4	Very low	87 Å²	87	132.4 Å²	132.4	72%	0.719	67%	0.672	S	S	*	*			trans	-56.8	85.1	163.8	0	0	0	0	0	107.1	Y872 K876	Y872-A874 PolarHBondContact O-N 2.85Å; A874-K876 PolarHBondContact O-N 2.73Å
875	R	24.8	Very low	32.1	Very low	212 Å²	212	137.2 Å²	137.2	80%	0.8	70%	0.703	S	S	*	*			trans	-65.2	89.2	164.8	-78.3	-171.4	-179	-162.9	-0.8	105.5	S873 N877	S873-R875 PolarHBondContact O-N 3.1Å; R875-N877 PolarHBondContact O-N 3.18Å
876	K	26.6	Very low	30	Very low	192 Å²	192	144 Å²	144	84%	0.835	74%	0.737	S	S	*	*			trans	-64.7	72.6	158.7	-71.6	-178.6	176.3	177.4	0	107.7	A874	A874-K876 PolarHBondContact O-N 2.73Å
877	N	26.7	Very low	28.4	Very low	127 Å²	127	138.4 Å²	138.4	68%	0.679	74%	0.735	S	S	*	*			trans	-113.6	100.9	164.3	-77.2	20.2	0	0	0	107	R875	R875-N877 PolarHBondContact O-N 3.18Å
878	D	26.3	Very low	27	Very low	139 Å²	139	141.5 Å²	141.5	74%	0.743	76%	0.758	S	S	*	*			trans	39.8	97.5	137.9	-58.6	-24.4	0	0	0	116.4	N880	D878-N880 PolarHBondContact O-N 2.9Å
879	T	26.2	Very low	26.1	Very low	121 Å²	121	140.6 Å²	140.6	74%	0.742	76%	0.758	S	S	*	*				18.6	102.3	124.7	56.9	0	0	0	0	115.5
880	N	24.8	Very low	25.4	Very low	157 Å²	157	141.7 Å²	141.7	84%	0.84	77%	0.768	S	S	*	*			trans	157.8	57.2	132.4	-77.9	-19.9	0	0	0	111.5	D878	D878-N880 PolarHBondContact O-N 2.9Å
881	V	26.4	Very low	25	Very low	135 Å²	135	141.8 Å²	141.8	82%	0.818	77%	0.769	S	S	*	*			trans	-136.7	110.6	149	-174.8	0	0	0	0	106.9	C883	V881-C883 PolarHBondContact O-N 2.8Å; V881-C883 VanDerWaalsContact O-N 3.1Å
882	Q	21.6	Very low	24.8	Very low	185 Å²	185	141 Å²	141	86%	0.864	77%	0.77	S	S	*	*			trans	-56.8	109.2	174.3	-75.2	165.6	-44.1	0	0	109.8
883	C	22.2	Very low	24.7	Very low	113 Å²	113	137 Å²	137	76%	0.764	76%	0.764	S	S	*	*			trans	-117.1	106.7	153.4	-79.5	0	0	0	0	107.4	V881 T885	V881-C883 PolarHBondContact O-N 2.8Å; V881-C883 VanDerWaalsContact O-N 3.1Å; C883-T885 PolarHBondContact O-N 3.08Å
884	N	21.2	Very low	24.4	Very low	156 Å²	156	139.6 Å²	139.6	83%	0.834	78%	0.781	S	S	*	*			trans	-66.5	102.9	172.4	-73.7	-27.1	0	0	0	109.7
885	T	24.7	Very low	24.3	Very low	121 Å²	121	143.3 Å²	143.3	74%	0.742	78%	0.783	S	S	*	*			trans	-154.2	92.7	156.9	12.2	0	0	0	0	109.8	C883 A887	C883-T885 PolarHBondContact O-N 3.08Å; T885-A887 PolarHBondContact O-N 3.01Å
886	I	24.3	Very low	24.1	Very low	163 Å²	163	142.5 Å²	142.5	84%	0.836	78%	0.781	S	S	*	*			trans	28.3	84.9	138.2	-49.1	171.4	0	0	0	114.1	V888	I886-V888 PolarHBondContact O-N 3.21Å
887	A	24.8	Very low	24	Very low	91 Å²	91	144.5 Å²	144.5	75%	0.752	78%	0.784	S	S	*	*			trans	-81	113.5	163.8	0	0	0	0	0	108.7	T885 N889	T885-A887 PolarHBondContact O-N 3.01Å; A887-N889 PolarHBondContact O-N 3.39Å
888	V	26.7	Very low	23.7	Very low	134 Å²	134	146 Å²	146	81%	0.812	79%	0.791	S	S	*	*			trans	-62.7	120.4	164.9	171	0	0	0	0	107.8	I886	I886-V888 PolarHBondContact O-N 3.21Å
889	N	22.8	Very low	23.5	Very low	143 Å²	143	148 Å²	148	77%	0.765	80%	0.796	S	S	*	*			trans	-62.2	154.6	167.9	-73.1	-37	0	0	0	110.9	A887	A887-N889 PolarHBondContact O-N 3.39Å
890	S	25.7	Very low	23.2	Very low	104 Å²	104	151.3 Å²	151.3	73%	0.727	80%	0.801	S	S	*	*			trans	111.6	118.3	143.9	83.4	0	0	0	0	117.5
891	L	24	Very low	23.1	Very low	145 Å²	145	152.5 Å²	152.5	76%	0.759	80%	0.801	S	S	*	*			trans	71.4	104.7	143.5	-92.8	53.4	0	0	0	116.6
892	D	22.8	Very low	22.8	Very low	137 Å²	137	155.3 Å²	155.3	73%	0.733	80%	0.803	S	S	*	*				73.2	132.9	74	-70.5	-36.7	0	0	0	112.9
893	N	23.9	Very low	22.9	Very low	136 Å²	136	154.9 Å²	154.9	73%	0.727	80%	0.803	S	S	*	*			trans	79.5	77.2	168.8	-59	-20.5	0	0	0	117.5
894	C	21.5	Very low	23	Very low	134 Å²	134	157.6 Å²	157.6	91%	0.905	80%	0.804	S	S	*	*			trans	-135.8	84.1	136.6	-153.1	0	0	0	0	108.5
895	H	21.5	Very low	23.1	Very low	164 Å²	164	153.6 Å²	153.6	76%	0.759	80%	0.8	S	S	*	*			trans	-64.5	153.7	162.5	-75.6	-79.8	0	0	0	109.1
896	Y	22.1	Very low	23.2	Very low	196 Å²	196	154 Å²	154	77%	0.769	80%	0.798	S	S	*	*			trans	99.1	73.7	159.9	-145.2	-88.4	0	0	0	117.2
897	W	22.9	Very low	23.7	Very low	234 Å²	234	151.8 Å²	151.8	89%	0.886	80%	0.797	S	S	*	*			trans	-150.5	62.4	141.8	-71.6	97.3	0	0	0	109.4	Q899	W897-Q899 PolarHBondContact O-N 2.8Å
898	D	20.9	Very low	24.3	Very low	157 Å²	157	152.2 Å²	152.2	84%	0.84	79%	0.786	S	S	*	*			trans	-75.3	104.4	154.6	-75.3	-40.1	0	0	0	107
899	Q	21.8	Very low	24.8	Very low	181 Å²	181	154 Å²	154	85%	0.846	79%	0.792	S	S	*	*			trans	162.4	62.6	158.6	-91.8	168.7	29.9	0	0	108.8	W897	W897-Q899 PolarHBondContact O-N 2.8Å
900	F	20.9	Very low	26.2	Very low	192 Å²	192	150.5 Å²	150.5	84%	0.842	77%	0.771	S	S	*	*			trans	-112.3	108.7	153.3	-92	-84.8	0	0	0	106.7	F902	F900-F902 PolarHBondContact O-N 2.78Å
901	E	22.1	Very low	27.9	Very low	182 Å²	182	148.2 Å²	148.2	85%	0.85	75%	0.754	S	S	*	*			trans	-42.4	117	170.2	-72.1	174.8	153.9	0	0	107.9	M903	E901-M903 PolarHBondContact O-N 3.2Å
902	F	20.6	Very low	29.7	Very low	193 Å²	193	145 Å²	145	85%	0.846	74%	0.737	S	S	*	*			trans	-53.5	94.4	166.7	-134	-97.9	0	0	0	105.6	F900 E904	F900-F902 PolarHBondContact O-N 2.78Å; F902-E904 PolarHBondContact O-N 2.82Å
903	M	23.4	Very low	31.6	Very low	177 Å²	177	141.1 Å²	141.1	87%	0.872	71%	0.714	S	S	*	*			trans	-63.8	100.7	158.4	-77.2	-161.8	71.9	0	0	103.6	E901 G905	E901-M903 PolarHBondContact O-N 3.2Å; M903-G905 PolarHBondContact O-N 2.96Å
904	E	24.7	Very low	33.8	Very low	169 Å²	169	135 Å²	135	79%	0.79	68%	0.682	S	S	*	*			trans	-36.2	118.9	169.9	-74.2	177.8	148.1	0	0	107	F902 D906	F902-E904 PolarHBondContact O-N 2.82Å; E904-D906 PolarHBondContact O-N 3.42Å
905	G	22.6	Very low	36.4	Very low	72 Å²	72	132.1 Å²	132.1	74%	0.742	66%	0.657	S	S	*	*			trans	-62.1	84.8	173.5	0	0	0	0	0	107.3	M903 S907	M903-G905 PolarHBondContact O-N 2.96Å; G905-S907 VanDerWaalsContact C-N 3.32Å; G905-S907 PolarHBondContact O-N 2.99Å
906	D	28.4	Very low	39.1	Very low	129 Å²	129	124.4 Å²	124.4	69%	0.69	62%	0.621	S	S	*	*			trans	-55.3	112.3	155.4	-94.2	-15.7	0	0	0	103.8	E904 N908	E904-D906 PolarHBondContact O-N 3.42Å; D906-N908 CarbonylContact O-C 3.59Å; D906-N908 PolarHBondContact O-N 2.9Å
907	S	34.3	Very low	41.9	Very low	117 Å²	117	115.3 Å²	115.3	82%	0.818	59%	0.586	S	S	*	*	S	Bend	trans	-54.5	8.5	179.7	49.4	0	0	0	0	114.5	G905 N909	G905-S907 VanDerWaalsContact C-N 3.32Å; G905-S907 PolarHBondContact O-N 2.99Å; S907-N909 PolarHBondContact O-N 3.42Å
908	N	37.2	Very low	44.6	Very low	100 Å²	100	104.1 Å²	104.1	54%	0.535	54%	0.543	S	S	.	.			trans	-87.2	83.2	168.1	-62.3	-28.5	0	0	0	107.9	D906 Q910	D906-N908 CarbonylContact O-C 3.59Å; D906-N908 PolarHBondContact O-N 2.9Å; N908-Q910 HydrophobicContact CB-CB 4.22Å; N908-Q910 HydrophobicContact CB-CG 4.15Å; N908-Q910 PolarHBondContact O-N 2.88Å
909	N	37.5	Very low	47.4	Very low	172 Å²	172	97.3 Å²	97.3	92%	0.92	51%	0.508	S	S	*	.			trans	-61.6	37.1	148.6	-89.1	-19.9	0	0	0	110.8	S907 S911	S907-N909 PolarHBondContact O-N 3.42Å; N909-S911 PolarHBondContact O-N 3.48Å
910	Q	51.6	Low	50.3	Low	70 Å²	70	88.8 Å²	88.8	33%	0.327	47%	0.468	S	S	.	.			trans	-57.6	112.2	163.9	-90.5	-177.3	-9.4	0	0	105.5	N908 I912 N955	N908-Q910 HydrophobicContact CB-CB 4.22Å; N908-Q910 HydrophobicContact CB-CG 4.15Å; N908-Q910 PolarHBondContact O-N 2.88Å; Q910-I912 PolarHBondContact O-N 2.75Å; Q910-I912 VanDerWaalsContact O-N 3.16Å; Q910-N955 PolarHBondContact NE2-ND2 3.38Å; Q910-N955 PolarHBondContact OE1-ND2 3.11Å
911	S	60.6	Low	53.2	Low	55 Å²	55	79.7 Å²	79.7	39%	0.385	43%	0.428	S	S	.	.			trans	-44.3	129.5	172.6	61.4	0	0	0	0	108.4	N909 F913 S914 L915	N909-S911 PolarHBondContact O-N 3.48Å; S911-F913 CarbonylContact O-C 3.54Å; S911-F913 PolarHBondContact O-N 2.78Å; S911-S914 WeakPolarHBondContact O-CA 3.43Å; S911-S914 PolarHBondContact O-N 3.11Å; S911-S914 PolarHBondContact O-OG 3.4Å; S911-S914 PolarHBondContact OG-N 3.47Å; S911-L915 PolarHBondContact O-N 3.14Å
912	I	63.2	Low	56.1	Low	77 Å²	77	72.7 Å²	72.7	40%	0.395	40%	0.395	S	S	.	.	H	α-helix	trans	-47.6	-31.2	172.5	-67.2	163.7	0	0	0	110	P869 Q910 L915 L916	P869-I912 HydrophobicContact CG-CD1 3.52Å; Q910-I912 PolarHBondContact O-N 2.75Å; Q910-I912 VanDerWaalsContact O-N 3.16Å; I912-L915 PolarHBondContact O-N 2.91Å; I912-L916 HydrophobicContact CG2-CD1 3.81Å; I912-L916 HydrophobicContact CG2-CG 4.3Å; I912-L916 WeakPolarHBondContact O-CB 3.41Å; I912-L916 WeakPolarHBondContact O-CG 3.34Å; I912-L916 PolarHBondContact O-N 2.86Å
913	F	62.3	Low	58.9	Low	56 Å²	56	63.8 Å²	63.8	25%	0.246	36%	0.356	C	S	.	.	H	α-helix	trans	-46.5	-59.1	166.1	-170.5	-77.8	0	0	0	112.9	S865 S911 L915 L916 F917 L952	S865-F913 WeakPolarHBondContact OG-CD2 3.25Å; S911-F913 CarbonylContact O-C 3.54Å; S911-F913 PolarHBondContact O-N 2.78Å; F913-L915 VanDerWaalsContact C-N 3.34Å; F913-L915 PolarHBondContact O-N 2.99Å; F913-L916 PolarHBondContact O-N 3.33Å; F913-F917 AromaticContact CD1-CD2 3.8Å; F913-F917 HydrophobicContact CD1-CD2 3.8Å; F913-F917 HydrophobicContact CD1-CE2 4Å; F913-F917 HydrophobicContact CD2-CE2 4.07Å; F913-F917 AromaticContact CE1-CD2 3.57Å; F913-F917 HydrophobicContact CE1-CD2 3.57Å; F913-F917 AromaticContact CE1-CE2 3.57Å; F913-F917 HydrophobicContact CE1-CE2 3.57Å; F913-F917 HydrophobicContact CE2-CD2 4.38Å; F913-F917 AromaticContact CE2-CE2 3.61Å; F913-F917 HydrophobicContact CE2-CE2 3.61Å; F913-F917 HydrophobicContact CE2-CZ 4.47Å; F913-F917 HydrophobicContact CG-CD2 4.29Å; F913-F917 HydrophobicContact CG-CE2 4.21Å; F913-F917 AromaticContact CZ-CD2 3.87Å; F913-F917 HydrophobicContact CZ-CD2 3.87Å; F913-F917 AromaticContact CZ-CE2 3.33Å; F913-F917 HydrophobicContact CZ-CE2 3.33Å; F913-F917 HydrophobicContact CZ-CZ 4.16Å; F913-F917 VanDerWaalsContact O-CD2 3.25Å; F913-F917 WeakPolarHBondContact O-CD2 3Å; F913-F917 PolarHBondContact O-N 2.92Å; F913-L952 HydrophobicContact CE1-CD2 4.08Å; F913-L952 HydrophobicContact CZ-CD2 3.83Å
914	S	70.5	Confident	61.6	Low	7 Å²	7	55.4 Å²	55.4	5%	0.049	32%	0.315	C	S	.	.	H	α-helix	trans	-62.3	-38.2	-179.1	67.4	0	0	0	0	113.2	S911 T918 K953	S911-S914 WeakPolarHBondContact O-CA 3.43Å; S911-S914 PolarHBondContact O-N 3.11Å; S911-S914 PolarHBondContact O-OG 3.4Å; S911-S914 PolarHBondContact OG-N 3.47Å; S914-T918 WeakPolarHBondContact O-CB 3.42Å; S914-T918 PolarHBondContact O-N 3.25Å; S914-T918 VanDerWaalsContact O-N 3.07Å; S914-T918 PolarHBondContact O-OG1 2.79Å; S914-K953 WeakPolarHBondContact CA-O 3.28Å
915	L	75	Confident	64.2	Low	75 Å²	75	47.3 Å²	47.3	39%	0.393	28%	0.277	S	S	.	.	H	α-helix	trans	-67.3	-44.2	-179.9	-172.7	65.5	0	0	0	111.2	S911 I912 F913 T918 T919	S911-L915 PolarHBondContact O-N 3.14Å; I912-L915 PolarHBondContact O-N 2.91Å; F913-L915 VanDerWaalsContact C-N 3.34Å; F913-L915 PolarHBondContact O-N 2.99Å; L915-T918 PolarHBondContact O-N 3Å; L915-T919 HydrophobicContact CD1-CG2 4.46Å; L915-T919 WeakPolarHBondContact O-CG2 3.3Å; L915-T919 PolarHBondContact O-N 3.18Å; L915-T919 PolarHBondContact O-OG1 3.41Å; L915-T919 VanDerWaalsContact O-OG1 3.09Å
916	L	79.3	Confident	66.8	Low	2 Å²	2	46.1 Å²	46.1	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-59.8	-51.7	178.9	-78.3	165.4	0	0	0	112.2	H840 Y860 F864 I912 F913 T918 T919 F920	H840-L916 HydrophobicContact CB-CD2 3.6Å; Y860-L916 HydrophobicContact CE1-CD2 4.24Å; F864-L916 HydrophobicContact CB-CD1 4.04Å; I912-L916 HydrophobicContact CG2-CD1 3.81Å; I912-L916 HydrophobicContact CG2-CG 4.3Å; I912-L916 WeakPolarHBondContact O-CB 3.41Å; I912-L916 WeakPolarHBondContact O-CG 3.34Å; I912-L916 PolarHBondContact O-N 2.86Å; F913-L916 PolarHBondContact O-N 3.33Å; L916-T918 VanDerWaalsContact C-N 3.3Å; L916-T918 PolarHBondContact O-N 3.3Å; L916-T919 WeakPolarHBondContact CA-OG1 3.42Å; L916-T919 PolarHBondContact O-N 2.76Å; L916-T919 PolarHBondContact O-OG1 2.9Å; L916-F920 WeakPolarHBondContact O-CB 3.17Å; L916-F920 PolarHBondContact O-N 3.06Å
917	F	80	Confident	69.1	Low	4 Å²	4	42.7 Å²	42.7	2%	0.018	23%	0.231	C	C	.	.	H	α-helix	trans	-65.3	-34.2	179	-76.5	-73.8	0	0	0	112.6	L858 C861 L862 F913 V921 L952 F954	L858-F917 HydrophobicContact CD2-CE1 4.34Å; C861-F917 HydrophobicContact CB-CD1 4.18Å; C861-F917 HydrophobicContact CB-CE1 3.77Å; C861-F917 HydrophobicContact CB-CE2 4.28Å; C861-F917 HydrophobicContact CB-CZ 3.81Å; L862-F917 HydrophobicContact CD2-CZ 3.84Å; L862-F917 HydrophobicContact CG-CZ 4.1Å; F913-F917 AromaticContact CD1-CD2 3.8Å; F913-F917 HydrophobicContact CD1-CD2 3.8Å; F913-F917 HydrophobicContact CD1-CE2 4Å; F913-F917 HydrophobicContact CD2-CE2 4.07Å; F913-F917 AromaticContact CE1-CD2 3.57Å; F913-F917 HydrophobicContact CE1-CD2 3.57Å; F913-F917 AromaticContact CE1-CE2 3.57Å; F913-F917 HydrophobicContact CE1-CE2 3.57Å; F913-F917 HydrophobicContact CE2-CD2 4.38Å; F913-F917 AromaticContact CE2-CE2 3.61Å; F913-F917 HydrophobicContact CE2-CE2 3.61Å; F913-F917 HydrophobicContact CE2-CZ 4.47Å; F913-F917 HydrophobicContact CG-CD2 4.29Å; F913-F917 HydrophobicContact CG-CE2 4.21Å; F913-F917 AromaticContact CZ-CD2 3.87Å; F913-F917 HydrophobicContact CZ-CD2 3.87Å; F913-F917 AromaticContact CZ-CE2 3.33Å; F913-F917 HydrophobicContact CZ-CE2 3.33Å; F913-F917 HydrophobicContact CZ-CZ 4.16Å; F913-F917 VanDerWaalsContact O-CD2 3.25Å; F913-F917 WeakPolarHBondContact O-CD2 3Å; F913-F917 PolarHBondContact O-N 2.92Å; F917-V921 WeakPolarHBondContact O-CG2 3.34Å; F917-V921 PolarHBondContact O-N 2.85Å; F917-V921 VanDerWaalsContact O-N 3.1Å; F917-L952 HydrophobicContact CD1-CD1 4.27Å; F917-L952 HydrophobicContact CD1-CD2 4.22Å; F917-L952 HydrophobicContact CD2-CD2 4.27Å; F917-L952 HydrophobicContact CE1-CD1 4.35Å; F917-L952 HydrophobicContact CE1-CD2 3.92Å; F917-L952 HydrophobicContact CE2-CD2 4.01Å; F917-L952 HydrophobicContact CG-CD2 4.4Å; F917-L952 HydrophobicContact CZ-CD2 3.82Å; F917-F954 HydrophobicContact CB-CD1 3.97Å; F917-F954 HydrophobicContact CB-CE1 3.75Å
918	T	79.5	Confident	71	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65	-49.8	174.4	-52.7	0	0	0	0	110.7	S914 L915 L916 F920 V921 E922 N955 K958 L959	S914-T918 WeakPolarHBondContact O-CB 3.42Å; S914-T918 PolarHBondContact O-N 3.25Å; S914-T918 VanDerWaalsContact O-N 3.07Å; S914-T918 PolarHBondContact O-OG1 2.79Å; L915-T918 PolarHBondContact O-N 3Å; L916-T918 VanDerWaalsContact C-N 3.3Å; L916-T918 PolarHBondContact O-N 3.3Å; T918-F920 VanDerWaalsContact C-N 3.32Å; T918-F920 PolarHBondContact O-N 3.23Å; T918-V921 PolarHBondContact O-N 3.42Å; T918-E922 WeakPolarHBondContact O-CG 2.9Å; T918-E922 PolarHBondContact O-N 2.93Å; T918-N955 HydrophobicContact CG2-CB 3.83Å; T918-N955 PolarHBondContact OG1-N 2.94Å; T918-K958 HydrophobicContact CG2-CB 4.26Å; T918-L959 HydrophobicContact CG2-CD1 4.35Å; T918-L959 HydrophobicContact CG2-CD2 4.03Å; T918-L959 HydrophobicContact CG2-CG 3.79Å
919	T	80	Confident	72.6	Confident	14 Å²	14	38.4 Å²	38.4	9%	0.086	20%	0.198	C	C	.	.	H	α-helix	trans	-62.6	-36.7	178.1	54.2	0	0	0	0	112.8	M841 L844 L915 L916 E922 I923	M841-T919 HydrophobicContact CG-CG2 4.47Å; L844-T919 WeakPolarHBondContact CD1-OG1 3.23Å; L915-T919 HydrophobicContact CD1-CG2 4.46Å; L915-T919 WeakPolarHBondContact O-CG2 3.3Å; L915-T919 PolarHBondContact O-N 3.18Å; L915-T919 PolarHBondContact O-OG1 3.41Å; L915-T919 VanDerWaalsContact O-OG1 3.09Å; L916-T919 WeakPolarHBondContact CA-OG1 3.42Å; L916-T919 PolarHBondContact O-N 2.76Å; L916-T919 PolarHBondContact O-OG1 2.9Å; T919-E922 PolarHBondContact O-N 2.82Å; T919-I923 WeakPolarHBondContact O-CD1 3.41Å; T919-I923 VanDerWaalsContact O-CG1 3.27Å; T919-I923 WeakPolarHBondContact O-CG1 3.4Å; T919-I923 PolarHBondContact O-N 3.33Å
920	F	83.1	Confident	74.1	Confident	1 Å²	1	36.4 Å²	36.4	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-58.5	-49.9	172.7	172.8	-89.2	0	0	0	111.2	L844 I848 A857 L858 L916 T918 I923 C924 M942 L946	L844-F920 HydrophobicContact CD1-CB 4.29Å; L844-F920 HydrophobicContact CD2-CD2 4.22Å; I848-F920 HydrophobicContact CD1-CD2 3.63Å; I848-F920 HydrophobicContact CD1-CE2 3.76Å; I848-F920 HydrophobicContact CG1-CD2 4.47Å; I848-F920 HydrophobicContact CG1-CE2 4.2Å; A857-F920 HydrophobicContact CB-CD2 3.92Å; A857-F920 HydrophobicContact CB-CE2 3.53Å; L858-F920 HydrophobicContact CD2-CD1 4.27Å; L858-F920 HydrophobicContact CD2-CE1 3.89Å; L858-F920 HydrophobicContact CD2-CE2 4.45Å; L858-F920 HydrophobicContact CD2-CZ 3.98Å; L858-F920 HydrophobicContact CG-CE1 4.28Å; L858-F920 HydrophobicContact CG-CE2 4.24Å; L858-F920 HydrophobicContact CG-CZ 3.86Å; L916-F920 WeakPolarHBondContact O-CB 3.17Å; L916-F920 PolarHBondContact O-N 3.06Å; T918-F920 VanDerWaalsContact C-N 3.32Å; T918-F920 PolarHBondContact O-N 3.23Å; F920-I923 PolarHBondContact O-N 2.95Å; F920-C924 VanDerWaalsContact CZ-SG 3.57Å; F920-C924 PolarHBondContact O-N 2.91Å; F920-C924 PolarHBondContact O-SG 2.8Å; F920-M942 HydrophobicContact CZ-CE 4.24Å; F920-L946 HydrophobicContact CD1-CD1 4.1Å; F920-L946 HydrophobicContact CE1-CD1 3.36Å; F920-L946 HydrophobicContact CZ-CD1 4.22Å
921	V	81.5	Confident	74.6	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-64.9	-40.9	179.3	173	0	0	0	0	111.3	F917 T918 I923 C924 L925 I943 L947 F954 L959	F917-V921 WeakPolarHBondContact O-CG2 3.34Å; F917-V921 PolarHBondContact O-N 2.85Å; F917-V921 VanDerWaalsContact O-N 3.1Å; T918-V921 PolarHBondContact O-N 3.42Å; V921-I923 PolarHBondContact O-N 3.35Å; V921-C924 PolarHBondContact O-N 2.94Å; V921-L925 HydrophobicContact CG1-CD1 3.93Å; V921-L925 HydrophobicContact CG1-CG 4.19Å; V921-L925 WeakPolarHBondContact O-CB 3.47Å; V921-L925 VanDerWaalsContact O-CG 3.3Å; V921-L925 WeakPolarHBondContact O-CG 3.38Å; V921-L925 PolarHBondContact O-N 3.17Å; V921-I943 HydrophobicContact CG1-CG2 4.02Å; V921-L947 HydrophobicContact CG1-CD2 4.11Å; V921-F954 HydrophobicContact CG2-CE1 3.91Å; V921-L959 HydrophobicContact CB-CD2 3.92Å; V921-L959 HydrophobicContact CG1-CD2 3.59Å
922	E	82.5	Confident	74.3	Confident	36 Å²	36	42.5 Å²	42.5	17%	0.168	21%	0.211	C	C	.	.	H	α-helix	trans	-57.7	-46.9	176.4	-74.6	176.4	166.1	0	0	112	T918 T919 L925 D926 L959	T918-E922 WeakPolarHBondContact O-CG 2.9Å; T918-E922 PolarHBondContact O-N 2.93Å; T919-E922 PolarHBondContact O-N 2.82Å; E922-L925 PolarHBondContact O-N 2.81Å; E922-D926 PolarHBondContact O-N 2.96Å; E922-L959 HydrophobicContact CG-CD2 4.18Å
923	I	80.2	Confident	73.9	Confident	6 Å²	6	46.1 Å²	46.1	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-66.4	-39.3	178.5	-63.7	164.4	0	0	0	110.8	L844 K845 I848 E849 T919 F920 V921 L925 D926 R927	L844-I923 HydrophobicContact CB-CD1 3.69Å; L844-I923 HydrophobicContact CD1-CD1 4.47Å; K845-I923 HydrophobicContact CG-CD1 4.07Å; I848-I923 HydrophobicContact CB-CG2 4.14Å; I848-I923 HydrophobicContact CD1-CB 4.14Å; I848-I923 HydrophobicContact CD1-CG2 3.88Å; I848-I923 HydrophobicContact CG2-CG2 3.97Å; E849-I923 HydrophobicContact CG-CG2 4.39Å; T919-I923 WeakPolarHBondContact O-CD1 3.41Å; T919-I923 VanDerWaalsContact O-CG1 3.27Å; T919-I923 WeakPolarHBondContact O-CG1 3.4Å; T919-I923 PolarHBondContact O-N 3.33Å; F920-I923 PolarHBondContact O-N 2.95Å; V921-I923 PolarHBondContact O-N 3.35Å; I923-L925 VanDerWaalsContact C-N 3.34Å; I923-D926 WeakPolarHBondContact O-CB 3.24Å; I923-D926 PolarHBondContact O-N 3.29Å; I923-R927 PolarHBondContact O-N 3.42Å; I923-R927 VanDerWaalsContact O-N 3.1Å
924	C	80	Confident	73.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.4	-36.6	175.2	-68.8	0	0	0	0	112.6	F920 V921 R927 L928 I943	F920-C924 VanDerWaalsContact CZ-SG 3.57Å; F920-C924 PolarHBondContact O-N 2.91Å; F920-C924 PolarHBondContact O-SG 2.8Å; V921-C924 PolarHBondContact O-N 2.94Å; C924-R927 PolarHBondContact O-N 3Å; C924-L928 PolarHBondContact O-N 3.49Å; C924-L928 VanDerWaalsContact O-N 3.1Å; C924-I943 HydrophobicContact CB-CD1 3.55Å; C924-I943 HydrophobicContact CB-CG1 3.85Å
925	L	78.4	Confident	72.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.7	-42	174.5	-75.6	173.6	0	0	0	111.7	V921 E922 I923 R927 L928 L929 I943 R962 P964 W967	V921-L925 HydrophobicContact CG1-CD1 3.93Å; V921-L925 HydrophobicContact CG1-CG 4.19Å; V921-L925 WeakPolarHBondContact O-CB 3.47Å; V921-L925 VanDerWaalsContact O-CG 3.3Å; V921-L925 WeakPolarHBondContact O-CG 3.38Å; V921-L925 PolarHBondContact O-N 3.17Å; E922-L925 PolarHBondContact O-N 2.81Å; I923-L925 VanDerWaalsContact C-N 3.34Å; L925-R927 VanDerWaalsContact C-N 3.31Å; L925-R927 PolarHBondContact O-N 3.15Å; L925-L928 WeakPolarHBondContact O-CB 3.39Å; L925-L928 PolarHBondContact O-N 2.69Å; L925-L929 WeakPolarHBondContact O-CG 3.47Å; L925-L929 PolarHBondContact O-N 2.51Å; L925-I943 HydrophobicContact CD2-CD1 4.07Å; L925-I943 HydrophobicContact CG-CD1 4.29Å; L925-R962 HydrophobicContact CD1-CB 4.27Å; L925-P964 HydrophobicContact CD2-CG 4.28Å; L925-W967 HydrophobicContact CD2-CH2 3.36Å; L925-W967 HydrophobicContact CD2-CZ2 3.69Å; L925-W967 HydrophobicContact CD2-CZ3 4.22Å
926	D	77.1	Confident	72.4	Confident	47 Å²	47	51.6 Å²	51.6	25%	0.251	26%	0.262	S	S	.	.	H	α-helix	trans	-55.7	-46.6	173	-86.9	-37.5	0	0	0	112	E922 I923 L928 L929 I930 R962	E922-D926 PolarHBondContact O-N 2.96Å; I923-D926 WeakPolarHBondContact O-CB 3.24Å; I923-D926 PolarHBondContact O-N 3.29Å; D926-L928 VanDerWaalsContact C-N 3.33Å; D926-L928 PolarHBondContact O-N 2.78Å; D926-L929 PolarHBondContact O-N 3.17Å; D926-I930 WeakPolarHBondContact O-CD1 3.43Å; D926-I930 VanDerWaalsContact O-CG1 3.3Å; D926-I930 WeakPolarHBondContact O-CG1 3.41Å; D926-I930 PolarHBondContact O-N 2.96Å; D926-R962 IonicContact OD1-CZ 3.03Å; D926-R962 IonicContact OD1-NH1 2.61Å; D926-R962 PolarHBondContact OD1-NH1 2.92Å; D926-R962 IonicContact OD1-NH2 2.72Å; D926-R962 PolarHBondContact OD1-NH2 3.48Å; D926-R962 IonicContact OD2-CZ 3.63Å; D926-R962 IonicContact OD2-NH1 3.94Å; D926-R962 IonicContact OD2-NH2 2.77Å; D926-R962 PolarHBondContact OD2-NH2 2.79Å
927	R	76.8	Confident	72	Confident	56 Å²	56	56.5 Å²	56.5	21%	0.211	29%	0.288	C	S	.	.	H	α-helix	trans	-60.4	-40.4	176.5	-100.7	-105.4	160.2	136.6	-4	113	I848 E849 N852 I923 C924 L925 L929 I930 N931	I848-R927 PolarHBondContact O-NH1 2.67Å; I848-R927 VanDerWaalsContact O-NH1 3.11Å; E849-R927 PolarHBondContact O-NH1 3.48Å; E849-R927 PolarHBondContact O-NH2 3.46Å; N852-R927 PolarHBondContact OD1-NH1 3.28Å; I923-R927 PolarHBondContact O-N 3.42Å; I923-R927 VanDerWaalsContact O-N 3.1Å; C924-R927 PolarHBondContact O-N 3Å; L925-R927 VanDerWaalsContact C-N 3.31Å; L925-R927 PolarHBondContact O-N 3.15Å; R927-L929 VanDerWaalsContact C-N 3.29Å; R927-L929 PolarHBondContact O-N 2.8Å; R927-I930 PolarHBondContact O-N 2.81Å; R927-N931 PolarHBondContact O-N 3.1Å; R927-N931 VanDerWaalsContact O-N 3.11Å
928	L	75	Confident	71.8	Confident	24 Å²	24	61.8 Å²	61.8	13%	0.126	32%	0.317	C	S	.	.	H	α-helix	trans	-65.7	-31.3	176.3	-116.3	161.8	0	0	0	112.9	C924 L925 D926 N936 I939 K940 I943 W967	C924-L928 PolarHBondContact O-N 3.49Å; C924-L928 VanDerWaalsContact O-N 3.1Å; L925-L928 WeakPolarHBondContact O-CB 3.39Å; L925-L928 PolarHBondContact O-N 2.69Å; D926-L928 VanDerWaalsContact C-N 3.33Å; D926-L928 PolarHBondContact O-N 2.78Å; L928-N936 HydrophobicContact CD2-CB 3.76Å; L928-N936 VanDerWaalsContact CD2-CG 3.49Å; L928-N936 WeakPolarHBondContact CD2-OD1 3.4Å; L928-I939 HydrophobicContact CD1-CB 4.29Å; L928-I939 HydrophobicContact CD1-CG2 3.69Å; L928-I939 HydrophobicContact CG-CB 4.33Å; L928-I939 HydrophobicContact CG-CG2 3.91Å; L928-K940 HydrophobicContact CD1-CB 4.31Å; L928-I943 HydrophobicContact CD1-CD1 3.52Å; L928-W967 HydrophobicContact CD1-CZ2 4.13Å
929	L	70.5	Confident	71.6	Confident	103 Å²	103	62.3 Å²	62.3	54%	0.539	32%	0.319	S	S	.	.	H	α-helix	trans	-76.8	-27.2	177.2	-70.7	166.3	0	0	0	112.7	L925 D926 R927	L925-L929 WeakPolarHBondContact O-CG 3.47Å; L925-L929 PolarHBondContact O-N 2.51Å; D926-L929 PolarHBondContact O-N 3.17Å; R927-L929 VanDerWaalsContact C-N 3.29Å; R927-L929 PolarHBondContact O-N 2.8Å
930	I	68.5	Low	71.5	Confident	130 Å²	130	63.7 Å²	63.7	67%	0.667	32%	0.324	S	S	*	.	H	α-helix	trans	-88.5	-41.1	-176	-64.3	163.4	0	0	0	112	D926 R927	D926-I930 WeakPolarHBondContact O-CD1 3.43Å; D926-I930 VanDerWaalsContact O-CG1 3.3Å; D926-I930 WeakPolarHBondContact O-CG1 3.41Å; D926-I930 PolarHBondContact O-N 2.96Å; R927-I930 PolarHBondContact O-N 2.81Å
931	N	62.8	Low	71.4	Confident	58 Å²	58	69.4 Å²	69.4	31%	0.31	35%	0.349	S	S	.	.			trans	-90.1	112.3	-176.4	-73.2	-7.5	0	0	0	109.7	R927 E933 N936	R927-N931 PolarHBondContact O-N 3.1Å; R927-N931 VanDerWaalsContact O-N 3.11Å; N931-E933 PolarHBondContact O-N 3.05Å; N931-N936 VanDerWaalsContact O-CG 3.22Å; N931-N936 PolarHBondContact O-ND2 2.82Å; N931-N936 PolarHBondContact O-OD1 3Å; N931-N936 VanDerWaalsContact O-OD1 3.08Å
932	E	54.5	Low	71.5	Confident	195 Å²	195	71.2 Å²	71.2	91%	0.911	36%	0.358	S	S	*	.			trans	-81	2.3	174.5	-69	-169.9	155.2	0	0	113.5
933	E	54.9	Low	71.4	Confident	154 Å²	154	69.5 Å²	69.5	72%	0.72	35%	0.35	S	S	*	.	S	Bend	trans	-91.7	159.5	-171.1	-62.5	-170	165.7	0	0	114.4	N931 S935 N936	N931-E933 PolarHBondContact O-N 3.05Å; E933-S935 PolarHBondContact O-N 2.82Å; E933-N936 PolarHBondContact O-N 2.7Å
934	N	53.9	Low	71.5	Confident	164 Å²	164	70.1 Å²	70.1	88%	0.877	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.5	-17.5	-172.8	-74	-24.1	0	0	0	117.2	N936	N934-N936 PolarHBondContact O-N 3.06Å
935	S	56.7	Low	71.6	Confident	55 Å²	55	75.8 Å²	75.8	39%	0.385	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-15.2	171.5	50.5	0	0	0	0	113.9	E933 D937 D938 I939	E933-S935 PolarHBondContact O-N 2.82Å; S935-D937 VanDerWaalsContact C-N 3.31Å; S935-D937 PolarHBondContact O-N 3.29Å; S935-D938 PolarHBondContact O-N 3.21Å; S935-I939 WeakPolarHBondContact O-CG1 3.33Å; S935-I939 PolarHBondContact O-N 2.97Å
936	N	64.3	Low	71.7	Confident	33 Å²	33	76.8 Å²	76.8	18%	0.176	39%	0.389	C	S	.	.	H	α-helix	trans	-60.7	-34.1	-177.2	-86	-8.1	0	0	0	114.4	L928 N931 E933 N934 I939 K940	L928-N936 HydrophobicContact CD2-CB 3.76Å; L928-N936 VanDerWaalsContact CD2-CG 3.49Å; L928-N936 WeakPolarHBondContact CD2-OD1 3.4Å; N931-N936 VanDerWaalsContact O-CG 3.22Å; N931-N936 PolarHBondContact O-ND2 2.82Å; N931-N936 PolarHBondContact O-OD1 3Å; N931-N936 VanDerWaalsContact O-OD1 3.08Å; E933-N936 PolarHBondContact O-N 2.7Å; N934-N936 PolarHBondContact O-N 3.06Å; N936-I939 PolarHBondContact O-N 2.84Å; N936-K940 WeakPolarHBondContact O-CB 3.1Å; N936-K940 PolarHBondContact O-N 2.65Å
937	D	71.9	Confident	71.9	Confident	105 Å²	105	74.6 Å²	74.6	56%	0.561	38%	0.377	S	S	*	.	H	α-helix	trans	-69.2	-37.7	-177	-95	0.3	0	0	0	112.6	S935 K941	S935-D937 VanDerWaalsContact C-N 3.31Å; S935-D937 PolarHBondContact O-N 3.29Å; D937-K941 WeakPolarHBondContact O-CB 3.49Å; D937-K941 VanDerWaalsContact O-CG 3.27Å; D937-K941 WeakPolarHBondContact O-CG 3.4Å; D937-K941 PolarHBondContact O-N 3.39Å
938	D	75.8	Confident	72.2	Confident	116 Å²	116	74.2 Å²	74.2	62%	0.62	38%	0.379	S	S	*	.	H	α-helix	trans	-72.6	-39.4	178.2	-72.6	-22.6	0	0	0	111.4	S935 K941 M942	S935-D938 PolarHBondContact O-N 3.21Å; D938-K941 PolarHBondContact O-N 3.13Å; D938-M942 WeakPolarHBondContact O-CB 3.4Å; D938-M942 PolarHBondContact O-N 3.18Å
939	I	75.2	Confident	72.6	Confident	10 Å²	10	75.7 Å²	75.7	5%	0.051	39%	0.387	C	S	.	.	H	α-helix	trans	-65	-45.6	174.3	-60.5	169	0	0	0	109.7	Y854 L928 S935 N936 K941 M942 I943	Y854-I939 HydrophobicContact CE2-CG1 4.34Å; Y854-I939 WeakPolarHBondContact OH-CD1 3.21Å; L928-I939 HydrophobicContact CD1-CB 4.29Å; L928-I939 HydrophobicContact CD1-CG2 3.69Å; L928-I939 HydrophobicContact CG-CB 4.33Å; L928-I939 HydrophobicContact CG-CG2 3.91Å; S935-I939 WeakPolarHBondContact O-CG1 3.33Å; S935-I939 PolarHBondContact O-N 2.97Å; N936-I939 PolarHBondContact O-N 2.84Å; I939-K941 PolarHBondContact O-N 3.05Å; I939-M942 PolarHBondContact O-N 3.22Å; I939-I943 HydrophobicContact CG2-CD1 4Å; I939-I943 HydrophobicContact CG2-CG1 4.35Å; I939-I943 WeakPolarHBondContact O-CG1 3.39Å; I939-I943 PolarHBondContact O-N 2.82Å
940	K	78.7	Confident	72.7	Confident	44 Å²	44	75.2 Å²	75.2	19%	0.191	39%	0.39	C	S	.	.	H	α-helix	trans	-57.6	-48.6	176.4	-175.1	-171.5	177.6	-159.5	0	110.6	L928 N936 M942 I943 L944 W967 E971	L928-K940 HydrophobicContact CD1-CB 4.31Å; N936-K940 WeakPolarHBondContact O-CB 3.1Å; N936-K940 PolarHBondContact O-N 2.65Å; K940-M942 VanDerWaalsContact C-N 3.33Å; K940-M942 PolarHBondContact O-N 3.46Å; K940-I943 PolarHBondContact O-N 2.99Å; K940-L944 HydrophobicContact CG-CD1 4.04Å; K940-L944 HydrophobicContact CG-CG 4.46Å; K940-L944 WeakPolarHBondContact O-CB 3.08Å; K940-L944 VanDerWaalsContact O-CG 3.28Å; K940-L944 WeakPolarHBondContact O-CG 3.35Å; K940-L944 PolarHBondContact O-N 3.06Å; K940-W967 HydrophobicContact CG-CZ2 4.29Å; K940-E971 WeakPolarHBondContact CE-OE2 3.42Å; K940-E971 VanDerWaalsContact NZ-CD 3.31Å; K940-E971 IonicContact NZ-OE1 3.08Å; K940-E971 PolarHBondContact NZ-OE1 3.39Å; K940-E971 VanDerWaalsContact NZ-OE1 3.08Å; K940-E971 IonicContact NZ-OE2 2.71Å; K940-E971 PolarHBondContact NZ-OE2 3.25Å
941	K	81.1	Confident	72.9	Confident	120 Å²	120	75.4 Å²	75.4	52%	0.522	39%	0.393	S	S	.	.	H	α-helix	trans	-59.2	-42.4	175.7	-77.7	172	-172.3	164.4	0	112.3	D937 D938 I939 L944 N945	D937-K941 WeakPolarHBondContact O-CB 3.49Å; D937-K941 VanDerWaalsContact O-CG 3.27Å; D937-K941 WeakPolarHBondContact O-CG 3.4Å; D937-K941 PolarHBondContact O-N 3.39Å; D938-K941 PolarHBondContact O-N 3.13Å; I939-K941 PolarHBondContact O-N 3.05Å; K941-L944 PolarHBondContact O-N 2.86Å; K941-N945 WeakPolarHBondContact O-CB 3.42Å; K941-N945 PolarHBondContact O-N 3.04Å; K941-N945 PolarHBondContact O-ND2 3.45Å
942	M	83	Confident	73.5	Confident	39 Å²	39	73.4 Å²	73.4	19%	0.192	38%	0.382	C	S	.	.	H	α-helix	trans	-64.2	-46.5	177.8	-176.9	-174.9	67.7	0	0	111.9	Y854 F920 D938 I939 K940 N945 L946	Y854-M942 WeakPolarHBondContact CB-SD 3.39Å; Y854-M942 HydrophobicContact CD1-CE 3.24Å; Y854-M942 HydrophobicContact CD1-SD 4.24Å; Y854-M942 HydrophobicContact CD2-CE 4.28Å; Y854-M942 HydrophobicContact CE1-CE 3.92Å; Y854-M942 HydrophobicContact CG-CE 3.44Å; Y854-M942 VanDerWaalsContact CG-CE 3.44Å; Y854-M942 HydrophobicContact CG-SD 3.84Å; F920-M942 HydrophobicContact CZ-CE 4.24Å; D938-M942 WeakPolarHBondContact O-CB 3.4Å; D938-M942 PolarHBondContact O-N 3.18Å; I939-M942 PolarHBondContact O-N 3.22Å; K940-M942 VanDerWaalsContact C-N 3.33Å; K940-M942 PolarHBondContact O-N 3.46Å; M942-N945 PolarHBondContact O-N 3.08Å; M942-L946 HydrophobicContact CG-CD1 4.2Å; M942-L946 WeakPolarHBondContact O-CG 2.94Å; M942-L946 PolarHBondContact O-N 3.32Å
943	I	80.5	Confident	74.4	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-63	-44.6	177.4	-64	175.6	0	0	0	110.4	V921 C924 L925 L928 I939 K940 N945 L946 L947 W967	V921-I943 HydrophobicContact CG1-CG2 4.02Å; C924-I943 HydrophobicContact CB-CD1 3.55Å; C924-I943 HydrophobicContact CB-CG1 3.85Å; L925-I943 HydrophobicContact CD2-CD1 4.07Å; L925-I943 HydrophobicContact CG-CD1 4.29Å; L928-I943 HydrophobicContact CD1-CD1 3.52Å; I939-I943 HydrophobicContact CG2-CD1 4Å; I939-I943 HydrophobicContact CG2-CG1 4.35Å; I939-I943 WeakPolarHBondContact O-CG1 3.39Å; I939-I943 PolarHBondContact O-N 2.82Å; K940-I943 PolarHBondContact O-N 2.99Å; I943-N945 VanDerWaalsContact C-N 3.33Å; I943-N945 PolarHBondContact O-N 3.03Å; I943-L946 PolarHBondContact O-N 2.61Å; I943-L946 VanDerWaalsContact O-N 3.15Å; I943-L947 HydrophobicContact CG2-CD1 3.63Å; I943-L947 HydrophobicContact CG2-CG 3.97Å; I943-L947 WeakPolarHBondContact O-CB 3.35Å; I943-L947 WeakPolarHBondContact O-CG 3.48Å; I943-L947 PolarHBondContact O-N 3.02Å; I943-W967 HydrophobicContact CB-CH2 4.35Å; I943-W967 HydrophobicContact CG2-CH2 3.76Å; I943-W967 HydrophobicContact CG2-CZ3 4.36Å
944	L	81.1	Confident	75.5	Confident	19 Å²	19	62.6 Å²	62.6	10%	0.099	33%	0.329	C	S	.	.	H	α-helix	trans	-60.3	-42.2	176.5	-74.1	174.3	0	0	0	111.8	K940 K941 L946 N948 W967 E971 I972	K940-L944 HydrophobicContact CG-CD1 4.04Å; K940-L944 HydrophobicContact CG-CG 4.46Å; K940-L944 WeakPolarHBondContact O-CB 3.08Å; K940-L944 VanDerWaalsContact O-CG 3.28Å; K940-L944 WeakPolarHBondContact O-CG 3.35Å; K940-L944 PolarHBondContact O-N 3.06Å; K941-L944 PolarHBondContact O-N 2.86Å; L944-L946 VanDerWaalsContact C-N 3.31Å; L944-L946 PolarHBondContact O-N 2.66Å; L944-N948 WeakPolarHBondContact O-CB 3.22Å; L944-N948 VanDerWaalsContact O-CG 3.28Å; L944-N948 PolarHBondContact O-N 3.18Å; L944-N948 PolarHBondContact O-ND2 2.76Å; L944-W967 HydrophobicContact CD2-CE3 4.25Å; L944-W967 HydrophobicContact CD2-CZ3 4.24Å; L944-E971 HydrophobicContact CD1-CB 4.14Å; L944-E971 HydrophobicContact CD2-CB 4.1Å; L944-I972 HydrophobicContact CD2-CG1 4.46Å
945	N	83	Confident	76.7	Confident	120 Å²	120	55.3 Å²	55.3	64%	0.642	29%	0.29	S	S	*	.	H	α-helix	trans	-63.5	-35.5	176	-75.8	-15.7	0	0	0	112.5	K941 M942 I943 N949	K941-N945 WeakPolarHBondContact O-CB 3.42Å; K941-N945 PolarHBondContact O-N 3.04Å; K941-N945 PolarHBondContact O-ND2 3.45Å; M942-N945 PolarHBondContact O-N 3.08Å; I943-N945 VanDerWaalsContact C-N 3.33Å; I943-N945 PolarHBondContact O-N 3.03Å; N945-N949 PolarHBondContact O-N 2.8Å
946	L	81.5	Confident	77.8	Confident	21 Å²	21	53.5 Å²	53.5	11%	0.11	28%	0.275	C	S	.	.	H	α-helix	trans	-74.6	-46.2	176.8	-70.9	166.2	0	0	0	112.3	L858 F920 M942 I943 L944 N948 N949 L952 F954	L858-L946 HydrophobicContact CD1-CD1 4.27Å; L858-L946 HydrophobicContact CD1-CD2 4.22Å; L858-L946 HydrophobicContact CD2-CD1 3.78Å; L858-L946 HydrophobicContact CD2-CD2 3.54Å; L858-L946 HydrophobicContact CD2-CG 4.32Å; F920-L946 HydrophobicContact CD1-CD1 4.1Å; F920-L946 HydrophobicContact CE1-CD1 3.36Å; F920-L946 HydrophobicContact CZ-CD1 4.22Å; M942-L946 HydrophobicContact CG-CD1 4.2Å; M942-L946 WeakPolarHBondContact O-CG 2.94Å; M942-L946 PolarHBondContact O-N 3.32Å; I943-L946 PolarHBondContact O-N 2.61Å; I943-L946 VanDerWaalsContact O-N 3.15Å; L944-L946 VanDerWaalsContact C-N 3.31Å; L944-L946 PolarHBondContact O-N 2.66Å; L946-N948 VanDerWaalsContact C-N 3.31Å; L946-N948 PolarHBondContact O-N 2.92Å; L946-N949 WeakPolarHBondContact O-CB 3.43Å; L946-N949 PolarHBondContact O-N 2.8Å; L946-L952 HydrophobicContact CD2-CD1 3.97Å; L946-F954 WeakPolarHBondContact O-CZ 3.45Å
947	L	81.3	Confident	78.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.4	-40.6	177.6	-74.3	175.9	0	0	0	111.6	V921 I943 N949 L959 L963 W967 F975	V921-L947 HydrophobicContact CG1-CD2 4.11Å; I943-L947 HydrophobicContact CG2-CD1 3.63Å; I943-L947 HydrophobicContact CG2-CG 3.97Å; I943-L947 WeakPolarHBondContact O-CB 3.35Å; I943-L947 WeakPolarHBondContact O-CG 3.48Å; I943-L947 PolarHBondContact O-N 3.02Å; L947-N949 VanDerWaalsContact C-N 3.25Å; L947-N949 PolarHBondContact O-N 3.08Å; L947-L959 HydrophobicContact CD2-CD1 3.94Å; L947-L963 HydrophobicContact CD1-CD2 4.01Å; L947-W967 HydrophobicContact CD1-CZ3 3.95Å; L947-F975 HydrophobicContact CB-CB 4.08Å; L947-F975 HydrophobicContact CB-CD2 3.95Å; L947-F975 HydrophobicContact CB-CG 4.12Å; L947-F975 HydrophobicContact CD2-CD2 3.72Å; L947-F975 HydrophobicContact CD2-CE2 3.63Å; L947-F975 HydrophobicContact CD2-CG 4.28Å; L947-F975 HydrophobicContact CD2-CZ 4.14Å; L947-F975 HydrophobicContact CG-CD2 4.41Å; L947-F975 WeakPolarHBondContact O-CD2 3.46Å
948	N	83	Confident	78.9	Confident	48 Å²	48	55.2 Å²	55.2	26%	0.257	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	1.4	-179.5	-67.4	-28.8	0	0	0	113.3	L944 L946 P950 E971 P974 F975	L944-N948 WeakPolarHBondContact O-CB 3.22Å; L944-N948 VanDerWaalsContact O-CG 3.28Å; L944-N948 PolarHBondContact O-N 3.18Å; L944-N948 PolarHBondContact O-ND2 2.76Å; L946-N948 VanDerWaalsContact C-N 3.31Å; L946-N948 PolarHBondContact O-N 2.92Å; N948-P950 WeakPolarHBondContact O-CD 3.29Å; N948-E971 PolarHBondContact ND2-O 2.98Å; N948-P974 HydrophobicContact CB-CB 4.06Å; N948-P974 HydrophobicContact CB-CG 4.42Å; N948-P974 WeakPolarHBondContact OD1-CB 3.4Å; N948-P974 WeakPolarHBondContact OD1-CD 3.39Å; N948-F975 PolarHBondContact OD1-N 2.97Å
949	N	81.7	Confident	79.1	Confident	55 Å²	55	49.7 Å²	49.7	29%	0.294	26%	0.256	S	S	.	.			trans	-76.9	118.9	175.1	-169.2	-30.3	0	0	0	110.3	N945 L946 L947 D951 L952	N945-N949 PolarHBondContact O-N 2.8Å; L946-N949 WeakPolarHBondContact O-CB 3.43Å; L946-N949 PolarHBondContact O-N 2.8Å; L947-N949 VanDerWaalsContact C-N 3.25Å; L947-N949 PolarHBondContact O-N 3.08Å; N949-D951 VanDerWaalsContact C-N 3.26Å; N949-D951 PolarHBondContact O-N 3Å; N949-D951 PolarHBondContact OD1-N 2.87Å; N949-L952 HydrophobicContact CB-CD1 4.08Å; N949-L952 HydrophobicContact CB-CG 4.23Å; N949-L952 PolarHBondContact O-N 2.82Å
950	P	72.9	Confident	79.4	Confident	94 Å²	94	53.1 Å²	53.1	61%	0.61	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-23.9	-176.8	27.8	-35.4	0	0	0	113.8	N948 L952	N948-P950 WeakPolarHBondContact O-CD 3.29Å; P950-L952 VanDerWaalsContact C-N 3.33Å
951	D	73.5	Confident	79.4	Confident	134 Å²	134	60.1 Å²	60.1	72%	0.717	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-14.7	-174.5	-61.9	-26.1	0	0	0	113	N949	N949-D951 VanDerWaalsContact C-N 3.26Å; N949-D951 PolarHBondContact O-N 3Å; N949-D951 PolarHBondContact OD1-N 2.87Å
952	L	74.8	Confident	79.4	Confident	16 Å²	16	58.6 Å²	58.6	8%	0.084	30%	0.296	C	S	.	.			trans	-93.7	123	-179.1	-61.7	179.3	0	0	0	110.7	F913 F917 L946 N949 P950 F954	F913-L952 HydrophobicContact CE1-CD2 4.08Å; F913-L952 HydrophobicContact CZ-CD2 3.83Å; F917-L952 HydrophobicContact CD1-CD1 4.27Å; F917-L952 HydrophobicContact CD1-CD2 4.22Å; F917-L952 HydrophobicContact CD2-CD2 4.27Å; F917-L952 HydrophobicContact CE1-CD1 4.35Å; F917-L952 HydrophobicContact CE1-CD2 3.92Å; F917-L952 HydrophobicContact CE2-CD2 4.01Å; F917-L952 HydrophobicContact CG-CD2 4.4Å; F917-L952 HydrophobicContact CZ-CD2 3.82Å; L946-L952 HydrophobicContact CD2-CD1 3.97Å; N949-L952 HydrophobicContact CB-CD1 4.08Å; N949-L952 HydrophobicContact CB-CG 4.23Å; N949-L952 PolarHBondContact O-N 2.82Å; P950-L952 VanDerWaalsContact C-N 3.33Å; L952-F954 HydrophobicContact CB-CD2 4.48Å; L952-F954 HydrophobicContact CB-CE2 3.63Å; L952-F954 HydrophobicContact CB-CZ 3.67Å; L952-F954 HydrophobicContact CD1-CZ 4.05Å; L952-F954 WeakPolarHBondContact O-CD2 3.43Å; L952-F954 WeakPolarHBondContact O-CE2 3.24Å
953	K	74.7	Confident	79.2	Confident	114 Å²	114	58.3 Å²	58.3	50%	0.496	29%	0.294	S	S	.	.			trans	-89.9	138.5	170.1	-66.2	-169.4	178	-171.1	0	110	S914	S914-K953 WeakPolarHBondContact CA-O 3.28Å
954	F	77.8	Confident	79	Confident	7 Å²	7	59.4 Å²	59.4	3%	0.031	30%	0.302	C	S	.	.			trans	-129	160.9	179.2	-58.4	-86	0	0	0	110.8	F917 V921 L946 L952 Y956 L959 F975	F917-F954 HydrophobicContact CB-CD1 3.97Å; F917-F954 HydrophobicContact CB-CE1 3.75Å; V921-F954 HydrophobicContact CG2-CE1 3.91Å; L946-F954 WeakPolarHBondContact O-CZ 3.45Å; L952-F954 HydrophobicContact CB-CD2 4.48Å; L952-F954 HydrophobicContact CB-CE2 3.63Å; L952-F954 HydrophobicContact CB-CZ 3.67Å; L952-F954 HydrophobicContact CD1-CZ 4.05Å; L952-F954 WeakPolarHBondContact O-CD2 3.43Å; L952-F954 WeakPolarHBondContact O-CE2 3.24Å; F954-Y956 VanDerWaalsContact C-N 3.31Å; F954-Y956 HydrophobicContact CB-CD1 4.22Å; F954-Y956 HydrophobicContact CB-CE1 4.12Å; F954-Y956 HydrophobicContact CD2-CE1 4.29Å; F954-Y956 WeakPolarHBondContact O-CD2 3.42Å; F954-Y956 WeakPolarHBondContact O-CE2 3.36Å; F954-Y956 PolarHBondContact O-N 2.86Å; F954-L959 HydrophobicContact CB-CD1 3.52Å; F954-L959 HydrophobicContact CD1-CD1 3.74Å; F954-L959 HydrophobicContact CG-CD1 3.73Å; F954-F975 HydrophobicContact CD2-CE2 4.17Å
955	N	77.5	Confident	78.6	Confident	11 Å²	11	64.5 Å²	64.5	6%	0.059	34%	0.339	C	S	.	.			trans	-76.5	89.6	162.5	-174.2	-37.2	0	0	0	108	Q910 T918 S957 K958 L959	Q910-N955 PolarHBondContact NE2-ND2 3.38Å; Q910-N955 PolarHBondContact OE1-ND2 3.11Å; T918-N955 HydrophobicContact CG2-CB 3.83Å; T918-N955 PolarHBondContact OG1-N 2.94Å; N955-S957 VanDerWaalsContact C-N 3.28Å; N955-S957 PolarHBondContact O-N 2.93Å; N955-S957 PolarHBondContact OD1-N 2.88Å; N955-S957 PolarHBondContact OD1-OG 3.02Å; N955-K958 HydrophobicContact CB-CB 4.37Å; N955-K958 PolarHBondContact O-N 2.87Å; N955-K958 PolarHBondContact OD1-N 2.93Å; N955-K958 VanDerWaalsContact OD1-N 3.14Å; N955-L959 PolarHBondContact O-N 2.81Å; N955-L959 VanDerWaalsContact O-N 3.13Å
956	Y	80.8	Confident	78.3	Confident	17 Å²	17	64.5 Å²	64.5	7%	0.067	34%	0.343	C	S	.	.	H	α-helix	trans	-61	-35.5	-173.3	-56.3	-68.6	0	0	0	112.7	F954 L959 L960 F975 A979 S982 T983	F954-Y956 VanDerWaalsContact C-N 3.31Å; F954-Y956 HydrophobicContact CB-CD1 4.22Å; F954-Y956 HydrophobicContact CB-CE1 4.12Å; F954-Y956 HydrophobicContact CD2-CE1 4.29Å; F954-Y956 WeakPolarHBondContact O-CD2 3.42Å; F954-Y956 WeakPolarHBondContact O-CE2 3.36Å; F954-Y956 PolarHBondContact O-N 2.86Å; Y956-L959 PolarHBondContact O-N 2.83Å; Y956-L960 VanDerWaalsContact O-CB 3.29Å; Y956-L960 WeakPolarHBondContact O-CB 3.43Å; Y956-L960 WeakPolarHBondContact O-CD1 3.32Å; Y956-L960 WeakPolarHBondContact O-CG 3.46Å; Y956-L960 PolarHBondContact O-N 2.81Å; Y956-F975 AromaticContact CD1-CE2 3.81Å; Y956-F975 HydrophobicContact CD1-CE2 3.81Å; Y956-F975 AromaticContact CD1-CZ 3.92Å; Y956-F975 HydrophobicContact CD1-CZ 3.92Å; Y956-F975 HydrophobicContact CE1-CE2 4.05Å; Y956-A979 HydrophobicContact CD1-CB 3.25Å; Y956-A979 HydrophobicContact CD2-CB 4.38Å; Y956-A979 HydrophobicContact CE1-CB 3.71Å; Y956-A979 HydrophobicContact CG-CB 3.64Å; Y956-S982 WeakPolarHBondContact CE2-OG 3.5Å; Y956-S982 VanDerWaalsContact OH-CB 3.26Å; Y956-S982 WeakPolarHBondContact OH-CB 3.5Å; Y956-S982 PolarHBondContact OH-OG 3.36Å; Y956-S982 VanDerWaalsContact OH-OG 3.08Å; Y956-T983 HydrophobicContact CD2-CG2 3.85Å; Y956-T983 HydrophobicContact CE2-CG2 4.48Å
957	S	79.2	Confident	78.2	Confident	72 Å²	72	64.5 Å²	64.5	50%	0.503	34%	0.342	S	S	.	.	H	α-helix	trans	-65.2	-47.8	179.5	59.1	0	0	0	0	111.2	N955 L959 L960 F961	N955-S957 VanDerWaalsContact C-N 3.28Å; N955-S957 PolarHBondContact O-N 2.93Å; N955-S957 PolarHBondContact OD1-N 2.88Å; N955-S957 PolarHBondContact OD1-OG 3.02Å; S957-L959 PolarHBondContact O-N 3.13Å; S957-L960 PolarHBondContact O-N 2.66Å; S957-F961 WeakPolarHBondContact O-CD2 3.28Å; S957-F961 PolarHBondContact O-N 2.69Å
958	K	80.1	Confident	78.3	Confident	102 Å²	102	68.5 Å²	68.5	44%	0.443	36%	0.363	S	S	.	.	H	α-helix	trans	-59.5	-44.9	175.9	-77.2	-171.8	176	-178.3	0	112.7	T918 N955	T918-K958 HydrophobicContact CG2-CB 4.26Å; N955-K958 HydrophobicContact CB-CB 4.37Å; N955-K958 PolarHBondContact O-N 2.87Å; N955-K958 PolarHBondContact OD1-N 2.93Å; N955-K958 VanDerWaalsContact OD1-N 3.14Å
959	L	80.9	Confident	78.1	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-67.6	-40.7	179.8	-74.1	178	0	0	0	113.2	T918 V921 E922 L947 F954 N955 Y956 S957 F961 R962 L963 F975	T918-L959 HydrophobicContact CG2-CD1 4.35Å; T918-L959 HydrophobicContact CG2-CD2 4.03Å; T918-L959 HydrophobicContact CG2-CG 3.79Å; V921-L959 HydrophobicContact CB-CD2 3.92Å; V921-L959 HydrophobicContact CG1-CD2 3.59Å; E922-L959 HydrophobicContact CG-CD2 4.18Å; L947-L959 HydrophobicContact CD2-CD1 3.94Å; F954-L959 HydrophobicContact CB-CD1 3.52Å; F954-L959 HydrophobicContact CD1-CD1 3.74Å; F954-L959 HydrophobicContact CG-CD1 3.73Å; N955-L959 PolarHBondContact O-N 2.81Å; N955-L959 VanDerWaalsContact O-N 3.13Å; Y956-L959 PolarHBondContact O-N 2.83Å; S957-L959 PolarHBondContact O-N 3.13Å; L959-F961 VanDerWaalsContact C-N 3.26Å; L959-F961 PolarHBondContact O-N 2.77Å; L959-R962 PolarHBondContact O-N 3.36Å; L959-L963 WeakPolarHBondContact O-CG 3.46Å; L959-L963 PolarHBondContact O-N 2.68Å; L959-L963 VanDerWaalsContact O-N 3.08Å; L959-F975 HydrophobicContact CB-CZ 4.13Å; L959-F975 HydrophobicContact CD1-CE2 4.15Å; L959-F975 HydrophobicContact CD1-CZ 4.07Å
960	L	79.7	Confident	78.3	Confident	83 Å²	83	75.7 Å²	75.7	44%	0.435	40%	0.4	S	S	.	.	H	α-helix	trans	-59.5	-36.8	-179.5	-77.8	167.5	0	0	0	112.2	Y956 S957 R962 L963 F975 L976	Y956-L960 VanDerWaalsContact O-CB 3.29Å; Y956-L960 WeakPolarHBondContact O-CB 3.43Å; Y956-L960 WeakPolarHBondContact O-CD1 3.32Å; Y956-L960 WeakPolarHBondContact O-CG 3.46Å; Y956-L960 PolarHBondContact O-N 2.81Å; S957-L960 PolarHBondContact O-N 2.66Å; L960-R962 PolarHBondContact O-N 2.91Å; L960-L963 HydrophobicContact CD2-CD1 4.27Å; L960-F975 HydrophobicContact CD2-CE1 4.28Å; L960-L976 HydrophobicContact CD2-CD2 3.56Å
961	F	80.6	Confident	78.8	Confident	190 Å²	190	74.5 Å²	74.5	83%	0.833	39%	0.386	S	S	*	.	H	α-helix	trans	-71.1	-17.6	175.5	-71.4	-63.7	0	0	0	113.9	S957 L959	S957-F961 WeakPolarHBondContact O-CD2 3.28Å; S957-F961 PolarHBondContact O-N 2.69Å; L959-F961 VanDerWaalsContact C-N 3.26Å; L959-F961 PolarHBondContact O-N 2.77Å
962	R	80.1	Confident	79.3	Confident	89 Å²	89	68.8 Å²	68.8	34%	0.336	36%	0.355	S	S	.	.	H	α-helix	trans	-102.7	-15.9	-174	-99.4	-72	-156.8	170.3	8.7	114.4	L925 D926 L959 L960	L925-R962 HydrophobicContact CD1-CB 4.27Å; D926-R962 IonicContact OD1-CZ 3.03Å; D926-R962 IonicContact OD1-NH1 2.61Å; D926-R962 PolarHBondContact OD1-NH1 2.92Å; D926-R962 IonicContact OD1-NH2 2.72Å; D926-R962 PolarHBondContact OD1-NH2 3.48Å; D926-R962 IonicContact OD2-CZ 3.63Å; D926-R962 IonicContact OD2-NH1 3.94Å; D926-R962 IonicContact OD2-NH2 2.77Å; D926-R962 PolarHBondContact OD2-NH2 2.79Å; L959-R962 PolarHBondContact O-N 3.36Å; L960-R962 PolarHBondContact O-N 2.91Å
963	L	79.5	Confident	79.8	Confident	32 Å²	32	74.5 Å²	74.5	17%	0.168	38%	0.38	C	S	.	.	S	Bend	trans	-63.1	132	-178.6	-77.3	167.4	0	0	0	111.1	L947 L959 L960 W967 I972 F975	L947-L963 HydrophobicContact CD1-CD2 4.01Å; L959-L963 WeakPolarHBondContact O-CG 3.46Å; L959-L963 PolarHBondContact O-N 2.68Å; L959-L963 VanDerWaalsContact O-N 3.08Å; L960-L963 HydrophobicContact CD2-CD1 4.27Å; L963-W967 HydrophobicContact CD2-CE3 3.86Å; L963-W967 HydrophobicContact CD2-CH2 4.44Å; L963-W967 HydrophobicContact CD2-CZ3 3.5Å; L963-W967 VanDerWaalsContact CD2-CZ3 3.5Å; L963-I972 HydrophobicContact CD1-CG2 4.16Å; L963-F975 HydrophobicContact CD1-CD1 4.29Å; L963-F975 HydrophobicContact CD1-CE1 3.9Å
964	P	75.8	Confident	80.3	Confident	23 Å²	23	72.1 Å²	72.1	15%	0.149	38%	0.376	C	S	.	.			trans	-63.1	138.5	176.4	-21.7	32.9	0	0	0	111.9	L925 T966 W967	L925-P964 HydrophobicContact CD2-CG 4.28Å; P964-T966 PolarHBondContact O-N 3.36Å; P964-W967 HydrophobicContact CB-CG 4.42Å; P964-W967 HydrophobicContact CG-CD2 4.26Å; P964-W967 HydrophobicContact CG-CZ2 4.13Å; P964-W967 PolarHBondContact O-N 2.98Å
965	S	72.6	Confident	80.7	Confident	126 Å²	126	71.8 Å²	71.8	88%	0.881	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-7.4	174.1	61.8	0	0	0	0	113.8
966	T	76	Confident	81.1	Confident	120 Å²	120	74.5 Å²	74.5	74%	0.736	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-16.4	-178.3	53.7	0	0	0	0	113.5	P964	P964-T966 PolarHBondContact O-N 3.36Å
967	W	80.8	Confident	81.3	Confident	22 Å²	22	79.5 Å²	79.5	8%	0.083	41%	0.412	C	S	.	.	S	Bend	trans	-77.5	139.8	-178.8	-70.7	5.8	0	0	0	110.8	L925 L928 K940 I943 L944 L947 L963 P964 I969 I972	L925-W967 HydrophobicContact CD2-CH2 3.36Å; L925-W967 HydrophobicContact CD2-CZ2 3.69Å; L925-W967 HydrophobicContact CD2-CZ3 4.22Å; L928-W967 HydrophobicContact CD1-CZ2 4.13Å; K940-W967 HydrophobicContact CG-CZ2 4.29Å; I943-W967 HydrophobicContact CB-CH2 4.35Å; I943-W967 HydrophobicContact CG2-CH2 3.76Å; I943-W967 HydrophobicContact CG2-CZ3 4.36Å; L944-W967 HydrophobicContact CD2-CE3 4.25Å; L944-W967 HydrophobicContact CD2-CZ3 4.24Å; L947-W967 HydrophobicContact CD1-CZ3 3.95Å; L963-W967 HydrophobicContact CD2-CE3 3.86Å; L963-W967 HydrophobicContact CD2-CH2 4.44Å; L963-W967 HydrophobicContact CD2-CZ3 3.5Å; L963-W967 VanDerWaalsContact CD2-CZ3 3.5Å; P964-W967 HydrophobicContact CB-CG 4.42Å; P964-W967 HydrophobicContact CG-CD2 4.26Å; P964-W967 HydrophobicContact CG-CZ2 4.13Å; P964-W967 PolarHBondContact O-N 2.98Å; W967-I969 PolarHBondContact O-N 3.37Å; W967-I972 HydrophobicContact CB-CD1 3.72Å; W967-I972 HydrophobicContact CB-CG1 4.28Å; W967-I972 HydrophobicContact CD2-CD1 4.45Å; W967-I972 HydrophobicContact CE3-CD1 3.73Å; W967-I972 HydrophobicContact CE3-CG1 4Å
968	D	82	Confident	81.6	Confident	83 Å²	83	77.4 Å²	77.4	44%	0.444	40%	0.395	S	S	.	.			trans	-67.9	130.6	176.5	-174.5	-7.4	0	0	0	109.1	L970 E971 I972	D968-L970 PolarHBondContact O-N 3.5Å; D968-L970 VanDerWaalsContact O-N 3.1Å; D968-L970 PolarHBondContact OD1-N 3.12Å; D968-E971 HydrophobicContact CB-CG 4.16Å; D968-E971 WeakPolarHBondContact O-CB 3.31Å; D968-E971 PolarHBondContact O-N 2.96Å; D968-I972 PolarHBondContact O-N 2.83Å
969	I	79.9	Confident	81.7	Confident	128 Å²	128	72.9 Å²	72.9	66%	0.656	38%	0.377	S	S	*	.	H	α-helix	trans	-53.9	-31.7	175.5	-64	170.9	0	0	0	110.5	W967 E971 I972 K973	W967-I969 PolarHBondContact O-N 3.37Å; I969-E971 VanDerWaalsContact C-N 3.3Å; I969-E971 PolarHBondContact O-N 3.09Å; I969-I972 PolarHBondContact O-N 2.94Å; I969-K973 WeakPolarHBondContact O-CB 3.06Å; I969-K973 PolarHBondContact O-N 3.01Å
970	L	84.9	Confident	81.9	Confident	127 Å²	127	78 Å²	78	67%	0.665	40%	0.403	S	S	*	.	H	α-helix	trans	-62.3	-33.9	175.9	-67	174.1	0	0	0	113.1	D968	D968-L970 PolarHBondContact O-N 3.5Å; D968-L970 VanDerWaalsContact O-N 3.1Å; D968-L970 PolarHBondContact OD1-N 3.12Å
971	E	84.5	Confident	82.2	Confident	69 Å²	69	82.1 Å²	82.1	32%	0.322	41%	0.413	S	S	.	.	H	α-helix	trans	-72.9	-33.4	178.5	-64.4	176.7	159.6	0	0	112	K940 L944 N948 D968 I969	K940-E971 WeakPolarHBondContact CE-OE2 3.42Å; K940-E971 VanDerWaalsContact NZ-CD 3.31Å; K940-E971 IonicContact NZ-OE1 3.08Å; K940-E971 PolarHBondContact NZ-OE1 3.39Å; K940-E971 VanDerWaalsContact NZ-OE1 3.08Å; K940-E971 IonicContact NZ-OE2 2.71Å; K940-E971 PolarHBondContact NZ-OE2 3.25Å; L944-E971 HydrophobicContact CD1-CB 4.14Å; L944-E971 HydrophobicContact CD2-CB 4.1Å; N948-E971 PolarHBondContact ND2-O 2.98Å; D968-E971 HydrophobicContact CB-CG 4.16Å; D968-E971 WeakPolarHBondContact O-CB 3.31Å; D968-E971 PolarHBondContact O-N 2.96Å; I969-E971 VanDerWaalsContact C-N 3.3Å; I969-E971 PolarHBondContact O-N 3.09Å
972	I	82.5	Confident	82.3	Confident	14 Å²	14	74 Å²	74	7%	0.072	38%	0.38	C	S	.	.	H	α-helix	trans	-94.9	-12.2	-176.6	-44.2	174.5	0	0	0	112.2	L944 L963 W967 D968 I969 P974 F975 L976	L944-I972 HydrophobicContact CD2-CG1 4.46Å; L963-I972 HydrophobicContact CD1-CG2 4.16Å; W967-I972 HydrophobicContact CB-CD1 3.72Å; W967-I972 HydrophobicContact CB-CG1 4.28Å; W967-I972 HydrophobicContact CD2-CD1 4.45Å; W967-I972 HydrophobicContact CE3-CD1 3.73Å; W967-I972 HydrophobicContact CE3-CG1 4Å; D968-I972 PolarHBondContact O-N 2.83Å; I969-I972 PolarHBondContact O-N 2.94Å; I972-P974 VanDerWaalsContact C-N 3.3Å; I972-P974 VanDerWaalsContact O-N 3.12Å; I972-F975 HydrophobicContact CG2-CB 4.09Å; I972-F975 HydrophobicContact CG2-CD1 3.74Å; I972-F975 HydrophobicContact CG2-CG 4.35Å; I972-F975 WeakPolarHBondContact O-CB 2.88Å; I972-F975 PolarHBondContact O-N 2.8Å; I972-L976 HydrophobicContact CG2-CG 4.11Å; I972-L976 PolarHBondContact O-N 2.89Å
973	K	85.4	Confident	82.4	Confident	136 Å²	136	72.7 Å²	72.7	59%	0.591	38%	0.382	S	S	*	.	H	α-helix	trans	-46.8	-43	-178.6	-177.9	-178.6	177.4	-177	0	114.1	I969 L976 H977	I969-K973 WeakPolarHBondContact O-CB 3.06Å; I969-K973 PolarHBondContact O-N 3.01Å; K973-L976 PolarHBondContact O-N 2.89Å; K973-H977 WeakPolarHBondContact O-CB 3.36Å; K973-H977 PolarHBondContact O-N 2.78Å
974	P	86.4	Confident	82.7	Confident	64 Å²	64	75.7 Å²	75.7	42%	0.416	40%	0.398	S	S	.	.	H	α-helix	trans	-64.8	-42.6	178.3	-16.2	29.6	0	0	0	112.6	N948 I972 H977 N978	N948-P974 HydrophobicContact CB-CB 4.06Å; N948-P974 HydrophobicContact CB-CG 4.42Å; N948-P974 WeakPolarHBondContact OD1-CB 3.4Å; N948-P974 WeakPolarHBondContact OD1-CD 3.39Å; I972-P974 VanDerWaalsContact C-N 3.3Å; I972-P974 VanDerWaalsContact O-N 3.12Å; P974-H977 PolarHBondContact O-N 2.73Å; P974-N978 WeakPolarHBondContact O-CB 3.34Å; P974-N978 PolarHBondContact O-N 2.74Å
975	F	85.7	Confident	83.1	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-59.9	-47.8	172.9	169.8	-101.7	0	0	0	112.2	L947 N948 F954 Y956 L959 L960 L963 I972 H977 N978 A979	L947-F975 HydrophobicContact CB-CB 4.08Å; L947-F975 HydrophobicContact CB-CD2 3.95Å; L947-F975 HydrophobicContact CB-CG 4.12Å; L947-F975 HydrophobicContact CD2-CD2 3.72Å; L947-F975 HydrophobicContact CD2-CE2 3.63Å; L947-F975 HydrophobicContact CD2-CG 4.28Å; L947-F975 HydrophobicContact CD2-CZ 4.14Å; L947-F975 HydrophobicContact CG-CD2 4.41Å; L947-F975 WeakPolarHBondContact O-CD2 3.46Å; N948-F975 PolarHBondContact OD1-N 2.97Å; F954-F975 HydrophobicContact CD2-CE2 4.17Å; Y956-F975 AromaticContact CD1-CE2 3.81Å; Y956-F975 HydrophobicContact CD1-CE2 3.81Å; Y956-F975 AromaticContact CD1-CZ 3.92Å; Y956-F975 HydrophobicContact CD1-CZ 3.92Å; Y956-F975 HydrophobicContact CE1-CE2 4.05Å; L959-F975 HydrophobicContact CB-CZ 4.13Å; L959-F975 HydrophobicContact CD1-CE2 4.15Å; L959-F975 HydrophobicContact CD1-CZ 4.07Å; L960-F975 HydrophobicContact CD2-CE1 4.28Å; L963-F975 HydrophobicContact CD1-CD1 4.29Å; L963-F975 HydrophobicContact CD1-CE1 3.9Å; I972-F975 HydrophobicContact CG2-CB 4.09Å; I972-F975 HydrophobicContact CG2-CD1 3.74Å; I972-F975 HydrophobicContact CG2-CG 4.35Å; I972-F975 WeakPolarHBondContact O-CB 2.88Å; I972-F975 PolarHBondContact O-N 2.8Å; F975-H977 VanDerWaalsContact C-N 3.31Å; F975-H977 PolarHBondContact O-N 3.15Å; F975-N978 CarbonylContact O-C 3.57Å; F975-N978 PolarHBondContact O-N 3.16Å; F975-N978 VanDerWaalsContact O-N 3.16Å; F975-A979 VanDerWaalsContact O-CB 3.32Å; F975-A979 WeakPolarHBondContact O-CB 3.38Å; F975-A979 PolarHBondContact O-N 3.39Å
976	L	85.5	Confident	83.5	Confident	67 Å²	67	78.8 Å²	78.8	35%	0.351	40%	0.396	S	S	.	.	H	α-helix	trans	-60.9	-42.1	178.5	-67.3	176.7	0	0	0	111.6	L960 I972 K973 A979 L980	L960-L976 HydrophobicContact CD2-CD2 3.56Å; I972-L976 HydrophobicContact CG2-CG 4.11Å; I972-L976 PolarHBondContact O-N 2.89Å; K973-L976 PolarHBondContact O-N 2.89Å; L976-A979 PolarHBondContact O-N 2.81Å; L976-L980 VanDerWaalsContact O-CB 3.31Å; L976-L980 WeakPolarHBondContact O-CB 3.21Å; L976-L980 PolarHBondContact O-N 3.4Å
977	H	85.8	Confident	83.7	Confident	123 Å²	123	81 Å²	81	57%	0.569	39%	0.391	S	S	*	.	H	α-helix	trans	-64.6	-41.9	175.7	-176.7	-87.6	0	0	0	111.5	K973 P974 F975 R981	K973-H977 WeakPolarHBondContact O-CB 3.36Å; K973-H977 PolarHBondContact O-N 2.78Å; P974-H977 PolarHBondContact O-N 2.73Å; F975-H977 VanDerWaalsContact C-N 3.31Å; F975-H977 PolarHBondContact O-N 3.15Å; H977-R981 WeakPolarHBondContact O-CB 3.34Å; H977-R981 PolarHBondContact O-N 2.86Å
978	N	84.6	Confident	84	Confident	28 Å²	28	82.1 Å²	82.1	15%	0.15	40%	0.402	C	S	.	.	H	α-helix	trans	-65.6	-43.4	176	-167.1	24.4	0	0	0	111.6	P974 F975 R981 S982	P974-N978 WeakPolarHBondContact O-CB 3.34Å; P974-N978 PolarHBondContact O-N 2.74Å; F975-N978 CarbonylContact O-C 3.57Å; F975-N978 PolarHBondContact O-N 3.16Å; F975-N978 VanDerWaalsContact O-N 3.16Å; N978-R981 PolarHBondContact O-N 3.36Å; N978-S982 WeakPolarHBondContact O-CA 3.48Å; N978-S982 WeakPolarHBondContact O-CB 3.47Å; N978-S982 PolarHBondContact O-N 3.22Å
979	A	83.1	Confident	83.9	Confident	6 Å²	6	83 Å²	83	5%	0.05	40%	0.404	C	S	.	.	H	α-helix	trans	-59.5	-49.3	176.8	0	0	0	0	0	111.4	Y956 F975 L976 S982 T983	Y956-A979 HydrophobicContact CD1-CB 3.25Å; Y956-A979 HydrophobicContact CD2-CB 4.38Å; Y956-A979 HydrophobicContact CE1-CB 3.71Å; Y956-A979 HydrophobicContact CG-CB 3.64Å; F975-A979 VanDerWaalsContact O-CB 3.32Å; F975-A979 WeakPolarHBondContact O-CB 3.38Å; F975-A979 PolarHBondContact O-N 3.39Å; L976-A979 PolarHBondContact O-N 2.81Å; A979-S982 PolarHBondContact O-N 2.88Å; A979-T983 WeakPolarHBondContact O-CB 3.47Å; A979-T983 WeakPolarHBondContact O-CG2 3.44Å; A979-T983 PolarHBondContact O-N 3.01Å; A979-T983 PolarHBondContact O-OG1 2.79Å
980	L	85.3	Confident	84	Confident	107 Å²	107	81.4 Å²	81.4	56%	0.56	40%	0.396	S	S	*	.	H	α-helix	trans	-65.7	-44	179.4	-157.3	159.7	0	0	0	110.6	L976 T983 L984	L976-L980 VanDerWaalsContact O-CB 3.31Å; L976-L980 WeakPolarHBondContact O-CB 3.21Å; L976-L980 PolarHBondContact O-N 3.4Å; L980-T983 WeakPolarHBondContact CA-OG1 3.46Å; L980-T983 PolarHBondContact O-OG1 3.08Å; L980-L984 HydrophobicContact CD2-CD1 3.37Å; L980-L984 HydrophobicContact CD2-CG 3.91Å; L980-L984 VanDerWaalsContact O-CB 3.28Å; L980-L984 WeakPolarHBondContact O-CB 3.45Å; L980-L984 VanDerWaalsContact O-CG 3.31Å; L980-L984 WeakPolarHBondContact O-CG 3.37Å; L980-L984 PolarHBondContact O-N 2.78Å
981	R	86.3	Confident	84.1	Confident	170 Å²	170	80.1 Å²	80.1	64%	0.642	39%	0.386	S	S	*	.	H	α-helix	trans	-62.9	-43.5	176	-175	-179.5	179	100.2	-0.3	112.1	H977 N978 H985	H977-R981 WeakPolarHBondContact O-CB 3.34Å; H977-R981 PolarHBondContact O-N 2.86Å; N978-R981 PolarHBondContact O-N 3.36Å; R981-H985 WeakPolarHBondContact O-CB 3.43Å; R981-H985 PolarHBondContact O-N 3.45Å
982	S	81.9	Confident	84.1	Confident	19 Å²	19	82.3 Å²	82.3	13%	0.133	40%	0.4	C	S	.	.	H	α-helix	trans	-67.6	-45.4	-178.3	-172.6	0	0	0	0	111.1	Y956 N978 A979 H985 E986	Y956-S982 WeakPolarHBondContact CE2-OG 3.5Å; Y956-S982 VanDerWaalsContact OH-CB 3.26Å; Y956-S982 WeakPolarHBondContact OH-CB 3.5Å; Y956-S982 PolarHBondContact OH-OG 3.36Å; Y956-S982 VanDerWaalsContact OH-OG 3.08Å; N978-S982 WeakPolarHBondContact O-CA 3.48Å; N978-S982 WeakPolarHBondContact O-CB 3.47Å; N978-S982 PolarHBondContact O-N 3.22Å; A979-S982 PolarHBondContact O-N 2.88Å; S982-H985 PolarHBondContact O-N 3.19Å; S982-E986 WeakPolarHBondContact O-CB 3.17Å; S982-E986 PolarHBondContact O-N 2.91Å
983	T	81.4	Confident	84	Confident	62 Å²	62	87 Å²	87	38%	0.38	42%	0.422	S	S	.	.	H	α-helix	trans	-66.3	-41.2	175.1	49.9	0	0	0	0	112.9	Y956 A979 L980 H985 W987	Y956-T983 HydrophobicContact CD2-CG2 3.85Å; Y956-T983 HydrophobicContact CE2-CG2 4.48Å; A979-T983 WeakPolarHBondContact O-CB 3.47Å; A979-T983 WeakPolarHBondContact O-CG2 3.44Å; A979-T983 PolarHBondContact O-N 3.01Å; A979-T983 PolarHBondContact O-OG1 2.79Å; L980-T983 WeakPolarHBondContact CA-OG1 3.46Å; L980-T983 PolarHBondContact O-OG1 3.08Å; T983-H985 VanDerWaalsContact C-N 3.31Å; T983-W987 WeakPolarHBondContact O-CB 3.47Å; T983-W987 PolarHBondContact O-N 2.53Å
984	L	85.7	Confident	83.9	Confident	96 Å²	96	86.8 Å²	86.8	50%	0.503	42%	0.418	S	S	.	.	H	α-helix	trans	-64.6	-38.1	171.6	-77.3	-179.6	0	0	0	111.8	L980 S988	L980-L984 HydrophobicContact CD2-CD1 3.37Å; L980-L984 HydrophobicContact CD2-CG 3.91Å; L980-L984 VanDerWaalsContact O-CB 3.28Å; L980-L984 WeakPolarHBondContact O-CB 3.45Å; L980-L984 VanDerWaalsContact O-CG 3.31Å; L980-L984 WeakPolarHBondContact O-CG 3.37Å; L980-L984 PolarHBondContact O-N 2.78Å; L984-S988 VanDerWaalsContact O-CB 3.3Å; L984-S988 WeakPolarHBondContact O-CB 3.31Å; L984-S988 PolarHBondContact O-N 3.11Å; L984-S988 PolarHBondContact O-OG 3.33Å
985	H	85.5	Confident	83.7	Confident	110 Å²	110	85.4 Å²	85.4	51%	0.509	42%	0.415	S	S	.	.	H	α-helix	trans	-66.5	-49.4	178.3	-175.8	52.8	0	0	0	110.9	R981 S982 T983 W987 S988 E989	R981-H985 WeakPolarHBondContact O-CB 3.43Å; R981-H985 PolarHBondContact O-N 3.45Å; S982-H985 PolarHBondContact O-N 3.19Å; T983-H985 VanDerWaalsContact C-N 3.31Å; H985-W987 VanDerWaalsContact C-N 3.32Å; H985-W987 PolarHBondContact O-N 2.95Å; H985-S988 WeakPolarHBondContact CA-OG 3.41Å; H985-S988 CarbonylContact O-C 3.59Å; H985-S988 PolarHBondContact O-N 3.01Å; H985-S988 VanDerWaalsContact O-N 3.11Å; H985-S988 PolarHBondContact O-OG 3.21Å; H985-E989 WeakPolarHBondContact O-CB 3.44Å; H985-E989 PolarHBondContact O-N 2.78Å
986	E	79.4	Confident	83.6	Confident	103 Å²	103	90.1 Å²	90.1	48%	0.481	44%	0.44	S	S	.	.	H	α-helix	trans	-58.6	-43.8	174.4	-175.1	176.3	-171.7	0	0	110.9	S982 S988 E989 L990	S982-E986 WeakPolarHBondContact O-CB 3.17Å; S982-E986 PolarHBondContact O-N 2.91Å; E986-S988 PolarHBondContact O-N 2.96Å; E986-E989 PolarHBondContact O-N 3.31Å; E986-L990 HydrophobicContact CG-CD1 4.1Å; E986-L990 HydrophobicContact CG-CG 4.48Å; E986-L990 VanDerWaalsContact O-CB 3.3Å; E986-L990 WeakPolarHBondContact O-CB 3.28Å; E986-L990 VanDerWaalsContact O-CG 3.25Å; E986-L990 WeakPolarHBondContact O-CG 3.38Å; E986-L990 PolarHBondContact O-N 2.8Å
987	W	81.4	Confident	83.2	Confident	168 Å²	168	90.5 Å²	90.5	64%	0.636	45%	0.445	S	S	*	.	H	α-helix	trans	-61.9	-42.1	174.3	-178.1	78	0	0	0	112.4	T983 H985 Q991	T983-W987 WeakPolarHBondContact O-CB 3.47Å; T983-W987 PolarHBondContact O-N 2.53Å; H985-W987 VanDerWaalsContact C-N 3.32Å; H985-W987 PolarHBondContact O-N 2.95Å; W987-Q991 VanDerWaalsContact O-CB 3.26Å; W987-Q991 WeakPolarHBondContact O-CB 3.38Å; W987-Q991 PolarHBondContact O-N 3.09Å
988	S	86.4	Confident	82.9	Confident	45 Å²	45	89.9 Å²	89.9	32%	0.315	44%	0.441	S	S	.	.	H	α-helix	trans	-68.9	-36.1	177	71.4	0	0	0	0	112.7	L984 H985 E986 Q991 L992	L984-S988 VanDerWaalsContact O-CB 3.3Å; L984-S988 WeakPolarHBondContact O-CB 3.31Å; L984-S988 PolarHBondContact O-N 3.11Å; L984-S988 PolarHBondContact O-OG 3.33Å; H985-S988 WeakPolarHBondContact CA-OG 3.41Å; H985-S988 CarbonylContact O-C 3.59Å; H985-S988 PolarHBondContact O-N 3.01Å; H985-S988 VanDerWaalsContact O-N 3.11Å; H985-S988 PolarHBondContact O-OG 3.21Å; E986-S988 PolarHBondContact O-N 2.96Å; S988-Q991 PolarHBondContact O-N 2.97Å; S988-L992 WeakPolarHBondContact O-CB 3.39Å; S988-L992 WeakPolarHBondContact O-CG 3.35Å; S988-L992 PolarHBondContact O-N 2.88Å
989	E	81.2	Confident	82.5	Confident	102 Å²	102	95.3 Å²	95.3	48%	0.477	46%	0.46	S	S	.	.	H	α-helix	trans	-68.1	-49	176.8	-175.5	177.3	-170.3	0	0	109.8	H985 E986 Q991 L992 E993	H985-E989 WeakPolarHBondContact O-CB 3.44Å; H985-E989 PolarHBondContact O-N 2.78Å; E986-E989 PolarHBondContact O-N 3.31Å; E989-Q991 VanDerWaalsContact C-N 3.25Å; E989-Q991 PolarHBondContact O-N 3.33Å; E989-L992 CarbonylContact O-C 3.59Å; E989-L992 WeakPolarHBondContact O-CB 3.07Å; E989-L992 PolarHBondContact O-N 2.83Å; E989-L992 VanDerWaalsContact O-N 3.17Å; E989-E993 WeakPolarHBondContact O-CB 3.24Å; E989-E993 PolarHBondContact O-N 3.43Å
990	L	81.3	Confident	82	Confident	94 Å²	94	99.2 Å²	99.2	49%	0.492	48%	0.48	S	S	.	.	H	α-helix	trans	-59.7	-36.8	173.3	-73.5	172.1	0	0	0	111.7	E986 E993 Y994	E986-L990 HydrophobicContact CG-CD1 4.1Å; E986-L990 HydrophobicContact CG-CG 4.48Å; E986-L990 VanDerWaalsContact O-CB 3.3Å; E986-L990 WeakPolarHBondContact O-CB 3.28Å; E986-L990 VanDerWaalsContact O-CG 3.25Å; E986-L990 WeakPolarHBondContact O-CG 3.38Å; E986-L990 PolarHBondContact O-N 2.8Å; L990-E993 PolarHBondContact O-N 2.8Å; L990-Y994 WeakPolarHBondContact O-CB 3.36Å; L990-Y994 PolarHBondContact O-N 2.79Å
991	Q	86.4	Confident	81.3	Confident	99 Å²	99	96.7 Å²	96.7	46%	0.463	47%	0.474	S	S	.	.	H	α-helix	trans	-75.4	-31.9	178.3	-165.7	64.7	-52.7	0	0	112.7	W987 S988 E989 Y994 G995	W987-Q991 VanDerWaalsContact O-CB 3.26Å; W987-Q991 WeakPolarHBondContact O-CB 3.38Å; W987-Q991 PolarHBondContact O-N 3.09Å; S988-Q991 PolarHBondContact O-N 2.97Å; E989-Q991 VanDerWaalsContact C-N 3.25Å; E989-Q991 PolarHBondContact O-N 3.33Å; Q991-Y994 VanDerWaalsContact OE1-CD1 3.25Å; Q991-G995 PolarHBondContact O-N 3.21Å
992	L	83.8	Confident	80.7	Confident	116 Å²	116	95 Å²	95	61%	0.607	47%	0.472	S	S	*	.	H	α-helix	trans	-67.5	-45.2	168.7	-86.9	163.5	0	0	0	111.1	S988 E989 G995 L996	S988-L992 WeakPolarHBondContact O-CB 3.39Å; S988-L992 WeakPolarHBondContact O-CG 3.35Å; S988-L992 PolarHBondContact O-N 2.88Å; E989-L992 CarbonylContact O-C 3.59Å; E989-L992 WeakPolarHBondContact O-CB 3.07Å; E989-L992 PolarHBondContact O-N 2.83Å; E989-L992 VanDerWaalsContact O-N 3.17Å; L992-G995 CarbonylContact O-C 3.45Å; L992-G995 PolarHBondContact O-N 2.81Å; L992-L996 VanDerWaalsContact O-CB 3.23Å; L992-L996 WeakPolarHBondContact O-CB 3.44Å; L992-L996 WeakPolarHBondContact O-CD1 3.41Å; L992-L996 WeakPolarHBondContact O-CG 3.2Å; L992-L996 PolarHBondContact O-N 2.81Å
993	E	81.1	Confident	80.1	Confident	113 Å²	113	97.5 Å²	97.5	53%	0.528	48%	0.483	S	S	.	.	H	α-helix	trans	-63.4	-43.9	176.5	-169.6	176	-168.2	0	0	110.3	E989 L990 G995 L996 T997	E989-E993 WeakPolarHBondContact O-CB 3.24Å; E989-E993 PolarHBondContact O-N 3.43Å; L990-E993 PolarHBondContact O-N 2.8Å; E993-G995 PolarHBondContact O-N 2.95Å; E993-L996 PolarHBondContact O-N 3.32Å; E993-T997 HydrophobicContact CG-CG2 4.32Å; E993-T997 VanDerWaalsContact O-CB 3.27Å; E993-T997 WeakPolarHBondContact O-CB 3.44Å; E993-T997 WeakPolarHBondContact O-CG2 3.29Å; E993-T997 PolarHBondContact O-N 2.83Å; E993-T997 PolarHBondContact O-OG1 2.78Å
994	Y	83.5	Confident	79.2	Confident	131 Å²	131	97.5 Å²	97.5	51%	0.514	49%	0.486	S	S	.	.	H	α-helix	trans	-61	-43.9	171.9	179.1	-102	0	0	0	111.8	L990 Q991 T997 K998	L990-Y994 WeakPolarHBondContact O-CB 3.36Å; L990-Y994 PolarHBondContact O-N 2.79Å; Q991-Y994 VanDerWaalsContact OE1-CD1 3.25Å; Y994-T997 VanDerWaalsContact CA-OG1 3.3Å; Y994-T997 WeakPolarHBondContact CA-OG1 3.43Å; Y994-T997 PolarHBondContact O-OG1 3.05Å; Y994-K998 HydrophobicContact CE1-CD 4.18Å; Y994-K998 WeakPolarHBondContact O-CB 3.31Å; Y994-K998 PolarHBondContact O-N 2.97Å
995	G	83.1	Confident	78.2	Confident	35 Å²	35	97.7 Å²	97.7	36%	0.361	49%	0.491	S	S	.	.	H	α-helix	trans	-63.5	-45.3	176.1	0	0	0	0	0	113	Q991 L992 E993 Y999	Q991-G995 PolarHBondContact O-N 3.21Å; L992-G995 CarbonylContact O-C 3.45Å; L992-G995 PolarHBondContact O-N 2.81Å; E993-G995 PolarHBondContact O-N 2.95Å; G995-Y999 WeakPolarHBondContact O-CB 3.39Å; G995-Y999 PolarHBondContact O-N 3.42Å
996	L	83.4	Confident	77.2	Confident	98 Å²	98	98 Å²	98	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-66.5	-46.4	177.9	-84.1	157.7	0	0	0	111.3	L992 E993 Y999 N1000	L992-L996 VanDerWaalsContact O-CB 3.23Å; L992-L996 WeakPolarHBondContact O-CB 3.44Å; L992-L996 WeakPolarHBondContact O-CD1 3.41Å; L992-L996 WeakPolarHBondContact O-CG 3.2Å; L992-L996 PolarHBondContact O-N 2.81Å; E993-L996 PolarHBondContact O-N 3.32Å; L996-Y999 PolarHBondContact O-N 2.9Å; L996-N1000 WeakPolarHBondContact O-CB 3.31Å; L996-N1000 PolarHBondContact O-N 2.84Å; L996-N1000 PolarHBondContact O-ND2 2.85Å
997	T	75.3	Confident	76.3	Confident	75 Å²	75	99.4 Å²	99.4	46%	0.46	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-43	175.9	51.7	0	0	0	0	110.9	E993 Y994 Y999 N1000 A1001	E993-T997 HydrophobicContact CG-CG2 4.32Å; E993-T997 VanDerWaalsContact O-CB 3.27Å; E993-T997 WeakPolarHBondContact O-CB 3.44Å; E993-T997 WeakPolarHBondContact O-CG2 3.29Å; E993-T997 PolarHBondContact O-N 2.83Å; E993-T997 PolarHBondContact O-OG1 2.78Å; Y994-T997 VanDerWaalsContact CA-OG1 3.3Å; Y994-T997 WeakPolarHBondContact CA-OG1 3.43Å; Y994-T997 PolarHBondContact O-OG1 3.05Å; T997-Y999 VanDerWaalsContact C-N 3.33Å; T997-Y999 PolarHBondContact O-N 2.77Å; T997-N1000 PolarHBondContact O-N 2.83Å; T997-A1001 VanDerWaalsContact O-CB 3.23Å; T997-A1001 WeakPolarHBondContact O-CB 3.29Å; T997-A1001 PolarHBondContact O-N 2.8Å
998	K	79.5	Confident	75.2	Confident	110 Å²	110	96.1 Å²	96.1	48%	0.478	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-38.4	173.6	-175.3	175.2	-175.3	170.1	0	112.7	Y994 K1002	Y994-K998 HydrophobicContact CE1-CD 4.18Å; Y994-K998 WeakPolarHBondContact O-CB 3.31Å; Y994-K998 PolarHBondContact O-N 2.97Å; K998-K1002 PolarHBondContact O-N 3.42Å
999	Y	77.9	Confident	73.7	Confident	143 Å²	143	98.4 Å²	98.4	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-76.9	-40.4	177.7	-172.6	-102.6	0	0	0	112.6	G995 L996 T997 A1001 K1002 L1003	G995-Y999 WeakPolarHBondContact O-CB 3.39Å; G995-Y999 PolarHBondContact O-N 3.42Å; L996-Y999 PolarHBondContact O-N 2.9Å; T997-Y999 VanDerWaalsContact C-N 3.33Å; T997-Y999 PolarHBondContact O-N 2.77Å; Y999-A1001 VanDerWaalsContact C-N 3.27Å; Y999-A1001 PolarHBondContact O-N 2.6Å; Y999-K1002 CarbonylContact O-C 3.56Å; Y999-K1002 WeakPolarHBondContact O-CA 3.44Å; Y999-K1002 WeakPolarHBondContact O-CB 3.31Å; Y999-K1002 PolarHBondContact O-N 2.95Å; Y999-L1003 HydrophobicContact CD1-CD1 3.69Å; Y999-L1003 HydrophobicContact CD1-CG 4.19Å; Y999-L1003 HydrophobicContact CE1-CD1 3.35Å; Y999-L1003 HydrophobicContact CE1-CD2 4.45Å; Y999-L1003 HydrophobicContact CE1-CG 3.79Å; Y999-L1003 PolarHBondContact O-N 2.78Å
1000	N	72	Confident	72.4	Confident	88 Å²	88	103.9 Å²	103.9	47%	0.471	54%	0.541	S	S	.	.	H	α-helix	trans	-60.5	-39.2	172.5	-75.2	-19	0	0	0	110.7	L996 T997 K1002 L1003 S1004	L996-N1000 WeakPolarHBondContact O-CB 3.31Å; L996-N1000 PolarHBondContact O-N 2.84Å; L996-N1000 PolarHBondContact O-ND2 2.85Å; T997-N1000 PolarHBondContact O-N 2.83Å; N1000-K1002 VanDerWaalsContact C-N 3.31Å; N1000-K1002 PolarHBondContact O-N 3.07Å; N1000-L1003 PolarHBondContact O-N 3.19Å; N1000-S1004 WeakPolarHBondContact O-CB 3.5Å; N1000-S1004 PolarHBondContact O-N 2.77Å; N1000-S1004 PolarHBondContact O-OG 3.43Å
1001	A	69.7	Low	70.9	Confident	53 Å²	53	109 Å²	109	44%	0.438	56%	0.56	S	S	.	*	H	α-helix	trans	-64.4	-33.5	171.7	0	0	0	0	0	112.5	T997 Y999 S1004 V1005	T997-A1001 VanDerWaalsContact O-CB 3.23Å; T997-A1001 WeakPolarHBondContact O-CB 3.29Å; T997-A1001 PolarHBondContact O-N 2.8Å; Y999-A1001 VanDerWaalsContact C-N 3.27Å; Y999-A1001 PolarHBondContact O-N 2.6Å; A1001-S1004 WeakPolarHBondContact CA-OG 3.44Å; A1001-S1004 PolarHBondContact O-OG 2.92Å; A1001-V1005 VanDerWaalsContact O-CG2 3.28Å; A1001-V1005 WeakPolarHBondContact O-CG2 3.45Å; A1001-V1005 PolarHBondContact O-N 2.87Å
1002	K	74.7	Confident	69.4	Low	134 Å²	134	107.3 Å²	107.3	58%	0.583	56%	0.559	S	S	*	*	H	α-helix	trans	-72.2	-38.4	172.1	-78	-177.5	175.4	-172.4	0	112.8	K998 Y999 N1000 V1005 V1006	K998-K1002 PolarHBondContact O-N 3.42Å; Y999-K1002 CarbonylContact O-C 3.56Å; Y999-K1002 WeakPolarHBondContact O-CA 3.44Å; Y999-K1002 WeakPolarHBondContact O-CB 3.31Å; Y999-K1002 PolarHBondContact O-N 2.95Å; N1000-K1002 VanDerWaalsContact C-N 3.31Å; N1000-K1002 PolarHBondContact O-N 3.07Å; K1002-V1005 WeakPolarHBondContact O-CB 3.35Å; K1002-V1005 PolarHBondContact O-N 2.82Å; K1002-V1006 PolarHBondContact O-N 2.78Å
1003	L	68.1	Low	68.4	Low	72 Å²	72	106.8 Å²	106.8	38%	0.377	56%	0.557	S	S	.	*	H	α-helix	trans	-65.8	-43.4	175.9	-84.7	168.7	0	0	0	111.5	Y999 N1000 V1005 V1006 D1007	Y999-L1003 HydrophobicContact CD1-CD1 3.69Å; Y999-L1003 HydrophobicContact CD1-CG 4.19Å; Y999-L1003 HydrophobicContact CE1-CD1 3.35Å; Y999-L1003 HydrophobicContact CE1-CD2 4.45Å; Y999-L1003 HydrophobicContact CE1-CG 3.79Å; Y999-L1003 PolarHBondContact O-N 2.78Å; N1000-L1003 PolarHBondContact O-N 3.19Å; L1003-V1005 PolarHBondContact O-N 2.92Å; L1003-V1006 WeakPolarHBondContact O-CA 3.3Å; L1003-V1006 WeakPolarHBondContact O-CB 3.48Å; L1003-V1006 PolarHBondContact O-N 2.78Å; L1003-D1007 PolarHBondContact O-N 3.47Å
1004	S	64.4	Low	67.4	Low	63 Å²	63	106.9 Å²	106.9	44%	0.441	57%	0.568	S	S	.	*	H	α-helix	trans	-61.9	-27.8	176.7	63	0	0	0	0	112.6	N1000 A1001 V1006 L1008	N1000-S1004 WeakPolarHBondContact O-CB 3.5Å; N1000-S1004 PolarHBondContact O-N 2.77Å; N1000-S1004 PolarHBondContact O-OG 3.43Å; A1001-S1004 WeakPolarHBondContact CA-OG 3.44Å; A1001-S1004 PolarHBondContact O-OG 2.92Å; S1004-V1006 VanDerWaalsContact C-N 3.35Å; S1004-L1008 PolarHBondContact O-N 3.09Å
1005	V	64.9	Low	66.7	Low	99 Å²	99	102.4 Å²	102.4	60%	0.6	55%	0.553	S	S	*	*	H	α-helix	trans	-67.1	-31.2	169.8	171.9	0	0	0	0	112.7	A1001 K1002 L1003	A1001-V1005 VanDerWaalsContact O-CG2 3.28Å; A1001-V1005 WeakPolarHBondContact O-CG2 3.45Å; A1001-V1005 PolarHBondContact O-N 2.87Å; K1002-V1005 WeakPolarHBondContact O-CB 3.35Å; K1002-V1005 PolarHBondContact O-N 2.82Å; L1003-V1005 PolarHBondContact O-N 2.92Å
1006	V	63.8	Low	65.9	Low	117 Å²	117	106.8 Å²	106.8	71%	0.709	57%	0.567	S	S	*	*	H	α-helix	trans	-78.5	-35.9	176.6	-179.8	0	0	0	0	111.5	K1002 L1003 S1004 L1008	K1002-V1006 PolarHBondContact O-N 2.78Å; L1003-V1006 WeakPolarHBondContact O-CA 3.3Å; L1003-V1006 WeakPolarHBondContact O-CB 3.48Å; L1003-V1006 PolarHBondContact O-N 2.78Å; S1004-V1006 VanDerWaalsContact C-N 3.35Å; V1006-L1008 PolarHBondContact O-N 2.82Å
1007	D	61.1	Low	65.3	Low	132 Å²	132	104.4 Å²	104.4	71%	0.706	56%	0.555	S	S	*	*	S	Bend	trans	-77.1	-4.1	178	-74.3	-28.3	0	0	0	113.7	L1003 P1009	L1003-D1007 PolarHBondContact O-N 3.47Å; D1007-P1009 WeakPolarHBondContact O-CD 3.27Å
1008	L	56.7	Low	65.2	Low	99 Å²	99	106.4 Å²	106.4	52%	0.518	56%	0.559	S	S	.	*	S	Bend	trans	-61.9	117.9	176.7	-109.6	138.5	0	0	0	110	S1004 V1006 K1010	S1004-L1008 PolarHBondContact O-N 3.09Å; V1006-L1008 PolarHBondContact O-N 2.82Å; L1008-K1010 PolarHBondContact O-N 2.84Å
1009	P	54.8	Low	64.7	Low	93 Å²	93	107.8 Å²	107.8	60%	0.604	57%	0.572	S	S	*	*			trans	-62.4	136.3	-172.5	21.6	-31.6	0	0	0	110.8	D1007 K1011 S1012	D1007-P1009 WeakPolarHBondContact O-CD 3.27Å; P1009-K1011 PolarHBondContact O-N 2.77Å; P1009-S1012 PolarHBondContact O-N 3Å; P1009-S1012 PolarHBondContact O-OG 2.96Å
1010	K	55.5	Low	64.5	Low	218 Å²	218	107.4 Å²	107.4	95%	0.948	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.4	-7.6	-179.2	-73.1	-176.4	177.1	179.5	0	116	L1008 S1012	L1008-K1010 PolarHBondContact O-N 2.84Å; K1010-S1012 VanDerWaalsContact C-N 3.32Å
1011	K	50.1	Low	64.9	Low	201 Å²	201	104.5 Å²	104.5	87%	0.874	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	30.6	171.5	-73.9	-173	174.8	-178.3	0	112.4	P1009	P1009-K1011 PolarHBondContact O-N 2.77Å
1012	S	54.3	Low	65.5	Low	63 Å²	63	106.3 Å²	106.3	44%	0.441	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-71.3	132.9	175.8	4.2	0	0	0	0	108.6	P1009 K1010 C1014	P1009-S1012 PolarHBondContact O-N 3Å; P1009-S1012 PolarHBondContact O-OG 2.96Å; K1010-S1012 VanDerWaalsContact C-N 3.32Å; S1012-C1014 PolarHBondContact O-N 2.98Å
1013	N	62.1	Low	65.9	Low	106 Å²	106	100 Å²	100	57%	0.567	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-53.7	129.1	165.7	-65	-30.2	0	0	0	107	W1041 I1043	N1013-W1041 VanDerWaalsContact C-CH2 3.48Å; N1013-W1041 HydrophobicContact CB-CH2 3.3Å; N1013-W1041 HydrophobicContact CB-CZ2 4.14Å; N1013-W1041 HydrophobicContact CB-CZ3 3.92Å; N1013-W1041 VanDerWaalsContact O-CH2 3.28Å; N1013-W1041 WeakPolarHBondContact O-CH2 3.3Å; N1013-W1041 WeakPolarHBondContact O-CZ3 3.26Å; N1013-I1043 VanDerWaalsContact ND2-CG2 3.33Å; N1013-I1043 WeakPolarHBondContact ND2-CG2 3.25Å
1014	C	61.5	Low	66.4	Low	114 Å²	114	98.4 Å²	98.4	77%	0.77	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-93.8	121.8	177.2	-167.5	0	0	0	0	108.1	S1012	S1012-C1014 PolarHBondContact O-N 2.98Å
1015	L	67.9	Low	67.1	Low	38 Å²	38	97.8 Å²	97.8	20%	0.199	53%	0.526	C	S	.	.			trans	-91	115.2	167.2	179.2	73.2	0	0	0	107.3	I1017 F1039 W1041 V1048	L1015-I1017 HydrophobicContact CD2-CD1 3.82Å; L1015-I1017 HydrophobicContact CD2-CG1 3.66Å; L1015-I1017 HydrophobicContact CG-CD1 4.48Å; L1015-I1017 HydrophobicContact CG-CG1 3.85Å; L1015-I1017 PolarHBondContact O-N 3.36Å; L1015-F1039 HydrophobicContact CD2-CE2 3.98Å; L1015-W1041 HydrophobicContact CB-CD2 3.95Å; L1015-W1041 HydrophobicContact CB-CE3 4.01Å; L1015-W1041 HydrophobicContact CB-CH2 3.84Å; L1015-W1041 HydrophobicContact CB-CZ2 3.86Å; L1015-W1041 HydrophobicContact CB-CZ3 3.96Å; L1015-W1041 HydrophobicContact CD1-CD2 4.34Å; L1015-W1041 HydrophobicContact CD1-CG 4.38Å; L1015-W1041 HydrophobicContact CD1-CZ2 4.2Å; L1015-W1041 HydrophobicContact CD2-CB 4.2Å; L1015-W1041 HydrophobicContact CD2-CD2 4.2Å; L1015-W1041 HydrophobicContact CD2-CG 3.95Å; L1015-W1041 HydrophobicContact CG-CD2 4.39Å; L1015-V1048 HydrophobicContact CD1-CG2 3.92Å; L1015-V1048 HydrophobicContact CD2-CG1 4.04Å; L1015-V1048 HydrophobicContact CD2-CG2 3.77Å; L1015-V1048 HydrophobicContact CG-CG2 4.42Å
1016	L	66.8	Low	67.9	Low	126 Å²	126	95.1 Å²	95.1	66%	0.66	51%	0.511	S	S	*	.			trans	-79.1	115.2	169	-149.6	94.7	0	0	0	107.6	E1018	L1016-E1018 HydrophobicContact CD2-CG 3.92Å; L1016-E1018 WeakPolarHBondContact CD2-OE1 3.49Å
1017	I	70	Confident	68.7	Low	48 Å²	48	95.9 Å²	95.9	25%	0.246	51%	0.506	C	S	.	.			trans	-102.5	103.7	175.6	-57.5	179	0	0	0	106.6	L1015 T1021 Y1031 F1039	L1015-I1017 HydrophobicContact CD2-CD1 3.82Å; L1015-I1017 HydrophobicContact CD2-CG1 3.66Å; L1015-I1017 HydrophobicContact CG-CD1 4.48Å; L1015-I1017 HydrophobicContact CG-CG1 3.85Å; L1015-I1017 PolarHBondContact O-N 3.36Å; I1017-T1021 HydrophobicContact CG2-CG2 4.39Å; I1017-T1021 WeakPolarHBondContact CG2-OG1 3.4Å; I1017-Y1031 HydrophobicContact CG2-CE2 4.09Å; I1017-F1039 HydrophobicContact CD1-CE1 3.76Å; I1017-F1039 HydrophobicContact CD1-CE2 3.65Å; I1017-F1039 HydrophobicContact CD1-CZ 3.12Å
1018	E	74	Confident	69.7	Low	117 Å²	117	93.7 Å²	93.7	55%	0.547	49%	0.492	S	S	.	.			trans	-86	159	170.1	-61	-177.7	166.1	0	0	109.5	L1016 D1020 T1021	L1016-E1018 HydrophobicContact CD2-CG 3.92Å; L1016-E1018 WeakPolarHBondContact CD2-OE1 3.49Å; E1018-D1020 PolarHBondContact O-N 3.14Å; E1018-T1021 HydrophobicContact CB-CG2 4.41Å; E1018-T1021 WeakPolarHBondContact O-CB 3.39Å; E1018-T1021 WeakPolarHBondContact O-CG2 3.21Å; E1018-T1021 PolarHBondContact O-N 2.9Å; E1018-T1021 PolarHBondContact O-OG1 2.8Å
1019	D	68.1	Low	70.8	Confident	140 Å²	140	90.7 Å²	90.7	75%	0.749	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-22.6	-179.3	-69.9	-25.6	0	0	0	112.6	T1021	D1019-T1021 VanDerWaalsContact C-N 3.31Å; D1019-T1021 PolarHBondContact O-N 3.44Å
1020	D	74.1	Confident	71.8	Confident	134 Å²	134	86.5 Å²	86.5	72%	0.717	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-1	-178.9	-51.2	2.9	0	0	0	112.9	E1018 L1022	E1018-D1020 PolarHBondContact O-N 3.14Å; D1020-L1022 PolarHBondContact O-N 2.75Å
1021	T	79.6	Confident	72.6	Confident	28 Å²	28	80.8 Å²	80.8	17%	0.172	43%	0.425	C	S	.	.			trans	-72.3	119.6	-176.2	50.6	0	0	0	0	112.3	I1017 E1018 D1019 I1030	I1017-T1021 HydrophobicContact CG2-CG2 4.39Å; I1017-T1021 WeakPolarHBondContact CG2-OG1 3.4Å; E1018-T1021 HydrophobicContact CB-CG2 4.41Å; E1018-T1021 WeakPolarHBondContact O-CB 3.39Å; E1018-T1021 WeakPolarHBondContact O-CG2 3.21Å; E1018-T1021 PolarHBondContact O-N 2.9Å; E1018-T1021 PolarHBondContact O-OG1 2.8Å; D1019-T1021 VanDerWaalsContact C-N 3.31Å; D1019-T1021 PolarHBondContact O-N 3.44Å; T1021-I1030 PolarHBondContact O-N 2.84Å
1022	L	82.7	Confident	73.7	Confident	91 Å²	91	74.9 Å²	74.9	48%	0.476	41%	0.405	S	S	.	.	B	Isolated β-bridge	trans	-104.8	145.8	-177.4	-56.1	174.9	0	0	0	111	D1020 S1024 Q1028	D1020-L1022 PolarHBondContact O-N 2.75Å; L1022-S1024 PolarHBondContact O-N 2.89Å; L1022-Q1028 CarbonylContact C-O 3.59Å; L1022-Q1028 WeakPolarHBondContact CA-O 3.45Å
1023	C	83	Confident	74.5	Confident	0 Å²	0	77 Å²	77	0%	0	41%	0.405	C	S	.	.			trans	-59.9	131.5	168.2	172.4	0	0	0	0	110.2	I1025 C1026 H1027 Q1028 V1048 H1050	C1023-I1025 PolarHBondContact O-N 3.45Å; C1023-I1025 VanDerWaalsContact O-N 3.12Å; C1023-C1026 WeakPolarHBondContact CB-SG 3.31Å; C1023-C1026 PolarHBondContact SG-SG 3.46Å; C1023-H1027 WeakPolarHBondContact O-CA 3.34Å; C1023-H1027 PolarHBondContact O-N 3.12Å; C1023-Q1028 PolarHBondContact N-O 3.29Å; C1023-V1048 CarbonylContact C-O 3.5Å; C1023-V1048 WeakPolarHBondContact CA-O 3.44Å; C1023-H1050 VanDerWaalsContact CB-CE1 3.45Å; C1023-H1050 WeakPolarHBondContact CB-CE1 3.44Å; C1023-H1050 VanDerWaalsContact CB-ND1 3.3Å; C1023-H1050 WeakPolarHBondContact CB-ND1 3.29Å; C1023-H1050 PolarHBondContact SG-N 2.73Å; C1023-H1050 VanDerWaalsContact SG-N 3.41Å; C1023-H1050 PolarHBondContact SG-ND1 3.31Å; C1023-H1050 VanDerWaalsContact SG-ND1 3.37Å
1024	S	79.3	Confident	74.7	Confident	40 Å²	40	72.9 Å²	72.9	28%	0.28	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-10.5	-177.3	-59.3	0	0	0	0	114.2	L1022 Q1047 V1048	L1022-S1024 PolarHBondContact O-N 2.89Å; S1024-Q1047 WeakPolarHBondContact OG-CB 3.31Å; S1024-Q1047 WeakPolarHBondContact OG-CG 3.4Å; S1024-V1048 PolarHBondContact N-O 2.86Å; S1024-V1048 PolarHBondContact OG-O 3Å
1025	I	78.5	Confident	74.8	Confident	50 Å²	50	73.2 Å²	73.2	26%	0.256	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-58.2	-178.9	-60.4	-178.9	0	0	0	110.9	C1023 V1049 C1053 N1057	C1023-I1025 PolarHBondContact O-N 3.45Å; C1023-I1025 VanDerWaalsContact O-N 3.12Å; I1025-V1049 HydrophobicContact CB-CG1 4.3Å; I1025-V1049 HydrophobicContact CD1-CG1 3.34Å; I1025-V1049 HydrophobicContact CG1-CG1 3.69Å; I1025-C1053 HydrophobicContact CB-CB 4Å; I1025-C1053 HydrophobicContact CD1-CB 3.95Å; I1025-C1053 WeakPolarHBondContact CD1-O 3.38Å; I1025-C1053 HydrophobicContact CG1-CB 4.48Å; I1025-C1053 HydrophobicContact CG2-CB 4.16Å; I1025-N1057 HydrophobicContact CD1-CB 3.8Å; I1025-N1057 WeakPolarHBondContact CD1-ND2 3.45Å; I1025-N1057 WeakPolarHBondContact CG1-ND2 2.95Å
1026	C	82.7	Confident	74.3	Confident	43 Å²	43	76.7 Å²	76.7	29%	0.291	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-6.2	-176.8	68.1	0	0	0	0	113.5	C1023 Q1028 H1050	C1023-C1026 WeakPolarHBondContact CB-SG 3.31Å; C1023-C1026 PolarHBondContact SG-SG 3.46Å; C1026-Q1028 PolarHBondContact O-N 2.94Å; C1026-H1050 PolarHBondContact SG-CE1 3.44Å; C1026-H1050 PolarHBondContact SG-ND1 2.82Å
1027	H	80.8	Confident	74.2	Confident	133 Å²	133	74.5 Å²	74.5	62%	0.616	40%	0.404	S	S	*	.			trans	54.1	19.5	-176.6	-60.8	-62.8	0	0	0	114.8	C1023	C1023-H1027 WeakPolarHBondContact O-CA 3.34Å; C1023-H1027 PolarHBondContact O-N 3.12Å
1028	Q	81.2	Confident	74.1	Confident	86 Å²	86	75.8 Å²	75.8	40%	0.402	42%	0.417	S	S	.	.	S	Bend	trans	-93	156.8	172.7	-66.3	-176.5	-1.6	0	0	110.7	L1022 C1023 C1026 I1030 V1032	L1022-Q1028 CarbonylContact C-O 3.59Å; L1022-Q1028 WeakPolarHBondContact CA-O 3.45Å; C1023-Q1028 PolarHBondContact N-O 3.29Å; C1026-Q1028 PolarHBondContact O-N 2.94Å; Q1028-I1030 PolarHBondContact O-N 2.95Å; Q1028-V1032 HydrophobicContact CB-CG2 3.91Å
1029	S	80.6	Confident	74.3	Confident	36 Å²	36	73.6 Å²	73.6	25%	0.252	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-52.3	138.6	173.7	166.4	0	0	0	0	110.5	Y1031 V1032 H1050	S1029-Y1031 PolarHBondContact O-N 2.88Å; S1029-Y1031 VanDerWaalsContact O-N 3.13Å; S1029-Y1031 PolarHBondContact OG-N 3.01Å; S1029-V1032 WeakPolarHBondContact O-CB 3.41Å; S1029-V1032 VanDerWaalsContact O-CG2 3.32Å; S1029-V1032 WeakPolarHBondContact O-CG2 3.33Å; S1029-V1032 PolarHBondContact O-N 2.87Å; S1029-H1050 PolarHBondContact O-CE1 3.44Å; S1029-H1050 PolarHBondContact O-NE2 2.98Å
1030	I	75.9	Confident	74.6	Confident	5 Å²	5	67.9 Å²	67.9	3%	0.026	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-28	177.6	-68.8	158.9	0	0	0	111	T1021 Q1028 F1039 V1048 H1050	T1021-I1030 PolarHBondContact O-N 2.84Å; Q1028-I1030 PolarHBondContact O-N 2.95Å; I1030-F1039 HydrophobicContact CG2-CB 3.72Å; I1030-F1039 HydrophobicContact CG2-CD1 3.47Å; I1030-F1039 VanDerWaalsContact CG2-CD1 3.47Å; I1030-F1039 HydrophobicContact CG2-CE1 4.29Å; I1030-F1039 HydrophobicContact CG2-CG 3.65Å; I1030-V1048 HydrophobicContact CD1-CB 3.56Å; I1030-V1048 HydrophobicContact CD1-CG1 3.57Å; I1030-V1048 HydrophobicContact CD1-CG2 4.09Å; I1030-V1048 HydrophobicContact CG1-CB 4.42Å; I1030-V1048 HydrophobicContact CG1-CG1 4.32Å; I1030-H1050 WeakPolarHBondContact CA-NE2 3.3Å; I1030-H1050 PolarHBondContact O-CD2 2.81Å; I1030-H1050 PolarHBondContact O-NE2 2.8Å
1031	Y	71.4	Confident	74.8	Confident	98 Å²	98	64.6 Å²	64.6	38%	0.384	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	6.2	178.9	-62.4	-62.5	0	0	0	115.2	I1017 S1029 Y1033 G1034	I1017-Y1031 HydrophobicContact CG2-CE2 4.09Å; S1029-Y1031 PolarHBondContact O-N 2.88Å; S1029-Y1031 VanDerWaalsContact O-N 3.13Å; S1029-Y1031 PolarHBondContact OG-N 3.01Å; Y1031-Y1033 PolarHBondContact O-N 2.89Å; Y1031-Y1033 VanDerWaalsContact O-N 3.09Å; Y1031-G1034 PolarHBondContact O-N 2.83Å
1032	V	73.5	Confident	74.5	Confident	77 Å²	77	66.1 Å²	66.1	47%	0.467	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-35.5	-178.2	161.4	0	0	0	0	113	Q1028 S1029 G1034	Q1028-V1032 HydrophobicContact CB-CG2 3.91Å; S1029-V1032 WeakPolarHBondContact O-CB 3.41Å; S1029-V1032 VanDerWaalsContact O-CG2 3.32Å; S1029-V1032 WeakPolarHBondContact O-CG2 3.33Å; S1029-V1032 PolarHBondContact O-N 2.87Å; V1032-G1034 VanDerWaalsContact C-N 3.35Å
1033	Y	71.4	Confident	73.8	Confident	108 Å²	108	66.2 Å²	66.2	42%	0.424	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	8.4	-178.3	-54.5	-77	0	0	0	113.7	Y1031 D1037 H1050 H1052	Y1031-Y1033 PolarHBondContact O-N 2.89Å; Y1031-Y1033 VanDerWaalsContact O-N 3.09Å; Y1033-D1037 WeakPolarHBondContact CB-OD2 3.4Å; Y1033-H1050 AromaticContact CD2-CD2 3.8Å; Y1033-H1050 AromaticContact CD2-NE2 3.82Å; Y1033-H1050 AromaticContact CE2-CD2 4Å; Y1033-H1050 AromaticContact CE2-CE1 3.95Å; Y1033-H1050 AromaticContact CE2-NE2 3.87Å; Y1033-H1052 AromaticContact CD2-CE1 3.54Å; Y1033-H1052 AromaticContact CE2-CE1 3.26Å; Y1033-H1052 WeakPolarHBondContact CE2-CE1 3.47Å; Y1033-H1052 AromaticContact CE2-NE2 3.38Å; Y1033-H1052 WeakPolarHBondContact CE2-NE2 3.35Å; Y1033-H1052 AromaticContact CZ-CE1 3.82Å; Y1033-H1052 AromaticContact CZ-NE2 3.67Å
1034	G	65.1	Low	73.1	Confident	19 Å²	19	72.3 Å²	72.3	20%	0.196	40%	0.402	C	S	.	.			trans	110.8	162	176.7	0	0	0	0	0	113.4	Y1031 V1032 S1036 D1037	Y1031-G1034 PolarHBondContact O-N 2.83Å; V1032-G1034 VanDerWaalsContact C-N 3.35Å; G1034-S1036 PolarHBondContact O-N 2.77Å; G1034-D1037 PolarHBondContact O-N 3.03Å
1035	P	63.1	Low	72.8	Confident	120 Å²	120	77.4 Å²	77.4	78%	0.779	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-16	-175.6	28.5	-35.2	0	0	0	113.8
1036	S	59.5	Low	72.6	Confident	111 Å²	111	80.1 Å²	80.1	78%	0.776	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-9.3	-179	50	0	0	0	0	114	G1034	G1034-S1036 PolarHBondContact O-N 2.77Å
1037	D	63.7	Low	72.4	Confident	80 Å²	80	81.8 Å²	81.8	43%	0.428	44%	0.438	S	S	.	.			trans	-77.2	139.8	-177.2	-104.7	7.3	0	0	0	111.6	Y1033 G1034	Y1033-D1037 WeakPolarHBondContact CB-OD2 3.4Å; G1034-D1037 PolarHBondContact O-N 3.03Å
1038	S	68	Low	72.4	Confident	76 Å²	76	76 Å²	76	53%	0.531	41%	0.412	S	S	.	.			trans	-78.9	137.6	-178.1	53.6	0	0	0	0	110.8	T1051	S1038-T1051 VanDerWaalsContact O-CG2 3.3Å; S1038-T1051 WeakPolarHBondContact O-CG2 3.3Å; S1038-T1051 PolarHBondContact O-OG1 2.99Å; S1038-T1051 VanDerWaalsContact O-OG1 3.04Å; S1038-T1051 WeakPolarHBondContact OG-CG2 3.36Å
1039	F	77.8	Confident	72.4	Confident	71 Å²	71	72 Å²	72	31%	0.311	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	153.2	168.5	60.1	-92.7	0	0	0	109.4	L1015 I1017 I1030 V1048 V1049	L1015-F1039 HydrophobicContact CD2-CE2 3.98Å; I1017-F1039 HydrophobicContact CD1-CE1 3.76Å; I1017-F1039 HydrophobicContact CD1-CE2 3.65Å; I1017-F1039 HydrophobicContact CD1-CZ 3.12Å; I1030-F1039 HydrophobicContact CG2-CB 3.72Å; I1030-F1039 HydrophobicContact CG2-CD1 3.47Å; I1030-F1039 VanDerWaalsContact CG2-CD1 3.47Å; I1030-F1039 HydrophobicContact CG2-CE1 4.29Å; I1030-F1039 HydrophobicContact CG2-CG 3.65Å; F1039-V1048 HydrophobicContact CB-CG1 4.25Å; F1039-V1048 HydrophobicContact CD2-CG1 3.21Å; F1039-V1048 HydrophobicContact CE2-CG1 3.79Å; F1039-V1048 HydrophobicContact CG-CG1 3.93Å; F1039-V1049 CarbonylContact C-O 3.55Å; F1039-V1049 WeakPolarHBondContact CA-O 3.5Å; F1039-V1049 WeakPolarHBondContact CB-O 3.42Å
1040	A	75	Confident	72.4	Confident	20 Å²	20	70.5 Å²	70.5	17%	0.165	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	131.5	173.5	0	0	0	0	0	109.7	V1048 V1049 L1054	A1040-V1048 WeakPolarHBondContact O-CA 3.43Å; A1040-V1049 PolarHBondContact N-O 2.82Å; A1040-V1049 PolarHBondContact O-N 3.25Å; A1040-L1054 HydrophobicContact CB-CD1 4.19Å; A1040-L1054 HydrophobicContact CB-CD2 3.97Å
1041	W	77.5	Confident	72.3	Confident	65 Å²	65	73.2 Å²	73.2	25%	0.246	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	112.2	170	176.5	34.6	0	0	0	110.2	N1013 L1015 I1043 N1046	N1013-W1041 VanDerWaalsContact C-CH2 3.48Å; N1013-W1041 HydrophobicContact CB-CH2 3.3Å; N1013-W1041 HydrophobicContact CB-CZ2 4.14Å; N1013-W1041 HydrophobicContact CB-CZ3 3.92Å; N1013-W1041 VanDerWaalsContact O-CH2 3.28Å; N1013-W1041 WeakPolarHBondContact O-CH2 3.3Å; N1013-W1041 WeakPolarHBondContact O-CZ3 3.26Å; L1015-W1041 HydrophobicContact CB-CD2 3.95Å; L1015-W1041 HydrophobicContact CB-CE3 4.01Å; L1015-W1041 HydrophobicContact CB-CH2 3.84Å; L1015-W1041 HydrophobicContact CB-CZ2 3.86Å; L1015-W1041 HydrophobicContact CB-CZ3 3.96Å; L1015-W1041 HydrophobicContact CD1-CD2 4.34Å; L1015-W1041 HydrophobicContact CD1-CG 4.38Å; L1015-W1041 HydrophobicContact CD1-CZ2 4.2Å; L1015-W1041 HydrophobicContact CD2-CB 4.2Å; L1015-W1041 HydrophobicContact CD2-CD2 4.2Å; L1015-W1041 HydrophobicContact CD2-CG 3.95Å; L1015-W1041 HydrophobicContact CG-CD2 4.39Å; W1041-I1043 HydrophobicContact CD2-CG1 4.15Å; W1041-I1043 HydrophobicContact CE3-CG1 4.19Å; W1041-I1043 PolarHBondContact O-N 3.39Å; W1041-I1043 VanDerWaalsContact O-N 3.1Å; W1041-N1046 WeakPolarHBondContact CZ2-OD1 3.35Å; W1041-N1046 PolarHBondContact NE1-OD1 3.49Å
1042	L	73.2	Confident	72.4	Confident	59 Å²	59	72.3 Å²	72.3	31%	0.309	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	85	174.7	-66.5	169.7	0	0	0	109.1	P1044 K1045 N1046 Q1047 V1049 L1054	L1042-P1044 VanDerWaalsContact C-CD 3.47Å; L1042-K1045 HydrophobicContact CB-CB 4.45Å; L1042-K1045 CarbonylContact O-C 3.6Å; L1042-K1045 PolarHBondContact O-N 2.82Å; L1042-N1046 WeakPolarHBondContact O-CA 3.32Å; L1042-N1046 PolarHBondContact O-N 2.72Å; L1042-Q1047 HydrophobicContact CB-CB 4.42Å; L1042-Q1047 PolarHBondContact N-O 2.65Å; L1042-Q1047 PolarHBondContact O-N 2.8Å; L1042-V1049 HydrophobicContact CD1-CG2 3.96Å; L1042-L1054 HydrophobicContact CD1-CD1 4.24Å; L1042-L1054 HydrophobicContact CD2-CD1 4.2Å; L1042-L1054 HydrophobicContact CG-CD1 4.37Å
1043	I	68.4	Low	72.4	Confident	94 Å²	94	69.2 Å²	69.2	48%	0.482	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-42.7	-51.1	-178.2	-55.3	171.2	0	0	0	113.7	N1013 W1041 K1045 N1046	N1013-I1043 VanDerWaalsContact ND2-CG2 3.33Å; N1013-I1043 WeakPolarHBondContact ND2-CG2 3.25Å; W1041-I1043 HydrophobicContact CD2-CG1 4.15Å; W1041-I1043 HydrophobicContact CE3-CG1 4.19Å; W1041-I1043 PolarHBondContact O-N 3.39Å; W1041-I1043 VanDerWaalsContact O-N 3.1Å; I1043-K1045 VanDerWaalsContact C-N 3.33Å; I1043-K1045 PolarHBondContact O-N 3.39Å; I1043-N1046 PolarHBondContact O-N 2.94Å
1044	P	69.5	Low	72.3	Confident	127 Å²	127	67.2 Å²	67.2	83%	0.825	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-68.4	-28.8	-176.2	24.2	-33.3	0	0	0	114	L1042	L1042-P1044 VanDerWaalsContact C-CD 3.47Å
1045	K	71.3	Confident	72.1	Confident	148 Å²	148	70.3 Å²	70.3	64%	0.643	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-93.4	-8.1	176.9	-66.3	-174.3	179.2	179	0	112.6	L1042 I1043 Q1047	L1042-K1045 HydrophobicContact CB-CB 4.45Å; L1042-K1045 CarbonylContact O-C 3.6Å; L1042-K1045 PolarHBondContact O-N 2.82Å; I1043-K1045 VanDerWaalsContact C-N 3.33Å; I1043-K1045 PolarHBondContact O-N 3.39Å; K1045-Q1047 HydrophobicContact CB-CB 4.16Å; K1045-Q1047 HydrophobicContact CB-CG 4.01Å; K1045-Q1047 PolarHBondContact O-N 3.39Å
1046	N	74.1	Confident	71.7	Confident	107 Å²	107	68.2 Å²	68.2	57%	0.572	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	40.9	-167.9	-151.4	29.3	0	0	0	113.3	W1041 L1042 I1043	W1041-N1046 WeakPolarHBondContact CZ2-OD1 3.35Å; W1041-N1046 PolarHBondContact NE1-OD1 3.49Å; L1042-N1046 WeakPolarHBondContact O-CA 3.32Å; L1042-N1046 PolarHBondContact O-N 2.72Å; I1043-N1046 PolarHBondContact O-N 2.94Å
1047	Q	79.1	Confident	70.9	Confident	78 Å²	78	68.7 Å²	68.7	36%	0.364	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	139.7	-177.1	-80.2	178.3	-15.8	0	0	110.5	S1024 L1042 K1045	S1024-Q1047 WeakPolarHBondContact OG-CB 3.31Å; S1024-Q1047 WeakPolarHBondContact OG-CG 3.4Å; L1042-Q1047 HydrophobicContact CB-CB 4.42Å; L1042-Q1047 PolarHBondContact N-O 2.65Å; L1042-Q1047 PolarHBondContact O-N 2.8Å; K1045-Q1047 HydrophobicContact CB-CB 4.16Å; K1045-Q1047 HydrophobicContact CB-CG 4.01Å; K1045-Q1047 PolarHBondContact O-N 3.39Å
1048	V	80.8	Confident	69.7	Low	12 Å²	12	76.1 Å²	76.1	7%	0.073	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.1	177.4	-148.4	0	0	0	0	109.1	L1015 C1023 S1024 I1030 F1039 A1040	L1015-V1048 HydrophobicContact CD1-CG2 3.92Å; L1015-V1048 HydrophobicContact CD2-CG1 4.04Å; L1015-V1048 HydrophobicContact CD2-CG2 3.77Å; L1015-V1048 HydrophobicContact CG-CG2 4.42Å; C1023-V1048 CarbonylContact C-O 3.5Å; C1023-V1048 WeakPolarHBondContact CA-O 3.44Å; S1024-V1048 PolarHBondContact N-O 2.86Å; S1024-V1048 PolarHBondContact OG-O 3Å; I1030-V1048 HydrophobicContact CD1-CB 3.56Å; I1030-V1048 HydrophobicContact CD1-CG1 3.57Å; I1030-V1048 HydrophobicContact CD1-CG2 4.09Å; I1030-V1048 HydrophobicContact CG1-CB 4.42Å; I1030-V1048 HydrophobicContact CG1-CG1 4.32Å; F1039-V1048 HydrophobicContact CB-CG1 4.25Å; F1039-V1048 HydrophobicContact CD2-CG1 3.21Å; F1039-V1048 HydrophobicContact CE2-CG1 3.79Å; F1039-V1048 HydrophobicContact CG-CG1 3.93Å; A1040-V1048 WeakPolarHBondContact O-CA 3.43Å
1049	V	81.5	Confident	69.8	Low	2 Å²	2	76.2 Å²	76.2	1%	0.012	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	141.4	-170.8	-168.1	0	0	0	0	109.1	I1025 F1039 A1040 L1042 C1053 L1054	I1025-V1049 HydrophobicContact CB-CG1 4.3Å; I1025-V1049 HydrophobicContact CD1-CG1 3.34Å; I1025-V1049 HydrophobicContact CG1-CG1 3.69Å; F1039-V1049 CarbonylContact C-O 3.55Å; F1039-V1049 WeakPolarHBondContact CA-O 3.5Å; F1039-V1049 WeakPolarHBondContact CB-O 3.42Å; A1040-V1049 PolarHBondContact N-O 2.82Å; A1040-V1049 PolarHBondContact O-N 3.25Å; L1042-V1049 HydrophobicContact CD1-CG2 3.96Å; V1049-C1053 HydrophobicContact CG1-CB 3.72Å; V1049-L1054 HydrophobicContact CB-CD1 4.36Å; V1049-L1054 HydrophobicContact CG1-CD1 4.41Å
1050	H	80.2	Confident	69.3	Low	4 Å²	4	76.4 Å²	76.4	2%	0.019	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	143.6	168.5	-57.4	108.4	0	0	0	110.4	C1023 C1026 S1029 I1030 Y1033 H1052 C1053 L1054	C1023-H1050 VanDerWaalsContact CB-CE1 3.45Å; C1023-H1050 WeakPolarHBondContact CB-CE1 3.44Å; C1023-H1050 VanDerWaalsContact CB-ND1 3.3Å; C1023-H1050 WeakPolarHBondContact CB-ND1 3.29Å; C1023-H1050 PolarHBondContact SG-N 2.73Å; C1023-H1050 VanDerWaalsContact SG-N 3.41Å; C1023-H1050 PolarHBondContact SG-ND1 3.31Å; C1023-H1050 VanDerWaalsContact SG-ND1 3.37Å; C1026-H1050 PolarHBondContact SG-CE1 3.44Å; C1026-H1050 PolarHBondContact SG-ND1 2.82Å; S1029-H1050 PolarHBondContact O-CE1 3.44Å; S1029-H1050 PolarHBondContact O-NE2 2.98Å; I1030-H1050 WeakPolarHBondContact CA-NE2 3.3Å; I1030-H1050 PolarHBondContact O-CD2 2.81Å; I1030-H1050 PolarHBondContact O-NE2 2.8Å; Y1033-H1050 AromaticContact CD2-CD2 3.8Å; Y1033-H1050 AromaticContact CD2-NE2 3.82Å; Y1033-H1050 AromaticContact CE2-CD2 4Å; Y1033-H1050 AromaticContact CE2-CE1 3.95Å; Y1033-H1050 AromaticContact CE2-NE2 3.87Å; H1050-H1052 VanDerWaalsContact C-N 3.26Å; H1050-H1052 WeakPolarHBondContact CB-CE1 3.35Å; H1050-H1052 AromaticContact CG-CE1 3.77Å; H1050-H1052 AromaticContact CG-NE2 3.97Å; H1050-H1052 PolarHBondContact O-N 3.49Å; H1050-C1053 HydrophobicContact CB-CB 4.12Å; H1050-C1053 WeakPolarHBondContact O-CB 3.43Å; H1050-C1053 PolarHBondContact O-N 3.14Å; H1050-L1054 PolarHBondContact O-N 3.43Å
1051	T	74	Confident	69	Low	61 Å²	61	79.6 Å²	79.6	37%	0.374	42%	0.421	S	S	.	.	H	α-helix	trans	-57.2	-38.2	-178.4	42.2	0	0	0	0	113.1	S1038 L1054	S1038-T1051 VanDerWaalsContact O-CG2 3.3Å; S1038-T1051 WeakPolarHBondContact O-CG2 3.3Å; S1038-T1051 PolarHBondContact O-OG1 2.99Å; S1038-T1051 VanDerWaalsContact O-OG1 3.04Å; S1038-T1051 WeakPolarHBondContact OG-CG2 3.36Å; T1051-L1054 VanDerWaalsContact O-CB 3.3Å; T1051-L1054 WeakPolarHBondContact O-CB 3.41Å; T1051-L1054 PolarHBondContact O-N 3.07Å
1052	H	73.5	Confident	68.5	Low	80 Å²	80	80.4 Å²	80.4	37%	0.37	43%	0.432	S	S	.	.	H	α-helix	trans	-74.4	-27.7	175	58.3	-93.5	0	0	0	113.6	Y1033 H1050 L1054 S1055	Y1033-H1052 AromaticContact CD2-CE1 3.54Å; Y1033-H1052 AromaticContact CE2-CE1 3.26Å; Y1033-H1052 WeakPolarHBondContact CE2-CE1 3.47Å; Y1033-H1052 AromaticContact CE2-NE2 3.38Å; Y1033-H1052 WeakPolarHBondContact CE2-NE2 3.35Å; Y1033-H1052 AromaticContact CZ-CE1 3.82Å; Y1033-H1052 AromaticContact CZ-NE2 3.67Å; H1050-H1052 VanDerWaalsContact C-N 3.26Å; H1050-H1052 WeakPolarHBondContact CB-CE1 3.35Å; H1050-H1052 AromaticContact CG-CE1 3.77Å; H1050-H1052 AromaticContact CG-NE2 3.97Å; H1050-H1052 PolarHBondContact O-N 3.49Å; H1052-L1054 VanDerWaalsContact C-N 3.29Å; H1052-S1055 PolarHBondContact O-OG 2.74Å
1053	C	74.5	Confident	68.2	Low	11 Å²	11	81.8 Å²	81.8	7%	0.074	44%	0.439	C	S	.	.	H	α-helix	trans	-71.2	-30.4	171.3	-69	0	0	0	0	110.8	I1025 V1049 H1050 S1055 S1056	I1025-C1053 HydrophobicContact CB-CB 4Å; I1025-C1053 HydrophobicContact CD1-CB 3.95Å; I1025-C1053 WeakPolarHBondContact CD1-O 3.38Å; I1025-C1053 HydrophobicContact CG1-CB 4.48Å; I1025-C1053 HydrophobicContact CG2-CB 4.16Å; V1049-C1053 HydrophobicContact CG1-CB 3.72Å; H1050-C1053 HydrophobicContact CB-CB 4.12Å; H1050-C1053 WeakPolarHBondContact O-CB 3.43Å; H1050-C1053 PolarHBondContact O-N 3.14Å; C1053-S1055 VanDerWaalsContact C-N 3.31Å; C1053-S1055 PolarHBondContact O-N 2.87Å; C1053-S1056 PolarHBondContact O-N 2.67Å; C1053-S1056 VanDerWaalsContact O-N 3.12Å; C1053-S1056 PolarHBondContact O-OG 3.19Å
1054	L	68.5	Low	68.2	Low	67 Å²	67	80.9 Å²	80.9	35%	0.351	44%	0.436	S	S	.	.	H	α-helix	trans	-60.6	-41.5	176.8	-160.4	79.7	0	0	0	111.6	A1040 L1042 V1049 H1050 T1051 H1052 S1056 N1057	A1040-L1054 HydrophobicContact CB-CD1 4.19Å; A1040-L1054 HydrophobicContact CB-CD2 3.97Å; L1042-L1054 HydrophobicContact CD1-CD1 4.24Å; L1042-L1054 HydrophobicContact CD2-CD1 4.2Å; L1042-L1054 HydrophobicContact CG-CD1 4.37Å; V1049-L1054 HydrophobicContact CB-CD1 4.36Å; V1049-L1054 HydrophobicContact CG1-CD1 4.41Å; H1050-L1054 PolarHBondContact O-N 3.43Å; T1051-L1054 VanDerWaalsContact O-CB 3.3Å; T1051-L1054 WeakPolarHBondContact O-CB 3.41Å; T1051-L1054 PolarHBondContact O-N 3.07Å; H1052-L1054 VanDerWaalsContact C-N 3.29Å; L1054-S1056 PolarHBondContact O-N 3.48Å; L1054-N1057 PolarHBondContact O-N 2.93Å
1055	S	61.5	Low	68.1	Low	83 Å²	83	77.6 Å²	77.6	58%	0.58	41%	0.409	S	S	*	.	H	α-helix	trans	-66.2	-20.3	176.4	39.6	0	0	0	0	114.1	H1052 C1053	H1052-S1055 PolarHBondContact O-OG 2.74Å; C1053-S1055 VanDerWaalsContact C-N 3.31Å; C1053-S1055 PolarHBondContact O-N 2.87Å
1056	S	53.6	Low	67.9	Low	77 Å²	77	72.2 Å²	72.2	54%	0.538	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-8.3	176.9	63.7	0	0	0	0	114.2	C1053 L1054	C1053-S1056 PolarHBondContact O-N 2.67Å; C1053-S1056 VanDerWaalsContact O-N 3.12Å; C1053-S1056 PolarHBondContact O-OG 3.19Å; L1054-S1056 PolarHBondContact O-N 3.48Å
1057	N	43.9	Very low	67.3	Low	121 Å²	121	69.3 Å²	69.3	65%	0.647	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	12.1	-178.7	-110.9	-2.2	0	0	0	113.5	I1025 L1054	I1025-N1057 HydrophobicContact CD1-CB 3.8Å; I1025-N1057 WeakPolarHBondContact CD1-ND2 3.45Å; I1025-N1057 WeakPolarHBondContact CG1-ND2 2.95Å; L1054-N1057 PolarHBondContact O-N 2.93Å
1058	Q	37.2	Very low	66.3	Low	236 Å²	236	68.5 Å²	68.5	100%	1.103	38%	0.377	S	S	*	.			trans	-106.5	0	153.5	-71.5	-168.9	-21.9	0	0	107.4

Retrieved 1,058 of 1,058 residues in 751.3 ms (Link to these results)

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