A0A3Q0KUA9_SCHMA Loading...

Putative gtpase activating protein

AlphaFold DB (A0A5K4F091), UniProt , Accession A0A3Q0KUA9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,194 aa.

						>A0A3Q0KUA9_SCHMA|A0A3Q0KUA9
MTQSRPYFTYDIHPGRYTCISTFRRTPLSGEEYLDVIPGDILVVECRPQNATAPTSFLYGLNETTKHKGYFPAYCVDIREFGSLQLRSKSTDRIAYIHFLPNSQSIKATNVDPQSLSQPVIPPRCKRLLNLSSPSSLLSIPYNSYSHSCTNLSVSSQDILPHEIQKCNVSVPTLSYRCHQFVNVSVSYPLICNLCNDYIVTPRCNANRCFTCKSIFHLVCAEYSKRFEVFTCQPPRNDNSTIKSEKLTCSSTCNAFSLLSSSISTTEQPLVSWNCTQVAHWLAVVGLCRFVRLFIKLNLDGNFLSEVTYDSPHLCRVADPFARETLERAILTLQGKEPTPGENLDIFANLDIDVKCPGKSSDSRQHDFQLTSFYRTVSCIVCNIPLLGFSHQGFQCKKCGAICHRICKALDYFSNCPGVFCASKAFNPENQDAGCGTNEVPTSLVPYVSEYFGVKLEEQKLDSNSKVPIFLTTCTEQIEKLATESFITASNNPCIQPVDMAMVYQQSALTYTLQELHNTFAHCLPLPDIEQSSTHPLDIVRFAQLMKAFLRDLPVNVIPEEYYLDFCSLANIRNIDEKEKAVHAFLESLPELHRLCLIHIFNHLGFVLNHQNKLKSYLSDSSSVNLNRSNSFSESSINVLNKATPWLMIFRQILVRPPWHLITDIAMGMDTHMRALEALFSTFVDFVSEESEYTSQTKNSEAQSHVLDSNLQRNYISFSQFEHISRYQGEKHTSSESISPYPTNVVAPTINTPPSPTSITANKKDLQNQEWYWGDITQEEVRELMTDLQDGYFLVRDASGSSSAAFTLVVRWRGLNKLNRIYHRGDYFGFTDPPYPSCRLVSELVEFCRVHPLTLTSCSNLRLIWPVSRRHKRFHGKTDILFDNTVSNENKSNADGVFACFLTESQLNGELKSKAAEINQLDKVITDLQLQSKNAIDLKEEGVRLIKGYQKIRKWLQTSLSQLDDYSYPSEKLKISPQIETLKREIDEIEKQIKINKEEVNNQSKKARIICENYANAIFRQRKVRRQAHEIRRALKDRGFKEESLSSSSSSLCDDSTSSTKQSIDNQSNIVPRNSINSHVDIYLPEEIRDRRYWFLTDATREKVEELLRDRPAGTFVVRPSATGDKLALGIRLATSVQHCLIHCVNGKYGFVENSCTYESLEDLICYYHVENLKRYNNLLNITLKYPIKLQLDE
					

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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	22.3	Very low	28.2	Very low	241 Å²	241	160.7 Å²	160.7	100%	1.187	80%	0.796	S	S	*	*				0	128.6	0	-84.1	-169.9	167.4	0	0	109.2
2	T	21.6	Very low	29.8	Very low	141 Å²	141	150.7 Å²	150.7	87%	0.865	75%	0.747	S	S	*	*			trans	-76.6	115.2	166.9	41.7	0	0	0	0	109.7
3	Q	23.1	Very low	31.4	Very low	183 Å²	183	148.2 Å²	148.2	86%	0.855	73%	0.732	S	S	*	*			trans	-134.3	114.5	155.5	-82.7	-168.6	-7.1	0	0	109.3	R5	Q3-R5 PolarHBondContact O-N 3.33Å
4	S	24	Very low	33.1	Very low	116 Å²	116	143.9 Å²	143.9	81%	0.811	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-59.5	116.2	178	46.8	0	0	0	0	112.3
5	R	23.7	Very low	34.7	Very low	228 Å²	228	135.1 Å²	135.1	86%	0.86	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-96	147.4	153.1	-78.5	-171.4	177.5	-172.7	0.3	108.7	Q3	Q3-R5 PolarHBondContact O-N 3.33Å
6	P	26.3	Very low	36.3	Very low	102 Å²	102	132.7 Å²	132.7	66%	0.662	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-64.6	137.4	-169.6	26	-33.6	0	0	0	112	F8	P6-F8 PolarHBondContact O-N 2.97Å
7	Y	29.7	Very low	37.9	Very low	192 Å²	192	125.8 Å²	125.8	75%	0.753	63%	0.626	S	S	*	*			trans	-63.6	107.9	178.6	-60.3	-89.5	0	0	0	110.2	T9 P54	Y7-T9 PolarHBondContact O-N 3.24Å; Y7-P54 HydrophobicContact CD1-CB 4.26Å; Y7-P54 HydrophobicContact CE1-CB 4.14Å; Y7-P54 HydrophobicContact CE1-CG 4.4Å
8	F	27.3	Very low	39.3	Very low	156 Å²	156	120.6 Å²	120.6	68%	0.684	60%	0.602	S	S	*	*			trans	-81.6	107.9	164.1	-76.3	-85.6	0	0	0	108.4	P6 Y10	P6-F8 PolarHBondContact O-N 2.97Å; F8-Y10 HydrophobicContact CB-CD2 3.97Å; F8-Y10 HydrophobicContact CB-CE2 3.42Å; F8-Y10 VanDerWaalsContact CB-CE2 3.42Å; F8-Y10 HydrophobicContact CG-CE2 4.26Å; F8-Y10 PolarHBondContact O-N 3.18Å
9	T	30.8	Very low	40.4	Very low	121 Å²	121	114.7 Å²	114.7	74%	0.742	57%	0.573	S	S	*	*			trans	-68.3	113.3	166.6	41.8	0	0	0	0	108.8	Y7	Y7-T9 PolarHBondContact O-N 3.24Å
10	Y	37.6	Very low	41.1	Very low	145 Å²	145	114.7 Å²	114.7	57%	0.569	57%	0.574	S	S	*	*			trans	-113.5	129	169.9	-71.6	-77.6	0	0	0	109.1	F8 I12	F8-Y10 HydrophobicContact CB-CD2 3.97Å; F8-Y10 HydrophobicContact CB-CE2 3.42Å; F8-Y10 VanDerWaalsContact CB-CE2 3.42Å; F8-Y10 HydrophobicContact CG-CE2 4.26Å; F8-Y10 PolarHBondContact O-N 3.18Å; Y10-I12 PolarHBondContact O-N 2.81Å
11	D	43.5	Very low	41.7	Very low	143 Å²	143	109.4 Å²	109.4	77%	0.765	55%	0.548	S	S	*	.			trans	-67.9	114.4	170.2	-71	-31.1	0	0	0	109.3	H13	D11-H13 PolarHBondContact O-N 3.01Å
12	I	48	Very low	43.1	Very low	40 Å²	40	102.7 Å²	102.7	21%	0.205	52%	0.521	C	S	.	.			trans	-81.3	107.5	173.9	-55.3	169.5	0	0	0	107.6	Y10 P48 A51 P72	Y10-I12 PolarHBondContact O-N 2.81Å; I12-P48 HydrophobicContact CG2-CG 4.19Å; I12-A51 HydrophobicContact CD1-CB 4.5Å; I12-P72 HydrophobicContact CD1-CB 4.35Å; I12-P72 HydrophobicContact CD1-CG 3.33Å; I12-P72 HydrophobicContact CG1-CG 3.59Å
13	H	50.4	Low	44.5	Very low	119 Å²	119	102.6 Å²	102.6	55%	0.551	51%	0.508	S	S	*	.			trans	-64.6	143.8	172.9	-65.8	-60.2	0	0	0	111.1	D11 Y17	D11-H13 PolarHBondContact O-N 3.01Å; H13-Y17 PolarHBondContact O-OH 3.4Å
14	P	55	Low	45.6	Very low	87 Å²	87	103.6 Å²	103.6	57%	0.565	50%	0.504	S	S	*	.	S	Bend	trans	-63.7	137.6	168.9	24.2	-31.2	0	0	0	110.5
15	G	56.8	Low	46.8	Very low	13 Å²	13	105.6 Å²	105.6	13%	0.134	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168	174.6	-179.1	0	0	0	0	0	116.2	Y17 C46	G15-Y17 VanDerWaalsContact O-CD2 3.31Å; G15-Y17 WeakPolarHBondContact O-CD2 3.46Å; G15-Y17 VanDerWaalsContact O-CE2 3.25Å; G15-Y17 WeakPolarHBondContact O-CE2 3.43Å; G15-C46 PolarHBondContact N-O 2.96Å; G15-C46 PolarHBondContact O-N 2.97Å
16	R	61	Low	48.2	Very low	96 Å²	96	95.8 Å²	95.8	36%	0.362	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	124.3	176.2	-169.4	172.4	-173.2	-131.1	10.6	110	V43 E63	R16-V43 HydrophobicContact CG-CG1 3.76Å; R16-V43 VanDerWaalsContact NE-CG1 3.29Å; R16-E63 VanDerWaalsContact CD-OE2 3.32Å; R16-E63 WeakPolarHBondContact CD-OE2 3.42Å; R16-E63 IonicContact CZ-OE2 3.22Å; R16-E63 IonicContact NE-OE2 3.73Å; R16-E63 IonicContact NH1-OE1 3.24Å; R16-E63 IonicContact NH1-OE2 2.71Å; R16-E63 PolarHBondContact NH1-OE2 2.96Å; R16-E63 PolarHBondContact O-N 3.5Å
17	Y	63.4	Low	49.3	Very low	16 Å²	16	93.1 Å²	93.1	6%	0.063	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.8	-173.9	-59.9	-82.1	0	0	0	110.6	H13 G15 V43 V44 C46 L61 N62 F71	H13-Y17 PolarHBondContact O-OH 3.4Å; G15-Y17 VanDerWaalsContact O-CD2 3.31Å; G15-Y17 WeakPolarHBondContact O-CD2 3.46Å; G15-Y17 VanDerWaalsContact O-CE2 3.25Å; G15-Y17 WeakPolarHBondContact O-CE2 3.43Å; Y17-V43 CarbonylContact O-C 3.58Å; Y17-V43 WeakPolarHBondContact O-CA 3.41Å; Y17-V44 PolarHBondContact N-O 3.13Å; Y17-V44 PolarHBondContact O-N 3.24Å; Y17-C46 HydrophobicContact CD2-CB 4.28Å; Y17-C46 HydrophobicContact CE2-CB 3.96Å; Y17-L61 WeakPolarHBondContact CA-O 3.44Å; Y17-N62 HydrophobicContact CD1-CB 3.88Å; Y17-N62 HydrophobicContact CE1-CB 3.65Å; Y17-N62 VanDerWaalsContact CE1-ND2 3.34Å; Y17-N62 WeakPolarHBondContact CE1-ND2 3.46Å; Y17-N62 PolarHBondContact OH-ND2 2.95Å; Y17-F71 HydrophobicContact CD1-CB 4.38Å; Y17-F71 AromaticContact CD1-CD1 3.57Å; Y17-F71 HydrophobicContact CD1-CD1 3.57Å; Y17-F71 AromaticContact CD1-CD2 3.55Å; Y17-F71 HydrophobicContact CD1-CD2 3.55Å; Y17-F71 AromaticContact CD1-CE1 3.67Å; Y17-F71 HydrophobicContact CD1-CE1 3.67Å; Y17-F71 AromaticContact CD1-CE2 3.58Å; Y17-F71 HydrophobicContact CD1-CE2 3.58Å; Y17-F71 AromaticContact CD1-CG 3.53Å; Y17-F71 HydrophobicContact CD1-CG 3.53Å; Y17-F71 AromaticContact CD1-CZ 3.67Å; Y17-F71 HydrophobicContact CD1-CZ 3.67Å; Y17-F71 AromaticContact CE1-CD1 3.27Å; Y17-F71 HydrophobicContact CE1-CD1 3.27Å; Y17-F71 HydrophobicContact CE1-CD2 4.16Å; Y17-F71 AromaticContact CE1-CE1 3.28Å; Y17-F71 HydrophobicContact CE1-CE1 3.28Å; Y17-F71 HydrophobicContact CE1-CE2 4.1Å; Y17-F71 AromaticContact CE1-CG 3.75Å; Y17-F71 HydrophobicContact CE1-CG 3.75Å; Y17-F71 AromaticContact CE1-CZ 3.71Å; Y17-F71 HydrophobicContact CE1-CZ 3.71Å; Y17-F71 HydrophobicContact CG-CD2 4.33Å; Y17-F71 HydrophobicContact CG-CG 4.29Å
18	T	62.3	Low	50.2	Low	32 Å²	32	85.2 Å²	85.2	20%	0.196	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124.2	178.7	-53.5	0	0	0	0	109.8	I41 L42 G60 L61 E63	T18-I41 HydrophobicContact CG2-CG2 3.31Å; T18-L42 WeakPolarHBondContact CA-O 3.39Å; T18-G60 VanDerWaalsContact O-CA 3.25Å; T18-G60 WeakPolarHBondContact O-CA 3.47Å; T18-L61 PolarHBondContact N-O 3.47Å; T18-L61 PolarHBondContact O-N 2.89Å; T18-E63 PolarHBondContact OG1-OE1 3.41Å
19	C	60.4	Low	50.9	Low	9 Å²	9	79.9 Å²	79.9	6%	0.061	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	164.9	178.1	55.7	0	0	0	0	111.7	I41 L42 L58	C19-I41 CarbonylContact O-C 3.15Å; C19-I41 WeakPolarHBondContact O-CA 3.48Å; C19-L42 PolarHBondContact N-O 3.23Å; C19-L42 PolarHBondContact O-N 3.16Å; C19-L58 HydrophobicContact CB-CB 4.47Å
20	I	55	Low	51.5	Low	113 Å²	113	77.7 Å²	77.7	58%	0.579	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.9	177.4	-62.7	172.9	0	0	0	108.3	D40 I41	I20-D40 CarbonylContact C-O 3.47Å; I20-D40 WeakPolarHBondContact CA-O 3.38Å; I20-I41 HydrophobicContact CG1-CG1 4.47Å
21	S	54.2	Low	51.7	Low	4 Å²	4	79.6 Å²	79.6	3%	0.028	41%	0.411	C	S	.	.			trans	-66.8	132.9	174.2	-178.4	0	0	0	0	110.4	F23 G39 D40	S21-F23 PolarHBondContact OG-N 3.03Å; S21-F23 PolarHBondContact OG-O 3.09Å; S21-G39 WeakPolarHBondContact O-CA 3.48Å; S21-G39 PolarHBondContact O-N 3.2Å; S21-D40 PolarHBondContact N-O 3.13Å
22	T	51.1	Low	51.7	Low	101 Å²	101	78.4 Å²	78.4	62%	0.62	40%	0.401	S	S	*	.			trans	-103.8	-4.5	170.2	50	0	0	0	0	112.6
23	F	50.5	Low	52.1	Low	139 Å²	139	82.8 Å²	82.8	61%	0.61	42%	0.415	S	S	*	.	S	Bend	trans	-116.9	147.3	-172.2	-59	-78.2	0	0	0	111.4	S21 R25	S21-F23 PolarHBondContact OG-N 3.03Å; S21-F23 PolarHBondContact OG-O 3.09Å; F23-R25 PolarHBondContact O-N 3.09Å
24	R	46.5	Very low	52.4	Low	204 Å²	204	77.5 Å²	77.5	77%	0.77	39%	0.391	S	S	*	.	S	Bend	trans	-68.4	-22	174.5	-89.9	-173.7	-176.1	-177	2.5	113.5	V36 P38	R24-V36 CarbonylContact C-O 3.51Å; R24-V36 WeakPolarHBondContact CA-O 3.3Å; R24-V36 PolarHBondContact O-N 3.44Å; R24-P38 HydrophobicContact CG-CG 3.59Å
25	R	49.7	Very low	52.5	Low	158 Å²	158	76.6 Å²	76.6	60%	0.596	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.5	130.4	179.7	-76.3	-176.6	173.5	172	0.5	109	F23 Y33 L34 D35	F23-R25 PolarHBondContact O-N 3.09Å; R25-Y33 HydrophobicContact CB-CD1 4.39Å; R25-L34 CarbonylContact C-O 3.59Å; R25-L34 WeakPolarHBondContact CA-O 3.48Å; R25-D35 VanDerWaalsContact CG-OD1 3.23Å; R25-D35 WeakPolarHBondContact CG-OD1 3.14Å; R25-D35 IonicContact CZ-OD1 3.82Å; R25-D35 IonicContact NE-OD1 3.93Å; R25-D35 PolarHBondContact NE-OD1 3.22Å; R25-D35 IonicContact NH2-OD1 2.82Å
26	T	52.6	Low	52.5	Low	22 Å²	22	76.2 Å²	76.2	14%	0.135	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	120	172.5	-57.1	0	0	0	0	108.4	L28 L34 V36	T26-L28 PolarHBondContact O-N 3.2Å; T26-L34 PolarHBondContact N-O 2.92Å; T26-L34 PolarHBondContact O-N 3.38Å; T26-V36 WeakPolarHBondContact OG1-CG2 3.11Å
27	P	49.2	Very low	52.3	Low	46 Å²	46	76.2 Å²	76.2	30%	0.299	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	133.4	175.4	-20	33.4	0	0	0	110.9	Y33 Y74	P27-Y33 HydrophobicContact CB-CD1 4.15Å; P27-Y33 HydrophobicContact CB-CE1 3.96Å; P27-Y33 HydrophobicContact CG-CD1 4.13Å; P27-Y33 HydrophobicContact CG-CE1 3.88Å; P27-Y74 HydrophobicContact CB-CE1 4Å; P27-Y74 WeakPolarHBondContact CD-OH 3.44Å; P27-Y74 HydrophobicContact CG-CE1 4.42Å; P27-Y74 WeakPolarHBondContact CG-OH 3.47Å
28	L	49.6	Very low	51.7	Low	25 Å²	25	78.5 Å²	78.5	13%	0.131	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-42.1	179	-65.2	168.1	0	0	0	111.6	T26 E32 L34 L86 A95 I97	T26-L28 PolarHBondContact O-N 3.2Å; L28-E32 HydrophobicContact CB-CB 4.25Å; L28-E32 WeakPolarHBondContact CB-O 3.45Å; L28-E32 HydrophobicContact CD1-CB 4.44Å; L28-E32 PolarHBondContact N-O 3.08Å; L28-L34 HydrophobicContact CD1-CB 3.89Å; L28-L34 HydrophobicContact CD2-CB 4.08Å; L28-L34 HydrophobicContact CG-CB 4.01Å; L28-L86 HydrophobicContact CD2-CB 4.33Å; L28-L86 HydrophobicContact CD2-CD1 3.76Å; L28-L86 HydrophobicContact CD2-CG 4.45Å; L28-A95 HydrophobicContact CD1-CB 3.53Å; L28-A95 HydrophobicContact CD2-CB 3.93Å; L28-A95 HydrophobicContact CG-CB 4.38Å; L28-I97 WeakPolarHBondContact O-CD1 3.47Å
29	S	42.2	Very low	51.2	Low	44 Å²	44	79.4 Å²	79.4	31%	0.308	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	-178	169.5	69.8	0	0	0	0	109.4	E31 E32	S29-E31 PolarHBondContact O-N 3.46Å; S29-E32 PolarHBondContact N-O 3.41Å; S29-E32 PolarHBondContact O-N 2.75Å
30	G	43.5	Very low	51.1	Low	76 Å²	76	79.8 Å²	79.8	78%	0.784	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.7	-26.7	-165.2	0	0	0	0	0	118.5
31	E	41	Very low	51.4	Low	185 Å²	185	77 Å²	77	86%	0.864	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.7	-0.9	173.2	-62.7	-166.3	158.6	0	0	115.6	S29	S29-E31 PolarHBondContact O-N 3.46Å
32	E	43.1	Very low	51.7	Low	118 Å²	118	76.9 Å²	76.9	55%	0.551	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	136.8	-179.7	-73.7	-167.5	163.9	0	0	113.1	L28 S29	L28-E32 HydrophobicContact CB-CB 4.25Å; L28-E32 WeakPolarHBondContact CB-O 3.45Å; L28-E32 HydrophobicContact CD1-CB 4.44Å; L28-E32 PolarHBondContact N-O 3.08Å; S29-E32 PolarHBondContact N-O 3.41Å; S29-E32 PolarHBondContact O-N 2.75Å
33	Y	56.1	Low	52.1	Low	132 Å²	132	72.9 Å²	72.9	52%	0.518	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	136.7	179.3	-65.4	-97.3	0	0	0	110.5	R25 P27	R25-Y33 HydrophobicContact CB-CD1 4.39Å; P27-Y33 HydrophobicContact CB-CD1 4.15Å; P27-Y33 HydrophobicContact CB-CE1 3.96Å; P27-Y33 HydrophobicContact CG-CD1 4.13Å; P27-Y33 HydrophobicContact CG-CE1 3.88Å
34	L	57.2	Low	52.5	Low	7 Å²	7	67.3 Å²	67.3	4%	0.037	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	116.2	166.3	-166.5	68.9	0	0	0	108.5	R25 T26 L28 V36 L42 R93 A95	R25-L34 CarbonylContact C-O 3.59Å; R25-L34 WeakPolarHBondContact CA-O 3.48Å; T26-L34 PolarHBondContact N-O 2.92Å; T26-L34 PolarHBondContact O-N 3.38Å; L28-L34 HydrophobicContact CD1-CB 3.89Å; L28-L34 HydrophobicContact CD2-CB 4.08Å; L28-L34 HydrophobicContact CG-CB 4.01Å; L34-V36 HydrophobicContact CB-CG2 4.42Å; L34-V36 HydrophobicContact CD2-CG2 4.35Å; L34-V36 HydrophobicContact CG-CG2 4.3Å; L34-V36 VanDerWaalsContact O-CG2 3.28Å; L34-V36 WeakPolarHBondContact O-CG2 3.4Å; L34-V36 PolarHBondContact O-N 3Å; L34-L42 HydrophobicContact CD2-CD2 4.04Å; L34-R93 HydrophobicContact CD1-CB 3.92Å; L34-A95 HydrophobicContact CD1-CB 4.44Å
35	D	57.5	Low	53	Low	69 Å²	69	60.6 Å²	60.6	37%	0.369	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	124.6	168	-72	-47.2	0	0	0	109.1	R25	R25-D35 VanDerWaalsContact CG-OD1 3.23Å; R25-D35 WeakPolarHBondContact CG-OD1 3.14Å; R25-D35 IonicContact CZ-OD1 3.82Å; R25-D35 IonicContact NE-OD1 3.93Å; R25-D35 PolarHBondContact NE-OD1 3.22Å; R25-D35 IonicContact NH2-OD1 2.82Å
36	V	56.5	Low	53.3	Low	5 Å²	5	54.3 Å²	54.3	3%	0.03	31%	0.312	C	S	.	.			trans	-135	145.8	-178.8	-135.9	0	0	0	0	110.1	R24 T26 L34 D40 L42	R24-V36 CarbonylContact C-O 3.51Å; R24-V36 WeakPolarHBondContact CA-O 3.3Å; R24-V36 PolarHBondContact O-N 3.44Å; T26-V36 WeakPolarHBondContact OG1-CG2 3.11Å; L34-V36 HydrophobicContact CB-CG2 4.42Å; L34-V36 HydrophobicContact CD2-CG2 4.35Å; L34-V36 HydrophobicContact CG-CG2 4.3Å; L34-V36 VanDerWaalsContact O-CG2 3.28Å; L34-V36 WeakPolarHBondContact O-CG2 3.4Å; L34-V36 PolarHBondContact O-N 3Å; V36-D40 HydrophobicContact CG1-CB 3.91Å; V36-D40 WeakPolarHBondContact CG1-OD2 3.17Å; V36-L42 HydrophobicContact CG1-CD2 3.71Å; V36-L42 HydrophobicContact CG1-CG 4.34Å; V36-L42 HydrophobicContact CG2-CD2 4.39Å
37	I	57.4	Low	53.2	Low	95 Å²	95	61.8 Å²	61.8	49%	0.487	34%	0.337	S	S	.	.			trans	-78.2	137.6	173.8	-53.2	175.2	0	0	0	108.5	G39 D40	I37-G39 PolarHBondContact O-N 2.91Å; I37-D40 HydrophobicContact CB-CB 4.31Å; I37-D40 WeakPolarHBondContact O-CB 3.5Å; I37-D40 PolarHBondContact O-N 3.49Å
38	P	50.8	Low	53.2	Low	64 Å²	64	60.6 Å²	60.6	42%	0.416	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	127.9	168.6	-23.2	33.7	0	0	0	110.4	R24	R24-P38 HydrophobicContact CG-CG 3.59Å
39	G	51.8	Low	52.7	Low	51 Å²	51	67.4 Å²	67.4	53%	0.526	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-2.1	-171.4	0	0	0	0	0	114.6	S21 I37	S21-G39 WeakPolarHBondContact O-CA 3.48Å; S21-G39 PolarHBondContact O-N 3.2Å; I37-G39 PolarHBondContact O-N 2.91Å
40	D	58.2	Low	52.5	Low	18 Å²	18	71.5 Å²	71.5	10%	0.096	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-73.7	148.7	179.8	-168.3	27.2	0	0	0	112.8	I20 S21 V36 I37 S88 S90	I20-D40 CarbonylContact C-O 3.47Å; I20-D40 WeakPolarHBondContact CA-O 3.38Å; S21-D40 PolarHBondContact N-O 3.13Å; V36-D40 HydrophobicContact CG1-CB 3.91Å; V36-D40 WeakPolarHBondContact CG1-OD2 3.17Å; I37-D40 HydrophobicContact CB-CB 4.31Å; I37-D40 WeakPolarHBondContact O-CB 3.5Å; I37-D40 PolarHBondContact O-N 3.49Å; D40-S88 PolarHBondContact OD2-OG 3.48Å; D40-S90 VanDerWaalsContact CG-N 3.3Å; D40-S90 WeakPolarHBondContact OD1-CA 3.4Å; D40-S90 WeakPolarHBondContact OD1-CB 3.41Å; D40-S90 PolarHBondContact OD1-N 2.82Å; D40-S90 PolarHBondContact OD1-OG 2.72Å; D40-S90 WeakPolarHBondContact OD2-CB 3.34Å; D40-S90 PolarHBondContact OD2-N 2.71Å; D40-S90 PolarHBondContact OD2-OG 3.34Å
41	I	61.2	Low	52.2	Low	53 Å²	53	68.8 Å²	68.8	27%	0.272	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	118.2	178.2	-60.2	176.2	0	0	0	108.7	T18 C19 I20 V43 K89	T18-I41 HydrophobicContact CG2-CG2 3.31Å; C19-I41 CarbonylContact O-C 3.15Å; C19-I41 WeakPolarHBondContact O-CA 3.48Å; I20-I41 HydrophobicContact CG1-CG1 4.47Å; I41-V43 HydrophobicContact CG2-CG2 4.43Å; I41-K89 HydrophobicContact CB-CB 3.98Å; I41-K89 HydrophobicContact CB-CD 3.85Å; I41-K89 HydrophobicContact CD1-CD 4.08Å; I41-K89 HydrophobicContact CG1-CD 4.46Å; I41-K89 HydrophobicContact CG2-CD 4.13Å; I41-K89 WeakPolarHBondContact O-CB 3.2Å; I41-K89 PolarHBondContact O-N 2.96Å
42	L	59.4	Low	51.8	Low	2 Å²	2	65.8 Å²	65.8	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	131.8	169.5	-69.2	172.2	0	0	0	109.1	T18 C19 L34 V36 R87	T18-L42 WeakPolarHBondContact CA-O 3.39Å; C19-L42 PolarHBondContact N-O 3.23Å; C19-L42 PolarHBondContact O-N 3.16Å; L34-L42 HydrophobicContact CD2-CD2 4.04Å; V36-L42 HydrophobicContact CG1-CD2 3.71Å; V36-L42 HydrophobicContact CG1-CG 4.34Å; V36-L42 HydrophobicContact CG2-CD2 4.39Å; L42-R87 WeakPolarHBondContact CA-O 3.36Å
43	V	60.5	Low	51.3	Low	17 Å²	17	62.2 Å²	62.2	10%	0.103	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.7	171.4	-178.9	0	0	0	0	107.8	R16 Y17 I41 R87	R16-V43 HydrophobicContact CG-CG1 3.76Å; R16-V43 VanDerWaalsContact NE-CG1 3.29Å; Y17-V43 CarbonylContact O-C 3.58Å; Y17-V43 WeakPolarHBondContact O-CA 3.41Å; I41-V43 HydrophobicContact CG2-CG2 4.43Å; V43-R87 HydrophobicContact CB-CB 4.43Å; V43-R87 PolarHBondContact N-O 2.99Å; V43-R87 PolarHBondContact O-N 3.21Å
44	V	59.1	Low	50.1	Low	22 Å²	22	60.4 Å²	60.4	13%	0.133	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	119.5	-179.7	-174.7	0	0	0	0	108	Y17 L84 L86	Y17-V44 PolarHBondContact N-O 3.13Å; Y17-V44 PolarHBondContact O-N 3.24Å; V44-L84 HydrophobicContact CG1-CD1 4.29Å; V44-L86 HydrophobicContact CG2-CD2 3.92Å; V44-L86 HydrophobicContact CG2-CG 4.37Å
45	E	56.4	Low	48.9	Very low	64 Å²	64	61.7 Å²	61.7	30%	0.299	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.7	173.6	-160.6	176.2	146.9	0	0	108.6	R47 Q85	E45-R47 IonicContact OE1-CZ 2.66Å; E45-R47 IonicContact OE1-NE 3.75Å; E45-R47 IonicContact OE1-NH2 2.85Å; E45-R47 PolarHBondContact OE1-NH2 3.11Å; E45-Q85 PolarHBondContact N-O 2.92Å; E45-Q85 VanDerWaalsContact N-O 3.16Å
46	C	55.5	Low	47.9	Very low	26 Å²	26	61.4 Å²	61.4	18%	0.176	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.5	-178.8	-162	0	0	0	0	109.3	G15 Y17 P48	G15-C46 PolarHBondContact N-O 2.96Å; G15-C46 PolarHBondContact O-N 2.97Å; Y17-C46 HydrophobicContact CD2-CB 4.28Å; Y17-C46 HydrophobicContact CE2-CB 3.96Å; C46-P48 WeakPolarHBondContact O-CD 3.47Å
47	R	51.6	Low	47.3	Very low	179 Å²	179	66.2 Å²	66.2	68%	0.675	37%	0.371	S	S	*	.			trans	-116.8	69.6	172.2	-62.7	-171.8	-175.8	177.3	3.3	111.2	E45	E45-R47 IonicContact OE1-CZ 2.66Å; E45-R47 IonicContact OE1-NE 3.75Å; E45-R47 IonicContact OE1-NH2 2.85Å; E45-R47 PolarHBondContact OE1-NH2 3.11Å
48	P	48.3	Very low	46.7	Very low	21 Å²	21	64.5 Å²	64.5	14%	0.136	36%	0.363	C	S	.	.			trans	-85.9	140.5	176	32.9	-27.3	0	0	0	110.9	I12 C46 A51	I12-P48 HydrophobicContact CG2-CG 4.19Å; C46-P48 WeakPolarHBondContact O-CD 3.47Å; P48-A51 HydrophobicContact CB-CB 4.32Å
49	Q	40	Very low	46.6	Very low	168 Å²	168	67.6 Å²	67.6	79%	0.785	37%	0.367	S	S	*	.	S	Bend	trans	-104.5	-7.4	164.2	-103.1	-174.8	3.1	0	0	114.1	F81	Q49-F81 HydrophobicContact CB-CD1 4.35Å
50	N	36.6	Very low	47	Very low	129 Å²	129	65.6 Å²	65.6	69%	0.69	35%	0.346	S	S	*	.	S	Bend	trans	173.9	120.5	155	-86.8	-25.6	0	0	0	107.4	F81	N50-F81 WeakPolarHBondContact O-CD2 3.4Å; N50-F81 WeakPolarHBondContact O-CE2 3.38Å
51	A	38.4	Very low	47	Very low	20 Å²	20	67.3 Å²	67.3	17%	0.165	36%	0.355	C	S	.	.			trans	-135	126.4	-176.5	0	0	0	0	0	111.4	I12 P48 V76	I12-A51 HydrophobicContact CD1-CB 4.5Å; P48-A51 HydrophobicContact CB-CB 4.32Å; A51-V76 HydrophobicContact CB-CG1 3.66Å
52	T	33	Very low	46.9	Very low	122 Å²	122	64.9 Å²	64.9	75%	0.748	34%	0.343	S	S	*	.			trans	-131.8	109.4	175.4	43.7	0	0	0	0	109.5
53	A	31.5	Very low	46.9	Very low	43 Å²	43	68 Å²	68	36%	0.355	36%	0.357	S	S	.	.			trans	-162.3	159.2	172.5	0	0	0	0	0	111.5
54	P	30.4	Very low	46.7	Very low	93 Å²	93	71.9 Å²	71.9	60%	0.604	38%	0.381	S	S	*	.			trans	-98.4	110.8	-165.1	33.9	-26.5	0	0	0	112.6	Y7	Y7-P54 HydrophobicContact CD1-CB 4.26Å; Y7-P54 HydrophobicContact CE1-CB 4.14Å; Y7-P54 HydrophobicContact CE1-CG 4.4Å
55	T	32.2	Very low	47.1	Very low	35 Å²	35	73.8 Å²	73.8	22%	0.215	39%	0.393	C	S	.	.			trans	-157.4	156.9	-175.6	40.1	0	0	0	0	115.2	Y74 C75	T55-Y74 WeakPolarHBondContact CB-O 3.44Å; T55-Y74 VanDerWaalsContact CG2-CB 3.5Å; T55-Y74 VanDerWaalsContact CG2-O 3.24Å; T55-Y74 WeakPolarHBondContact CG2-O 3.38Å; T55-Y74 PolarHBondContact OG1-O 3.4Å; T55-C75 HydrophobicContact CG2-CB 3.73Å
56	S	37.7	Very low	47.4	Very low	63 Å²	63	77.6 Å²	77.6	44%	0.441	41%	0.408	S	S	.	.			trans	-53.8	163.2	-177.5	48.7	0	0	0	0	114.2	A73 Y74	S56-A73 CarbonylContact C-O 3.55Å; S56-A73 PolarHBondContact N-O 3.25Å; S56-A73 CarbonylContact O-C 3.58Å; S56-A73 WeakPolarHBondContact O-CA 3.37Å; S56-A73 PolarHBondContact O-N 3.46Å; S56-A73 PolarHBondContact OG-O 3.26Å; S56-Y74 WeakPolarHBondContact OG-CD2 3.47Å
57	F	43.3	Very low	47.4	Very low	105 Å²	105	82.9 Å²	82.9	46%	0.461	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.7	-173.8	-61.9	-91.9	0	0	0	112.6	Y70 F71	F57-Y70 HydrophobicContact CB-CD1 3.86Å; F57-Y70 HydrophobicContact CB-CG 4.27Å; F57-F71 CarbonylContact C-O 3.47Å; F57-F71 VanDerWaalsContact CA-O 3.31Å; F57-F71 WeakPolarHBondContact CA-O 3.28Å
58	L	45	Very low	47.3	Very low	59 Å²	59	81.7 Å²	81.7	31%	0.309	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	117.9	161.3	-76.4	167.3	0	0	0	108.7	C19 G60 F71 A73	C19-L58 HydrophobicContact CB-CB 4.47Å; L58-G60 PolarHBondContact O-N 3.21Å; L58-F71 PolarHBondContact N-O 3.5Å; L58-F71 PolarHBondContact O-N 3.01Å; L58-A73 HydrophobicContact CB-CB 3.97Å; L58-A73 HydrophobicContact CD1-CB 3.4Å; L58-A73 VanDerWaalsContact CD1-CB 3.4Å; L58-A73 HydrophobicContact CG-CB 3.34Å
59	Y	49.1	Very low	47.3	Very low	130 Å²	130	81.6 Å²	81.6	51%	0.51	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	125.3	170.4	-171.3	-96.4	0	0	0	109.6	G69 Y70	Y59-G69 WeakPolarHBondContact CA-O 3.11Å; Y59-Y70 AromaticContact CD2-CD1 3.89Å; Y59-Y70 HydrophobicContact CD2-CD1 3.89Å; Y59-Y70 AromaticContact CD2-CD2 3.91Å; Y59-Y70 HydrophobicContact CD2-CD2 3.91Å; Y59-Y70 AromaticContact CD2-CE1 3.79Å; Y59-Y70 HydrophobicContact CD2-CE1 3.79Å; Y59-Y70 AromaticContact CD2-CE2 3.8Å; Y59-Y70 HydrophobicContact CD2-CE2 3.8Å; Y59-Y70 AromaticContact CD2-CG 3.96Å; Y59-Y70 HydrophobicContact CD2-CG 3.96Å; Y59-Y70 AromaticContact CD2-CZ 3.74Å; Y59-Y70 HydrophobicContact CE2-CD2 4.36Å; Y59-Y70 HydrophobicContact CE2-CE2 4.13Å; Y59-Y70 HydrophobicContact CG-CD1 4.44Å; Y59-Y70 HydrophobicContact CG-CE1 4.26Å
60	G	60.5	Low	47.6	Very low	8 Å²	8	80.2 Å²	80.2	8%	0.082	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	-168.4	-177.4	0	0	0	0	0	113.4	T18 L58 K68 G69 F71	T18-G60 VanDerWaalsContact O-CA 3.25Å; T18-G60 WeakPolarHBondContact O-CA 3.47Å; L58-G60 PolarHBondContact O-N 3.21Å; G60-K68 VanDerWaalsContact O-CA 3.29Å; G60-K68 WeakPolarHBondContact O-CA 3.49Å; G60-G69 PolarHBondContact N-O 3.4Å; G60-G69 PolarHBondContact O-N 2.97Å; G60-F71 VanDerWaalsContact C-CE2 3.41Å; G60-F71 VanDerWaalsContact O-CE2 3.29Å; G60-F71 WeakPolarHBondContact O-CE2 3.38Å
61	L	58.3	Low	48.3	Very low	54 Å²	54	75.8 Å²	75.8	28%	0.283	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.1	170.2	-178.1	75.3	0	0	0	109.7	Y17 T18 E63 K66 K68	Y17-L61 WeakPolarHBondContact CA-O 3.44Å; T18-L61 PolarHBondContact N-O 3.47Å; T18-L61 PolarHBondContact O-N 2.89Å; L61-E63 PolarHBondContact O-N 3.23Å; L61-K66 WeakPolarHBondContact CD1-O 3.38Å; L61-K68 HydrophobicContact CD1-CG 3.54Å
62	N	59.1	Low	48.5	Very low	3 Å²	3	77.2 Å²	77.2	2%	0.016	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	112.9	162.7	-175.8	-31.6	0	0	0	107.8	Y17 T64 T65 K66 H67 F71	Y17-N62 HydrophobicContact CD1-CB 3.88Å; Y17-N62 HydrophobicContact CE1-CB 3.65Å; Y17-N62 VanDerWaalsContact CE1-ND2 3.34Å; Y17-N62 WeakPolarHBondContact CE1-ND2 3.46Å; Y17-N62 PolarHBondContact OH-ND2 2.95Å; N62-T64 PolarHBondContact O-N 2.98Å; N62-T64 WeakPolarHBondContact OD1-CA 3.44Å; N62-T64 VanDerWaalsContact OD1-CB 3.22Å; N62-T64 WeakPolarHBondContact OD1-CB 3.45Å; N62-T64 PolarHBondContact OD1-N 3.38Å; N62-T64 PolarHBondContact OD1-OG1 3.09Å; N62-T65 VanDerWaalsContact CB-OG1 3.32Å; N62-T65 WeakPolarHBondContact CB-OG1 3.49Å; N62-T65 PolarHBondContact ND2-OG1 2.97Å; N62-T65 PolarHBondContact OD1-N 3.43Å; N62-T65 VanDerWaalsContact OD1-N 3.13Å; N62-K66 WeakPolarHBondContact O-CA 3.33Å; N62-K66 PolarHBondContact O-N 3.34Å; N62-H67 PolarHBondContact N-O 3.48Å; N62-F71 HydrophobicContact CB-CE1 4.17Å; N62-F71 HydrophobicContact CB-CZ 3.72Å
63	E	58.7	Low	48.7	Very low	67 Å²	67	72.1 Å²	72.1	31%	0.313	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-27.1	-177.3	-68.5	-163.3	142.4	0	0	112.5	R16 T18 L61 K66	R16-E63 VanDerWaalsContact CD-OE2 3.32Å; R16-E63 WeakPolarHBondContact CD-OE2 3.42Å; R16-E63 IonicContact CZ-OE2 3.22Å; R16-E63 IonicContact NE-OE2 3.73Å; R16-E63 IonicContact NH1-OE1 3.24Å; R16-E63 IonicContact NH1-OE2 2.71Å; R16-E63 PolarHBondContact NH1-OE2 2.96Å; R16-E63 PolarHBondContact O-N 3.5Å; T18-E63 PolarHBondContact OG1-OE1 3.41Å; L61-E63 PolarHBondContact O-N 3.23Å; E63-K66 WeakPolarHBondContact O-CD 3.48Å; E63-K66 WeakPolarHBondContact O-CE 3.48Å; E63-K66 PolarHBondContact O-NZ 2.96Å
64	T	56.2	Low	48.9	Very low	99 Å²	99	75.5 Å²	75.5	61%	0.607	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-49.5	-177.6	-7	0	0	0	0	111.8	N62	N62-T64 PolarHBondContact O-N 2.98Å; N62-T64 WeakPolarHBondContact OD1-CA 3.44Å; N62-T64 VanDerWaalsContact OD1-CB 3.22Å; N62-T64 WeakPolarHBondContact OD1-CB 3.45Å; N62-T64 PolarHBondContact OD1-N 3.38Å; N62-T64 PolarHBondContact OD1-OG1 3.09Å
65	T	68	Low	48.9	Very low	61 Å²	61	75.7 Å²	75.7	37%	0.374	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-8.1	-178.9	64.5	0	0	0	0	113.6	N62 H67	N62-T65 VanDerWaalsContact CB-OG1 3.32Å; N62-T65 WeakPolarHBondContact CB-OG1 3.49Å; N62-T65 PolarHBondContact ND2-OG1 2.97Å; N62-T65 PolarHBondContact OD1-N 3.43Å; N62-T65 VanDerWaalsContact OD1-N 3.13Å; T65-H67 PolarHBondContact O-N 2.91Å; T65-H67 PolarHBondContact OG1-N 3.23Å
66	K	61.5	Low	48.9	Very low	145 Å²	145	76 Å²	76	63%	0.63	38%	0.383	S	S	*	.			trans	57	9.8	-171.3	-55.5	-58	-175	-156.8	0	114.8	L61 N62 E63	L61-K66 WeakPolarHBondContact CD1-O 3.38Å; N62-K66 WeakPolarHBondContact O-CA 3.33Å; N62-K66 PolarHBondContact O-N 3.34Å; E63-K66 WeakPolarHBondContact O-CD 3.48Å; E63-K66 WeakPolarHBondContact O-CE 3.48Å; E63-K66 PolarHBondContact O-NZ 2.96Å
67	H	56.3	Low	48.6	Very low	136 Å²	136	76.9 Å²	76.9	63%	0.63	38%	0.382	S	S	*	.			trans	-78.9	130.8	174.7	-70.1	-56.3	0	0	0	111	N62 T65	N62-H67 PolarHBondContact N-O 3.48Å; T65-H67 PolarHBondContact O-N 2.91Å; T65-H67 PolarHBondContact OG1-N 3.23Å
68	K	48.6	Very low	48.2	Very low	155 Å²	155	73.9 Å²	73.9	67%	0.674	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	129.5	167.7	-66.5	-179.7	-179.1	177.4	0	108.3	G60 L61	G60-K68 VanDerWaalsContact O-CA 3.29Å; G60-K68 WeakPolarHBondContact O-CA 3.49Å; L61-K68 HydrophobicContact CD1-CG 3.54Å
69	G	48	Very low	47.8	Very low	19 Å²	19	80.8 Å²	80.8	20%	0.196	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	168.1	-174.1	0	0	0	0	0	113.2	Y59 G60 F71	Y59-G69 WeakPolarHBondContact CA-O 3.11Å; G60-G69 PolarHBondContact N-O 3.4Å; G60-G69 PolarHBondContact O-N 2.97Å; G69-F71 WeakPolarHBondContact O-CD2 3.41Å; G69-F71 VanDerWaalsContact O-CE2 3.3Å; G69-F71 WeakPolarHBondContact O-CE2 3.32Å; G69-F71 PolarHBondContact O-N 3.21Å
70	Y	47.5	Very low	47.3	Very low	138 Å²	138	82.2 Å²	82.2	54%	0.541	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	113.1	169.8	-71.7	-78.2	0	0	0	108.4	F57 Y59	F57-Y70 HydrophobicContact CB-CD1 3.86Å; F57-Y70 HydrophobicContact CB-CG 4.27Å; Y59-Y70 AromaticContact CD2-CD1 3.89Å; Y59-Y70 HydrophobicContact CD2-CD1 3.89Å; Y59-Y70 AromaticContact CD2-CD2 3.91Å; Y59-Y70 HydrophobicContact CD2-CD2 3.91Å; Y59-Y70 AromaticContact CD2-CE1 3.79Å; Y59-Y70 HydrophobicContact CD2-CE1 3.79Å; Y59-Y70 AromaticContact CD2-CE2 3.8Å; Y59-Y70 HydrophobicContact CD2-CE2 3.8Å; Y59-Y70 AromaticContact CD2-CG 3.96Å; Y59-Y70 HydrophobicContact CD2-CG 3.96Å; Y59-Y70 AromaticContact CD2-CZ 3.74Å; Y59-Y70 HydrophobicContact CE2-CD2 4.36Å; Y59-Y70 HydrophobicContact CE2-CE2 4.13Å; Y59-Y70 HydrophobicContact CG-CD1 4.44Å; Y59-Y70 HydrophobicContact CG-CE1 4.26Å
71	F	50.6	Low	46.1	Very low	36 Å²	36	85.3 Å²	85.3	16%	0.158	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	136.3	176.3	-55.8	-63.8	0	0	0	109.2	Y17 F57 L58 G60 N62 G69 A73	Y17-F71 HydrophobicContact CD1-CB 4.38Å; Y17-F71 AromaticContact CD1-CD1 3.57Å; Y17-F71 HydrophobicContact CD1-CD1 3.57Å; Y17-F71 AromaticContact CD1-CD2 3.55Å; Y17-F71 HydrophobicContact CD1-CD2 3.55Å; Y17-F71 AromaticContact CD1-CE1 3.67Å; Y17-F71 HydrophobicContact CD1-CE1 3.67Å; Y17-F71 AromaticContact CD1-CE2 3.58Å; Y17-F71 HydrophobicContact CD1-CE2 3.58Å; Y17-F71 AromaticContact CD1-CG 3.53Å; Y17-F71 HydrophobicContact CD1-CG 3.53Å; Y17-F71 AromaticContact CD1-CZ 3.67Å; Y17-F71 HydrophobicContact CD1-CZ 3.67Å; Y17-F71 AromaticContact CE1-CD1 3.27Å; Y17-F71 HydrophobicContact CE1-CD1 3.27Å; Y17-F71 HydrophobicContact CE1-CD2 4.16Å; Y17-F71 AromaticContact CE1-CE1 3.28Å; Y17-F71 HydrophobicContact CE1-CE1 3.28Å; Y17-F71 HydrophobicContact CE1-CE2 4.1Å; Y17-F71 AromaticContact CE1-CG 3.75Å; Y17-F71 HydrophobicContact CE1-CG 3.75Å; Y17-F71 AromaticContact CE1-CZ 3.71Å; Y17-F71 HydrophobicContact CE1-CZ 3.71Å; Y17-F71 HydrophobicContact CG-CD2 4.33Å; Y17-F71 HydrophobicContact CG-CG 4.29Å; F57-F71 CarbonylContact C-O 3.47Å; F57-F71 VanDerWaalsContact CA-O 3.31Å; F57-F71 WeakPolarHBondContact CA-O 3.28Å; L58-F71 PolarHBondContact N-O 3.5Å; L58-F71 PolarHBondContact O-N 3.01Å; G60-F71 VanDerWaalsContact C-CE2 3.41Å; G60-F71 VanDerWaalsContact O-CE2 3.29Å; G60-F71 WeakPolarHBondContact O-CE2 3.38Å; N62-F71 HydrophobicContact CB-CE1 4.17Å; N62-F71 HydrophobicContact CB-CZ 3.72Å; G69-F71 WeakPolarHBondContact O-CD2 3.41Å; G69-F71 VanDerWaalsContact O-CE2 3.3Å; G69-F71 WeakPolarHBondContact O-CE2 3.32Å; G69-F71 PolarHBondContact O-N 3.21Å; F71-A73 PolarHBondContact O-N 2.93Å
72	P	42.6	Very low	45.3	Very low	50 Å²	50	85.3 Å²	85.3	33%	0.325	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	128.7	179.4	21.1	-27.7	0	0	0	109.7	I12	I12-P72 HydrophobicContact CD1-CB 4.35Å; I12-P72 HydrophobicContact CD1-CG 3.33Å; I12-P72 HydrophobicContact CG1-CG 3.59Å
73	A	38.3	Very low	44.7	Very low	15 Å²	15	88.1 Å²	88.1	12%	0.124	45%	0.448	C	S	.	.			trans	-118.1	130	169.2	0	0	0	0	0	106	S56 L58 F71	S56-A73 CarbonylContact C-O 3.55Å; S56-A73 PolarHBondContact N-O 3.25Å; S56-A73 CarbonylContact O-C 3.58Å; S56-A73 WeakPolarHBondContact O-CA 3.37Å; S56-A73 PolarHBondContact O-N 3.46Å; S56-A73 PolarHBondContact OG-O 3.26Å; L58-A73 HydrophobicContact CB-CB 3.97Å; L58-A73 HydrophobicContact CD1-CB 3.4Å; L58-A73 VanDerWaalsContact CD1-CB 3.4Å; L58-A73 HydrophobicContact CG-CB 3.34Å; F71-A73 PolarHBondContact O-N 2.93Å
74	Y	34.6	Very low	44.4	Very low	115 Å²	115	86.7 Å²	86.7	45%	0.451	44%	0.442	S	S	.	.	S	Bend	trans	101.3	152	-178.2	-69.5	-99.7	0	0	0	116.9	P27 T55 S56 V76	P27-Y74 HydrophobicContact CB-CE1 4Å; P27-Y74 WeakPolarHBondContact CD-OH 3.44Å; P27-Y74 HydrophobicContact CG-CE1 4.42Å; P27-Y74 WeakPolarHBondContact CG-OH 3.47Å; T55-Y74 WeakPolarHBondContact CB-O 3.44Å; T55-Y74 VanDerWaalsContact CG2-CB 3.5Å; T55-Y74 VanDerWaalsContact CG2-O 3.24Å; T55-Y74 WeakPolarHBondContact CG2-O 3.38Å; T55-Y74 PolarHBondContact OG1-O 3.4Å; S56-Y74 WeakPolarHBondContact OG-CD2 3.47Å; Y74-V76 VanDerWaalsContact C-N 3.3Å; Y74-V76 PolarHBondContact O-N 2.84Å
75	C	31.4	Very low	44.3	Very low	96 Å²	96	84.2 Å²	84.2	65%	0.649	42%	0.424	S	S	*	.			trans	19.5	60.8	162	-59.1	0	0	0	0	115.5	T55	T55-C75 HydrophobicContact CG2-CB 3.73Å
76	V	31.3	Very low	43.7	Very low	43 Å²	43	82 Å²	82	26%	0.261	41%	0.41	S	S	.	.			trans	-61.5	135.2	148.6	177.2	0	0	0	0	105.8	A51 Y74 I78	A51-V76 HydrophobicContact CB-CG1 3.66Å; Y74-V76 VanDerWaalsContact C-N 3.3Å; Y74-V76 PolarHBondContact O-N 2.84Å; V76-I78 HydrophobicContact CB-CD1 4.25Å; V76-I78 HydrophobicContact CB-CG1 3.59Å; V76-I78 HydrophobicContact CG1-CG1 3.7Å; V76-I78 WeakPolarHBondContact O-CG1 3.44Å; V76-I78 PolarHBondContact O-N 2.79Å
77	D	31.3	Very low	43.4	Very low	81 Å²	81	79.4 Å²	79.4	43%	0.433	40%	0.396	S	S	.	.			trans	-71.4	78.5	165.6	-161.7	-9.4	0	0	0	107.4	R79	D77-R79 PolarHBondContact O-N 3.06Å; D77-R79 VanDerWaalsContact O-N 3.09Å; D77-R79 WeakPolarHBondContact OD1-CB 3.41Å; D77-R79 WeakPolarHBondContact OD1-CD 3.28Å; D77-R79 VanDerWaalsContact OD1-CG 3.23Å; D77-R79 WeakPolarHBondContact OD1-CG 3.3Å; D77-R79 IonicContact OD1-CZ 3.5Å; D77-R79 IonicContact OD1-NE 3.9Å; D77-R79 PolarHBondContact OD1-NE 3.48Å; D77-R79 IonicContact OD1-NH2 2.87Å; D77-R79 IonicContact OD2-CZ 3.71Å; D77-R79 IonicContact OD2-NE 2.76Å; D77-R79 PolarHBondContact OD2-NE 3.1Å; D77-R79 IonicContact OD2-NH2 3.61Å; D77-R79 PolarHBondContact OD2-NH2 2.77Å
78	I	35.8	Very low	43.5	Very low	41 Å²	41	72.9 Å²	72.9	21%	0.21	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-75.4	10.5	-175.5	-46.1	179.9	0	0	0	110.5	V76 E80 F81 G82 L84	V76-I78 HydrophobicContact CB-CD1 4.25Å; V76-I78 HydrophobicContact CB-CG1 3.59Å; V76-I78 HydrophobicContact CG1-CG1 3.7Å; V76-I78 WeakPolarHBondContact O-CG1 3.44Å; V76-I78 PolarHBondContact O-N 2.79Å; I78-E80 PolarHBondContact O-N 3.29Å; I78-F81 WeakPolarHBondContact CG2-O 3.16Å; I78-F81 PolarHBondContact O-N 2.98Å; I78-G82 WeakPolarHBondContact CG2-O 3.41Å; I78-L84 HydrophobicContact CD1-CB 4.3Å
79	R	37.2	Very low	43.8	Very low	204 Å²	204	72.2 Å²	72.2	77%	0.77	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-53.7	-22.8	179.8	-77.7	-172.9	-74.1	178.2	-1.5	113	D77	D77-R79 PolarHBondContact O-N 3.06Å; D77-R79 VanDerWaalsContact O-N 3.09Å; D77-R79 WeakPolarHBondContact OD1-CB 3.41Å; D77-R79 WeakPolarHBondContact OD1-CD 3.28Å; D77-R79 VanDerWaalsContact OD1-CG 3.23Å; D77-R79 WeakPolarHBondContact OD1-CG 3.3Å; D77-R79 IonicContact OD1-CZ 3.5Å; D77-R79 IonicContact OD1-NE 3.9Å; D77-R79 PolarHBondContact OD1-NE 3.48Å; D77-R79 IonicContact OD1-NH2 2.87Å; D77-R79 IonicContact OD2-CZ 3.71Å; D77-R79 IonicContact OD2-NE 2.76Å; D77-R79 PolarHBondContact OD2-NE 3.1Å; D77-R79 IonicContact OD2-NH2 3.61Å; D77-R79 PolarHBondContact OD2-NH2 2.77Å
80	E	36.8	Very low	44.1	Very low	160 Å²	160	73.1 Å²	73.1	75%	0.748	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-111	-3.4	177.5	-70.3	-173.5	170.4	0	0	115.7	I78	I78-E80 PolarHBondContact O-N 3.29Å
81	F	35.2	Very low	44.5	Very low	74 Å²	74	68.7 Å²	68.7	33%	0.325	35%	0.353	S	S	.	.	S	Bend	trans	-149.9	83	-161.6	-62.9	-75.4	0	0	0	116.9	Q49 N50 I78	Q49-F81 HydrophobicContact CB-CD1 4.35Å; N50-F81 WeakPolarHBondContact O-CD2 3.4Å; N50-F81 WeakPolarHBondContact O-CE2 3.38Å; I78-F81 WeakPolarHBondContact CG2-O 3.16Å; I78-F81 PolarHBondContact O-N 2.98Å
82	G	42.4	Very low	44.6	Very low	54 Å²	54	70.5 Å²	70.5	56%	0.557	37%	0.365	S	S	*	.			trans	65.8	153.1	152.9	0	0	0	0	0	118.6	I78	I78-G82 WeakPolarHBondContact CG2-O 3.41Å
83	S	47.2	Very low	44.9	Very low	61 Å²	61	75.2 Å²	75.2	43%	0.427	38%	0.376	S	S	.	.			trans	-71.5	141.3	-175.8	55.9	0	0	0	0	113.9
84	L	51.6	Low	45.5	Very low	38 Å²	38	77.3 Å²	77.3	20%	0.199	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	135.3	167	-168.5	80.5	0	0	0	110.5	V44 I78 L86 I97	V44-L84 HydrophobicContact CG1-CD1 4.29Å; I78-L84 HydrophobicContact CD1-CB 4.3Å; L84-L86 HydrophobicContact CD2-CD1 3.55Å; L84-L86 HydrophobicContact CD2-CG 4.48Å; L84-L86 HydrophobicContact CG-CD1 4.28Å; L84-I97 HydrophobicContact CD2-CD1 4.19Å; L84-I97 PolarHBondContact O-N 3.47Å
85	Q	53.9	Low	46.4	Very low	46 Å²	46	72.5 Å²	72.5	22%	0.215	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	117.9	175.8	-167.5	-179.8	5.8	0	0	110.8	E45 I94 Y96	E45-Q85 PolarHBondContact N-O 2.92Å; E45-Q85 VanDerWaalsContact N-O 3.16Å; Q85-I94 HydrophobicContact CG-CG2 3.47Å; Q85-I94 VanDerWaalsContact CG-CG2 3.47Å; Q85-Y96 HydrophobicContact CG-CD1 4.39Å; Q85-Y96 HydrophobicContact CG-CE1 4.02Å; Q85-Y96 PolarHBondContact NE2-OH 3.09Å
86	L	55.9	Low	47.3	Very low	16 Å²	16	74 Å²	74	8%	0.084	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.9	172.8	-81.1	119.5	0	0	0	110.4	L28 V44 L84 I94 A95 I97	L28-L86 HydrophobicContact CD2-CB 4.33Å; L28-L86 HydrophobicContact CD2-CD1 3.76Å; L28-L86 HydrophobicContact CD2-CG 4.45Å; V44-L86 HydrophobicContact CG2-CD2 3.92Å; V44-L86 HydrophobicContact CG2-CG 4.37Å; L84-L86 HydrophobicContact CD2-CD1 3.55Å; L84-L86 HydrophobicContact CD2-CG 4.48Å; L84-L86 HydrophobicContact CG-CD1 4.28Å; L86-I94 CarbonylContact O-C 3.56Å; L86-I94 WeakPolarHBondContact O-CA 3.35Å; L86-A95 PolarHBondContact N-O 2.95Å; L86-A95 VanDerWaalsContact N-O 3.15Å; L86-A95 PolarHBondContact O-N 3.06Å; L86-I97 HydrophobicContact CD1-CD1 4.29Å
87	R	55.1	Low	48.1	Very low	89 Å²	89	73 Å²	73	34%	0.336	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.8	179.3	-171.2	179.6	-153.7	159.4	7.9	111.3	L42 V43 D92 R93 I94	L42-R87 WeakPolarHBondContact CA-O 3.36Å; V43-R87 HydrophobicContact CB-CB 4.43Å; V43-R87 PolarHBondContact N-O 2.99Å; V43-R87 PolarHBondContact O-N 3.21Å; R87-D92 IonicContact CZ-OD1 3.56Å; R87-D92 IonicContact NE-OD1 3.85Å; R87-D92 PolarHBondContact NE-OD1 3.16Å; R87-D92 IonicContact NH2-OD1 3.19Å; R87-D92 PolarHBondContact NH2-OD1 3.49Å; R87-D92 IonicContact NH2-OD2 3.66Å; R87-R93 WeakPolarHBondContact CA-O 3.37Å; R87-I94 HydrophobicContact CB-CG1 4.41Å; R87-I94 HydrophobicContact CG-CG1 3.99Å
88	S	58.8	Low	48.6	Very low	0 Å²	0	75.7 Å²	75.7	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	128.2	167.1	156.6	0	0	0	0	110.1	D40 S90 T91 D92 R93	D40-S88 PolarHBondContact OD2-OG 3.48Å; S88-S90 PolarHBondContact OG-OG 2.95Å; S88-T91 WeakPolarHBondContact CB-OG1 3.44Å; S88-T91 PolarHBondContact OG-N 3.46Å; S88-T91 VanDerWaalsContact OG-N 3.13Å; S88-T91 PolarHBondContact OG-OG1 3.47Å; S88-D92 WeakPolarHBondContact O-CA 3.38Å; S88-D92 PolarHBondContact O-N 2.88Å; S88-R93 PolarHBondContact N-O 3.06Å; S88-R93 VanDerWaalsContact N-O 3.13Å
89	K	54.8	Low	48.7	Very low	140 Å²	140	80.3 Å²	80.3	61%	0.609	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-27.8	-179.8	-162.6	178.8	-175.7	177.7	0	112.6	I41	I41-K89 HydrophobicContact CB-CB 3.98Å; I41-K89 HydrophobicContact CB-CD 3.85Å; I41-K89 HydrophobicContact CD1-CD 4.08Å; I41-K89 HydrophobicContact CG1-CD 4.46Å; I41-K89 HydrophobicContact CG2-CD 4.13Å; I41-K89 WeakPolarHBondContact O-CB 3.2Å; I41-K89 PolarHBondContact O-N 2.96Å
90	S	53.2	Low	48.4	Very low	38 Å²	38	78.2 Å²	78.2	27%	0.266	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-39.7	177	67.8	0	0	0	0	113	D40 S88	D40-S90 VanDerWaalsContact CG-N 3.3Å; D40-S90 WeakPolarHBondContact OD1-CA 3.4Å; D40-S90 WeakPolarHBondContact OD1-CB 3.41Å; D40-S90 PolarHBondContact OD1-N 2.82Å; D40-S90 PolarHBondContact OD1-OG 2.72Å; D40-S90 WeakPolarHBondContact OD2-CB 3.34Å; D40-S90 PolarHBondContact OD2-N 2.71Å; D40-S90 PolarHBondContact OD2-OG 3.34Å; S88-S90 PolarHBondContact OG-OG 2.95Å
91	T	56	Low	48	Very low	45 Å²	45	75.8 Å²	75.8	28%	0.276	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-16.7	-177.7	66.9	0	0	0	0	112.8	S88 R93	S88-T91 WeakPolarHBondContact CB-OG1 3.44Å; S88-T91 PolarHBondContact OG-N 3.46Å; S88-T91 VanDerWaalsContact OG-N 3.13Å; S88-T91 PolarHBondContact OG-OG1 3.47Å; T91-R93 PolarHBondContact O-N 3.18Å; T91-R93 PolarHBondContact OG1-N 3.28Å
92	D	52.9	Low	47.6	Very low	74 Å²	74	79.9 Å²	79.9	40%	0.396	41%	0.41	S	S	.	.			trans	51.9	15	-167.9	-152.1	19.1	0	0	0	113.6	R87 S88 I94	R87-D92 IonicContact CZ-OD1 3.56Å; R87-D92 IonicContact NE-OD1 3.85Å; R87-D92 PolarHBondContact NE-OD1 3.16Å; R87-D92 IonicContact NH2-OD1 3.19Å; R87-D92 PolarHBondContact NH2-OD1 3.49Å; R87-D92 IonicContact NH2-OD2 3.66Å; S88-D92 WeakPolarHBondContact O-CA 3.38Å; S88-D92 PolarHBondContact O-N 2.88Å; D92-I94 PolarHBondContact O-N 3.29Å
93	R	49.8	Very low	46.7	Very low	150 Å²	150	83.3 Å²	83.3	57%	0.566	43%	0.425	S	S	*	.			trans	-69.4	128.7	172.9	-76.4	-170.5	176.5	179.7	0.9	108.9	L34 R87 S88 T91	L34-R93 HydrophobicContact CD1-CB 3.92Å; R87-R93 WeakPolarHBondContact CA-O 3.37Å; S88-R93 PolarHBondContact N-O 3.06Å; S88-R93 VanDerWaalsContact N-O 3.13Å; T91-R93 PolarHBondContact O-N 3.18Å; T91-R93 PolarHBondContact OG1-N 3.28Å
94	I	50.5	Low	45.6	Very low	58 Å²	58	89 Å²	89	30%	0.297	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.3	174.4	-60.2	174.2	0	0	0	106.4	Q85 L86 R87 D92 Y96	Q85-I94 HydrophobicContact CG-CG2 3.47Å; Q85-I94 VanDerWaalsContact CG-CG2 3.47Å; L86-I94 CarbonylContact O-C 3.56Å; L86-I94 WeakPolarHBondContact O-CA 3.35Å; R87-I94 HydrophobicContact CB-CG1 4.41Å; R87-I94 HydrophobicContact CG-CG1 3.99Å; D92-I94 PolarHBondContact O-N 3.29Å; I94-Y96 HydrophobicContact CB-CE2 4.14Å; I94-Y96 HydrophobicContact CG2-CD2 3.93Å; I94-Y96 HydrophobicContact CG2-CE1 4.18Å; I94-Y96 HydrophobicContact CG2-CE2 3.37Å
95	A	53.2	Low	44.1	Very low	15 Å²	15	92.4 Å²	92.4	12%	0.124	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	127.2	169	0	0	0	0	0	109	L28 L34 L86	L28-A95 HydrophobicContact CD1-CB 3.53Å; L28-A95 HydrophobicContact CD2-CB 3.93Å; L28-A95 HydrophobicContact CG-CB 4.38Å; L34-A95 HydrophobicContact CD1-CB 4.44Å; L86-A95 PolarHBondContact N-O 2.95Å; L86-A95 VanDerWaalsContact N-O 3.15Å; L86-A95 PolarHBondContact O-N 3.06Å
96	Y	51.5	Low	42.5	Very low	127 Å²	127	98.3 Å²	98.3	50%	0.498	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	120.1	172.1	-66.3	-86.8	0	0	0	108.3	Q85 I94	Q85-Y96 HydrophobicContact CG-CD1 4.39Å; Q85-Y96 HydrophobicContact CG-CE1 4.02Å; Q85-Y96 PolarHBondContact NE2-OH 3.09Å; I94-Y96 HydrophobicContact CB-CE2 4.14Å; I94-Y96 HydrophobicContact CG2-CD2 3.93Å; I94-Y96 HydrophobicContact CG2-CE1 4.18Å; I94-Y96 HydrophobicContact CG2-CE2 3.37Å
97	I	47.6	Very low	40.8	Very low	22 Å²	22	107 Å²	107	11%	0.113	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	106.8	173.5	-61.5	175.3	0	0	0	107.7	L28 L84 L86 F99	L28-I97 WeakPolarHBondContact O-CD1 3.47Å; L84-I97 HydrophobicContact CD2-CD1 4.19Å; L84-I97 PolarHBondContact O-N 3.47Å; L86-I97 HydrophobicContact CD1-CD1 4.29Å; I97-F99 HydrophobicContact CG2-CD2 3.55Å; I97-F99 HydrophobicContact CG2-CE2 3.16Å; I97-F99 HydrophobicContact CG2-CG 4.5Å; I97-F99 HydrophobicContact CG2-CZ 3.83Å
98	H	40.6	Very low	39.1	Very low	137 Å²	137	107.6 Å²	107.6	63%	0.634	57%	0.565	S	S	*	*			trans	-114	112.6	169	-70.4	-81.9	0	0	0	108.4
99	F	38.4	Very low	37.3	Very low	139 Å²	139	114.4 Å²	114.4	61%	0.61	61%	0.606	S	S	*	*			trans	-94.4	119.5	173.5	-74.7	-72.5	0	0	0	110.3	I97	I97-F99 HydrophobicContact CG2-CD2 3.55Å; I97-F99 HydrophobicContact CG2-CE2 3.16Å; I97-F99 HydrophobicContact CG2-CG 4.5Å; I97-F99 HydrophobicContact CG2-CZ 3.83Å
100	L	30	Very low	35.8	Very low	159 Å²	159	115.1 Å²	115.1	83%	0.832	62%	0.617	S	S	*	*			trans	-77.3	137.1	160.6	-90.1	89.6	0	0	0	109.3	N102	L100-N102 PolarHBondContact O-N 2.87Å
101	P	30.1	Very low	34.4	Very low	110 Å²	110	120.2 Å²	120.2	71%	0.714	65%	0.646	S	S	*	*	S	Bend	trans	-78	106.9	-178.2	30.5	-30	0	0	0	109
102	N	25.2	Very low	32.8	Very low	160 Å²	160	125.1 Å²	125.1	86%	0.856	67%	0.67	S	S	*	*			trans	139	99.7	150.5	-69	-22	0	0	0	112.8	L100	L100-N102 PolarHBondContact O-N 2.87Å
103	S	25.3	Very low	31.7	Very low	126 Å²	126	126.7 Å²	126.7	88%	0.881	69%	0.685	S	S	*	*			trans	-151.9	112.7	150.8	57.3	0	0	0	0	110.2
104	Q	23	Very low	30.3	Very low	180 Å²	180	129.1 Å²	129.1	84%	0.841	70%	0.703	S	S	*	*			trans	-85.7	150.1	-177.1	-72.7	177.5	-18	0	0	112.7
105	S	20.8	Very low	29.1	Very low	110 Å²	110	131.5 Å²	131.5	77%	0.769	72%	0.724	S	S	*	*			trans	9.6	124.6	154.8	63.2	0	0	0	0	119.5
106	I	20.6	Very low	27.7	Very low	169 Å²	169	138.6 Å²	138.6	87%	0.867	76%	0.759	S	S	*	*			trans	-132.1	122.9	158.4	-59	-179.7	0	0	0	109.9
107	K	19.1	Very low	26.3	Very low	199 Å²	199	137.3 Å²	137.3	87%	0.865	77%	0.769	S	S	*	*			trans	-87	152.9	177	-77.5	177.8	174.2	176.7	0	111
108	A	20.2	Very low	25	Very low	102 Å²	102	144.6 Å²	144.6	84%	0.843	80%	0.802	S	S	*	*			trans	-77.7	143.5	178.6	0	0	0	0	0	113.4
109	T	21.2	Very low	24.2	Very low	142 Å²	142	144.2 Å²	144.2	87%	0.871	81%	0.812	S	S	*	*			trans	-142.3	142.6	166.8	39.9	0	0	0	0	111.8
110	N	22.2	Very low	23.5	Very low	155 Å²	155	144 Å²	144	83%	0.829	82%	0.821	S	S	*	*			trans	-51.9	162.1	176.5	-63	-37.8	0	0	0	115.1
111	V	23.7	Very low	23.1	Very low	145 Å²	145	143.7 Å²	143.7	88%	0.879	82%	0.819	S	S	*	*				176.3	161.5	117.2	162.5	0	0	0	0	111.7
112	D	22.5	Very low	22.8	Very low	148 Å²	148	143.9 Å²	143.9	79%	0.791	82%	0.82	S	S	*	*			trans	-61.7	160.3	-147.1	-92.5	-45.8	0	0	0	123.2
113	P	29.2	Very low	22.8	Very low	108 Å²	108	142.2 Å²	142.2	70%	0.701	82%	0.818	S	S	*	*			trans	-104.2	103	174.1	35.6	-20.4	0	0	0	112.1
114	Q	22.2	Very low	22.9	Very low	201 Å²	201	147.9 Å²	147.9	94%	0.939	82%	0.82	S	S	*	*			trans	-163.9	67.6	160.3	-112.7	173.3	50	0	0	112.3
115	S	23.6	Very low	23	Very low	108 Å²	108	144.5 Å²	144.5	76%	0.755	82%	0.816	S	S	*	*			trans	-169.6	134.2	160.2	77.5	0	0	0	0	106.3
116	L	24.2	Very low	23.2	Very low	164 Å²	164	149.7 Å²	149.7	86%	0.859	82%	0.824	S	S	*	*			cis	-157.3	139.3	10.7	-100.5	133	0	0	0	107.3
117	S	22.1	Very low	23.3	Very low	99 Å²	99	152.5 Å²	152.5	69%	0.692	82%	0.824	S	S	*	*			trans	-85.6	161.1	165.3	47	0	0	0	0	110.8
118	Q	20.7	Very low	23.6	Very low	176 Å²	176	151 Å²	151	82%	0.822	83%	0.825	S	S	*	*			trans	91.8	109.8	166.2	-55.8	-170.1	-7.6	0	0	118.4
119	P	24.5	Very low	23.7	Very low	128 Å²	128	154 Å²	154	83%	0.831	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-94.4	127	163.8	23.7	-9.2	0	0	0	111.8
120	V	23.6	Very low	23.8	Very low	134 Å²	134	153.7 Å²	153.7	81%	0.812	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-85.7	132.6	177	173.3	0	0	0	0	110.2
121	I	22.1	Very low	23.7	Very low	154 Å²	154	153.5 Å²	153.5	79%	0.79	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-89.6	129.1	177.6	-63.2	171.4	0	0	0	110
122	P	22.9	Very low	23.7	Very low	113 Å²	113	152 Å²	152	73%	0.734	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-82.2	140.8	179.7	-11	27.6	0	0	0	113.9
123	P	25.6	Very low	23.8	Very low	125 Å²	125	150.6 Å²	150.6	81%	0.812	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-98.7	120.1	177.9	35.1	-27.2	0	0	0	111.3
124	R	26.9	Very low	24.1	Very low	245 Å²	245	151 Å²	151	93%	0.925	82%	0.817	S	S	*	*			trans	-140.9	88.6	156.6	-147.7	171.2	-179.2	153.7	-0.7	109.8
125	C	24.8	Very low	24.1	Very low	110 Å²	110	146.7 Å²	146.7	74%	0.743	81%	0.809	S	S	*	*			trans	30.1	111.6	146.2	-55.8	0	0	0	0	116.3
126	K	24.9	Very low	24	Very low	218 Å²	218	146.6 Å²	146.6	95%	0.948	81%	0.809	S	S	*	*				33.4	68.1	57.2	-84.5	-169.1	-178.7	179.6	0	112.6
127	R	23.6	Very low	24	Very low	229 Å²	229	146.3 Å²	146.3	86%	0.864	81%	0.807	S	S	*	*			trans	-157.7	104.4	150.3	-136.8	178.5	137.9	142.5	-2.7	108.9
128	L	25	Very low	24.1	Very low	167 Å²	167	148.6 Å²	148.6	87%	0.874	81%	0.811	S	S	*	*			trans	155.3	67	151.3	-80.3	160.4	0	0	0	108.3
129	L	21.9	Very low	24.1	Very low	164 Å²	164	145 Å²	145	86%	0.859	81%	0.805	S	S	*	*			trans	-73.8	126.1	146.1	-78.5	156.1	0	0	0	106.5
130	N	23.5	Very low	24	Very low	137 Å²	137	146.7 Å²	146.7	73%	0.733	81%	0.806	S	S	*	*			trans	-149.1	97.1	148.9	-95.9	-11.6	0	0	0	105.2
131	L	21.4	Very low	24	Very low	151 Å²	151	146 Å²	146	79%	0.791	80%	0.804	S	S	*	*				64.2	102.7	92.1	-86.6	139.7	0	0	0	112.5
132	S	23.3	Very low	23.8	Very low	114 Å²	114	149.3 Å²	149.3	80%	0.797	81%	0.808	S	S	*	*				172.2	105.8	115	54.7	0	0	0	0	111.5
133	S	24.2	Very low	23.8	Very low	118 Å²	118	151.3 Å²	151.3	83%	0.825	81%	0.813	S	S	*	*			trans	16	156.6	145.1	-39.6	0	0	0	0	123.9
134	P	34.7	Very low	23.7	Very low	116 Å²	116	149.7 Å²	149.7	75%	0.753	80%	0.804	S	S	*	*			trans	-105	165.2	-159.4	40.4	-29.9	0	0	0	113.9
135	S	22.2	Very low	23.3	Very low	111 Å²	111	148.6 Å²	148.6	78%	0.776	80%	0.801	S	S	*	*			trans	-152.6	107.7	159.9	-64.5	0	0	0	0	110.5
136	S	22.5	Very low	23.2	Very low	106 Å²	106	149 Å²	149	74%	0.741	81%	0.806	S	S	*	*			trans	60.1	119.4	131.4	-41	0	0	0	0	119.3
137	L	24.3	Very low	23.1	Very low	157 Å²	157	147.3 Å²	147.3	82%	0.822	80%	0.801	S	S	*	*			trans	154.2	84.9	132.2	-78.4	164	0	0	0	107.8
138	L	22.7	Very low	23	Very low	147 Å²	147	141.7 Å²	141.7	77%	0.77	80%	0.797	S	S	*	*				47.1	88.6	100.3	-71.8	163.5	0	0	0	111.8
139	S	21.6	Very low	22.7	Very low	102 Å²	102	139.9 Å²	139.9	71%	0.713	80%	0.797	S	S	*	*				55.9	98.8	90.2	68.7	0	0	0	0	114.2
140	I	22.8	Very low	22.8	Very low	163 Å²	163	137.9 Å²	137.9	84%	0.836	79%	0.791	S	S	*	*			trans	-109.7	128	159.6	-61	175.8	0	0	0	107
141	P	23.2	Very low	22.7	Very low	120 Å²	120	138.1 Å²	138.1	78%	0.779	79%	0.793	S	S	*	*			trans	-90.3	142.7	-165.8	23	-10.3	0	0	0	113.5
142	Y	18.2	Very low	22.5	Very low	223 Å²	223	138.6 Å²	138.6	88%	0.875	80%	0.795	S	S	*	*			trans	-64	134.3	154.7	-86.9	-103.3	0	0	0	110
143	N	23.6	Very low	22.5	Very low	155 Å²	155	138.7 Å²	138.7	83%	0.829	80%	0.796	S	S	*	*			trans	-157.6	117.4	142	-102.8	-17	0	0	0	113.2
144	S	22	Very low	22.3	Very low	91 Å²	91	139.1 Å²	139.1	64%	0.636	79%	0.793	S	S	*	*			trans	-3.8	132	145.4	25.3	0	0	0	0	121.3
145	Y	19.8	Very low	21.7	Very low	221 Å²	221	139.1 Å²	139.1	87%	0.867	80%	0.796	S	S	*	*				27.8	116.8	125.8	-72.1	-88.2	0	0	0	119.1
146	S	22.8	Very low	21.7	Very low	120 Å²	120	138.5 Å²	138.5	84%	0.839	79%	0.792	S	S	*	*				-171.6	143.5	124.2	46.9	0	0	0	0	112.1
147	H	21.6	Very low	21.7	Very low	181 Å²	181	141.6 Å²	141.6	84%	0.838	79%	0.794	S	S	*	*			trans	-72.9	135.7	174.4	-73.7	-92.1	0	0	0	111.5
148	S	22.9	Very low	21.7	Very low	112 Å²	112	140.5 Å²	140.5	78%	0.783	79%	0.789	S	S	*	*				164	122.8	124.2	47.7	0	0	0	0	110.3
149	C	18.3	Very low	21.9	Very low	129 Å²	129	141.8 Å²	141.8	87%	0.872	80%	0.795	S	S	*	*			trans	-84	120.2	168.4	-57.2	0	0	0	0	108.1
150	T	22.5	Very low	22	Very low	121 Å²	121	144.9 Å²	144.9	74%	0.742	80%	0.803	S	S	*	*			trans	-163.2	115.9	149.1	19.6	0	0	0	0	110.5
151	N	21.3	Very low	22.5	Very low	143 Å²	143	142 Å²	142	77%	0.765	80%	0.795	S	S	*	*			trans	52	117.5	143	-65.3	-18.8	0	0	0	121.5
152	L	19	Very low	22.6	Very low	160 Å²	160	145.1 Å²	145.1	84%	0.838	80%	0.799	S	S	*	*			trans	33	117.8	133.1	-92.5	83.1	0	0	0	117.8
153	S	22.2	Very low	22.8	Very low	116 Å²	116	143.5 Å²	143.5	81%	0.811	80%	0.799	S	S	*	*				-153.8	120.5	120.7	43.4	0	0	0	0	110.5
154	V	19.3	Very low	23	Very low	127 Å²	127	143.9 Å²	143.9	77%	0.77	80%	0.799	S	S	*	*			trans	-66.9	126.9	169	173.2	0	0	0	0	107.6
155	S	23.7	Very low	23.1	Very low	117 Å²	117	148.4 Å²	148.4	82%	0.818	81%	0.811	S	S	*	*			trans	-118.7	118	161.7	40.2	0	0	0	0	108.9
156	S	20.6	Very low	23.2	Very low	98 Å²	98	147 Å²	147	69%	0.685	81%	0.809	S	S	*	*			trans	-77.1	139.2	175.7	-45.5	0	0	0	0	110.1
157	Q	23.6	Very low	23.2	Very low	170 Å²	170	146.6 Å²	146.6	79%	0.794	81%	0.805	S	S	*	*				154.4	119	128.6	-85.8	178.5	-27.3	0	0	111.8
158	D	23.1	Very low	23.2	Very low	134 Å²	134	145.3 Å²	145.3	72%	0.717	80%	0.804	S	S	*	*			trans	55.7	109.5	132.9	-52.8	-31.4	0	0	0	119.4
159	I	28.5	Very low	23.4	Very low	175 Å²	175	145.3 Å²	145.3	90%	0.897	80%	0.799	S	S	*	*				-170.9	140.1	109.2	-84.1	147.9	0	0	0	109.7
160	L	23.2	Very low	23.8	Very low	166 Å²	166	144.1 Å²	144.1	87%	0.869	79%	0.792	S	S	*	*			trans	-65	177.5	-169.6	-101	129.8	0	0	0	116.4
161	P	33	Very low	23.9	Very low	104 Å²	104	144.3 Å²	144.3	68%	0.675	79%	0.793	S	S	*	*				-116	161.1	-121.6	41.6	-27.5	0	0	0	114
162	H	25.6	Very low	24.2	Very low	185 Å²	185	142.1 Å²	142.1	86%	0.856	79%	0.787	S	S	*	*			trans	-126.7	120.7	155.5	-118.3	-77.1	0	0	0	109.3	I164	H162-I164 PolarHBondContact O-N 3.24Å
163	E	22.4	Very low	24.6	Very low	189 Å²	189	140.9 Å²	140.9	88%	0.883	79%	0.786	S	S	*	*			trans	-55.2	115.1	175.8	-66.2	173.1	135.3	0	0	110.7
164	I	27.1	Very low	25	Very low	162 Å²	162	142.5 Å²	142.5	83%	0.831	79%	0.785	S	S	*	*			trans	-121.6	120.4	156.4	-60.8	179	0	0	0	106.3	H162 K166	H162-I164 PolarHBondContact O-N 3.24Å; I164-K166 PolarHBondContact O-N 2.92Å
165	Q	24.3	Very low	26	Very low	187 Å²	187	140.3 Å²	140.3	87%	0.874	78%	0.775	S	S	*	*			trans	-43.7	124.8	-175.8	-79.8	166.9	-33.6	0	0	112.4	C167	Q165-C167 PolarHBondContact O-N 3.35Å
166	K	21.2	Very low	27	Very low	190 Å²	190	143.2 Å²	143.2	83%	0.826	77%	0.77	S	S	*	*			trans	-61.4	95.3	168.1	-69.4	175.7	177.5	176	0	109.5	I164 N168	I164-K166 PolarHBondContact O-N 2.92Å; K166-N168 PolarHBondContact O-N 3.41Å
167	C	22.9	Very low	29.1	Very low	113 Å²	113	146.4 Å²	146.4	76%	0.764	77%	0.767	S	S	*	*			trans	-72.1	100.5	151.2	-72.8	0	0	0	0	107	Q165 V169	Q165-C167 PolarHBondContact O-N 3.35Å; C167-V169 HydrophobicContact CB-CG2 4.47Å; C167-V169 PolarHBondContact O-N 3.42Å
168	N	22.8	Very low	31.2	Very low	153 Å²	153	142.4 Å²	142.4	82%	0.818	76%	0.757	S	S	*	*			trans	-61	81.8	163.6	-83.2	-18.3	0	0	0	108.6	K166	K166-N168 PolarHBondContact O-N 3.41Å
169	V	26.9	Very low	34	Very low	112 Å²	112	137.1 Å²	137.1	68%	0.679	73%	0.728	S	S	*	*			trans	-95.9	99	158.7	-174.7	0	0	0	0	105.2	C167 V171	C167-V169 HydrophobicContact CB-CG2 4.47Å; C167-V169 PolarHBondContact O-N 3.42Å; V169-V171 PolarHBondContact O-N 2.88Å
170	S	26.6	Very low	36.7	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	71%	0.71	S	S	*	*			trans	-44.6	112.2	161.6	45.3	0	0	0	0	108.3	P172	S170-P172 WeakPolarHBondContact O-CD 3.3Å
171	V	25.7	Very low	39.9	Very low	125 Å²	125	128.5 Å²	128.5	76%	0.758	68%	0.678	S	S	*	*			trans	-54.1	111	174.7	178.7	0	0	0	0	106.9	V169 T173	V169-V171 PolarHBondContact O-N 2.88Å; V171-T173 PolarHBondContact O-N 3.24Å; V171-T173 VanDerWaalsContact O-N 3.13Å
172	P	26.3	Very low	42.6	Very low	98 Å²	98	126.7 Å²	126.7	64%	0.636	67%	0.665	S	S	*	*			trans	-65.1	121.1	170.4	-9.4	25.5	0	0	0	105.3	S170 L174	S170-P172 WeakPolarHBondContact O-CD 3.3Å; P172-L174 VanDerWaalsContact C-N 3.34Å; P172-L174 PolarHBondContact O-N 3.5Å
173	T	26.8	Very low	45.8	Very low	134 Å²	134	121.8 Å²	121.8	82%	0.822	65%	0.645	S	S	*	*			trans	-49.2	103.1	163.6	32.6	0	0	0	0	107.4	V171 S175	V171-T173 PolarHBondContact O-N 3.24Å; V171-T173 VanDerWaalsContact O-N 3.13Å; T173-S175 VanDerWaalsContact C-N 3.32Å; T173-S175 PolarHBondContact O-N 3.36Å
174	L	32.3	Very low	49.1	Very low	149 Å²	149	113 Å²	113	78%	0.78	60%	0.604	S	S	*	*			trans	-58.8	97.2	176.8	-89.5	115	0	0	0	107.8	P172 Y176	P172-L174 VanDerWaalsContact C-N 3.34Å; P172-L174 PolarHBondContact O-N 3.5Å; L174-Y176 VanDerWaalsContact C-N 3.35Å; L174-Y176 PolarHBondContact O-N 3.27Å
175	S	39.5	Very low	52.2	Low	82 Å²	82	105.2 Å²	105.2	57%	0.573	57%	0.565	S	S	*	*			trans	-64.9	103.3	160.5	69.5	0	0	0	0	105.8	T173 R177	T173-S175 VanDerWaalsContact C-N 3.32Å; T173-S175 PolarHBondContact O-N 3.36Å; S175-R177 PolarHBondContact O-N 2.94Å
176	Y	45.8	Very low	55.4	Low	178 Å²	178	96.3 Å²	96.3	70%	0.698	52%	0.523	S	S	*	.			trans	-54.8	98.3	174.1	-83.7	-94.8	0	0	0	109.1	L174	L174-Y176 VanDerWaalsContact C-N 3.35Å; L174-Y176 PolarHBondContact O-N 3.27Å
177	R	62.9	Low	58.6	Low	164 Å²	164	87.4 Å²	87.4	62%	0.619	49%	0.485	S	S	*	.			trans	-119.2	-22.9	176.8	-71	-167.3	179.2	-161.2	0.5	113.7	S175 C232	S175-R177 PolarHBondContact O-N 2.94Å; R177-C232 PolarHBondContact O-N 3.44Å
178	C	69.4	Low	61.8	Low	87 Å²	87	84.5 Å²	84.5	59%	0.588	46%	0.458	S	S	*	.	S	Bend	trans	-99.6	140.1	-176.3	-52.4	0	0	0	0	112.1
179	H	81.3	Confident	65.1	Low	23 Å²	23	77.4 Å²	77.4	11%	0.106	42%	0.42	C	S	.	.			trans	-68.5	138.3	172.4	-71.4	-82.2	0	0	0	111.8	F181 C209 C212 F230 C232	H179-F181 HydrophobicContact CB-CD1 4.17Å; H179-F181 HydrophobicContact CB-CD2 4.22Å; H179-F181 HydrophobicContact CB-CE1 3.55Å; H179-F181 HydrophobicContact CB-CE2 3.63Å; H179-F181 HydrophobicContact CB-CG 4.47Å; H179-F181 HydrophobicContact CB-CZ 3.26Å; H179-F181 AromaticContact CG-CE1 3.92Å; H179-F181 AromaticContact CG-CZ 3.67Å; H179-C209 HydrophobicContact CB-CB 4.43Å; H179-C209 PolarHBondContact ND1-SG 3.21Å; H179-C212 PolarHBondContact CE1-SG 3.41Å; H179-C212 PolarHBondContact ND1-SG 3.06Å; H179-C212 VanDerWaalsContact ND1-SG 3.39Å; H179-F230 PolarHBondContact CD2-O 3.16Å; H179-F230 AromaticContact NE2-CD1 3.55Å; H179-F230 PolarHBondContact NE2-O 3.39Å; H179-F230 VanDerWaalsContact NE2-O 3.14Å; H179-C232 HydrophobicContact CB-CB 4.47Å; H179-C232 VanDerWaalsContact CE1-CA 3.41Å; H179-C232 WeakPolarHBondContact CE1-CA 3.28Å; H179-C232 WeakPolarHBondContact ND1-CB 3.46Å; H179-C232 PolarHBondContact NE2-N 2.84Å
180	Q	85	Confident	68.2	Low	111 Å²	111	73 Å²	73	52%	0.519	39%	0.393	S	S	.	.			trans	-97	107.4	166.1	-69.3	-178	-15	0	0	109.4	C209 F210	Q180-C209 CarbonylContact O-C 3.46Å; Q180-C209 VanDerWaalsContact O-CA 3.24Å; Q180-C209 WeakPolarHBondContact O-CA 3.49Å; Q180-F210 HydrophobicContact CB-CB 4.28Å; Q180-F210 PolarHBondContact O-N 3.27Å
181	F	90.9	Very high	71.4	Confident	49 Å²	49	70.6 Å²	70.6	22%	0.215	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	145.9	-174.6	-65.5	-58.5	0	0	0	113.3	H179 N207 R208 C209 F216 A221	H179-F181 HydrophobicContact CB-CD1 4.17Å; H179-F181 HydrophobicContact CB-CD2 4.22Å; H179-F181 HydrophobicContact CB-CE1 3.55Å; H179-F181 HydrophobicContact CB-CE2 3.63Å; H179-F181 HydrophobicContact CB-CG 4.47Å; H179-F181 HydrophobicContact CB-CZ 3.26Å; H179-F181 AromaticContact CG-CE1 3.92Å; H179-F181 AromaticContact CG-CZ 3.67Å; F181-N207 HydrophobicContact CB-CB 4.03Å; F181-N207 HydrophobicContact CD1-CB 3.9Å; F181-N207 HydrophobicContact CG-CB 4.02Å; F181-R208 WeakPolarHBondContact CA-O 3.25Å; F181-C209 HydrophobicContact CD1-CB 4.18Å; F181-C209 HydrophobicContact CE1-CB 4.13Å; F181-F216 HydrophobicContact CD1-CD2 4.38Å; F181-F216 AromaticContact CE1-CD2 3.45Å; F181-F216 HydrophobicContact CE1-CD2 3.45Å; F181-F216 VanDerWaalsContact CE1-CD2 3.45Å; F181-F216 AromaticContact CE1-CE2 3.65Å; F181-F216 HydrophobicContact CE1-CE2 3.65Å; F181-F216 HydrophobicContact CE1-CG 4.3Å; F181-F216 HydrophobicContact CZ-CD2 4.06Å; F181-F216 HydrophobicContact CZ-CE2 4.16Å; F181-A221 HydrophobicContact CD1-CB 4.42Å; F181-A221 HydrophobicContact CD2-CB 4.02Å; F181-A221 HydrophobicContact CE1-CB 4.22Å; F181-A221 HydrophobicContact CE2-CB 3.78Å; F181-A221 HydrophobicContact CG-CB 4.33Å; F181-A221 HydrophobicContact CZ-CB 3.88Å
182	V	90	Very high	74.6	Confident	65 Å²	65	64.7 Å²	64.7	39%	0.394	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	133	167.5	177	0	0	0	0	108.2	N207 R208 T265	V182-N207 WeakPolarHBondContact O-CA 3.36Å; V182-R208 PolarHBondContact N-O 3.03Å; V182-R208 PolarHBondContact O-N 3.23Å; V182-T265 HydrophobicContact CG1-CG2 4.13Å
183	N	92.4	Very high	77.7	Confident	82 Å²	82	62.8 Å²	62.8	44%	0.439	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	131.7	174.8	-73.2	22.5	0	0	0	110.4	C204 A206 N207	N183-C204 HydrophobicContact CB-CB 4.27Å; N183-C204 WeakPolarHBondContact CB-O 3.27Å; N183-C204 PolarHBondContact ND2-O 2.97Å; N183-A206 CarbonylContact C-O 3.48Å; N183-A206 VanDerWaalsContact CA-O 3.31Å; N183-A206 WeakPolarHBondContact CA-O 3.3Å; N183-N207 PolarHBondContact OD1-OD1 3.46Å
184	V	91.3	Very high	80.7	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.024	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	150.1	-176.7	-64.6	0	0	0	0	111.1	V186 C204 N205 A206 R208 I215 I263 S264 T265	V184-V186 HydrophobicContact CG2-CG2 4.36Å; V184-C204 CarbonylContact O-C 3.58Å; V184-C204 WeakPolarHBondContact O-CA 3.41Å; V184-N205 PolarHBondContact O-N 2.99Å; V184-A206 HydrophobicContact CG2-CB 4.1Å; V184-A206 WeakPolarHBondContact CG2-O 3.46Å; V184-A206 PolarHBondContact N-O 3.36Å; V184-A206 PolarHBondContact O-N 3.47Å; V184-A206 VanDerWaalsContact O-N 3.09Å; V184-R208 HydrophobicContact CG1-CB 4.02Å; V184-R208 HydrophobicContact CG2-CB 4Å; V184-I215 HydrophobicContact CG2-CD1 4.35Å; V184-I263 HydrophobicContact CB-CG2 3.69Å; V184-I263 HydrophobicContact CG1-CG2 3.85Å; V184-I263 HydrophobicContact CG2-CG2 3.86Å; V184-S264 CarbonylContact C-O 3.36Å; V184-S264 WeakPolarHBondContact CA-O 3.4Å; V184-S264 VanDerWaalsContact CB-O 3.22Å; V184-S264 WeakPolarHBondContact CB-O 3.34Å; V184-T265 HydrophobicContact CG1-CG2 4.27Å
185	S	91.4	Very high	83.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	153.8	163.6	74.5	0	0	0	0	110.1	R203 I263 S264 T266 Q268	S185-R203 WeakPolarHBondContact CA-O 3.42Å; S185-I263 WeakPolarHBondContact O-CA 3.47Å; S185-S264 PolarHBondContact N-O 2.99Å; S185-S264 PolarHBondContact O-N 3.47Å; S185-S264 VanDerWaalsContact O-N 3.08Å; S185-T266 PolarHBondContact OG-O 3.49Å; S185-Q268 VanDerWaalsContact OG-CG 3.29Å; S185-Q268 WeakPolarHBondContact OG-CG 3.27Å; S185-Q268 PolarHBondContact OG-OE1 3.48Å
186	V	92	Very high	85.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	102.5	-175.2	-178.5	0	0	0	0	108.8	V184 Y188 L190 I199 T201 A206 I215	V184-V186 HydrophobicContact CG2-CG2 4.36Å; V186-Y188 WeakPolarHBondContact CG1-O 3.28Å; V186-L190 HydrophobicContact CG1-CB 4.2Å; V186-L190 HydrophobicContact CG1-CD1 3.92Å; V186-L190 HydrophobicContact CG1-CG 3.9Å; V186-I199 HydrophobicContact CB-CG2 4.17Å; V186-I199 HydrophobicContact CG1-CG2 4.48Å; V186-I199 VanDerWaalsContact CG1-O 3.25Å; V186-I199 WeakPolarHBondContact CG1-O 3.35Å; V186-I199 HydrophobicContact CG2-CG2 3.92Å; V186-T201 CarbonylContact C-O 3.49Å; V186-T201 PolarHBondContact N-O 3.37Å; V186-T201 CarbonylContact O-C 3.2Å; V186-T201 PolarHBondContact O-N 2.97Å; V186-T201 VanDerWaalsContact O-O 3.14Å; V186-A206 HydrophobicContact CG2-CB 4.04Å; V186-I215 HydrophobicContact CG2-CD1 3.56Å
187	S	89.2	Confident	88.1	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.021	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-16	-178	58.3	0	0	0	0	114.2	S262 Q268 Q277	S187-S262 PolarHBondContact N-O 3.21Å; S187-S262 VanDerWaalsContact N-O 3.1Å; S187-S262 PolarHBondContact OG-O 3.3Å; S187-Q268 VanDerWaalsContact CB-OE1 3.3Å; S187-Q268 PolarHBondContact OG-NE2 2.97Å; S187-Q268 PolarHBondContact OG-OE1 3.11Å; S187-Q277 PolarHBondContact OG-NE2 3.47Å
188	Y	89.8	Confident	89.6	Confident	52 Å²	52	38 Å²	38	20%	0.204	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.2	171.1	-171.5	-90.7	0	0	0	109	V186 L190 S262 H280	V186-Y188 WeakPolarHBondContact CG1-O 3.28Å; Y188-L190 PolarHBondContact O-N 3.32Å; Y188-S262 WeakPolarHBondContact CB-OG 3.46Å; Y188-H280 HydrophobicContact CE2-CB 4.45Å; Y188-H280 AromaticContact CE2-CD2 3.28Å; Y188-H280 WeakPolarHBondContact CE2-CD2 3.43Å; Y188-H280 AromaticContact CE2-CE1 3.76Å; Y188-H280 AromaticContact CE2-CG 3.71Å; Y188-H280 AromaticContact CE2-ND1 3.98Å; Y188-H280 AromaticContact CE2-NE2 3.34Å; Y188-H280 VanDerWaalsContact CE2-NE2 3.34Å; Y188-H280 WeakPolarHBondContact CE2-NE2 3.45Å; Y188-H280 AromaticContact CZ-CD2 3.38Å; Y188-H280 AromaticContact CZ-NE2 3.52Å; Y188-H280 PolarHBondContact OH-CD2 2.88Å; Y188-H280 PolarHBondContact OH-NE2 2.86Å
189	P	92.2	Very high	90.6	Very high	4 Å²	4	34.1 Å²	34.1	3%	0.026	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	124.5	-176.1	-18.5	27	0	0	0	113.9	Y198 V200 H280 V284 T663	P189-Y198 HydrophobicContact CB-CD1 3.39Å; P189-Y198 HydrophobicContact CB-CE1 3.91Å; P189-Y198 HydrophobicContact CB-CG 4.1Å; P189-V200 VanDerWaalsContact CA-CG2 3.47Å; P189-V200 HydrophobicContact CB-CG2 3.43Å; P189-V200 VanDerWaalsContact CB-CG2 3.43Å; P189-V200 HydrophobicContact CG-CG2 3.47Å; P189-V200 VanDerWaalsContact CG-CG2 3.47Å; P189-H280 HydrophobicContact CG-CB 3.86Å; P189-V284 HydrophobicContact CB-CG2 3.7Å; P189-V284 HydrophobicContact CG-CG2 3.8Å; P189-T663 HydrophobicContact CB-CG2 4.21Å; P189-T663 HydrophobicContact CG-CG2 4.13Å
190	L	92	Very high	91.2	Very high	19 Å²	19	34.4 Å²	34.4	10%	0.099	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	146	175.6	-62.4	177.9	0	0	0	111	V186 Y188 Y198 I199 I215 L259 I263	V186-L190 HydrophobicContact CG1-CB 4.2Å; V186-L190 HydrophobicContact CG1-CD1 3.92Å; V186-L190 HydrophobicContact CG1-CG 3.9Å; Y188-L190 PolarHBondContact O-N 3.32Å; L190-Y198 CarbonylContact O-C 3.49Å; L190-Y198 WeakPolarHBondContact O-CA 3.45Å; L190-I199 PolarHBondContact N-O 2.83Å; L190-I199 VanDerWaalsContact N-O 3.12Å; L190-I199 WeakPolarHBondContact O-CB 3.37Å; L190-I199 PolarHBondContact O-N 2.99Å; L190-I215 HydrophobicContact CB-CD1 4.43Å; L190-I215 HydrophobicContact CB-CG2 4.32Å; L190-I215 HydrophobicContact CD1-CD1 3.84Å; L190-L259 HydrophobicContact CD2-CD2 3.57Å; L190-I263 HydrophobicContact CD1-CD1 3.49Å; L190-I263 VanDerWaalsContact CD1-CD1 3.49Å; L190-I263 HydrophobicContact CD1-CG1 3.39Å
191	I	92.8	Very high	91.4	Very high	54 Å²	54	29.4 Å²	29.4	28%	0.277	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	130	-177.3	-60.9	170.2	0	0	0	110.3	N196 Y198 I215 H660	I191-N196 HydrophobicContact CG2-CB 4.38Å; I191-Y198 HydrophobicContact CD1-CE1 4.38Å; I191-Y198 HydrophobicContact CG1-CD1 3.96Å; I191-Y198 HydrophobicContact CG1-CE1 3.73Å; I191-Y198 HydrophobicContact CG1-CE2 4.5Å; I191-Y198 HydrophobicContact CG1-CG 4.47Å; I191-I215 WeakPolarHBondContact O-CG2 3.49Å; I191-H660 HydrophobicContact CD1-CB 3.47Å; I191-H660 VanDerWaalsContact CD1-CB 3.47Å
192	C	93.7	Very high	91.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.147	C	C	.	.			trans	-66.7	130.3	171.6	176.9	0	0	0	0	111.1	L194 C195 N196 D197 I199 I215 H217	C192-L194 PolarHBondContact O-N 2.72Å; C192-C195 VanDerWaalsContact CB-SG 3.51Å; C192-N196 WeakPolarHBondContact O-CA 3.38Å; C192-N196 PolarHBondContact O-N 2.82Å; C192-D197 VanDerWaalsContact CB-O 3.25Å; C192-D197 WeakPolarHBondContact CB-O 3.49Å; C192-D197 PolarHBondContact N-O 2.87Å; C192-I199 HydrophobicContact CB-CD1 3.76Å; C192-I199 HydrophobicContact CB-CG1 3.92Å; C192-I215 WeakPolarHBondContact CA-O 3.36Å; C192-H217 VanDerWaalsContact CB-CE1 3.43Å; C192-H217 WeakPolarHBondContact CB-CE1 3.5Å; C192-H217 VanDerWaalsContact CB-ND1 3.34Å; C192-H217 WeakPolarHBondContact CB-ND1 3.45Å; C192-H217 PolarHBondContact SG-ND1 3.14Å; C192-H217 VanDerWaalsContact SG-ND1 3.38Å
193	N	91.3	Very high	91.3	Very high	59 Å²	59	27 Å²	27	32%	0.316	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-15.6	-179.2	-75.9	99.9	0	0	0	114.8	S214 I215 F216 F230	N193-S214 VanDerWaalsContact OD1-CA 3.27Å; N193-S214 WeakPolarHBondContact OD1-CA 3.44Å; N193-S214 WeakPolarHBondContact OD1-CB 3.35Å; N193-I215 PolarHBondContact N-O 3.43Å; N193-I215 PolarHBondContact OD1-N 3.08Å; N193-I215 PolarHBondContact OD1-O 2.94Å; N193-F216 HydrophobicContact CB-CD1 4.29Å; N193-F216 HydrophobicContact CB-CE1 3.7Å; N193-F216 HydrophobicContact CB-CE2 4.42Å; N193-F216 HydrophobicContact CB-CZ 3.79Å; N193-F230 HydrophobicContact CB-CE1 4.38Å; N193-F230 HydrophobicContact CB-CZ 4.24Å; N193-F230 WeakPolarHBondContact O-CE2 3.19Å
194	L	90.2	Very high	91.1	Very high	28 Å²	28	24.1 Å²	24.1	15%	0.147	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-59.1	176.8	-177.3	72.6	0	0	0	112	C192 F216 C220 Y223 V229 F230 L410	C192-L194 PolarHBondContact O-N 2.72Å; L194-F216 HydrophobicContact CB-CD1 3.89Å; L194-F216 HydrophobicContact CB-CE1 4.05Å; L194-C220 HydrophobicContact CB-CB 4.06Å; L194-C220 HydrophobicContact CD2-CB 3.68Å; L194-C220 HydrophobicContact CG-CB 4.49Å; L194-Y223 HydrophobicContact CD2-CD1 3.82Å; L194-Y223 HydrophobicContact CD2-CG 4.48Å; L194-V229 HydrophobicContact CD1-CG1 4.41Å; L194-F230 HydrophobicContact CD1-CB 4.41Å; L194-L410 HydrophobicContact CD2-CD2 4.24Å
195	C	90.2	Very high	91	Very high	16 Å²	16	26 Å²	26	11%	0.108	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-4.4	-170.9	65.5	0	0	0	0	114.3	C192 D197 H217 A409	C192-C195 VanDerWaalsContact CB-SG 3.51Å; C195-D197 HydrophobicContact CB-CB 4.47Å; C195-D197 PolarHBondContact O-N 3.47Å; C195-D197 VanDerWaalsContact O-N 3.11Å; C195-D197 WeakPolarHBondContact SG-CB 3.44Å; C195-H217 PolarHBondContact SG-CE1 3.11Å; C195-H217 PolarHBondContact SG-ND1 3.31Å; C195-A409 HydrophobicContact CB-CB 3.34Å
196	N	90.8	Very high	91.1	Very high	106 Å²	106	26 Å²	26	57%	0.567	13%	0.134	S	C	*	.			trans	53.5	25.7	-173.2	-63.4	-32.8	0	0	0	113.7	I191 C192 W659	I191-N196 HydrophobicContact CG2-CB 4.38Å; C192-N196 WeakPolarHBondContact O-CA 3.38Å; C192-N196 PolarHBondContact O-N 2.82Å; N196-W659 PolarHBondContact O-NE1 3.13Å
197	D	91.6	Very high	91.2	Very high	22 Å²	22	26.7 Å²	26.7	12%	0.118	14%	0.138	C	C	.	.			trans	-106.3	154.3	176.3	-160.5	7.5	0	0	0	110.4	C192 C195 H217 R405 I406 W659	C192-D197 VanDerWaalsContact CB-O 3.25Å; C192-D197 WeakPolarHBondContact CB-O 3.49Å; C192-D197 PolarHBondContact N-O 2.87Å; C195-D197 HydrophobicContact CB-CB 4.47Å; C195-D197 PolarHBondContact O-N 3.47Å; C195-D197 VanDerWaalsContact O-N 3.11Å; C195-D197 WeakPolarHBondContact SG-CB 3.44Å; D197-H217 PolarHBondContact O-CE1 2.86Å; D197-R405 HydrophobicContact CB-CB 4.33Å; D197-R405 WeakPolarHBondContact OD2-CB 3.35Å; D197-I406 HydrophobicContact CB-CG1 4.2Å; D197-I406 VanDerWaalsContact OD2-CG1 3.32Å; D197-I406 WeakPolarHBondContact OD2-CG1 3.46Å; D197-W659 WeakPolarHBondContact OD1-CZ2 3.46Å
198	Y	93.5	Very high	91.3	Very high	15 Å²	15	30.8 Å²	30.8	6%	0.059	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	146.5	-176.7	-77.1	-83.7	0	0	0	112.5	P189 L190 I191 H217 V284 W659 H660 I662 T663	P189-Y198 HydrophobicContact CB-CD1 3.39Å; P189-Y198 HydrophobicContact CB-CE1 3.91Å; P189-Y198 HydrophobicContact CB-CG 4.1Å; L190-Y198 CarbonylContact O-C 3.49Å; L190-Y198 WeakPolarHBondContact O-CA 3.45Å; I191-Y198 HydrophobicContact CD1-CE1 4.38Å; I191-Y198 HydrophobicContact CG1-CD1 3.96Å; I191-Y198 HydrophobicContact CG1-CE1 3.73Å; I191-Y198 HydrophobicContact CG1-CE2 4.5Å; I191-Y198 HydrophobicContact CG1-CG 4.47Å; Y198-H217 PolarHBondContact O-NE2 3.19Å; Y198-V284 HydrophobicContact CD1-CG2 4.08Å; Y198-V284 HydrophobicContact CD2-CB 4.43Å; Y198-V284 HydrophobicContact CD2-CG1 3.92Å; Y198-V284 HydrophobicContact CD2-CG2 3.74Å; Y198-V284 HydrophobicContact CE1-CG2 4.37Å; Y198-V284 HydrophobicContact CE2-CG2 4.08Å; Y198-V284 HydrophobicContact CG-CB 4.45Å; Y198-V284 HydrophobicContact CG-CG1 3.81Å; Y198-V284 HydrophobicContact CG-CG2 3.74Å; Y198-W659 AromaticContact CD2-CE2 3.75Å; Y198-W659 HydrophobicContact CD2-CH2 4.28Å; Y198-W659 AromaticContact CD2-CZ2 3.58Å; Y198-W659 HydrophobicContact CD2-CZ2 3.58Å; Y198-W659 AromaticContact CD2-NE1 3.93Å; Y198-W659 HydrophobicContact CE2-CD2 4.33Å; Y198-W659 AromaticContact CE2-CE2 3.92Å; Y198-W659 HydrophobicContact CE2-CZ2 4.11Å; Y198-W659 WeakPolarHBondContact CE2-O 3.29Å; Y198-W659 PolarHBondContact OH-O 2.67Å; Y198-W659 VanDerWaalsContact OH-O 3.08Å; Y198-H660 PolarHBondContact OH-O 3.48Å; Y198-I662 HydrophobicContact CD2-CG2 4.17Å; Y198-I662 HydrophobicContact CE2-CG2 3.35Å; Y198-T663 HydrophobicContact CE1-CG2 4.18Å
199	I	91.9	Very high	91.3	Very high	4 Å²	4	28.3 Å²	28.3	2%	0.021	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	119.1	173.2	-57	169	0	0	0	106.3	V186 L190 C192 T201 A206 I215 H217	V186-I199 HydrophobicContact CB-CG2 4.17Å; V186-I199 HydrophobicContact CG1-CG2 4.48Å; V186-I199 VanDerWaalsContact CG1-O 3.25Å; V186-I199 WeakPolarHBondContact CG1-O 3.35Å; V186-I199 HydrophobicContact CG2-CG2 3.92Å; L190-I199 PolarHBondContact N-O 2.83Å; L190-I199 VanDerWaalsContact N-O 3.12Å; L190-I199 WeakPolarHBondContact O-CB 3.37Å; L190-I199 PolarHBondContact O-N 2.99Å; C192-I199 HydrophobicContact CB-CD1 3.76Å; C192-I199 HydrophobicContact CB-CG1 3.92Å; I199-T201 HydrophobicContact CG2-CG2 4.39Å; I199-A206 HydrophobicContact CG2-CB 3.47Å; I199-A206 VanDerWaalsContact CG2-CB 3.47Å; I199-I215 HydrophobicContact CD1-CB 4.35Å; I199-I215 HydrophobicContact CD1-CD1 4.28Å; I199-I215 HydrophobicContact CD1-CG1 3.8Å; I199-I215 HydrophobicContact CD1-CG2 4.03Å; I199-H217 WeakPolarHBondContact CG1-NE2 3.22Å
200	V	91.9	Very high	90.9	Very high	30 Å²	30	34.3 Å²	34.3	18%	0.182	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	113.7	171.4	179.5	0	0	0	0	106.1	P189 W273 W281 L333	P189-V200 VanDerWaalsContact CA-CG2 3.47Å; P189-V200 HydrophobicContact CB-CG2 3.43Å; P189-V200 VanDerWaalsContact CB-CG2 3.43Å; P189-V200 HydrophobicContact CG-CG2 3.47Å; P189-V200 VanDerWaalsContact CG-CG2 3.47Å; V200-W273 HydrophobicContact CG1-CH2 3.53Å; V200-W273 HydrophobicContact CG1-CZ3 4.11Å; V200-W281 HydrophobicContact CG1-CB 4.37Å; V200-W281 HydrophobicContact CG1-CG 4.43Å; V200-L333 HydrophobicContact CG1-CD1 4.47Å
201	T	90.9	Very high	90.5	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.031	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	124.4	178.8	-176.5	0	0	0	0	110.3	V186 I199 R203 A206 E342	V186-T201 CarbonylContact C-O 3.49Å; V186-T201 PolarHBondContact N-O 3.37Å; V186-T201 CarbonylContact O-C 3.2Å; V186-T201 PolarHBondContact O-N 2.97Å; V186-T201 VanDerWaalsContact O-O 3.14Å; I199-T201 HydrophobicContact CG2-CG2 4.39Å; T201-R203 VanDerWaalsContact CG2-O 3.29Å; T201-R203 WeakPolarHBondContact CG2-O 3.41Å; T201-R203 PolarHBondContact O-N 2.61Å; T201-R203 PolarHBondContact OG1-N 2.81Å; T201-R203 PolarHBondContact OG1-O 3Å; T201-A206 HydrophobicContact CG2-CB 4.06Å; T201-E342 PolarHBondContact OG1-OE1 3.02Å
202	P	89.1	Confident	90.1	Very high	10 Å²	10	33.6 Å²	33.6	7%	0.065	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	-16.5	172.9	29.2	-33.9	0	0	0	111.9	E267 Q268 L270 W273 L333	P202-E267 WeakPolarHBondContact O-CA 3.4Å; P202-Q268 WeakPolarHBondContact CB-O 3.44Å; P202-Q268 PolarHBondContact O-N 3.39Å; P202-L270 HydrophobicContact CB-CD2 4.06Å; P202-L270 HydrophobicContact CB-CG 4.42Å; P202-L270 HydrophobicContact CG-CD2 3.97Å; P202-L270 HydrophobicContact CG-CG 4.33Å; P202-W273 HydrophobicContact CB-CZ2 3.86Å; P202-W273 HydrophobicContact CG-CZ2 4.42Å; P202-L333 HydrophobicContact CG-CD1 4.4Å; P202-L333 WeakPolarHBondContact CG-O 3.35Å
203	R	88.5	Confident	89.9	Confident	55 Å²	55	38.5 Å²	38.5	21%	0.208	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	154.3	-177.9	-65.7	171.8	-73.8	120.7	7	109.3	S185 T201 N205 E342	S185-R203 WeakPolarHBondContact CA-O 3.42Å; T201-R203 VanDerWaalsContact CG2-O 3.29Å; T201-R203 WeakPolarHBondContact CG2-O 3.41Å; T201-R203 PolarHBondContact O-N 2.61Å; T201-R203 PolarHBondContact OG1-N 2.81Å; T201-R203 PolarHBondContact OG1-O 3Å; R203-N205 PolarHBondContact NH1-ND2 3.1Å; R203-N205 PolarHBondContact O-N 3Å; R203-E342 IonicContact CZ-OE1 3.5Å; R203-E342 IonicContact CZ-OE2 3.78Å; R203-E342 IonicContact NH1-OE1 2.91Å; R203-E342 IonicContact NH1-OE2 2.83Å; R203-E342 PolarHBondContact NH1-OE2 3.03Å; R203-E342 IonicContact NH2-OE1 2.96Å; R203-E342 PolarHBondContact NH2-OE1 3.15Å; R203-E342 IonicContact NH2-OE2 3.6Å; R203-E342 PolarHBondContact NH2-OE2 3.45Å
204	C	88.5	Confident	89.8	Confident	21 Å²	21	36.7 Å²	36.7	14%	0.142	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	57.2	177.4	-69.7	0	0	0	0	112.3	N183 V184 T265 E267	N183-C204 HydrophobicContact CB-CB 4.27Å; N183-C204 WeakPolarHBondContact CB-O 3.27Å; N183-C204 PolarHBondContact ND2-O 2.97Å; V184-C204 CarbonylContact O-C 3.58Å; V184-C204 WeakPolarHBondContact O-CA 3.41Å; C204-T265 PolarHBondContact SG-O 3.34Å; C204-E267 PolarHBondContact SG-N 3.48Å; C204-E267 VanDerWaalsContact SG-N 3.39Å
205	N	90.5	Very high	89.9	Confident	44 Å²	44	35.9 Å²	35.9	24%	0.235	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	20.7	-172.6	-70.2	0.1	0	0	0	112.6	V184 R203 L218 E342	V184-N205 PolarHBondContact O-N 2.99Å; R203-N205 PolarHBondContact NH1-ND2 3.1Å; R203-N205 PolarHBondContact O-N 3Å; N205-L218 WeakPolarHBondContact O-CB 3.49Å; N205-E342 HydrophobicContact CB-CB 4.49Å; N205-E342 HydrophobicContact CB-CG 3.69Å; N205-E342 VanDerWaalsContact CB-OE1 3.28Å; N205-E342 WeakPolarHBondContact CB-OE1 3.43Å; N205-E342 PolarHBondContact ND2-OE2 3.32Å
206	A	92.5	Very high	90.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	156	164.9	0	0	0	0	0	109.5	N183 V184 V186 I199 T201	N183-A206 CarbonylContact C-O 3.48Å; N183-A206 VanDerWaalsContact CA-O 3.31Å; N183-A206 WeakPolarHBondContact CA-O 3.3Å; V184-A206 HydrophobicContact CG2-CB 4.1Å; V184-A206 WeakPolarHBondContact CG2-O 3.46Å; V184-A206 PolarHBondContact N-O 3.36Å; V184-A206 PolarHBondContact O-N 3.47Å; V184-A206 VanDerWaalsContact O-N 3.09Å; V186-A206 HydrophobicContact CG2-CB 4.04Å; I199-A206 HydrophobicContact CG2-CB 3.47Å; I199-A206 VanDerWaalsContact CG2-CB 3.47Å; T201-A206 HydrophobicContact CG2-CB 4.06Å
207	N	93.4	Very high	90.2	Very high	13 Å²	13	30.7 Å²	30.7	7%	0.07	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	124.2	-177.2	-79.7	0.2	0	0	0	110.5	F181 V182 N183 I215 F216 A221	F181-N207 HydrophobicContact CB-CB 4.03Å; F181-N207 HydrophobicContact CD1-CB 3.9Å; F181-N207 HydrophobicContact CG-CB 4.02Å; V182-N207 WeakPolarHBondContact O-CA 3.36Å; N183-N207 PolarHBondContact OD1-OD1 3.46Å; N207-I215 CarbonylContact O-C 3.6Å; N207-I215 WeakPolarHBondContact O-CA 3.45Å; N207-F216 PolarHBondContact N-O 2.61Å; N207-F216 PolarHBondContact O-N 2.9Å; N207-A221 HydrophobicContact CB-CB 3.53Å; N207-A221 WeakPolarHBondContact ND2-CB 3.46Å
208	R	92.5	Very high	90.3	Very high	89 Å²	89	31.1 Å²	31.1	34%	0.336	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.2	170.7	-173.7	177.9	-175.6	-172.4	1.6	109.8	F181 V182 V184 S214	F181-R208 WeakPolarHBondContact CA-O 3.25Å; V182-R208 PolarHBondContact N-O 3.03Å; V182-R208 PolarHBondContact O-N 3.23Å; V184-R208 HydrophobicContact CG1-CB 4.02Å; V184-R208 HydrophobicContact CG2-CB 4Å; R208-S214 CarbonylContact C-O 3.57Å; R208-S214 WeakPolarHBondContact CA-O 3.12Å
209	C	89.2	Confident	90.2	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	131.1	174.4	-175.6	0	0	0	0	111	H179 Q180 F181 T211 C212 K213 S214	H179-C209 HydrophobicContact CB-CB 4.43Å; H179-C209 PolarHBondContact ND1-SG 3.21Å; Q180-C209 CarbonylContact O-C 3.46Å; Q180-C209 VanDerWaalsContact O-CA 3.24Å; Q180-C209 WeakPolarHBondContact O-CA 3.49Å; F181-C209 HydrophobicContact CD1-CB 4.18Å; F181-C209 HydrophobicContact CE1-CB 4.13Å; C209-T211 VanDerWaalsContact C-N 3.31Å; C209-T211 PolarHBondContact O-N 3.34Å; C209-C212 WeakPolarHBondContact CB-SG 3.38Å; C209-K213 WeakPolarHBondContact O-CA 3.48Å; C209-K213 PolarHBondContact O-N 2.89Å; C209-S214 PolarHBondContact N-O 3.4Å
210	F	84.2	Confident	90.2	Very high	130 Å²	130	30.2 Å²	30.2	57%	0.57	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-38.3	176.6	-172.8	-98.9	0	0	0	112.2	Q180 K213	Q180-F210 HydrophobicContact CB-CB 4.28Å; Q180-F210 PolarHBondContact O-N 3.27Å; F210-K213 VanDerWaalsContact O-CE 3.31Å; F210-K213 WeakPolarHBondContact O-CE 3.41Å; F210-K213 PolarHBondContact O-NZ 2.95Å
211	T	82.6	Confident	90.1	Very high	44 Å²	44	28.8 Å²	28.8	27%	0.27	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-58.5	-172.5	-45.6	0	0	0	0	112.6	C209	C209-T211 VanDerWaalsContact C-N 3.31Å; C209-T211 PolarHBondContact O-N 3.34Å
212	C	85.9	Confident	90	Very high	14 Å²	14	30.7 Å²	30.7	10%	0.095	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-7	-177.3	67.8	0	0	0	0	114.2	H179 C209 S214 Q233	H179-C212 PolarHBondContact CE1-SG 3.41Å; H179-C212 PolarHBondContact ND1-SG 3.06Å; H179-C212 VanDerWaalsContact ND1-SG 3.39Å; C209-C212 WeakPolarHBondContact CB-SG 3.38Å; C212-S214 PolarHBondContact O-N 3.25Å; C212-S214 WeakPolarHBondContact SG-CB 3.24Å; C212-S214 PolarHBondContact SG-OG 2.93Å; C212-Q233 WeakPolarHBondContact CB-O 3.33Å
213	K	87.7	Confident	89.9	Confident	102 Å²	102	31 Å²	31	44%	0.443	15%	0.147	S	C	.	.			trans	61.2	1	-175.4	-54	-53.8	-173.1	-164.6	0	116	C209 F210	C209-K213 WeakPolarHBondContact O-CA 3.48Å; C209-K213 PolarHBondContact O-N 2.89Å; F210-K213 VanDerWaalsContact O-CE 3.31Å; F210-K213 WeakPolarHBondContact O-CE 3.41Å; F210-K213 PolarHBondContact O-NZ 2.95Å
214	S	90.1	Very high	89.8	Confident	21 Å²	21	28.6 Å²	28.6	15%	0.147	14%	0.138	C	C	.	.			trans	-55.1	147.4	171.1	-59.3	0	0	0	0	111.9	N193 R208 C209 C212 F216	N193-S214 VanDerWaalsContact OD1-CA 3.27Å; N193-S214 WeakPolarHBondContact OD1-CA 3.44Å; N193-S214 WeakPolarHBondContact OD1-CB 3.35Å; R208-S214 CarbonylContact C-O 3.57Å; R208-S214 WeakPolarHBondContact CA-O 3.12Å; C209-S214 PolarHBondContact N-O 3.4Å; C212-S214 PolarHBondContact O-N 3.25Å; C212-S214 WeakPolarHBondContact SG-CB 3.24Å; C212-S214 PolarHBondContact SG-OG 2.93Å; S214-F216 VanDerWaalsContact CB-CE2 3.49Å
215	I	92.6	Very high	89.5	Confident	12 Å²	12	34.4 Å²	34.4	6%	0.062	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	142.2	-177.6	-162.6	172.7	0	0	0	110.5	V184 V186 L190 I191 C192 N193 I199 N207 I263	V184-I215 HydrophobicContact CG2-CD1 4.35Å; V186-I215 HydrophobicContact CG2-CD1 3.56Å; L190-I215 HydrophobicContact CB-CD1 4.43Å; L190-I215 HydrophobicContact CB-CG2 4.32Å; L190-I215 HydrophobicContact CD1-CD1 3.84Å; I191-I215 WeakPolarHBondContact O-CG2 3.49Å; C192-I215 WeakPolarHBondContact CA-O 3.36Å; N193-I215 PolarHBondContact N-O 3.43Å; N193-I215 PolarHBondContact OD1-N 3.08Å; N193-I215 PolarHBondContact OD1-O 2.94Å; I199-I215 HydrophobicContact CD1-CB 4.35Å; I199-I215 HydrophobicContact CD1-CD1 4.28Å; I199-I215 HydrophobicContact CD1-CG1 3.8Å; I199-I215 HydrophobicContact CD1-CG2 4.03Å; N207-I215 CarbonylContact O-C 3.6Å; N207-I215 WeakPolarHBondContact O-CA 3.45Å; I215-I263 HydrophobicContact CD1-CD1 4.21Å
216	F	93.3	Very high	89.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	148.8	-174.1	-60.7	-93.1	0	0	0	110.1	F181 N193 L194 N207 S214 C220 A221 F230	F181-F216 HydrophobicContact CD1-CD2 4.38Å; F181-F216 AromaticContact CE1-CD2 3.45Å; F181-F216 HydrophobicContact CE1-CD2 3.45Å; F181-F216 VanDerWaalsContact CE1-CD2 3.45Å; F181-F216 AromaticContact CE1-CE2 3.65Å; F181-F216 HydrophobicContact CE1-CE2 3.65Å; F181-F216 HydrophobicContact CE1-CG 4.3Å; F181-F216 HydrophobicContact CZ-CD2 4.06Å; F181-F216 HydrophobicContact CZ-CE2 4.16Å; N193-F216 HydrophobicContact CB-CD1 4.29Å; N193-F216 HydrophobicContact CB-CE1 3.7Å; N193-F216 HydrophobicContact CB-CE2 4.42Å; N193-F216 HydrophobicContact CB-CZ 3.79Å; L194-F216 HydrophobicContact CB-CD1 3.89Å; L194-F216 HydrophobicContact CB-CE1 4.05Å; N207-F216 PolarHBondContact N-O 2.61Å; N207-F216 PolarHBondContact O-N 2.9Å; S214-F216 VanDerWaalsContact CB-CE2 3.49Å; F216-C220 HydrophobicContact CB-CB 4.24Å; F216-C220 HydrophobicContact CD1-CB 4.5Å; F216-A221 HydrophobicContact CB-CB 3.88Å; F216-F230 HydrophobicContact CE1-CD1 4.13Å; F216-F230 HydrophobicContact CE1-CG 4.37Å; F216-F230 AromaticContact CZ-CD1 3.77Å; F216-F230 HydrophobicContact CZ-CD1 3.77Å; F216-F230 HydrophobicContact CZ-CE1 4.1Å; F216-F230 HydrophobicContact CZ-CG 4.44Å
217	H	94.1	Very high	88.5	Confident	13 Å²	13	39.6 Å²	39.6	6%	0.06	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	154.2	160.1	-56.9	94.6	0	0	0	109.5	C192 C195 D197 Y198 I199 V219 C220 A221	C192-H217 VanDerWaalsContact CB-CE1 3.43Å; C192-H217 WeakPolarHBondContact CB-CE1 3.5Å; C192-H217 VanDerWaalsContact CB-ND1 3.34Å; C192-H217 WeakPolarHBondContact CB-ND1 3.45Å; C192-H217 PolarHBondContact SG-ND1 3.14Å; C192-H217 VanDerWaalsContact SG-ND1 3.38Å; C195-H217 PolarHBondContact SG-CE1 3.11Å; C195-H217 PolarHBondContact SG-ND1 3.31Å; D197-H217 PolarHBondContact O-CE1 2.86Å; Y198-H217 PolarHBondContact O-NE2 3.19Å; I199-H217 WeakPolarHBondContact CG1-NE2 3.22Å; H217-V219 VanDerWaalsContact C-N 3.28Å; H217-V219 PolarHBondContact O-N 3.47Å; H217-C220 HydrophobicContact CB-CB 3.99Å; H217-C220 WeakPolarHBondContact O-CB 3.46Å; H217-C220 PolarHBondContact O-N 3.23Å; H217-C220 VanDerWaalsContact O-N 3.08Å; H217-A221 PolarHBondContact O-N 3.14Å
218	L	92.9	Very high	87.5	Confident	30 Å²	30	44.9 Å²	44.9	16%	0.157	20%	0.203	C	C	.	.	H	α-helix	trans	-54.3	-45.7	177.2	-179.2	61	0	0	0	111.8	N205 A221 E222 G341 L344	N205-L218 WeakPolarHBondContact O-CB 3.49Å; L218-A221 PolarHBondContact O-N 3.35Å; L218-E222 PolarHBondContact O-N 3.22Å; L218-E222 VanDerWaalsContact O-N 3.08Å; L218-G341 PolarHBondContact N-O 3.2Å; L218-L344 HydrophobicContact CD2-CD1 4.17Å; L218-L344 HydrophobicContact CD2-CG 4.29Å; L218-L344 HydrophobicContact CG-CD1 4.27Å; L218-L344 HydrophobicContact CG-CD2 4.2Å; L218-L344 HydrophobicContact CG-CG 4.3Å
219	V	91.3	Very high	86.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.6	-42.1	176.2	176.8	0	0	0	0	112.1	H217 A221 E222 Y223 G341 N343 L344 I346 F347 L410	H217-V219 VanDerWaalsContact C-N 3.28Å; H217-V219 PolarHBondContact O-N 3.47Å; V219-A221 PolarHBondContact O-N 3.23Å; V219-E222 PolarHBondContact O-N 2.97Å; V219-Y223 WeakPolarHBondContact O-CB 3.1Å; V219-Y223 PolarHBondContact O-N 3.5Å; V219-G341 WeakPolarHBondContact CG2-O 3.25Å; V219-G341 PolarHBondContact N-O 3.16Å; V219-G341 VanDerWaalsContact N-O 3.1Å; V219-N343 WeakPolarHBondContact CG2-O 3.35Å; V219-L344 HydrophobicContact CG2-CD2 4.23Å; V219-I346 HydrophobicContact CG1-CD1 4.34Å; V219-F347 HydrophobicContact CG1-CE2 3.9Å; V219-F347 HydrophobicContact CG1-CZ 4.04Å; V219-L410 HydrophobicContact CG1-CD1 3.55Å; V219-L410 HydrophobicContact CG1-CD2 4.26Å
220	C	92.1	Very high	85.8	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.9	-37.2	179	-69.3	0	0	0	0	112.5	L194 F216 H217 S224	L194-C220 HydrophobicContact CB-CB 4.06Å; L194-C220 HydrophobicContact CD2-CB 3.68Å; L194-C220 HydrophobicContact CG-CB 4.49Å; F216-C220 HydrophobicContact CB-CB 4.24Å; F216-C220 HydrophobicContact CD1-CB 4.5Å; H217-C220 HydrophobicContact CB-CB 3.99Å; H217-C220 WeakPolarHBondContact O-CB 3.46Å; H217-C220 PolarHBondContact O-N 3.23Å; H217-C220 VanDerWaalsContact O-N 3.08Å; C220-S224 WeakPolarHBondContact O-CB 3.31Å; C220-S224 PolarHBondContact O-N 3.14Å; C220-S224 PolarHBondContact O-OG 3.33Å
221	A	90.5	Very high	85.5	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.8	-44	175.9	0	0	0	0	0	111.6	F181 N207 F216 H217 L218 V219 S224 K225	F181-A221 HydrophobicContact CD1-CB 4.42Å; F181-A221 HydrophobicContact CD2-CB 4.02Å; F181-A221 HydrophobicContact CE1-CB 4.22Å; F181-A221 HydrophobicContact CE2-CB 3.78Å; F181-A221 HydrophobicContact CG-CB 4.33Å; F181-A221 HydrophobicContact CZ-CB 3.88Å; N207-A221 HydrophobicContact CB-CB 3.53Å; N207-A221 WeakPolarHBondContact ND2-CB 3.46Å; F216-A221 HydrophobicContact CB-CB 3.88Å; H217-A221 PolarHBondContact O-N 3.14Å; L218-A221 PolarHBondContact O-N 3.35Å; V219-A221 PolarHBondContact O-N 3.23Å; A221-S224 PolarHBondContact O-N 3.03Å; A221-K225 WeakPolarHBondContact O-CB 3.42Å; A221-K225 PolarHBondContact O-N 3.39Å
222	E	87.9	Confident	85.4	Confident	45 Å²	45	43.5 Å²	43.5	21%	0.21	21%	0.209	C	C	.	.	H	α-helix	trans	-63.9	-42.9	176.1	-174.6	62.1	-167.2	0	0	111.2	L218 V219 S224 K225 R226 L344 F347	L218-E222 PolarHBondContact O-N 3.22Å; L218-E222 VanDerWaalsContact O-N 3.08Å; V219-E222 PolarHBondContact O-N 2.97Å; E222-S224 PolarHBondContact O-N 2.94Å; E222-K225 PolarHBondContact O-N 3.06Å; E222-R226 WeakPolarHBondContact O-CG 3.37Å; E222-R226 PolarHBondContact O-N 3.22Å; E222-R226 IonicContact OE1-CZ 3.39Å; E222-R226 IonicContact OE1-NE 2.77Å; E222-R226 PolarHBondContact OE1-NE 3.07Å; E222-R226 IonicContact OE1-NH2 3.1Å; E222-R226 PolarHBondContact OE1-NH2 3.38Å; E222-R226 VanDerWaalsContact OE1-NH2 3.1Å; E222-L344 HydrophobicContact CB-CD2 3.89Å; E222-L344 HydrophobicContact CG-CD2 4.1Å; E222-F347 HydrophobicContact CB-CD2 4.46Å; E222-F347 HydrophobicContact CB-CE2 3.85Å; E222-F347 HydrophobicContact CB-CZ 4.35Å; E222-F347 HydrophobicContact CG-CD2 3.89Å; E222-F347 HydrophobicContact CG-CE2 3.73Å; E222-F347 HydrophobicContact CG-CZ 4.29Å
223	Y	87.3	Confident	84.9	Confident	18 Å²	18	49.2 Å²	49.2	7%	0.071	23%	0.234	C	C	.	.	H	α-helix	trans	-58.3	-48.9	173.3	-172.1	-97.1	0	0	0	112	L194 V219 K225 R226 F227 V229 F347 L410	L194-Y223 HydrophobicContact CD2-CD1 3.82Å; L194-Y223 HydrophobicContact CD2-CG 4.48Å; V219-Y223 WeakPolarHBondContact O-CB 3.1Å; V219-Y223 PolarHBondContact O-N 3.5Å; Y223-K225 VanDerWaalsContact C-N 3.27Å; Y223-K225 PolarHBondContact O-N 2.94Å; Y223-R226 PolarHBondContact O-N 3.39Å; Y223-F227 HydrophobicContact CD1-CD2 4.36Å; Y223-F227 AromaticContact CD2-CD2 3.41Å; Y223-F227 HydrophobicContact CD2-CD2 3.41Å; Y223-F227 VanDerWaalsContact CD2-CD2 3.41Å; Y223-F227 AromaticContact CD2-CE2 3.55Å; Y223-F227 HydrophobicContact CD2-CE2 3.55Å; Y223-F227 HydrophobicContact CE1-CD2 4.34Å; Y223-F227 AromaticContact CE2-CD2 3.34Å; Y223-F227 HydrophobicContact CE2-CD2 3.34Å; Y223-F227 AromaticContact CE2-CE2 3.49Å; Y223-F227 HydrophobicContact CE2-CE2 3.49Å; Y223-F227 VanDerWaalsContact CE2-CE2 3.49Å; Y223-F227 HydrophobicContact CE2-CG 4.28Å; Y223-F227 AromaticContact CG-CD2 3.92Å; Y223-F227 HydrophobicContact CG-CD2 3.92Å; Y223-F227 HydrophobicContact CG-CE2 4.44Å; Y223-F227 AromaticContact CZ-CD2 3.84Å; Y223-F227 WeakPolarHBondContact O-CD2 3.39Å; Y223-F227 PolarHBondContact O-N 3.44Å; Y223-V229 HydrophobicContact CE1-CB 4.41Å; Y223-V229 HydrophobicContact CE1-CG2 3.83Å; Y223-F347 HydrophobicContact CD2-CE1 4.17Å; Y223-F347 HydrophobicContact CD2-CZ 4.41Å; Y223-L410 HydrophobicContact CD1-CD2 4.13Å; Y223-L410 HydrophobicContact CD2-CB 4.43Å; Y223-L410 HydrophobicContact CD2-CD2 3.95Å; Y223-L410 HydrophobicContact CE2-CB 4.43Å; Y223-L410 VanDerWaalsContact CE2-O 3.3Å; Y223-L410 WeakPolarHBondContact CE2-O 3.34Å; Y223-L410 HydrophobicContact CG-CD2 3.68Å; Y223-L410 VanDerWaalsContact CZ-O 3.24Å; Y223-L410 PolarHBondContact OH-O 3Å; Y223-L410 VanDerWaalsContact OH-O 3.06Å
224	S	85.8	Confident	84.1	Confident	4 Å²	4	48.5 Å²	48.5	3%	0.028	24%	0.24	C	C	.	.	H	α-helix	trans	-62.2	-35.5	178.8	-57.1	0	0	0	0	112.1	C220 A221 E222 E228	C220-S224 WeakPolarHBondContact O-CB 3.31Å; C220-S224 PolarHBondContact O-N 3.14Å; C220-S224 PolarHBondContact O-OG 3.33Å; A221-S224 PolarHBondContact O-N 3.03Å; E222-S224 PolarHBondContact O-N 2.94Å; S224-E228 WeakPolarHBondContact O-CA 3.1Å; S224-E228 PolarHBondContact O-N 3.42Å; S224-E228 VanDerWaalsContact O-N 3.1Å
225	K	83.1	Confident	82.5	Confident	143 Å²	143	51.7 Å²	51.7	62%	0.622	26%	0.26	S	S	*	.	H	α-helix	trans	-68.9	-42.6	176.4	-176.3	-174.6	174.5	-168.1	0	112.3	A221 E222 Y223	A221-K225 WeakPolarHBondContact O-CB 3.42Å; A221-K225 PolarHBondContact O-N 3.39Å; E222-K225 PolarHBondContact O-N 3.06Å; Y223-K225 VanDerWaalsContact C-N 3.27Å; Y223-K225 PolarHBondContact O-N 2.94Å
226	R	81.9	Confident	80.3	Confident	114 Å²	114	60.9 Å²	60.9	43%	0.43	29%	0.294	S	S	.	.	H	α-helix	trans	-73.8	-36	-177.5	-72.3	-176.6	-175.9	-147.3	5.5	113.6	E222 Y223	E222-R226 WeakPolarHBondContact O-CG 3.37Å; E222-R226 PolarHBondContact O-N 3.22Å; E222-R226 IonicContact OE1-CZ 3.39Å; E222-R226 IonicContact OE1-NE 2.77Å; E222-R226 PolarHBondContact OE1-NE 3.07Å; E222-R226 IonicContact OE1-NH2 3.1Å; E222-R226 PolarHBondContact OE1-NH2 3.38Å; E222-R226 VanDerWaalsContact OE1-NH2 3.1Å; Y223-R226 PolarHBondContact O-N 3.39Å
227	F	79.4	Confident	77.5	Confident	38 Å²	38	68.1 Å²	68.1	17%	0.167	33%	0.333	C	S	.	.	H	α-helix	trans	-115.3	1	-167.7	-63.5	-66	0	0	0	114.4	Y223 V229 F347 C356	Y223-F227 HydrophobicContact CD1-CD2 4.36Å; Y223-F227 AromaticContact CD2-CD2 3.41Å; Y223-F227 HydrophobicContact CD2-CD2 3.41Å; Y223-F227 VanDerWaalsContact CD2-CD2 3.41Å; Y223-F227 AromaticContact CD2-CE2 3.55Å; Y223-F227 HydrophobicContact CD2-CE2 3.55Å; Y223-F227 HydrophobicContact CE1-CD2 4.34Å; Y223-F227 AromaticContact CE2-CD2 3.34Å; Y223-F227 HydrophobicContact CE2-CD2 3.34Å; Y223-F227 AromaticContact CE2-CE2 3.49Å; Y223-F227 HydrophobicContact CE2-CE2 3.49Å; Y223-F227 VanDerWaalsContact CE2-CE2 3.49Å; Y223-F227 HydrophobicContact CE2-CG 4.28Å; Y223-F227 AromaticContact CG-CD2 3.92Å; Y223-F227 HydrophobicContact CG-CD2 3.92Å; Y223-F227 HydrophobicContact CG-CE2 4.44Å; Y223-F227 AromaticContact CZ-CD2 3.84Å; Y223-F227 WeakPolarHBondContact O-CD2 3.39Å; Y223-F227 PolarHBondContact O-N 3.44Å; F227-V229 HydrophobicContact CB-CG2 3.77Å; F227-V229 PolarHBondContact O-N 2.91Å; F227-F347 HydrophobicContact CE2-CE1 4.48Å; F227-C356 VanDerWaalsContact CB-SG 3.59Å; F227-C356 HydrophobicContact CD1-CB 4.44Å; F227-C356 WeakPolarHBondContact CD1-SG 3.46Å
228	E	73.1	Confident	74.5	Confident	125 Å²	125	71.6 Å²	71.6	58%	0.584	35%	0.352	S	S	*	.			trans	52.4	25.1	178.8	-58.1	-171.4	170.2	0	0	114.8	S224 F230	S224-E228 WeakPolarHBondContact O-CA 3.1Å; S224-E228 PolarHBondContact O-N 3.42Å; S224-E228 VanDerWaalsContact O-N 3.1Å; E228-F230 VanDerWaalsContact C-N 3.32Å; E228-F230 PolarHBondContact O-N 3.14Å
229	V	72.4	Confident	71.7	Confident	80 Å²	80	78 Å²	78	49%	0.485	39%	0.386	S	S	.	.			trans	-67.3	-33.1	-175.2	179.9	0	0	0	0	112.3	L194 Y223 F227	L194-V229 HydrophobicContact CD1-CG1 4.41Å; Y223-V229 HydrophobicContact CE1-CB 4.41Å; Y223-V229 HydrophobicContact CE1-CG2 3.83Å; F227-V229 HydrophobicContact CB-CG2 3.77Å; F227-V229 PolarHBondContact O-N 2.91Å
230	F	73.7	Confident	68.6	Low	75 Å²	75	81.4 Å²	81.4	33%	0.329	41%	0.41	S	S	.	.	S	Bend	trans	-120.7	111.2	178.2	-156	-89.4	0	0	0	109.2	H179 N193 L194 F216 E228	H179-F230 PolarHBondContact CD2-O 3.16Å; H179-F230 AromaticContact NE2-CD1 3.55Å; H179-F230 PolarHBondContact NE2-O 3.39Å; H179-F230 VanDerWaalsContact NE2-O 3.14Å; N193-F230 HydrophobicContact CB-CE1 4.38Å; N193-F230 HydrophobicContact CB-CZ 4.24Å; N193-F230 WeakPolarHBondContact O-CE2 3.19Å; L194-F230 HydrophobicContact CD1-CB 4.41Å; F216-F230 HydrophobicContact CE1-CD1 4.13Å; F216-F230 HydrophobicContact CE1-CG 4.37Å; F216-F230 AromaticContact CZ-CD1 3.77Å; F216-F230 HydrophobicContact CZ-CD1 3.77Å; F216-F230 HydrophobicContact CZ-CE1 4.1Å; F216-F230 HydrophobicContact CZ-CG 4.44Å; E228-F230 VanDerWaalsContact C-N 3.32Å; E228-F230 PolarHBondContact O-N 3.14Å
231	T	78.5	Confident	65.6	Low	68 Å²	68	88.4 Å²	88.4	42%	0.417	45%	0.453	S	S	.	.			trans	-86	140.7	-177.9	57	0	0	0	0	111.7	Q233	T231-Q233 PolarHBondContact O-N 3.27Å; T231-Q233 VanDerWaalsContact O-N 3.11Å
232	C	80.1	Confident	62.6	Low	11 Å²	11	94.5 Å²	94.5	7%	0.074	48%	0.484	C	S	.	.			trans	-71.2	105.9	178.8	-176.1	0	0	0	0	112	R177 H179	R177-C232 PolarHBondContact O-N 3.44Å; H179-C232 HydrophobicContact CB-CB 4.47Å; H179-C232 VanDerWaalsContact CE1-CA 3.41Å; H179-C232 WeakPolarHBondContact CE1-CA 3.28Å; H179-C232 WeakPolarHBondContact ND1-CB 3.46Å; H179-C232 PolarHBondContact NE2-N 2.84Å
233	Q	75.2	Confident	59.5	Low	135 Å²	135	101.3 Å²	101.3	63%	0.631	51%	0.513	S	S	*	.			trans	-107.1	124.3	171.5	-64.9	-175.4	-3	0	0	110.3	C212 T231	C212-Q233 WeakPolarHBondContact CB-O 3.33Å; T231-Q233 PolarHBondContact O-N 3.27Å; T231-Q233 VanDerWaalsContact O-N 3.11Å
234	P	70.3	Confident	56.7	Low	87 Å²	87	105.3 Å²	105.3	57%	0.565	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-58.5	148.1	172.3	-17.5	29	0	0	0	110.9	R236	P234-R236 PolarHBondContact O-N 3.13Å
235	P	57.5	Low	53.8	Low	88 Å²	88	113.8 Å²	113.8	57%	0.571	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-56	125.9	173	23.4	-32	0	0	0	109.3	N237	P235-N237 PolarHBondContact O-N 3.33Å
236	R	44.9	Very low	50.9	Low	204 Å²	204	116.1 Å²	116.1	77%	0.77	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-61.1	119.4	176.3	-71.3	-174.2	178.9	-167.1	0.2	108.7	P234 D238	P234-R236 PolarHBondContact O-N 3.13Å; R236-D238 PolarHBondContact O-N 2.98Å
237	N	35.2	Very low	48.3	Very low	152 Å²	152	118.5 Å²	118.5	81%	0.813	61%	0.614	S	S	*	*			trans	-74.4	68.5	165.3	-88.8	-5.5	0	0	0	108.8	P235 N239	P235-N237 PolarHBondContact O-N 3.33Å; N237-N239 VanDerWaalsContact C-N 3.28Å; N237-N239 PolarHBondContact O-N 3.29Å
238	D	31.5	Very low	45.6	Very low	86 Å²	86	122.2 Å²	122.2	46%	0.46	64%	0.64	S	S	.	*			trans	-78.3	83.8	169.9	-74.3	-23.9	0	0	0	108.5	R236 S240 I242	R236-D238 PolarHBondContact O-N 2.98Å; D238-S240 PolarHBondContact O-N 3.19Å; D238-I242 HydrophobicContact CB-CD1 4.29Å
239	N	33.2	Very low	43.4	Very low	165 Å²	165	119.5 Å²	119.5	88%	0.882	63%	0.633	S	S	*	*			trans	-77.7	6.6	165	-91.1	-4.6	0	0	0	112.5	N237	N237-N239 VanDerWaalsContact C-N 3.28Å; N237-N239 PolarHBondContact O-N 3.29Å
240	S	27.4	Very low	41.2	Very low	71 Å²	71	121.2 Å²	121.2	50%	0.497	65%	0.649	S	S	.	*	S	Bend	trans	-94.5	97.8	173.7	56.2	0	0	0	0	109.8	D238 I242	D238-S240 PolarHBondContact O-N 3.19Å; S240-I242 VanDerWaalsContact C-N 3.3Å; S240-I242 WeakPolarHBondContact O-CG1 3.23Å; S240-I242 PolarHBondContact O-N 2.98Å
241	T	29	Very low	39.3	Very low	148 Å²	148	121.4 Å²	121.4	91%	0.908	66%	0.66	S	S	*	*			trans	14.3	65.9	148.2	20.2	0	0	0	0	116	K243	T241-K243 PolarHBondContact O-N 3.26Å
242	I	27.8	Very low	36.9	Very low	128 Å²	128	121.8 Å²	121.8	66%	0.656	66%	0.662	S	S	*	*			trans	-78.3	107.9	165.1	-66.7	177.5	0	0	0	104.8	D238 S240 S244	D238-I242 HydrophobicContact CB-CD1 4.29Å; S240-I242 VanDerWaalsContact C-N 3.3Å; S240-I242 WeakPolarHBondContact O-CG1 3.23Å; S240-I242 PolarHBondContact O-N 2.98Å; I242-S244 PolarHBondContact O-N 3.47Å
243	K	22.8	Very low	34.4	Very low	187 Å²	187	126.8 Å²	126.8	81%	0.813	70%	0.696	S	S	*	*			trans	-38.2	113	161	-71.2	174.6	177.1	176.6	0	107	T241 E245	T241-K243 PolarHBondContact O-N 3.26Å; K243-E245 PolarHBondContact O-N 3.46Å
244	S	27.2	Very low	32.2	Very low	103 Å²	103	126.4 Å²	126.4	72%	0.72	70%	0.698	S	S	*	*			trans	-54.8	88.5	173.2	46.2	0	0	0	0	109.2	I242 K246	I242-S244 PolarHBondContact O-N 3.47Å; S244-K246 PolarHBondContact O-N 2.96Å
245	E	25.5	Very low	30.4	Very low	181 Å²	181	124.4 Å²	124.4	85%	0.846	69%	0.689	S	S	*	*			trans	-64.1	94	156.1	-79.7	-176.3	165.6	0	0	106.3	K243 L247	K243-E245 PolarHBondContact O-N 3.46Å; E245-L247 PolarHBondContact O-N 3.25Å
246	K	23.3	Very low	29.1	Very low	192 Å²	192	128.8 Å²	128.8	84%	0.835	70%	0.699	S	S	*	*	S	Bend	trans	25.2	73.4	153.9	-68.2	-180	174.5	-178.4	0	115.6	S244	S244-K246 PolarHBondContact O-N 2.96Å
247	L	25.9	Very low	28.6	Very low	165 Å²	165	123.6 Å²	123.6	86%	0.864	69%	0.694	S	S	*	*			trans	-129.5	54.4	145.8	-92.4	138.9	0	0	0	108	E245 C249	E245-L247 PolarHBondContact O-N 3.25Å; L247-C249 PolarHBondContact O-N 3.34Å
248	T	23	Very low	28.7	Very low	116 Å²	116	120.8 Å²	120.8	71%	0.712	68%	0.679	S	S	*	*			trans	-87.7	81.7	167	51	0	0	0	0	108.3	S250	T248-S250 PolarHBondContact O-N 3Å
249	C	26.2	Very low	29.4	Very low	67 Å²	67	120.2 Å²	120.2	45%	0.453	68%	0.675	S	S	.	*			trans	-85.5	101.2	160.3	-166.3	0	0	0	0	107.3	L247 S251	L247-C249 PolarHBondContact O-N 3.34Å; C249-S251 PolarHBondContact O-N 3.35Å
250	S	27.9	Very low	30.1	Very low	117 Å²	117	116.9 Å²	116.9	82%	0.818	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	15.5	-177.1	49.7	0	0	0	0	114.3	T248	T248-S250 PolarHBondContact O-N 3Å
251	S	32.2	Very low	31.6	Very low	78 Å²	78	117.2 Å²	117.2	55%	0.545	67%	0.667	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.1	4.6	179.9	55.6	0	0	0	0	115.7	C249	C249-S251 PolarHBondContact O-N 3.35Å
252	T	29.6	Very low	34	Very low	76 Å²	76	110.4 Å²	110.4	47%	0.466	63%	0.626	S	S	.	*			trans	-114.2	26.9	-178.6	45.2	0	0	0	0	114.7	N254 A255	T252-N254 PolarHBondContact O-N 2.98Å; T252-A255 WeakPolarHBondContact O-CB 3.39Å; T252-A255 PolarHBondContact O-N 3.35Å
253	C	26.7	Very low	36.7	Very low	117 Å²	117	105.9 Å²	105.9	79%	0.791	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-5.9	176.4	53	0	0	0	0	115.7
254	N	28.6	Very low	39.9	Very low	126 Å²	126	98.3 Å²	98.3	67%	0.674	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-8.2	172.4	-76.4	-18.9	0	0	0	115.2	T252 L258	T252-N254 PolarHBondContact O-N 2.98Å; N254-L258 WeakPolarHBondContact O-CD1 3.4Å; N254-L258 WeakPolarHBondContact O-CG 3.41Å
255	A	32.9	Very low	42.6	Very low	45 Å²	45	98.2 Å²	98.2	37%	0.372	57%	0.569	S	S	.	*	H	α-helix	trans	-71.1	-40.1	-173.9	0	0	0	0	0	113.4	T252 S257 L258 L259	T252-A255 WeakPolarHBondContact O-CB 3.39Å; T252-A255 PolarHBondContact O-N 3.35Å; A255-S257 PolarHBondContact O-N 3.36Å; A255-L258 PolarHBondContact O-N 3.32Å; A255-L259 WeakPolarHBondContact O-CD1 3.45Å; A255-L259 PolarHBondContact O-N 3.12Å
256	F	31.4	Very low	45.5	Very low	181 Å²	181	93.9 Å²	93.9	79%	0.794	55%	0.554	S	S	*	*	H	α-helix	trans	-67.5	-36.4	-174.5	-109	-87.1	0	0	0	113.8	L258 L259	F256-L258 VanDerWaalsContact C-N 3.35Å; F256-L259 PolarHBondContact O-N 3.48Å
257	S	32.8	Very low	48.6	Very low	95 Å²	95	90.8 Å²	90.8	66%	0.664	54%	0.543	S	S	*	.	H	α-helix	trans	-71.7	-27.6	175.6	-73.8	0	0	0	0	113.3	A255 S260	A255-S257 PolarHBondContact O-N 3.36Å; S257-S260 PolarHBondContact O-OG 3.07Å
258	L	37.2	Very low	51.5	Low	92 Å²	92	84.4 Å²	84.4	48%	0.482	51%	0.509	S	S	.	.	H	α-helix	trans	-76.7	-35.4	174.6	-71.3	168.7	0	0	0	111.7	N254 A255 F256 S260 S261 S262	N254-L258 WeakPolarHBondContact O-CD1 3.4Å; N254-L258 WeakPolarHBondContact O-CG 3.41Å; A255-L258 PolarHBondContact O-N 3.32Å; F256-L258 VanDerWaalsContact C-N 3.35Å; L258-S260 VanDerWaalsContact C-N 3.32Å; L258-S260 PolarHBondContact O-N 2.87Å; L258-S261 PolarHBondContact O-N 2.94Å; L258-S261 PolarHBondContact O-OG 2.97Å; L258-S261 VanDerWaalsContact O-OG 3.09Å; L258-S262 WeakPolarHBondContact O-CB 3.35Å; L258-S262 PolarHBondContact O-N 3.02Å; L258-S262 PolarHBondContact O-OG 2.87Å
259	L	46.5	Very low	54.5	Low	74 Å²	74	82.9 Å²	82.9	39%	0.387	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-35.1	-177.8	-89.7	149.7	0	0	0	113.5	L190 A255 F256	L190-L259 HydrophobicContact CD2-CD2 3.57Å; A255-L259 WeakPolarHBondContact O-CD1 3.45Å; A255-L259 PolarHBondContact O-N 3.12Å; F256-L259 PolarHBondContact O-N 3.48Å
260	S	48.1	Very low	57.4	Low	96 Å²	96	80.5 Å²	80.5	67%	0.671	48%	0.483	S	S	*	.	H	α-helix	trans	-74.8	-32.1	178.3	47.5	0	0	0	0	114.2	S257 L258	S257-S260 PolarHBondContact O-OG 3.07Å; L258-S260 VanDerWaalsContact C-N 3.32Å; L258-S260 PolarHBondContact O-N 2.87Å
261	S	58.9	Low	60.3	Low	77 Å²	77	79 Å²	79	54%	0.538	47%	0.469	S	S	.	.	H	α-helix	trans	-85.8	-8.5	178.6	55	0	0	0	0	113.6	L258	L258-S261 PolarHBondContact O-N 2.94Å; L258-S261 PolarHBondContact O-OG 2.97Å; L258-S261 VanDerWaalsContact O-OG 3.09Å
262	S	79.5	Confident	62.9	Low	5 Å²	5	78.8 Å²	78.8	4%	0.035	47%	0.467	C	S	.	.	S	Bend	trans	-78.1	-25.1	-176.2	-67.1	0	0	0	0	114.4	S187 Y188 L258	S187-S262 PolarHBondContact N-O 3.21Å; S187-S262 VanDerWaalsContact N-O 3.1Å; S187-S262 PolarHBondContact OG-O 3.3Å; Y188-S262 WeakPolarHBondContact CB-OG 3.46Å; L258-S262 WeakPolarHBondContact O-CB 3.35Å; L258-S262 PolarHBondContact O-N 3.02Å; L258-S262 PolarHBondContact O-OG 2.87Å
263	I	85.4	Confident	65.8	Low	33 Å²	33	75.3 Å²	75.3	17%	0.169	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.3	-177.2	-52.8	173.6	0	0	0	109.1	V184 S185 L190 I215	V184-I263 HydrophobicContact CB-CG2 3.69Å; V184-I263 HydrophobicContact CG1-CG2 3.85Å; V184-I263 HydrophobicContact CG2-CG2 3.86Å; S185-I263 WeakPolarHBondContact O-CA 3.47Å; L190-I263 HydrophobicContact CD1-CD1 3.49Å; L190-I263 VanDerWaalsContact CD1-CD1 3.49Å; L190-I263 HydrophobicContact CD1-CG1 3.39Å; I215-I263 HydrophobicContact CD1-CD1 4.21Å
264	S	88.3	Confident	68.8	Low	29 Å²	29	73.6 Å²	73.6	20%	0.203	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149	175.9	-178.6	0	0	0	0	110.9	V184 S185 T266	V184-S264 CarbonylContact C-O 3.36Å; V184-S264 WeakPolarHBondContact CA-O 3.4Å; V184-S264 VanDerWaalsContact CB-O 3.22Å; V184-S264 WeakPolarHBondContact CB-O 3.34Å; S185-S264 PolarHBondContact N-O 2.99Å; S185-S264 PolarHBondContact O-N 3.47Å; S185-S264 VanDerWaalsContact O-N 3.08Å; S264-T266 VanDerWaalsContact C-N 3.27Å; S264-T266 WeakPolarHBondContact CB-O 3.45Å; S264-T266 PolarHBondContact OG-N 2.97Å; S264-T266 VanDerWaalsContact OG-N 3.09Å; S264-T266 PolarHBondContact OG-O 3.1Å; S264-T266 PolarHBondContact OG-OG1 3.13Å; S264-T266 VanDerWaalsContact OG-OG1 3.05Å
265	T	85.2	Confident	71.7	Confident	101 Å²	101	68.7 Å²	68.7	62%	0.62	40%	0.404	S	S	*	.	S	Bend	trans	-83.4	-6.7	169.6	52	0	0	0	0	112.5	V182 V184 C204	V182-T265 HydrophobicContact CG1-CG2 4.13Å; V184-T265 HydrophobicContact CG1-CG2 4.27Å; C204-T265 PolarHBondContact SG-O 3.34Å
266	T	85.4	Confident	74.3	Confident	89 Å²	89	69.4 Å²	69.4	55%	0.546	40%	0.404	S	S	.	.	S	Bend	trans	-113.6	151.1	174.7	67.2	0	0	0	0	110.3	S185 S264	S185-T266 PolarHBondContact OG-O 3.49Å; S264-T266 VanDerWaalsContact C-N 3.27Å; S264-T266 WeakPolarHBondContact CB-O 3.45Å; S264-T266 PolarHBondContact OG-N 2.97Å; S264-T266 VanDerWaalsContact OG-N 3.09Å; S264-T266 PolarHBondContact OG-O 3.1Å; S264-T266 PolarHBondContact OG-OG1 3.13Å; S264-T266 VanDerWaalsContact OG-OG1 3.05Å
267	E	88.5	Confident	77.1	Confident	128 Å²	128	62.4 Å²	62.4	60%	0.598	37%	0.374	S	S	*	.			trans	-55.6	142.6	176.6	-61.1	-170.2	156.4	0	0	111.9	P202 C204 P269	P202-E267 WeakPolarHBondContact O-CA 3.4Å; C204-E267 PolarHBondContact SG-N 3.48Å; C204-E267 VanDerWaalsContact SG-N 3.39Å; E267-P269 WeakPolarHBondContact O-CD 3.33Å
268	Q	86.4	Confident	80	Confident	31 Å²	31	57.9 Å²	57.9	15%	0.145	34%	0.342	C	S	.	.			trans	-112.1	90.8	177.9	-73.1	176.1	-55.6	0	0	108.1	S185 S187 P202 W273	S185-Q268 VanDerWaalsContact OG-CG 3.29Å; S185-Q268 WeakPolarHBondContact OG-CG 3.27Å; S185-Q268 PolarHBondContact OG-OE1 3.48Å; S187-Q268 VanDerWaalsContact CB-OE1 3.3Å; S187-Q268 PolarHBondContact OG-NE2 2.97Å; S187-Q268 PolarHBondContact OG-OE1 3.11Å; P202-Q268 WeakPolarHBondContact CB-O 3.44Å; P202-Q268 PolarHBondContact O-N 3.39Å; Q268-W273 PolarHBondContact O-NE1 3.41Å
269	P	87	Confident	82.5	Confident	83 Å²	83	53.5 Å²	53.5	54%	0.539	32%	0.319	S	S	.	.			trans	-58.8	143.9	-173	25	-34.8	0	0	0	110.9	E267 V271 S272	E267-P269 WeakPolarHBondContact O-CD 3.33Å; P269-V271 PolarHBondContact O-N 2.95Å; P269-V271 VanDerWaalsContact O-N 3.07Å; P269-S272 PolarHBondContact O-N 3.04Å; P269-S272 PolarHBondContact O-OG 3.4Å
270	L	88	Confident	84.7	Confident	18 Å²	18	50.5 Å²	50.5	9%	0.094	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-53.9	-36.6	-176.1	-70.3	175.3	0	0	0	112.8	P202 S272 W273 G301 L304 L333 Q334	P202-L270 HydrophobicContact CB-CD2 4.06Å; P202-L270 HydrophobicContact CB-CG 4.42Å; P202-L270 HydrophobicContact CG-CD2 3.97Å; P202-L270 HydrophobicContact CG-CG 4.33Å; L270-S272 PolarHBondContact O-N 3.33Å; L270-W273 HydrophobicContact CD2-CD2 4.08Å; L270-W273 HydrophobicContact CD2-CE3 4.32Å; L270-W273 HydrophobicContact CD2-CH2 4.44Å; L270-W273 HydrophobicContact CD2-CZ2 4.22Å; L270-W273 HydrophobicContact CD2-CZ3 4.49Å; L270-W273 VanDerWaalsContact O-CB 3.3Å; L270-W273 WeakPolarHBondContact O-CB 3.33Å; L270-W273 PolarHBondContact O-N 3Å; L270-G301 CarbonylContact C-O 3.48Å; L270-G301 CarbonylContact O-C 3.57Å; L270-G301 VanDerWaalsContact O-C 3.32Å; L270-G301 WeakPolarHBondContact O-CA 3.35Å; L270-L304 HydrophobicContact CD1-CB 4.49Å; L270-L333 HydrophobicContact CD2-CD2 3.66Å; L270-L333 HydrophobicContact CD2-CG 3.89Å; L270-Q334 HydrophobicContact CD1-CG 3.88Å
271	V	87.5	Confident	86.9	Confident	84 Å²	84	46.4 Å²	46.4	51%	0.509	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-49.7	-29.6	174.6	175.7	0	0	0	0	113.4	P269 W273 N302	P269-V271 PolarHBondContact O-N 2.95Å; P269-V271 VanDerWaalsContact O-N 3.07Å; V271-W273 VanDerWaalsContact C-N 3.33Å; V271-N302 WeakPolarHBondContact CA-OD1 3.26Å; V271-N302 WeakPolarHBondContact CB-OD1 3.44Å; V271-N302 WeakPolarHBondContact CG1-OD1 3.26Å; V271-N302 PolarHBondContact O-OD1 2.97Å
272	S	86.9	Confident	88.6	Confident	74 Å²	74	42.8 Å²	42.8	52%	0.517	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-83	-7.2	178.7	72.3	0	0	0	0	114.3	P269 L270	P269-S272 PolarHBondContact O-N 3.04Å; P269-S272 PolarHBondContact O-OG 3.4Å; L270-S272 PolarHBondContact O-N 3.33Å
273	W	90.6	Very high	89.1	Confident	3 Å²	3	42.6 Å²	42.6	1%	0.011	25%	0.246	C	C	.	.			trans	-80.1	131.7	-176.1	-69.7	31.5	0	0	0	111.4	V200 P202 Q268 L270 V271 Q277 V278 W281 G301 L333	V200-W273 HydrophobicContact CG1-CH2 3.53Å; V200-W273 HydrophobicContact CG1-CZ3 4.11Å; P202-W273 HydrophobicContact CB-CZ2 3.86Å; P202-W273 HydrophobicContact CG-CZ2 4.42Å; Q268-W273 PolarHBondContact O-NE1 3.41Å; L270-W273 HydrophobicContact CD2-CD2 4.08Å; L270-W273 HydrophobicContact CD2-CE3 4.32Å; L270-W273 HydrophobicContact CD2-CH2 4.44Å; L270-W273 HydrophobicContact CD2-CZ2 4.22Å; L270-W273 HydrophobicContact CD2-CZ3 4.49Å; L270-W273 VanDerWaalsContact O-CB 3.3Å; L270-W273 WeakPolarHBondContact O-CB 3.33Å; L270-W273 PolarHBondContact O-N 3Å; V271-W273 VanDerWaalsContact C-N 3.33Å; W273-Q277 VanDerWaalsContact CA-OE1 3.27Å; W273-Q277 HydrophobicContact CB-CB 4.42Å; W273-Q277 HydrophobicContact CD2-CB 4.45Å; W273-Q277 HydrophobicContact CE3-CB 4.15Å; W273-V278 HydrophobicContact CB-CG2 4.49Å; W273-W281 HydrophobicContact CZ3-CB 4.21Å; W273-W281 HydrophobicContact CZ3-CG 4.44Å; W273-G301 PolarHBondContact O-N 2.89Å; W273-L333 HydrophobicContact CH2-CD1 3.97Å; W273-L333 HydrophobicContact CH2-CD2 4.41Å; W273-L333 HydrophobicContact CZ3-CD1 4.4Å; W273-L333 HydrophobicContact CZ3-CD2 4.1Å
274	N	89	Confident	89.4	Confident	81 Å²	81	42 Å²	42	43%	0.433	24%	0.244	S	C	.	.			trans	-84.2	167.3	174.6	64	43.2	0	0	0	112.1	T276 Q277 V278	N274-T276 PolarHBondContact O-N 2.9Å; N274-T276 VanDerWaalsContact O-N 3.16Å; N274-T276 WeakPolarHBondContact OD1-CA 3.17Å; N274-T276 VanDerWaalsContact OD1-CB 3.3Å; N274-T276 WeakPolarHBondContact OD1-CB 3.32Å; N274-T276 PolarHBondContact OD1-N 3.47Å; N274-T276 VanDerWaalsContact OD1-N 3.09Å; N274-Q277 PolarHBondContact ND2-OE1 3.15Å; N274-Q277 PolarHBondContact O-N 3.47Å; N274-Q277 WeakPolarHBondContact OD1-CG 3.36Å; N274-Q277 PolarHBondContact OD1-N 3.37Å; N274-Q277 PolarHBondContact OD1-OE1 3.35Å; N274-V278 WeakPolarHBondContact O-CG2 3.49Å; N274-V278 PolarHBondContact O-N 2.9Å; N274-V278 VanDerWaalsContact O-N 3.15Å
275	C	89.4	Confident	89.5	Confident	23 Å²	23	41.9 Å²	41.9	16%	0.155	24%	0.243	C	C	.	.	H	α-helix	trans	-56.6	-31.8	178.6	-71.9	0	0	0	0	113.2	V278 A279 N298	C275-V278 PolarHBondContact O-N 3.31Å; C275-A279 WeakPolarHBondContact O-CB 3.39Å; C275-A279 PolarHBondContact O-N 3.11Å; C275-N298 VanDerWaalsContact SG-C 3.59Å; C275-N298 PolarHBondContact SG-OD1 3.47Å
276	T	88.4	Confident	89.8	Confident	61 Å²	61	38 Å²	38	37%	0.374	22%	0.222	S	C	.	.	H	α-helix	trans	-67.9	-46.6	178.8	-55.4	0	0	0	0	111.1	N274 V278 A279 H280 M667	N274-T276 PolarHBondContact O-N 2.9Å; N274-T276 VanDerWaalsContact O-N 3.16Å; N274-T276 WeakPolarHBondContact OD1-CA 3.17Å; N274-T276 VanDerWaalsContact OD1-CB 3.3Å; N274-T276 WeakPolarHBondContact OD1-CB 3.32Å; N274-T276 PolarHBondContact OD1-N 3.47Å; N274-T276 VanDerWaalsContact OD1-N 3.09Å; T276-V278 VanDerWaalsContact C-N 3.31Å; T276-V278 PolarHBondContact O-N 3.06Å; T276-A279 WeakPolarHBondContact O-CB 3.25Å; T276-A279 PolarHBondContact O-N 3.44Å; T276-H280 VanDerWaalsContact CG2-CE1 3.45Å; T276-H280 WeakPolarHBondContact CG2-CE1 3.35Å; T276-H280 PolarHBondContact O-N 3.26Å; T276-H280 PolarHBondContact O-ND1 3.04Å; T276-M667 HydrophobicContact CG2-CE 4.25Å; T276-M667 HydrophobicContact CG2-CG 4.33Å; T276-M667 HydrophobicContact CG2-SD 3.95Å
277	Q	90.9	Very high	90	Very high	33 Å²	33	33.7 Å²	33.7	15%	0.154	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-42.6	175.7	-72.7	165.3	-50.7	0	0	111	S187 W273 N274 A279 H280 W281	S187-Q277 PolarHBondContact OG-NE2 3.47Å; W273-Q277 VanDerWaalsContact CA-OE1 3.27Å; W273-Q277 HydrophobicContact CB-CB 4.42Å; W273-Q277 HydrophobicContact CD2-CB 4.45Å; W273-Q277 HydrophobicContact CE3-CB 4.15Å; N274-Q277 PolarHBondContact ND2-OE1 3.15Å; N274-Q277 PolarHBondContact O-N 3.47Å; N274-Q277 WeakPolarHBondContact OD1-CG 3.36Å; N274-Q277 PolarHBondContact OD1-N 3.37Å; N274-Q277 PolarHBondContact OD1-OE1 3.35Å; Q277-A279 PolarHBondContact O-N 2.95Å; Q277-H280 PolarHBondContact O-N 3.27Å; Q277-W281 WeakPolarHBondContact O-CB 3.41Å; Q277-W281 PolarHBondContact O-N 3.46Å
278	V	92.2	Very high	89.9	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.8	-42.4	174.8	175.9	0	0	0	0	111.8	W273 N274 C275 T276 H280 W281 L282 F294 L304	W273-V278 HydrophobicContact CB-CG2 4.49Å; N274-V278 WeakPolarHBondContact O-CG2 3.49Å; N274-V278 PolarHBondContact O-N 2.9Å; N274-V278 VanDerWaalsContact O-N 3.15Å; C275-V278 PolarHBondContact O-N 3.31Å; T276-V278 VanDerWaalsContact C-N 3.31Å; T276-V278 PolarHBondContact O-N 3.06Å; V278-H280 PolarHBondContact O-N 3.44Å; V278-W281 HydrophobicContact CG1-CE3 4.29Å; V278-W281 PolarHBondContact O-N 3.3Å; V278-L282 HydrophobicContact CG1-CD1 4.25Å; V278-L282 HydrophobicContact CG1-CG 4.49Å; V278-L282 WeakPolarHBondContact O-CG 3.18Å; V278-L282 PolarHBondContact O-N 3.38Å; V278-F294 HydrophobicContact CG1-CD1 3.76Å; V278-F294 HydrophobicContact CG1-CE1 4.29Å; V278-L304 HydrophobicContact CB-CD1 4.35Å; V278-L304 HydrophobicContact CG1-CD1 3.94Å; V278-L304 HydrophobicContact CG1-CG 4.47Å; V278-L304 HydrophobicContact CG2-CD1 3.58Å; V278-L304 HydrophobicContact CG2-CG 4.34Å
279	A	91.1	Very high	89.8	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-62.4	-41.7	177.2	0	0	0	0	0	112.6	C275 T276 Q277 L282 A283 V291 I295 A666	C275-A279 WeakPolarHBondContact O-CB 3.39Å; C275-A279 PolarHBondContact O-N 3.11Å; T276-A279 WeakPolarHBondContact O-CB 3.25Å; T276-A279 PolarHBondContact O-N 3.44Å; Q277-A279 PolarHBondContact O-N 2.95Å; A279-L282 PolarHBondContact O-N 3.37Å; A279-A283 PolarHBondContact O-N 3.14Å; A279-A283 VanDerWaalsContact O-N 3.08Å; A279-V291 HydrophobicContact CB-CG1 3.76Å; A279-V291 WeakPolarHBondContact O-CG2 3.37Å; A279-I295 HydrophobicContact CB-CD1 4.07Å; A279-I295 HydrophobicContact CB-CG1 4.28Å; A279-A666 HydrophobicContact CB-CB 4.11Å
280	H	92.5	Very high	89.8	Confident	11 Å²	11	28.6 Å²	28.6	5%	0.051	16%	0.164	C	C	.	.	H	α-helix	trans	-66.9	-41.8	176	-74	79.7	0	0	0	112.1	Y188 P189 T276 Q277 V278 A283 V284 M667	Y188-H280 HydrophobicContact CE2-CB 4.45Å; Y188-H280 AromaticContact CE2-CD2 3.28Å; Y188-H280 WeakPolarHBondContact CE2-CD2 3.43Å; Y188-H280 AromaticContact CE2-CE1 3.76Å; Y188-H280 AromaticContact CE2-CG 3.71Å; Y188-H280 AromaticContact CE2-ND1 3.98Å; Y188-H280 AromaticContact CE2-NE2 3.34Å; Y188-H280 VanDerWaalsContact CE2-NE2 3.34Å; Y188-H280 WeakPolarHBondContact CE2-NE2 3.45Å; Y188-H280 AromaticContact CZ-CD2 3.38Å; Y188-H280 AromaticContact CZ-NE2 3.52Å; Y188-H280 PolarHBondContact OH-CD2 2.88Å; Y188-H280 PolarHBondContact OH-NE2 2.86Å; P189-H280 HydrophobicContact CG-CB 3.86Å; T276-H280 VanDerWaalsContact CG2-CE1 3.45Å; T276-H280 WeakPolarHBondContact CG2-CE1 3.35Å; T276-H280 PolarHBondContact O-N 3.26Å; T276-H280 PolarHBondContact O-ND1 3.04Å; Q277-H280 PolarHBondContact O-N 3.27Å; V278-H280 PolarHBondContact O-N 3.44Å; H280-A283 WeakPolarHBondContact O-CB 3.41Å; H280-A283 PolarHBondContact O-N 2.73Å; H280-V284 PolarHBondContact O-N 3.33Å; H280-V284 VanDerWaalsContact O-N 3.11Å; H280-M667 WeakPolarHBondContact CE1-CG 3.47Å
281	W	94	Very high	89.7	Confident	10 Å²	10	28 Å²	28	4%	0.038	16%	0.161	C	C	.	.	H	α-helix	trans	-59.7	-47.7	173.6	165.6	73.5	0	0	0	111.8	V200 W273 Q277 V278 A283 V284 V285 L304 A329 I330 L333	V200-W281 HydrophobicContact CG1-CB 4.37Å; V200-W281 HydrophobicContact CG1-CG 4.43Å; W273-W281 HydrophobicContact CZ3-CB 4.21Å; W273-W281 HydrophobicContact CZ3-CG 4.44Å; Q277-W281 WeakPolarHBondContact O-CB 3.41Å; Q277-W281 PolarHBondContact O-N 3.46Å; V278-W281 HydrophobicContact CG1-CE3 4.29Å; V278-W281 PolarHBondContact O-N 3.3Å; W281-A283 PolarHBondContact O-N 3Å; W281-V284 PolarHBondContact O-N 3.4Å; W281-V285 HydrophobicContact CG-CG2 4.47Å; W281-V285 HydrophobicContact CZ2-CG2 4.38Å; W281-V285 WeakPolarHBondContact O-CG2 3.45Å; W281-V285 PolarHBondContact O-N 3.45Å; W281-L304 HydrophobicContact CE3-CD1 4.29Å; W281-L304 HydrophobicContact CZ3-CD1 4.23Å; W281-L304 HydrophobicContact CZ3-CD2 4.16Å; W281-A329 HydrophobicContact CH2-CB 4.34Å; W281-A329 HydrophobicContact CZ2-CB 4.06Å; W281-I330 HydrophobicContact CH2-CG1 3.8Å; W281-L333 HydrophobicContact CD2-CD2 3.92Å; W281-L333 HydrophobicContact CE3-CD2 4.39Å; W281-L333 HydrophobicContact CG-CD2 4.32Å; W281-L333 HydrophobicContact CH2-CD2 4.46Å; W281-L333 HydrophobicContact CZ2-CB 4.08Å; W281-L333 HydrophobicContact CZ2-CD2 3.99Å
282	L	93.5	Very high	89.4	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-57.7	-37.4	175.8	-76.4	172	0	0	0	112.1	V278 A279 L287 C288 F290 V291 F294 L326	V278-L282 HydrophobicContact CG1-CD1 4.25Å; V278-L282 HydrophobicContact CG1-CG 4.49Å; V278-L282 WeakPolarHBondContact O-CG 3.18Å; V278-L282 PolarHBondContact O-N 3.38Å; A279-L282 PolarHBondContact O-N 3.37Å; L282-L287 HydrophobicContact CB-CB 4.4Å; L282-L287 HydrophobicContact CD2-CB 3.78Å; L282-L287 HydrophobicContact CD2-CD1 3.94Å; L282-L287 CarbonylContact O-C 3.57Å; L282-L287 VanDerWaalsContact O-CA 3.3Å; L282-L287 WeakPolarHBondContact O-CA 3.46Å; L282-L287 WeakPolarHBondContact O-CB 3.26Å; L282-L287 PolarHBondContact O-N 3.44Å; L282-C288 PolarHBondContact O-N 2.77Å; L282-F290 HydrophobicContact CD1-CB 4.41Å; L282-V291 HydrophobicContact CB-CG2 3.76Å; L282-V291 HydrophobicContact CD1-CG2 4.33Å; L282-F294 HydrophobicContact CD1-CB 3.96Å; L282-F294 HydrophobicContact CD1-CD1 3.83Å; L282-F294 HydrophobicContact CD1-CD2 3.91Å; L282-F294 HydrophobicContact CD1-CE1 4.28Å; L282-F294 HydrophobicContact CD1-CE2 4.36Å; L282-F294 HydrophobicContact CD1-CG 3.62Å; L282-L326 HydrophobicContact CD2-CD1 4.07Å
283	A	91.1	Very high	89.2	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-47.6	178	0	0	0	0	0	111.9	A279 H280 W281 V285 G286 C288 A666	A279-A283 PolarHBondContact O-N 3.14Å; A279-A283 VanDerWaalsContact O-N 3.08Å; H280-A283 WeakPolarHBondContact O-CB 3.41Å; H280-A283 PolarHBondContact O-N 2.73Å; W281-A283 PolarHBondContact O-N 3Å; A283-V285 PolarHBondContact O-N 3.39Å; A283-G286 PolarHBondContact O-N 3.39Å; A283-G286 VanDerWaalsContact O-N 3.11Å; A283-C288 VanDerWaalsContact CA-SG 3.51Å; A283-C288 PolarHBondContact O-SG 3.35Å; A283-A666 HydrophobicContact CB-CB 4.22Å
284	V	91.3	Very high	89	Confident	20 Å²	20	30.8 Å²	30.8	12%	0.121	16%	0.157	C	C	.	.	H	α-helix	trans	-66.1	-36.7	-178.8	166.6	0	0	0	0	113.1	P189 Y198 H280 W281 G286 I662 T663	P189-V284 HydrophobicContact CB-CG2 3.7Å; P189-V284 HydrophobicContact CG-CG2 3.8Å; Y198-V284 HydrophobicContact CD1-CG2 4.08Å; Y198-V284 HydrophobicContact CD2-CB 4.43Å; Y198-V284 HydrophobicContact CD2-CG1 3.92Å; Y198-V284 HydrophobicContact CD2-CG2 3.74Å; Y198-V284 HydrophobicContact CE1-CG2 4.37Å; Y198-V284 HydrophobicContact CE2-CG2 4.08Å; Y198-V284 HydrophobicContact CG-CB 4.45Å; Y198-V284 HydrophobicContact CG-CG1 3.81Å; Y198-V284 HydrophobicContact CG-CG2 3.74Å; H280-V284 PolarHBondContact O-N 3.33Å; H280-V284 VanDerWaalsContact O-N 3.11Å; W281-V284 PolarHBondContact O-N 3.4Å; V284-G286 PolarHBondContact O-N 3.32Å; V284-I662 HydrophobicContact CG2-CG2 4.02Å; V284-T663 HydrophobicContact CG2-CG2 4.13Å
285	V	91.5	Very high	88.8	Confident	28 Å²	28	29.9 Å²	29.9	17%	0.17	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-4.5	176.8	-177.7	0	0	0	0	112.2	W281 A283 L287 A329 L387 G388	W281-V285 HydrophobicContact CG-CG2 4.47Å; W281-V285 HydrophobicContact CZ2-CG2 4.38Å; W281-V285 WeakPolarHBondContact O-CG2 3.45Å; W281-V285 PolarHBondContact O-N 3.45Å; A283-V285 PolarHBondContact O-N 3.39Å; V285-L287 HydrophobicContact CB-CD1 4.3Å; V285-L287 HydrophobicContact CB-CG 4.26Å; V285-L287 HydrophobicContact CG1-CD1 3.85Å; V285-L287 HydrophobicContact CG1-CG 3.98Å; V285-A329 HydrophobicContact CG1-CB 3.89Å; V285-L387 HydrophobicContact CG1-CB 3.82Å; V285-L387 HydrophobicContact CG1-CD1 4.33Å; V285-G388 WeakPolarHBondContact O-CA 3.37Å
286	G	90.2	Very high	88.3	Confident	18 Å²	18	36.8 Å²	36.8	19%	0.186	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	28.6	-177.3	0	0	0	0	0	113.1	A283 V284 F389	A283-G286 PolarHBondContact O-N 3.39Å; A283-G286 VanDerWaalsContact O-N 3.11Å; V284-G286 PolarHBondContact O-N 3.32Å; G286-F389 PolarHBondContact O-N 3.23Å
287	L	91	Very high	87.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.172	C	C	.	.			trans	-110.2	23.8	178.3	-57.1	178.4	0	0	0	111.8	L282 V285 R289 F290 T325 L326 A329 F389	L282-L287 HydrophobicContact CB-CB 4.4Å; L282-L287 HydrophobicContact CD2-CB 3.78Å; L282-L287 HydrophobicContact CD2-CD1 3.94Å; L282-L287 CarbonylContact O-C 3.57Å; L282-L287 VanDerWaalsContact O-CA 3.3Å; L282-L287 WeakPolarHBondContact O-CA 3.46Å; L282-L287 WeakPolarHBondContact O-CB 3.26Å; L282-L287 PolarHBondContact O-N 3.44Å; V285-L287 HydrophobicContact CB-CD1 4.3Å; V285-L287 HydrophobicContact CB-CG 4.26Å; V285-L287 HydrophobicContact CG1-CD1 3.85Å; V285-L287 HydrophobicContact CG1-CG 3.98Å; L287-R289 PolarHBondContact O-N 2.91Å; L287-F290 HydrophobicContact CB-CD2 4.29Å; L287-F290 PolarHBondContact O-N 3.06Å; L287-T325 HydrophobicContact CD2-CG2 4.15Å; L287-L326 HydrophobicContact CD1-CD1 3.8Å; L287-A329 HydrophobicContact CD1-CB 3.71Å; L287-F389 HydrophobicContact CD2-CD2 3.69Å; L287-F389 HydrophobicContact CD2-CE1 4.25Å; L287-F389 HydrophobicContact CD2-CE2 3.12Å; L287-F389 HydrophobicContact CD2-CG 4.46Å; L287-F389 HydrophobicContact CD2-CZ 3.45Å; L287-F389 VanDerWaalsContact CD2-CZ 3.45Å; L287-F389 HydrophobicContact CG-CE2 4.37Å
288	C	85.6	Confident	87.5	Confident	33 Å²	33	39.9 Å²	39.9	22%	0.223	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-47.3	-34.9	-176.2	-59.2	0	0	0	0	114.1	L282 A283 F290 V291 I665	L282-C288 PolarHBondContact O-N 2.77Å; A283-C288 VanDerWaalsContact CA-SG 3.51Å; A283-C288 PolarHBondContact O-SG 3.35Å; C288-F290 PolarHBondContact O-N 2.94Å; C288-F290 VanDerWaalsContact O-N 3.1Å; C288-V291 WeakPolarHBondContact O-CB 3.46Å; C288-V291 WeakPolarHBondContact O-CG2 3Å; C288-V291 PolarHBondContact O-N 3.49Å; C288-I665 HydrophobicContact CB-CG2 3.97Å
289	R	83.8	Confident	87.2	Confident	85 Å²	85	40.5 Å²	40.5	32%	0.321	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-56.9	-26.1	178.2	66	169.6	164.7	178.8	-11.8	113.8	L287 F389	L287-R289 PolarHBondContact O-N 2.91Å; R289-F389 HydrophobicContact CG-CD2 4.12Å; R289-F389 HydrophobicContact CG-CE2 4.13Å; R289-F389 VanDerWaalsContact CZ-CE2 3.49Å; R289-F389 VanDerWaalsContact NH2-CD2 3.31Å
290	F	86.9	Confident	87	Confident	16 Å²	16	42.4 Å²	42.4	7%	0.07	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-90	-11.5	179.4	-66.9	-61.6	0	0	0	113.9	L282 L287 C288 R292 L293 F294 V317 A322 L326 F389	L282-F290 HydrophobicContact CD1-CB 4.41Å; L287-F290 HydrophobicContact CB-CD2 4.29Å; L287-F290 PolarHBondContact O-N 3.06Å; C288-F290 PolarHBondContact O-N 2.94Å; C288-F290 VanDerWaalsContact O-N 3.1Å; F290-R292 PolarHBondContact O-N 3.47Å; F290-L293 HydrophobicContact CD1-CD2 4.03Å; F290-L293 WeakPolarHBondContact O-CB 3.27Å; F290-L293 PolarHBondContact O-N 3.09Å; F290-F294 HydrophobicContact CB-CD2 3.96Å; F290-F294 HydrophobicContact CB-CE2 3.99Å; F290-F294 VanDerWaalsContact O-CD2 3.29Å; F290-F294 WeakPolarHBondContact O-CD2 3.4Å; F290-F294 PolarHBondContact O-N 2.77Å; F290-V317 HydrophobicContact CE1-CG1 4.3Å; F290-V317 HydrophobicContact CE1-CG2 3.91Å; F290-V317 HydrophobicContact CZ-CG1 3.97Å; F290-V317 HydrophobicContact CZ-CG2 4.14Å; F290-A322 HydrophobicContact CZ-CB 4.23Å; F290-L326 HydrophobicContact CD1-CD2 4.45Å; F290-L326 HydrophobicContact CD2-CD1 4.19Å; F290-L326 HydrophobicContact CD2-CD2 4.1Å; F290-L326 HydrophobicContact CE1-CD2 4.37Å; F290-L326 HydrophobicContact CE2-CB 4.19Å; F290-L326 HydrophobicContact CE2-CD2 3.97Å; F290-L326 HydrophobicContact CE2-CG 4.47Å; F290-L326 HydrophobicContact CG-CD2 4.33Å; F290-L326 HydrophobicContact CZ-CD2 4.13Å; F290-F389 AromaticContact CD2-CE2 3.96Å; F290-F389 HydrophobicContact CD2-CE2 3.96Å; F290-F389 AromaticContact CE2-CE2 3.44Å; F290-F389 HydrophobicContact CE2-CE2 3.44Å; F290-F389 VanDerWaalsContact CE2-CE2 3.44Å; F290-F389 AromaticContact CE2-CZ 3.69Å; F290-F389 HydrophobicContact CE2-CZ 3.69Å; F290-F389 HydrophobicContact CZ-CE2 4.43Å
291	V	87.3	Confident	86.7	Confident	5 Å²	5	41.9 Å²	41.9	3%	0.03	20%	0.204	C	C	.	.	H	α-helix	trans	-55.9	-50.9	-177.1	170.7	0	0	0	0	111.6	A279 L282 C288 L293 F294 I295 A666	A279-V291 HydrophobicContact CB-CG1 3.76Å; A279-V291 WeakPolarHBondContact O-CG2 3.37Å; L282-V291 HydrophobicContact CB-CG2 3.76Å; L282-V291 HydrophobicContact CD1-CG2 4.33Å; C288-V291 WeakPolarHBondContact O-CB 3.46Å; C288-V291 WeakPolarHBondContact O-CG2 3Å; C288-V291 PolarHBondContact O-N 3.49Å; V291-L293 VanDerWaalsContact C-N 3.28Å; V291-L293 PolarHBondContact O-N 2.79Å; V291-F294 PolarHBondContact O-N 3.43Å; V291-I295 HydrophobicContact CG1-CD1 3.64Å; V291-I295 HydrophobicContact CG1-CG1 4.36Å; V291-I295 WeakPolarHBondContact O-CG1 3.42Å; V291-I295 PolarHBondContact O-N 2.96Å; V291-A666 HydrophobicContact CG1-CB 4.17Å
292	R	81.3	Confident	86.3	Confident	137 Å²	137	44.3 Å²	44.3	52%	0.517	22%	0.218	S	C	.	.	H	α-helix	trans	-62	-36.7	178.7	-174	-178.8	174.5	103.8	-2.3	112	F290 K296	F290-R292 PolarHBondContact O-N 3.47Å; R292-K296 WeakPolarHBondContact O-CB 3.47Å; R292-K296 PolarHBondContact O-N 3.45Å
293	L	82.3	Confident	86	Confident	76 Å²	76	45.5 Å²	45.5	40%	0.398	22%	0.223	S	C	.	.	H	α-helix	trans	-65.7	-46.1	177.3	-179.4	66.4	0	0	0	110.7	F290 V291 K296 L297	F290-L293 HydrophobicContact CD1-CD2 4.03Å; F290-L293 WeakPolarHBondContact O-CB 3.27Å; F290-L293 PolarHBondContact O-N 3.09Å; V291-L293 VanDerWaalsContact C-N 3.28Å; V291-L293 PolarHBondContact O-N 2.79Å; L293-K296 PolarHBondContact O-N 3.38Å; L293-L297 HydrophobicContact CD1-CD1 3.71Å; L293-L297 HydrophobicContact CD1-CG 4.17Å; L293-L297 HydrophobicContact CG-CD1 3.98Å; L293-L297 VanDerWaalsContact O-CB 3.31Å; L293-L297 WeakPolarHBondContact O-CB 3.31Å; L293-L297 VanDerWaalsContact O-CG 3.31Å; L293-L297 WeakPolarHBondContact O-CG 3.21Å; L293-L297 PolarHBondContact O-N 3.3Å
294	F	86.6	Confident	85.8	Confident	8 Å²	8	45.4 Å²	45.4	4%	0.035	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-44.3	179.8	-86	-119.7	0	0	0	111.7	V278 L282 F290 V291 L297 N298 L299 F303 L304 L326	V278-F294 HydrophobicContact CG1-CD1 3.76Å; V278-F294 HydrophobicContact CG1-CE1 4.29Å; L282-F294 HydrophobicContact CD1-CB 3.96Å; L282-F294 HydrophobicContact CD1-CD1 3.83Å; L282-F294 HydrophobicContact CD1-CD2 3.91Å; L282-F294 HydrophobicContact CD1-CE1 4.28Å; L282-F294 HydrophobicContact CD1-CE2 4.36Å; L282-F294 HydrophobicContact CD1-CG 3.62Å; F290-F294 HydrophobicContact CB-CD2 3.96Å; F290-F294 HydrophobicContact CB-CE2 3.99Å; F290-F294 VanDerWaalsContact O-CD2 3.29Å; F290-F294 WeakPolarHBondContact O-CD2 3.4Å; F290-F294 PolarHBondContact O-N 2.77Å; V291-F294 PolarHBondContact O-N 3.43Å; F294-L297 CarbonylContact O-C 3.32Å; F294-L297 PolarHBondContact O-N 3.49Å; F294-N298 PolarHBondContact O-N 3.17Å; F294-L299 HydrophobicContact CB-CB 4.28Å; F294-L299 HydrophobicContact CD1-CB 3.64Å; F294-L299 HydrophobicContact CD1-CD1 4Å; F294-L299 HydrophobicContact CD1-CG 4.45Å; F294-L299 HydrophobicContact CD2-CD1 4.13Å; F294-L299 HydrophobicContact CE1-CB 4.23Å; F294-L299 HydrophobicContact CE1-CD1 4.16Å; F294-L299 HydrophobicContact CE2-CD1 4.29Å; F294-L299 HydrophobicContact CG-CB 4.09Å; F294-L299 HydrophobicContact CG-CD1 4Å; F294-L299 HydrophobicContact CZ-CD1 4.31Å; F294-L299 PolarHBondContact O-N 3.17Å; F294-F303 HydrophobicContact CE1-CD1 4.14Å; F294-F303 AromaticContact CE1-CE1 3.89Å; F294-F303 HydrophobicContact CE1-CE1 3.89Å; F294-F303 HydrophobicContact CZ-CE1 4.06Å; F294-L304 HydrophobicContact CE1-CD2 4.08Å; F294-L326 HydrophobicContact CE2-CD2 4.28Å; F294-L326 HydrophobicContact CZ-CD1 4.23Å; F294-L326 HydrophobicContact CZ-CD2 4.37Å
295	I	84.5	Confident	85.5	Confident	62 Å²	62	46.6 Å²	46.6	32%	0.318	23%	0.232	S	C	.	.	H	α-helix	trans	-62.5	-47.9	175	-66.6	171.2	0	0	0	110.6	A279 V291 L297 N298 M669	A279-I295 HydrophobicContact CB-CD1 4.07Å; A279-I295 HydrophobicContact CB-CG1 4.28Å; V291-I295 HydrophobicContact CG1-CD1 3.64Å; V291-I295 HydrophobicContact CG1-CG1 4.36Å; V291-I295 WeakPolarHBondContact O-CG1 3.42Å; V291-I295 PolarHBondContact O-N 2.96Å; I295-L297 VanDerWaalsContact C-N 3.26Å; I295-L297 PolarHBondContact O-N 3.39Å; I295-N298 PolarHBondContact O-N 3.25Å; I295-M669 HydrophobicContact CD1-CE 4.2Å
296	K	79.1	Confident	85	Confident	168 Å²	168	52.6 Å²	52.6	73%	0.73	26%	0.258	S	S	*	.	H	α-helix	trans	-62.1	-34.1	-179.6	-178.4	178	178.1	-177.4	0	112.6	R292 L293	R292-K296 WeakPolarHBondContact O-CB 3.47Å; R292-K296 PolarHBondContact O-N 3.45Å; L293-K296 PolarHBondContact O-N 3.38Å
297	L	80.4	Confident	84.3	Confident	46 Å²	46	51.9 Å²	51.9	24%	0.241	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	0.5	177.7	-67.2	-179.9	0	0	0	113.2	L293 F294 I295 L299	L293-L297 HydrophobicContact CD1-CD1 3.71Å; L293-L297 HydrophobicContact CD1-CG 4.17Å; L293-L297 HydrophobicContact CG-CD1 3.98Å; L293-L297 VanDerWaalsContact O-CB 3.31Å; L293-L297 WeakPolarHBondContact O-CB 3.31Å; L293-L297 VanDerWaalsContact O-CG 3.31Å; L293-L297 WeakPolarHBondContact O-CG 3.21Å; L293-L297 PolarHBondContact O-N 3.3Å; F294-L297 CarbonylContact O-C 3.32Å; F294-L297 PolarHBondContact O-N 3.49Å; I295-L297 VanDerWaalsContact C-N 3.26Å; I295-L297 PolarHBondContact O-N 3.39Å; L297-L299 HydrophobicContact CB-CD1 4.09Å; L297-L299 HydrophobicContact CB-CD2 4.16Å; L297-L299 HydrophobicContact CB-CG 3.71Å; L297-L299 HydrophobicContact CD1-CD1 4.15Å; L297-L299 PolarHBondContact O-N 3.49Å
298	N	82	Confident	83.3	Confident	112 Å²	112	55 Å²	55	60%	0.599	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	43.1	-175.4	-163.1	62	0	0	0	112.6	C275 F294 I295 D300	C275-N298 VanDerWaalsContact SG-C 3.59Å; C275-N298 PolarHBondContact SG-OD1 3.47Å; F294-N298 PolarHBondContact O-N 3.17Å; I295-N298 PolarHBondContact O-N 3.25Å; N298-D300 PolarHBondContact O-N 2.86Å
299	L	85	Confident	82.2	Confident	14 Å²	14	59.7 Å²	59.7	7%	0.073	28%	0.284	C	S	.	.			trans	-81.2	105.2	177.9	-59.4	179.3	0	0	0	109.1	F294 L297 F303	F294-L299 HydrophobicContact CB-CB 4.28Å; F294-L299 HydrophobicContact CD1-CB 3.64Å; F294-L299 HydrophobicContact CD1-CD1 4Å; F294-L299 HydrophobicContact CD1-CG 4.45Å; F294-L299 HydrophobicContact CD2-CD1 4.13Å; F294-L299 HydrophobicContact CE1-CB 4.23Å; F294-L299 HydrophobicContact CE1-CD1 4.16Å; F294-L299 HydrophobicContact CE2-CD1 4.29Å; F294-L299 HydrophobicContact CG-CB 4.09Å; F294-L299 HydrophobicContact CG-CD1 4Å; F294-L299 HydrophobicContact CZ-CD1 4.31Å; F294-L299 PolarHBondContact O-N 3.17Å; L297-L299 HydrophobicContact CB-CD1 4.09Å; L297-L299 HydrophobicContact CB-CD2 4.16Å; L297-L299 HydrophobicContact CB-CG 3.71Å; L297-L299 HydrophobicContact CD1-CD1 4.15Å; L297-L299 PolarHBondContact O-N 3.49Å; L299-F303 HydrophobicContact CB-CB 4.38Å; L299-F303 HydrophobicContact CB-CD1 3.89Å; L299-F303 HydrophobicContact CB-CE1 4.48Å; L299-F303 HydrophobicContact CB-CG 4.21Å; L299-F303 HydrophobicContact CD1-CD1 4.12Å; L299-F303 HydrophobicContact CD1-CE1 3.9Å; L299-F303 HydrophobicContact CD1-CZ 4.21Å; L299-F303 HydrophobicContact CD2-CB 4.26Å; L299-F303 HydrophobicContact CD2-CD1 4.17Å; L299-F303 HydrophobicContact CD2-CD2 3.96Å; L299-F303 HydrophobicContact CD2-CE2 4.34Å; L299-F303 HydrophobicContact CD2-CG 3.85Å; L299-F303 HydrophobicContact CG-CD1 4.26Å; L299-F303 HydrophobicContact CG-CG 4.42Å
300	D	87.3	Confident	81.1	Confident	40 Å²	40	62 Å²	62	21%	0.214	30%	0.302	C	S	.	.			trans	-101.6	-167.3	-179.7	67.1	9.4	0	0	0	111.8	N298 N302 F303 L304	N298-D300 PolarHBondContact O-N 2.86Å; D300-N302 PolarHBondContact O-N 3.4Å; D300-N302 VanDerWaalsContact OD1-CB 3.22Å; D300-N302 WeakPolarHBondContact OD1-CB 3.4Å; D300-N302 PolarHBondContact OD1-N 3.25Å; D300-N302 PolarHBondContact OD2-ND2 2.86Å; D300-F303 WeakPolarHBondContact O-CB 3.27Å; D300-F303 PolarHBondContact O-N 3.08Å; D300-F303 PolarHBondContact OD1-N 2.82Å; D300-L304 PolarHBondContact O-N 3.31Å
301	G	85.6	Confident	80.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66	-20.6	178.8	0	0	0	0	0	115.6	L270 W273 L304 S305	L270-G301 CarbonylContact C-O 3.48Å; L270-G301 CarbonylContact O-C 3.57Å; L270-G301 VanDerWaalsContact O-C 3.32Å; L270-G301 WeakPolarHBondContact O-CA 3.35Å; W273-G301 PolarHBondContact O-N 2.89Å; G301-L304 PolarHBondContact O-N 3.16Å; G301-S305 PolarHBondContact O-N 3.1Å
302	N	86.5	Confident	79.2	Confident	62 Å²	62	65.8 Å²	65.8	33%	0.332	33%	0.329	S	S	.	.	H	α-helix	trans	-65.1	-47.7	171.9	-64.3	-38.2	0	0	0	109.9	V271 D300 L304 S305 E306	V271-N302 WeakPolarHBondContact CA-OD1 3.26Å; V271-N302 WeakPolarHBondContact CB-OD1 3.44Å; V271-N302 WeakPolarHBondContact CG1-OD1 3.26Å; V271-N302 PolarHBondContact O-OD1 2.97Å; D300-N302 PolarHBondContact O-N 3.4Å; D300-N302 VanDerWaalsContact OD1-CB 3.22Å; D300-N302 WeakPolarHBondContact OD1-CB 3.4Å; D300-N302 PolarHBondContact OD1-N 3.25Å; D300-N302 PolarHBondContact OD2-ND2 2.86Å; N302-L304 VanDerWaalsContact C-N 3.32Å; N302-L304 PolarHBondContact O-N 3.45Å; N302-S305 PolarHBondContact O-N 3.24Å; N302-S305 PolarHBondContact O-OG 3.18Å; N302-E306 PolarHBondContact O-N 2.74Å; N302-E306 VanDerWaalsContact O-N 3.14Å
303	F	86.2	Confident	78.6	Confident	24 Å²	24	63 Å²	63	11%	0.105	32%	0.322	C	S	.	.	H	α-helix	trans	-56.8	-48.4	174.1	170.9	-103.5	0	0	0	110.8	F294 L299 D300 S305 E306 V307 H313	F294-F303 HydrophobicContact CE1-CD1 4.14Å; F294-F303 AromaticContact CE1-CE1 3.89Å; F294-F303 HydrophobicContact CE1-CE1 3.89Å; F294-F303 HydrophobicContact CZ-CE1 4.06Å; L299-F303 HydrophobicContact CB-CB 4.38Å; L299-F303 HydrophobicContact CB-CD1 3.89Å; L299-F303 HydrophobicContact CB-CE1 4.48Å; L299-F303 HydrophobicContact CB-CG 4.21Å; L299-F303 HydrophobicContact CD1-CD1 4.12Å; L299-F303 HydrophobicContact CD1-CE1 3.9Å; L299-F303 HydrophobicContact CD1-CZ 4.21Å; L299-F303 HydrophobicContact CD2-CB 4.26Å; L299-F303 HydrophobicContact CD2-CD1 4.17Å; L299-F303 HydrophobicContact CD2-CD2 3.96Å; L299-F303 HydrophobicContact CD2-CE2 4.34Å; L299-F303 HydrophobicContact CD2-CG 3.85Å; L299-F303 HydrophobicContact CG-CD1 4.26Å; L299-F303 HydrophobicContact CG-CG 4.42Å; D300-F303 WeakPolarHBondContact O-CB 3.27Å; D300-F303 PolarHBondContact O-N 3.08Å; D300-F303 PolarHBondContact OD1-N 2.82Å; F303-S305 PolarHBondContact O-N 3.1Å; F303-E306 PolarHBondContact O-N 3.32Å; F303-E306 VanDerWaalsContact O-N 3.1Å; F303-V307 HydrophobicContact CD1-CG2 3.9Å; F303-V307 HydrophobicContact CD2-CG2 3.86Å; F303-V307 HydrophobicContact CE1-CG2 3.49Å; F303-V307 VanDerWaalsContact CE1-CG2 3.49Å; F303-V307 HydrophobicContact CE2-CG2 3.43Å; F303-V307 VanDerWaalsContact CE2-CG2 3.43Å; F303-V307 HydrophobicContact CG-CG2 4.08Å; F303-V307 HydrophobicContact CZ-CG2 3.24Å; F303-V307 WeakPolarHBondContact O-CG2 3.15Å; F303-V307 PolarHBondContact O-N 3.13Å; F303-H313 HydrophobicContact CE2-CB 3.71Å; F303-H313 AromaticContact CE2-CD2 3.61Å; F303-H313 AromaticContact CE2-CG 3.82Å; F303-H313 HydrophobicContact CZ-CB 3.74Å
304	L	87.3	Confident	78	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-29.3	178	-64.3	-174.7	0	0	0	113.2	L270 V278 W281 F294 D300 G301 N302 I330 L333 Q334	L270-L304 HydrophobicContact CD1-CB 4.49Å; V278-L304 HydrophobicContact CB-CD1 4.35Å; V278-L304 HydrophobicContact CG1-CD1 3.94Å; V278-L304 HydrophobicContact CG1-CG 4.47Å; V278-L304 HydrophobicContact CG2-CD1 3.58Å; V278-L304 HydrophobicContact CG2-CG 4.34Å; W281-L304 HydrophobicContact CE3-CD1 4.29Å; W281-L304 HydrophobicContact CZ3-CD1 4.23Å; W281-L304 HydrophobicContact CZ3-CD2 4.16Å; F294-L304 HydrophobicContact CE1-CD2 4.08Å; D300-L304 PolarHBondContact O-N 3.31Å; G301-L304 PolarHBondContact O-N 3.16Å; N302-L304 VanDerWaalsContact C-N 3.32Å; N302-L304 PolarHBondContact O-N 3.45Å; L304-I330 HydrophobicContact CD2-CD1 4.11Å; L304-I330 HydrophobicContact CD2-CG1 4.01Å; L304-I330 HydrophobicContact CD2-CG2 4.44Å; L304-L333 HydrophobicContact CD1-CD2 3.93Å; L304-Q334 PolarHBondContact O-NE2 2.98Å
305	S	85	Confident	77.1	Confident	45 Å²	45	62.7 Å²	62.7	32%	0.315	33%	0.325	S	S	.	.	H	α-helix	trans	-77	-28.7	177.4	76.8	0	0	0	0	113.8	G301 N302 F303	G301-S305 PolarHBondContact O-N 3.1Å; N302-S305 PolarHBondContact O-N 3.24Å; N302-S305 PolarHBondContact O-OG 3.18Å; F303-S305 PolarHBondContact O-N 3.1Å
306	E	80.6	Confident	76.5	Confident	153 Å²	153	69 Å²	69	72%	0.715	35%	0.345	S	S	*	.	H	α-helix	trans	-96.1	-15	-175.4	-67.8	-178.1	174.7	0	0	113.7	N302 F303 T308	N302-E306 PolarHBondContact O-N 2.74Å; N302-E306 VanDerWaalsContact O-N 3.14Å; F303-E306 PolarHBondContact O-N 3.32Å; F303-E306 VanDerWaalsContact O-N 3.1Å; E306-T308 PolarHBondContact O-N 3.4Å
307	V	76.7	Confident	76.5	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.018	32%	0.316	C	S	.	.			trans	-59.8	125.6	-179.6	165	0	0	0	0	111.6	F303 L314 I330 Q334	F303-V307 HydrophobicContact CD1-CG2 3.9Å; F303-V307 HydrophobicContact CD2-CG2 3.86Å; F303-V307 HydrophobicContact CE1-CG2 3.49Å; F303-V307 VanDerWaalsContact CE1-CG2 3.49Å; F303-V307 HydrophobicContact CE2-CG2 3.43Å; F303-V307 VanDerWaalsContact CE2-CG2 3.43Å; F303-V307 HydrophobicContact CG-CG2 4.08Å; F303-V307 HydrophobicContact CZ-CG2 3.24Å; F303-V307 WeakPolarHBondContact O-CG2 3.15Å; F303-V307 PolarHBondContact O-N 3.13Å; V307-L314 HydrophobicContact CG1-CD1 3.54Å; V307-L314 HydrophobicContact CG1-CG 4.39Å; V307-I330 HydrophobicContact CB-CG2 4.1Å; V307-I330 HydrophobicContact CG1-CD1 3.99Å; V307-I330 HydrophobicContact CG1-CG2 3.99Å; V307-I330 HydrophobicContact CG2-CD1 4.5Å; V307-Q334 PolarHBondContact O-NE2 3.05Å
308	T	69.3	Low	76.3	Confident	66 Å²	66	63.9 Å²	63.9	41%	0.405	34%	0.339	S	S	.	.			trans	-123.7	172	171.6	61.6	0	0	0	0	110.3	E306 D310 S311	E306-T308 PolarHBondContact O-N 3.4Å; T308-D310 PolarHBondContact O-N 3.26Å; T308-S311 WeakPolarHBondContact O-CB 3.44Å; T308-S311 PolarHBondContact O-N 2.8Å
309	Y	63.6	Low	76.4	Confident	132 Å²	132	59.2 Å²	59.2	52%	0.518	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-31.4	178.5	-71	-92.4	0	0	0	114	E327 L331	Y309-E327 VanDerWaalsContact CA-OE1 3.26Å; Y309-E327 WeakPolarHBondContact CA-OE1 3.5Å; Y309-E327 WeakPolarHBondContact CD1-OE1 3.49Å; Y309-E327 WeakPolarHBondContact CE1-OE1 3.49Å; Y309-L331 HydrophobicContact CE1-CD1 4.41Å; Y309-L331 HydrophobicContact CE2-CD1 4.38Å
310	D	60.1	Low	76.4	Confident	133 Å²	133	61.9 Å²	61.9	71%	0.711	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	19	-176	-59.3	-50.9	0	0	0	114.1	T308	T308-D310 PolarHBondContact O-N 3.26Å
311	S	68.9	Low	76.5	Confident	11 Å²	11	61.2 Å²	61.2	8%	0.077	33%	0.327	C	S	.	.			trans	-60.4	125.3	-177.2	180	0	0	0	0	111.7	T308 H313 L314 C315	T308-S311 WeakPolarHBondContact O-CB 3.44Å; T308-S311 PolarHBondContact O-N 2.8Å; S311-H313 PolarHBondContact O-N 2.84Å; S311-H313 VanDerWaalsContact O-N 3.07Å; S311-L314 PolarHBondContact O-N 3.3Å; S311-C315 PolarHBondContact O-N 3.14Å; S311-C315 VanDerWaalsContact O-N 3.13Å; S311-C315 PolarHBondContact O-SG 3.4Å
312	P	65.1	Low	76.6	Confident	90 Å²	90	61.2 Å²	61.2	58%	0.584	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.4	-176	24.9	-34.7	0	0	0	113.1
313	H	68.9	Low	76.7	Confident	79 Å²	79	63 Å²	63	37%	0.366	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-35.7	177	-66.7	-79.3	0	0	0	112.5	F303 S311	F303-H313 HydrophobicContact CE2-CB 3.71Å; F303-H313 AromaticContact CE2-CD2 3.61Å; F303-H313 AromaticContact CE2-CG 3.82Å; F303-H313 HydrophobicContact CZ-CB 3.74Å; S311-H313 PolarHBondContact O-N 2.84Å; S311-H313 VanDerWaalsContact O-N 3.07Å
314	L	69.7	Low	76.8	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.026	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-74.3	-34	175.1	-67.1	-178.8	0	0	0	111.6	V307 S311 R316 V317 R323 L326 E327 I330	V307-L314 HydrophobicContact CG1-CD1 3.54Å; V307-L314 HydrophobicContact CG1-CG 4.39Å; S311-L314 PolarHBondContact O-N 3.3Å; L314-R316 PolarHBondContact O-N 3.46Å; L314-R316 VanDerWaalsContact O-N 3.09Å; L314-V317 WeakPolarHBondContact O-CB 3.41Å; L314-V317 PolarHBondContact O-N 3.3Å; L314-R323 WeakPolarHBondContact O-CD 3.41Å; L314-L326 HydrophobicContact CD2-CD2 3.43Å; L314-L326 VanDerWaalsContact CD2-CD2 3.43Å; L314-L326 HydrophobicContact CD2-CG 3.81Å; L314-E327 HydrophobicContact CD1-CB 4.26Å; L314-E327 HydrophobicContact CD1-CG 4.4Å; L314-I330 HydrophobicContact CD2-CD1 4.3Å
315	C	66.9	Low	77	Confident	72 Å²	72	65.6 Å²	65.6	49%	0.486	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-60.6	-18.1	175.9	-68.2	0	0	0	0	114.1	S311 V317	S311-C315 PolarHBondContact O-N 3.14Å; S311-C315 VanDerWaalsContact O-N 3.13Å; S311-C315 PolarHBondContact O-SG 3.4Å; C315-V317 VanDerWaalsContact C-N 3.33Å
316	R	71.6	Confident	77.3	Confident	195 Å²	195	63.6 Å²	63.6	74%	0.736	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-79.1	-12.1	175.1	-68.8	-178.4	176.9	-174.6	-1	113.9	L314 A318	L314-R316 PolarHBondContact O-N 3.46Å; L314-R316 VanDerWaalsContact O-N 3.09Å; R316-A318 PolarHBondContact O-N 3.17Å
317	V	78.7	Confident	77.7	Confident	18 Å²	18	57.5 Å²	57.5	11%	0.109	30%	0.299	C	S	.	.			trans	-75.4	109.4	174.5	-178	0	0	0	0	108.2	F290 L314 C315 D319 A322 R323 L326	F290-V317 HydrophobicContact CE1-CG1 4.3Å; F290-V317 HydrophobicContact CE1-CG2 3.91Å; F290-V317 HydrophobicContact CZ-CG1 3.97Å; F290-V317 HydrophobicContact CZ-CG2 4.14Å; L314-V317 WeakPolarHBondContact O-CB 3.41Å; L314-V317 PolarHBondContact O-N 3.3Å; C315-V317 VanDerWaalsContact C-N 3.33Å; V317-D319 VanDerWaalsContact C-N 3.35Å; V317-D319 PolarHBondContact O-N 2.93Å; V317-A322 HydrophobicContact CG1-CB 3.62Å; V317-R323 HydrophobicContact CB-CB 4.16Å; V317-R323 HydrophobicContact CG1-CB 4.21Å; V317-L326 HydrophobicContact CG2-CD2 4.48Å
318	A	77.4	Confident	78.3	Confident	88 Å²	88	59.9 Å²	59.9	73%	0.727	31%	0.308	S	S	*	.			trans	-66.5	-33.6	-175.2	0	0	0	0	0	113.5	R316 P320	R316-A318 PolarHBondContact O-N 3.17Å; A318-P320 WeakPolarHBondContact O-CD 3.32Å
319	D	84.7	Confident	79.4	Confident	13 Å²	13	56.8 Å²	56.8	7%	0.07	29%	0.289	C	S	.	.			trans	-79.4	116.5	180	178.1	6.5	0	0	0	111	V317 F321 A322 R323 L509 T510	V317-D319 VanDerWaalsContact C-N 3.35Å; V317-D319 PolarHBondContact O-N 2.93Å; D319-F321 VanDerWaalsContact C-N 3.32Å; D319-F321 PolarHBondContact O-N 2.77Å; D319-F321 PolarHBondContact OD1-N 3.39Å; D319-F321 VanDerWaalsContact OD1-N 3.15Å; D319-A322 HydrophobicContact CB-CB 3.63Å; D319-A322 WeakPolarHBondContact O-CB 3.4Å; D319-A322 PolarHBondContact O-N 3.46Å; D319-R323 PolarHBondContact O-N 2.88Å; D319-L509 HydrophobicContact CB-CD2 3.88Å; D319-T510 PolarHBondContact OD1-OG1 3Å; D319-T510 PolarHBondContact OD2-N 3.06Å; D319-T510 PolarHBondContact OD2-OG1 2.99Å
320	P	84.2	Confident	80.7	Confident	71 Å²	71	50.6 Å²	50.6	46%	0.461	27%	0.265	S	S	.	.	H	α-helix	trans	-58.4	-40.8	-178.9	-24.3	34.6	0	0	0	113.3	A318 R323 E324	A318-P320 WeakPolarHBondContact O-CD 3.32Å; P320-R323 PolarHBondContact O-N 2.64Å; P320-E324 WeakPolarHBondContact O-CB 3.22Å; P320-E324 PolarHBondContact O-N 3.04Å
321	F	88.7	Confident	82.2	Confident	25 Å²	25	44.7 Å²	44.7	11%	0.11	23%	0.234	C	C	.	.	H	α-helix	trans	-67.4	-39.6	178.8	175.7	-109	0	0	0	111.2	D319 R323 E324 T325 R375 F389 T510	D319-F321 VanDerWaalsContact C-N 3.32Å; D319-F321 PolarHBondContact O-N 2.77Å; D319-F321 PolarHBondContact OD1-N 3.39Å; D319-F321 VanDerWaalsContact OD1-N 3.15Å; F321-R323 VanDerWaalsContact C-N 3.33Å; F321-R323 PolarHBondContact O-N 3.03Å; F321-E324 PolarHBondContact O-N 3.46Å; F321-T325 VanDerWaalsContact O-CB 3.28Å; F321-T325 WeakPolarHBondContact O-CB 3.13Å; F321-T325 PolarHBondContact O-N 3.34Å; F321-T325 PolarHBondContact O-OG1 3.34Å; F321-R375 VanDerWaalsContact CE2-C 3.45Å; F321-F389 HydrophobicContact CD1-CD1 4.2Å; F321-F389 HydrophobicContact CD1-CE1 4.28Å; F321-F389 AromaticContact CE1-CD1 3.86Å; F321-F389 HydrophobicContact CE1-CD1 3.86Å; F321-F389 HydrophobicContact CE1-CE1 4.23Å; F321-T510 HydrophobicContact CB-CG2 3.95Å; F321-T510 HydrophobicContact CD1-CG2 3.56Å; F321-T510 VanDerWaalsContact CD1-OG1 3.3Å; F321-T510 WeakPolarHBondContact CD1-OG1 3.44Å; F321-T510 HydrophobicContact CE1-CG2 4.2Å; F321-T510 HydrophobicContact CG-CG2 3.82Å
322	A	88.6	Confident	83.2	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-43	175.7	0	0	0	0	0	112.4	F290 V317 D319 L326 F389	F290-A322 HydrophobicContact CZ-CB 4.23Å; V317-A322 HydrophobicContact CG1-CB 3.62Å; D319-A322 HydrophobicContact CB-CB 3.63Å; D319-A322 WeakPolarHBondContact O-CB 3.4Å; D319-A322 PolarHBondContact O-N 3.46Å; A322-L326 VanDerWaalsContact O-CB 3.27Å; A322-L326 WeakPolarHBondContact O-CB 3.02Å; A322-L326 PolarHBondContact O-N 3.01Å; A322-F389 HydrophobicContact CB-CE1 4.16Å; A322-F389 HydrophobicContact CB-CZ 4.03Å
323	R	88.2	Confident	84.4	Confident	101 Å²	101	41.2 Å²	41.2	38%	0.381	21%	0.21	S	C	.	.	H	α-helix	trans	-63.7	-51.5	178	-175.3	174.1	63.7	-162.9	0.7	111.2	L314 V317 D319 P320 F321 T325 L326 E327	L314-R323 WeakPolarHBondContact O-CD 3.41Å; V317-R323 HydrophobicContact CB-CB 4.16Å; V317-R323 HydrophobicContact CG1-CB 4.21Å; D319-R323 PolarHBondContact O-N 2.88Å; P320-R323 PolarHBondContact O-N 2.64Å; F321-R323 VanDerWaalsContact C-N 3.33Å; F321-R323 PolarHBondContact O-N 3.03Å; R323-T325 VanDerWaalsContact C-N 3.34Å; R323-T325 PolarHBondContact O-N 2.94Å; R323-L326 PolarHBondContact O-N 3.21Å; R323-E327 VanDerWaalsContact O-CB 3.28Å; R323-E327 WeakPolarHBondContact O-CB 3.46Å; R323-E327 PolarHBondContact O-N 3.37Å
324	E	88.2	Confident	85.4	Confident	73 Å²	73	39.1 Å²	39.1	34%	0.341	20%	0.2	S	C	.	.	H	α-helix	trans	-60.3	-42.4	179.3	-170	-165.5	143.4	0	0	112	P320 F321 E327 R328 T376	P320-E324 WeakPolarHBondContact O-CB 3.22Å; P320-E324 PolarHBondContact O-N 3.04Å; F321-E324 PolarHBondContact O-N 3.46Å; E324-E327 PolarHBondContact O-N 3.37Å; E324-R328 WeakPolarHBondContact O-CB 3.44Å; E324-R328 PolarHBondContact O-N 3.42Å; E324-R328 IonicContact OE1-CZ 3.13Å; E324-R328 VanDerWaalsContact OE1-CZ 3.25Å; E324-R328 IonicContact OE1-NH1 3.98Å; E324-R328 PolarHBondContact OE1-NH1 3.09Å; E324-R328 IonicContact OE1-NH2 2.64Å; E324-R328 PolarHBondContact OE1-NH2 3.02Å; E324-T376 PolarHBondContact OE1-OG1 3.42Å
325	T	91.1	Very high	86.2	Confident	5 Å²	5	40.6 Å²	40.6	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-69.1	-42.7	-179.4	-56.9	0	0	0	0	112.2	L287 F321 R323 E327 A329 F389	L287-T325 HydrophobicContact CD2-CG2 4.15Å; F321-T325 VanDerWaalsContact O-CB 3.28Å; F321-T325 WeakPolarHBondContact O-CB 3.13Å; F321-T325 PolarHBondContact O-N 3.34Å; F321-T325 PolarHBondContact O-OG1 3.34Å; R323-T325 VanDerWaalsContact C-N 3.34Å; R323-T325 PolarHBondContact O-N 2.94Å; T325-E327 VanDerWaalsContact C-N 3.34Å; T325-A329 WeakPolarHBondContact O-CB 3.36Å; T325-A329 PolarHBondContact O-N 2.77Å; T325-F389 HydrophobicContact CG2-CD1 4.35Å; T325-F389 HydrophobicContact CG2-CE1 3.72Å; T325-F389 HydrophobicContact CG2-CZ 4.15Å
326	L	91.5	Very high	87.1	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-43.6	175.5	177.2	60.7	0	0	0	110.8	L282 L287 F290 F294 L314 V317 A322 R323 A329 I330	L282-L326 HydrophobicContact CD2-CD1 4.07Å; L287-L326 HydrophobicContact CD1-CD1 3.8Å; F290-L326 HydrophobicContact CD1-CD2 4.45Å; F290-L326 HydrophobicContact CD2-CD1 4.19Å; F290-L326 HydrophobicContact CD2-CD2 4.1Å; F290-L326 HydrophobicContact CE1-CD2 4.37Å; F290-L326 HydrophobicContact CE2-CB 4.19Å; F290-L326 HydrophobicContact CE2-CD2 3.97Å; F290-L326 HydrophobicContact CE2-CG 4.47Å; F290-L326 HydrophobicContact CG-CD2 4.33Å; F290-L326 HydrophobicContact CZ-CD2 4.13Å; F294-L326 HydrophobicContact CE2-CD2 4.28Å; F294-L326 HydrophobicContact CZ-CD1 4.23Å; F294-L326 HydrophobicContact CZ-CD2 4.37Å; L314-L326 HydrophobicContact CD2-CD2 3.43Å; L314-L326 VanDerWaalsContact CD2-CD2 3.43Å; L314-L326 HydrophobicContact CD2-CG 3.81Å; V317-L326 HydrophobicContact CG2-CD2 4.48Å; A322-L326 VanDerWaalsContact O-CB 3.27Å; A322-L326 WeakPolarHBondContact O-CB 3.02Å; A322-L326 PolarHBondContact O-N 3.01Å; R323-L326 PolarHBondContact O-N 3.21Å; L326-A329 PolarHBondContact O-N 3.49Å; L326-I330 HydrophobicContact CD1-CD1 4.31Å; L326-I330 HydrophobicContact CG-CD1 4.25Å; L326-I330 VanDerWaalsContact O-CG1 3.31Å; L326-I330 WeakPolarHBondContact O-CG1 3.47Å; L326-I330 PolarHBondContact O-N 3.46Å; L326-I330 VanDerWaalsContact O-N 3.08Å
327	E	89.1	Confident	87.8	Confident	26 Å²	26	37.4 Å²	37.4	12%	0.121	20%	0.201	C	C	.	.	H	α-helix	trans	-60.8	-52	176.9	-178.2	-179.1	-176.5	0	0	112.2	Y309 L314 R323 E324 T325 A329 I330 L331	Y309-E327 VanDerWaalsContact CA-OE1 3.26Å; Y309-E327 WeakPolarHBondContact CA-OE1 3.5Å; Y309-E327 WeakPolarHBondContact CD1-OE1 3.49Å; Y309-E327 WeakPolarHBondContact CE1-OE1 3.49Å; L314-E327 HydrophobicContact CD1-CB 4.26Å; L314-E327 HydrophobicContact CD1-CG 4.4Å; R323-E327 VanDerWaalsContact O-CB 3.28Å; R323-E327 WeakPolarHBondContact O-CB 3.46Å; R323-E327 PolarHBondContact O-N 3.37Å; E324-E327 PolarHBondContact O-N 3.37Å; T325-E327 VanDerWaalsContact C-N 3.34Å; E327-A329 PolarHBondContact O-N 3.43Å; E327-I330 PolarHBondContact O-N 3.28Å; E327-L331 HydrophobicContact CG-CD1 4.14Å; E327-L331 HydrophobicContact CG-CG 4.47Å; E327-L331 WeakPolarHBondContact O-CG 3.49Å; E327-L331 PolarHBondContact O-N 3.31Å
328	R	89.6	Confident	88.2	Confident	52 Å²	52	39.6 Å²	39.6	20%	0.196	22%	0.216	C	C	.	.	H	α-helix	trans	-59.1	-37.9	178.7	-170	176.9	-73.5	112.7	2	111.8	E324 L331 T332 L387	E324-R328 WeakPolarHBondContact O-CB 3.44Å; E324-R328 PolarHBondContact O-N 3.42Å; E324-R328 IonicContact OE1-CZ 3.13Å; E324-R328 VanDerWaalsContact OE1-CZ 3.25Å; E324-R328 IonicContact OE1-NH1 3.98Å; E324-R328 PolarHBondContact OE1-NH1 3.09Å; E324-R328 IonicContact OE1-NH2 2.64Å; E324-R328 PolarHBondContact OE1-NH2 3.02Å; R328-L331 PolarHBondContact O-N 3.02Å; R328-T332 WeakPolarHBondContact O-CB 3.35Å; R328-T332 PolarHBondContact O-N 3.36Å; R328-T332 PolarHBondContact O-OG1 2.87Å; R328-L387 HydrophobicContact CB-CD2 4.08Å; R328-L387 HydrophobicContact CG-CD2 3.88Å
329	A	92.6	Very high	88.7	Confident	2 Å²	2	37 Å²	37	2%	0.017	19%	0.191	C	C	.	.	H	α-helix	trans	-62	-43	174.2	0	0	0	0	0	112.4	W281 V285 L287 T325 L326 E327 T332 L333 L387	W281-A329 HydrophobicContact CH2-CB 4.34Å; W281-A329 HydrophobicContact CZ2-CB 4.06Å; V285-A329 HydrophobicContact CG1-CB 3.89Å; L287-A329 HydrophobicContact CD1-CB 3.71Å; T325-A329 WeakPolarHBondContact O-CB 3.36Å; T325-A329 PolarHBondContact O-N 2.77Å; L326-A329 PolarHBondContact O-N 3.49Å; E327-A329 PolarHBondContact O-N 3.43Å; A329-T332 PolarHBondContact O-N 3.35Å; A329-L333 PolarHBondContact O-N 3.43Å; A329-L387 HydrophobicContact CB-CD1 4.23Å; A329-L387 HydrophobicContact CB-CD2 4.36Å
330	I	91.3	Very high	88.8	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-45	176.4	-64.7	169.9	0	0	0	110.6	W281 L304 V307 L314 L326 E327 T332 L333 Q334	W281-I330 HydrophobicContact CH2-CG1 3.8Å; L304-I330 HydrophobicContact CD2-CD1 4.11Å; L304-I330 HydrophobicContact CD2-CG1 4.01Å; L304-I330 HydrophobicContact CD2-CG2 4.44Å; V307-I330 HydrophobicContact CB-CG2 4.1Å; V307-I330 HydrophobicContact CG1-CD1 3.99Å; V307-I330 HydrophobicContact CG1-CG2 3.99Å; V307-I330 HydrophobicContact CG2-CD1 4.5Å; L314-I330 HydrophobicContact CD2-CD1 4.3Å; L326-I330 HydrophobicContact CD1-CD1 4.31Å; L326-I330 HydrophobicContact CG-CD1 4.25Å; L326-I330 VanDerWaalsContact O-CG1 3.31Å; L326-I330 WeakPolarHBondContact O-CG1 3.47Å; L326-I330 PolarHBondContact O-N 3.46Å; L326-I330 VanDerWaalsContact O-N 3.08Å; E327-I330 PolarHBondContact O-N 3.28Å; I330-T332 VanDerWaalsContact C-N 3.31Å; I330-T332 PolarHBondContact O-N 2.9Å; I330-L333 PolarHBondContact O-N 3.43Å; I330-Q334 HydrophobicContact CG2-CG 4.37Å; I330-Q334 WeakPolarHBondContact O-CG 3.44Å; I330-Q334 PolarHBondContact O-N 3.22Å
331	L	90.3	Very high	88.8	Confident	10 Å²	10	33.9 Å²	33.9	5%	0.052	17%	0.172	C	C	.	.	H	α-helix	trans	-62	-37.6	177.4	-67.5	175.4	0	0	0	112.4	Y309 E327 R328 Q334 G335 K336 E337	Y309-L331 HydrophobicContact CE1-CD1 4.41Å; Y309-L331 HydrophobicContact CE2-CD1 4.38Å; E327-L331 HydrophobicContact CG-CD1 4.14Å; E327-L331 HydrophobicContact CG-CG 4.47Å; E327-L331 WeakPolarHBondContact O-CG 3.49Å; E327-L331 PolarHBondContact O-N 3.31Å; R328-L331 PolarHBondContact O-N 3.02Å; L331-Q334 PolarHBondContact O-N 3.41Å; L331-G335 PolarHBondContact O-N 2.9Å; L331-K336 HydrophobicContact CB-CB 4.49Å; L331-K336 HydrophobicContact CD2-CB 4.43Å; L331-K336 HydrophobicContact CD2-CD 3.81Å; L331-K336 PolarHBondContact O-N 3.28Å; L331-E337 HydrophobicContact CB-CB 4.36Å; L331-E337 HydrophobicContact CB-CG 3.69Å; L331-E337 HydrophobicContact CD1-CG 4.43Å; L331-E337 PolarHBondContact O-N 3.15Å
332	T	91	Very high	88.6	Confident	17 Å²	17	34.3 Å²	34.3	10%	0.104	17%	0.174	C	C	.	.	H	α-helix	trans	-64.3	-43.5	174.2	-55.2	0	0	0	0	110.8	R328 A329 I330 G335 L387	R328-T332 WeakPolarHBondContact O-CB 3.35Å; R328-T332 PolarHBondContact O-N 3.36Å; R328-T332 PolarHBondContact O-OG1 2.87Å; A329-T332 PolarHBondContact O-N 3.35Å; I330-T332 VanDerWaalsContact C-N 3.31Å; I330-T332 PolarHBondContact O-N 2.9Å; T332-G335 PolarHBondContact O-N 3.34Å; T332-G335 VanDerWaalsContact O-N 3.09Å; T332-L387 HydrophobicContact CG2-CD1 4.22Å
333	L	91.2	Very high	88.3	Confident	10 Å²	10	35.7 Å²	35.7	5%	0.052	18%	0.181	C	C	.	.	H	α-helix	trans	-65.7	-38.8	176.5	-171.8	70	0	0	0	112.2	V200 P202 L270 W273 W281 L304 A329 I330 G335	V200-L333 HydrophobicContact CG1-CD1 4.47Å; P202-L333 HydrophobicContact CG-CD1 4.4Å; P202-L333 WeakPolarHBondContact CG-O 3.35Å; L270-L333 HydrophobicContact CD2-CD2 3.66Å; L270-L333 HydrophobicContact CD2-CG 3.89Å; W273-L333 HydrophobicContact CH2-CD1 3.97Å; W273-L333 HydrophobicContact CH2-CD2 4.41Å; W273-L333 HydrophobicContact CZ3-CD1 4.4Å; W273-L333 HydrophobicContact CZ3-CD2 4.1Å; W281-L333 HydrophobicContact CD2-CD2 3.92Å; W281-L333 HydrophobicContact CE3-CD2 4.39Å; W281-L333 HydrophobicContact CG-CD2 4.32Å; W281-L333 HydrophobicContact CH2-CD2 4.46Å; W281-L333 HydrophobicContact CZ2-CB 4.08Å; W281-L333 HydrophobicContact CZ2-CD2 3.99Å; L304-L333 HydrophobicContact CD1-CD2 3.93Å; A329-L333 PolarHBondContact O-N 3.43Å; I330-L333 PolarHBondContact O-N 3.43Å; L333-G335 PolarHBondContact O-N 3.35Å
334	Q	89	Confident	88	Confident	35 Å²	35	34.1 Å²	34.1	16%	0.164	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-13.2	172.9	-71.6	177.7	-2	0	0	113.2	L270 L304 V307 I330 L331 K336	L270-Q334 HydrophobicContact CD1-CG 3.88Å; L304-Q334 PolarHBondContact O-NE2 2.98Å; V307-Q334 PolarHBondContact O-NE2 3.05Å; I330-Q334 HydrophobicContact CG2-CG 4.37Å; I330-Q334 WeakPolarHBondContact O-CG 3.44Å; I330-Q334 PolarHBondContact O-N 3.22Å; L331-Q334 PolarHBondContact O-N 3.41Å; Q334-K336 VanDerWaalsContact C-N 3.35Å; Q334-K336 HydrophobicContact CB-CG 4.34Å; Q334-K336 VanDerWaalsContact OE1-CD 3.32Å; Q334-K336 VanDerWaalsContact OE1-CE 3.22Å
335	G	86.6	Confident	87.6	Confident	36 Å²	36	36.3 Å²	36.3	37%	0.371	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	16.6	-175.6	0	0	0	0	0	114.4	L331 T332 L333	L331-G335 PolarHBondContact O-N 2.9Å; T332-G335 PolarHBondContact O-N 3.34Å; T332-G335 VanDerWaalsContact O-N 3.09Å; L333-G335 PolarHBondContact O-N 3.35Å
336	K	86	Confident	86.8	Confident	132 Å²	132	36.9 Å²	36.9	57%	0.574	20%	0.197	S	C	*	.	S	Bend	trans	-84.3	-23.8	173.8	-67.7	177.7	-176.1	158.2	0	112.6	L331 Q334	L331-K336 HydrophobicContact CB-CB 4.49Å; L331-K336 HydrophobicContact CD2-CB 4.43Å; L331-K336 HydrophobicContact CD2-CD 3.81Å; L331-K336 PolarHBondContact O-N 3.28Å; Q334-K336 VanDerWaalsContact C-N 3.35Å; Q334-K336 HydrophobicContact CB-CG 4.34Å; Q334-K336 VanDerWaalsContact OE1-CD 3.32Å; Q334-K336 VanDerWaalsContact OE1-CE 3.22Å
337	E	86.7	Confident	86	Confident	69 Å²	69	37.4 Å²	37.4	32%	0.322	20%	0.199	S	C	.	.	S	Bend	trans	-116.9	149.6	175.6	-70.5	-73.2	171.1	0	0	109.7	L331	L331-E337 HydrophobicContact CB-CB 4.36Å; L331-E337 HydrophobicContact CB-CG 3.69Å; L331-E337 HydrophobicContact CD1-CG 4.43Å; L331-E337 PolarHBondContact O-N 3.15Å
338	P	86.1	Confident	85.1	Confident	64 Å²	64	39.6 Å²	39.6	42%	0.416	22%	0.221	S	C	.	.			trans	-70	147.9	-178.1	30	-34.8	0	0	0	111.7	I384	P338-I384 HydrophobicContact CB-CD1 3.9Å; P338-I384 HydrophobicContact CB-CG1 4.07Å; P338-I384 HydrophobicContact CG-CD1 4.39Å; P338-I384 HydrophobicContact CG-CG1 4.02Å; P338-I384 HydrophobicContact CG-CG2 4.37Å; P338-I384 WeakPolarHBondContact O-CG2 3.11Å
339	T	88.4	Confident	83.5	Confident	33 Å²	33	44.2 Å²	44.2	20%	0.202	25%	0.25	C	C	.	.			trans	-119.3	138.1	174.6	172.1	0	0	0	0	110.7	G341 E342 N343	T339-G341 PolarHBondContact O-N 2.93Å; T339-E342 HydrophobicContact CG2-CB 3.63Å; T339-E342 HydrophobicContact CG2-CG 3.32Å; T339-E342 WeakPolarHBondContact CG2-OE2 3.27Å; T339-E342 PolarHBondContact O-N 2.74Å; T339-E342 VanDerWaalsContact O-N 3.14Å; T339-N343 PolarHBondContact O-N 3.03Å
340	P	86.7	Confident	81.7	Confident	17 Å²	17	45.9 Å²	45.9	11%	0.11	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-25.8	-176.3	23.7	-34.1	0	0	0	113.7	E342 I406	P340-E342 VanDerWaalsContact C-N 3.3Å; P340-E342 PolarHBondContact O-N 3.13Å; P340-I406 HydrophobicContact CB-CD1 4.38Å; P340-I406 HydrophobicContact CG-CD1 4.18Å
341	G	84.4	Confident	79.3	Confident	2 Å²	2	52.6 Å²	52.6	2%	0.021	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-15.3	179.1	0	0	0	0	0	114.7	L218 V219 T339	L218-G341 PolarHBondContact N-O 3.2Å; V219-G341 WeakPolarHBondContact CG2-O 3.25Å; V219-G341 PolarHBondContact N-O 3.16Å; V219-G341 VanDerWaalsContact N-O 3.1Å; T339-G341 PolarHBondContact O-N 2.93Å
342	E	84.4	Confident	77.1	Confident	34 Å²	34	59.3 Å²	59.3	16%	0.159	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-11.7	-173.1	-53.4	177.3	175.1	0	0	113.1	T201 R203 N205 T339 P340 L344	T201-E342 PolarHBondContact OG1-OE1 3.02Å; R203-E342 IonicContact CZ-OE1 3.5Å; R203-E342 IonicContact CZ-OE2 3.78Å; R203-E342 IonicContact NH1-OE1 2.91Å; R203-E342 IonicContact NH1-OE2 2.83Å; R203-E342 PolarHBondContact NH1-OE2 3.03Å; R203-E342 IonicContact NH2-OE1 2.96Å; R203-E342 PolarHBondContact NH2-OE1 3.15Å; R203-E342 IonicContact NH2-OE2 3.6Å; R203-E342 PolarHBondContact NH2-OE2 3.45Å; N205-E342 HydrophobicContact CB-CB 4.49Å; N205-E342 HydrophobicContact CB-CG 3.69Å; N205-E342 VanDerWaalsContact CB-OE1 3.28Å; N205-E342 WeakPolarHBondContact CB-OE1 3.43Å; N205-E342 PolarHBondContact ND2-OE2 3.32Å; T339-E342 HydrophobicContact CG2-CB 3.63Å; T339-E342 HydrophobicContact CG2-CG 3.32Å; T339-E342 WeakPolarHBondContact CG2-OE2 3.27Å; T339-E342 PolarHBondContact O-N 2.74Å; T339-E342 VanDerWaalsContact O-N 3.14Å; P340-E342 VanDerWaalsContact C-N 3.3Å; P340-E342 PolarHBondContact O-N 3.13Å; E342-L344 PolarHBondContact O-N 2.97Å
343	N	82	Confident	74.8	Confident	28 Å²	28	66.6 Å²	66.6	15%	0.15	37%	0.367	C	S	.	.			trans	-80	101.7	-177.2	-171.4	-4.8	0	0	0	112.4	V219 T339 D345 I384	V219-N343 WeakPolarHBondContact CG2-O 3.35Å; T339-N343 PolarHBondContact O-N 3.03Å; N343-D345 VanDerWaalsContact C-N 3.32Å; N343-D345 WeakPolarHBondContact OD1-CB 3.13Å; N343-D345 PolarHBondContact OD1-N 2.86Å; N343-D345 PolarHBondContact OD1-OD2 3.41Å; N343-I384 HydrophobicContact CB-CD1 3.92Å
344	L	82.3	Confident	72.6	Confident	69 Å²	69	70.4 Å²	70.4	36%	0.361	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-80.7	-5.7	175.6	-65.3	176.8	0	0	0	114.1	L218 V219 E222 E342 I346 F347	L218-L344 HydrophobicContact CD2-CD1 4.17Å; L218-L344 HydrophobicContact CD2-CG 4.29Å; L218-L344 HydrophobicContact CG-CD1 4.27Å; L218-L344 HydrophobicContact CG-CD2 4.2Å; L218-L344 HydrophobicContact CG-CG 4.3Å; V219-L344 HydrophobicContact CG2-CD2 4.23Å; E222-L344 HydrophobicContact CB-CD2 3.89Å; E222-L344 HydrophobicContact CG-CD2 4.1Å; E342-L344 PolarHBondContact O-N 2.97Å; L344-I346 PolarHBondContact O-N 2.85Å; L344-I346 VanDerWaalsContact O-N 3.09Å; L344-F347 HydrophobicContact CB-CD2 4.42Å; L344-F347 HydrophobicContact CD2-CD2 3.9Å; L344-F347 HydrophobicContact CD2-CE2 3.87Å; L344-F347 WeakPolarHBondContact O-CB 3.44Å; L344-F347 PolarHBondContact O-N 3.43Å
345	D	78.9	Confident	70.4	Confident	118 Å²	118	78 Å²	78	63%	0.631	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-60.7	-23	-179.1	-61.5	-21.9	0	0	0	112.5	N343 F347 A348	N343-D345 VanDerWaalsContact C-N 3.32Å; N343-D345 WeakPolarHBondContact OD1-CB 3.13Å; N343-D345 PolarHBondContact OD1-N 2.86Å; N343-D345 PolarHBondContact OD1-OD2 3.41Å; D345-F347 PolarHBondContact O-N 3.17Å; D345-A348 WeakPolarHBondContact O-CB 3.29Å; D345-A348 PolarHBondContact O-N 3.06Å
346	I	73.8	Confident	68.2	Low	18 Å²	18	78.6 Å²	78.6	9%	0.092	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-54.1	-28.6	173.1	-53.8	172.1	0	0	0	110.7	V219 L344 V381 C382 L410 Y412	V219-I346 HydrophobicContact CG1-CD1 4.34Å; L344-I346 PolarHBondContact O-N 2.85Å; L344-I346 VanDerWaalsContact O-N 3.09Å; I346-V381 HydrophobicContact CD1-CG1 4.49Å; I346-V381 HydrophobicContact CG2-CG1 4.13Å; I346-C382 HydrophobicContact CD1-CB 3.82Å; I346-C382 HydrophobicContact CG1-CB 4.14Å; I346-L410 HydrophobicContact CD1-CD1 4.46Å; I346-Y412 HydrophobicContact CG2-CD1 4.07Å; I346-Y412 HydrophobicContact CG2-CE1 4.29Å
347	F	76.1	Confident	66.3	Low	12 Å²	12	75.3 Å²	75.3	5%	0.053	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-93.2	-8.6	179.9	-59.2	-61.7	0	0	0	115.1	V219 E222 Y223 F227 L344 D345 N349 L350	V219-F347 HydrophobicContact CG1-CE2 3.9Å; V219-F347 HydrophobicContact CG1-CZ 4.04Å; E222-F347 HydrophobicContact CB-CD2 4.46Å; E222-F347 HydrophobicContact CB-CE2 3.85Å; E222-F347 HydrophobicContact CB-CZ 4.35Å; E222-F347 HydrophobicContact CG-CD2 3.89Å; E222-F347 HydrophobicContact CG-CE2 3.73Å; E222-F347 HydrophobicContact CG-CZ 4.29Å; Y223-F347 HydrophobicContact CD2-CE1 4.17Å; Y223-F347 HydrophobicContact CD2-CZ 4.41Å; F227-F347 HydrophobicContact CE2-CE1 4.48Å; L344-F347 HydrophobicContact CB-CD2 4.42Å; L344-F347 HydrophobicContact CD2-CD2 3.9Å; L344-F347 HydrophobicContact CD2-CE2 3.87Å; L344-F347 WeakPolarHBondContact O-CB 3.44Å; L344-F347 PolarHBondContact O-N 3.43Å; D345-F347 PolarHBondContact O-N 3.17Å; F347-N349 VanDerWaalsContact C-N 3.26Å; F347-N349 PolarHBondContact O-N 3.41Å; F347-L350 HydrophobicContact CD1-CD1 4.16Å; F347-L350 PolarHBondContact O-N 3.25Å
348	A	68.8	Low	64	Low	72 Å²	72	74.5 Å²	74.5	60%	0.595	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-24.4	-172.7	0	0	0	0	0	113.5	D345	D345-A348 WeakPolarHBondContact O-CB 3.29Å; D345-A348 PolarHBondContact O-N 3.06Å
349	N	56	Low	61.8	Low	149 Å²	149	80.5 Å²	80.5	80%	0.797	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	8	179.2	-68.6	-29.1	0	0	0	113.8	F347	F347-N349 VanDerWaalsContact C-N 3.26Å; F347-N349 PolarHBondContact O-N 3.41Å
350	L	55.1	Low	59.6	Low	38 Å²	38	82.1 Å²	82.1	20%	0.199	46%	0.456	C	S	.	.			trans	-105.4	62.6	-178.7	-80.8	143.7	0	0	0	110.7	F347 Y412	F347-L350 HydrophobicContact CD1-CD1 4.16Å; F347-L350 PolarHBondContact O-N 3.25Å; L350-Y412 HydrophobicContact CD1-CE2 3.69Å; L350-Y412 WeakPolarHBondContact CD1-OH 3.4Å; L350-Y412 HydrophobicContact CD2-CE2 4.21Å; L350-Y412 HydrophobicContact CG-CE2 4.34Å
351	D	42	Very low	57.9	Low	142 Å²	142	87 Å²	87	76%	0.759	49%	0.491	S	S	*	.			trans	-94.4	138.3	153.3	-83	-34.3	0	0	0	107.4
352	I	44.5	Very low	56.3	Low	151 Å²	151	94.2 Å²	94.2	77%	0.774	53%	0.528	S	S	*	.	S	Bend	trans	93.5	92.8	174.2	-46.4	158.6	0	0	0	115.4	V354	I352-V354 VanDerWaalsContact C-N 3.3Å; I352-V354 PolarHBondContact O-N 3.25Å
353	D	42.8	Very low	55.2	Low	169 Å²	169	93.8 Å²	93.8	90%	0.904	53%	0.53	S	S	*	.			trans	43.1	28.1	145.8	-76.7	-26.2	0	0	0	120.9	K355	D353-K355 PolarHBondContact O-N 3.28Å; D353-K355 VanDerWaalsContact O-N 3.16Å
354	V	44.5	Very low	55	Low	91 Å²	91	100.7 Å²	100.7	55%	0.552	55%	0.554	S	S	*	*			trans	-80.4	96.7	166.4	-175.9	0	0	0	0	108.8	I352 C356	I352-V354 VanDerWaalsContact C-N 3.3Å; I352-V354 PolarHBondContact O-N 3.25Å; V354-C356 PolarHBondContact O-N 3.48Å
355	K	41.9	Very low	55.1	Low	194 Å²	194	103.7 Å²	103.7	84%	0.843	57%	0.565	S	S	*	*			trans	-46.8	139.5	155.4	-80.5	179.2	176.7	175.1	0	107.7	D353	D353-K355 PolarHBondContact O-N 3.28Å; D353-K355 VanDerWaalsContact O-N 3.16Å
356	C	41.5	Very low	55.5	Low	49 Å²	49	99.5 Å²	99.5	33%	0.331	54%	0.542	S	S	.	.	S	Bend	trans	-26	129.4	178.7	-63.1	0	0	0	0	110.2	F227 V354 G358	F227-C356 VanDerWaalsContact CB-SG 3.59Å; F227-C356 HydrophobicContact CD1-CB 4.44Å; F227-C356 WeakPolarHBondContact CD1-SG 3.46Å; V354-C356 PolarHBondContact O-N 3.48Å; C356-G358 VanDerWaalsContact C-N 3.25Å; C356-G358 WeakPolarHBondContact O-CA 3.5Å; C356-G358 PolarHBondContact O-N 2.86Å
357	P	45.4	Very low	56.3	Low	62 Å²	62	102.1 Å²	102.1	40%	0.403	56%	0.556	S	S	.	*			trans	-45.5	101.5	178.3	17.1	-29.1	0	0	0	107.7	K359	P357-K359 PolarHBondContact O-N 3.31Å
358	G	39.7	Very low	57	Low	53 Å²	53	102.8 Å²	102.8	55%	0.546	56%	0.559	S	S	.	*			trans	-66.8	145.6	-163.7	0	0	0	0	0	105.6	C356 S360	C356-G358 VanDerWaalsContact C-N 3.25Å; C356-G358 WeakPolarHBondContact O-CA 3.5Å; C356-G358 PolarHBondContact O-N 2.86Å; G358-S360 PolarHBondContact O-N 3.45Å
359	K	38.7	Very low	57.9	Low	189 Å²	189	102.4 Å²	102.4	82%	0.822	55%	0.545	S	S	*	.			trans	-57.9	73.3	157.7	-65.6	177.9	179.6	179	0	108	P357 S361	P357-K359 PolarHBondContact O-N 3.31Å; K359-S361 PolarHBondContact O-N 3.34Å
360	S	42.1	Very low	59.5	Low	68 Å²	68	97.2 Å²	97.2	48%	0.476	52%	0.517	S	S	.	.			trans	-63.2	124.9	163.1	46	0	0	0	0	104.6	G358 D362 S363	G358-S360 PolarHBondContact O-N 3.45Å; S360-D362 PolarHBondContact O-N 2.91Å; S360-S363 PolarHBondContact O-N 2.89Å; S360-S363 PolarHBondContact O-OG 3.46Å; S360-S363 WeakPolarHBondContact OG-CB 3.29Å
361	S	51.2	Low	61.1	Low	120 Å²	120	96.6 Å²	96.6	84%	0.839	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-17.8	-174.4	42.8	0	0	0	0	113.5	K359	K359-S361 PolarHBondContact O-N 3.34Å
362	D	51	Low	63.3	Low	152 Å²	152	90.7 Å²	90.7	81%	0.813	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	15	179.1	-68.8	-36.4	0	0	0	114.8	S360 R364	S360-D362 PolarHBondContact O-N 2.91Å; D362-R364 PolarHBondContact O-N 3.42Å
363	S	61	Low	65.4	Low	26 Å²	26	83.9 Å²	83.9	18%	0.182	45%	0.45	C	S	.	.			trans	-71.4	121.7	177.4	50.5	0	0	0	0	111.7	S360 Q365 N415	S360-S363 PolarHBondContact O-N 2.89Å; S360-S363 PolarHBondContact O-OG 3.46Å; S360-S363 WeakPolarHBondContact OG-CB 3.29Å; S363-Q365 PolarHBondContact O-N 2.97Å; S363-N415 WeakPolarHBondContact CB-OD1 3.43Å
364	R	78.6	Confident	67.6	Low	173 Å²	173	77.8 Å²	77.8	65%	0.653	41%	0.414	S	S	*	.			trans	-66	95.7	172.3	-61	-176.9	-151.1	174.2	6.9	108.8	D362 C416	D362-R364 PolarHBondContact O-N 3.42Å; R364-C416 HydrophobicContact CB-CB 4.33Å; R364-C416 WeakPolarHBondContact CB-O 3.39Å; R364-C416 WeakPolarHBondContact CD-O 3.49Å; R364-C416 WeakPolarHBondContact O-CB 3.36Å; R364-C416 PolarHBondContact O-N 2.92Å
365	Q	83.2	Confident	69.7	Low	131 Å²	131	79.7 Å²	79.7	61%	0.612	41%	0.412	S	S	*	.			trans	-74.1	142.2	-179.8	-68.6	-179.5	-4	0	0	112	S363 K398	S363-Q365 PolarHBondContact O-N 2.97Å; Q365-K398 PolarHBondContact O-NZ 2.83Å
366	H	88.8	Confident	72	Confident	31 Å²	31	71.6 Å²	71.6	14%	0.144	38%	0.378	C	S	.	.			trans	-67.3	136.6	171.2	-75.9	-90.8	0	0	0	110.7	F368 C396 C399 S414 C416	H366-F368 HydrophobicContact CB-CD2 3.59Å; H366-F368 HydrophobicContact CB-CE1 4.43Å; H366-F368 HydrophobicContact CB-CE2 3.29Å; H366-F368 HydrophobicContact CB-CG 4.29Å; H366-F368 HydrophobicContact CB-CZ 3.76Å; H366-F368 AromaticContact CG-CE2 3.78Å; H366-F368 AromaticContact CG-CZ 3.82Å; H366-F368 PolarHBondContact O-N 3.27Å; H366-C396 HydrophobicContact CB-CB 4.43Å; H366-C396 PolarHBondContact ND1-SG 2.97Å; H366-C399 PolarHBondContact CE1-SG 2.97Å; H366-C399 PolarHBondContact ND1-SG 3.33Å; H366-S414 PolarHBondContact CD2-O 3.09Å; H366-S414 PolarHBondContact NE2-O 3.08Å; H366-C416 HydrophobicContact CB-CB 4.4Å; H366-C416 WeakPolarHBondContact NE2-CA 3.34Å
367	D	89.4	Confident	74.4	Confident	73 Å²	73	69.3 Å²	69.3	39%	0.39	36%	0.363	S	S	.	.			trans	-95.8	85	171.5	-178.8	14.3	0	0	0	110	C396 K397 K398	D367-C396 PolarHBondContact N-SG 3.41Å; D367-C396 VanDerWaalsContact N-SG 3.37Å; D367-C396 CarbonylContact O-C 3.44Å; D367-C396 VanDerWaalsContact O-CA 3.22Å; D367-C396 WeakPolarHBondContact O-CA 3.33Å; D367-K397 HydrophobicContact CB-CB 4.46Å; D367-K397 PolarHBondContact O-N 3Å; D367-K397 WeakPolarHBondContact OD2-CD 3.38Å; D367-K398 HydrophobicContact CB-CD 4.34Å; D367-K398 HydrophobicContact CB-CG 4.34Å
368	F	91.4	Very high	76.7	Confident	26 Å²	26	66.6 Å²	66.6	11%	0.114	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	114.8	-174.4	-79.7	-61.8	0	0	0	112.6	H366 F394 C396 C403 K408 F413	H366-F368 HydrophobicContact CB-CD2 3.59Å; H366-F368 HydrophobicContact CB-CE1 4.43Å; H366-F368 HydrophobicContact CB-CE2 3.29Å; H366-F368 HydrophobicContact CB-CG 4.29Å; H366-F368 HydrophobicContact CB-CZ 3.76Å; H366-F368 AromaticContact CG-CE2 3.78Å; H366-F368 AromaticContact CG-CZ 3.82Å; H366-F368 PolarHBondContact O-N 3.27Å; F368-F394 HydrophobicContact CB-CB 3.98Å; F368-F394 HydrophobicContact CB-CD1 4.21Å; F368-F394 HydrophobicContact CB-CG 4.36Å; F368-F394 HydrophobicContact CD1-CB 3.86Å; F368-F394 HydrophobicContact CG-CB 4.2Å; F368-C396 HydrophobicContact CD1-CB 3.97Å; F368-C396 HydrophobicContact CE1-CB 3.89Å; F368-C403 VanDerWaalsContact CE1-SG 3.51Å; F368-K408 HydrophobicContact CB-CD 4.2Å; F368-K408 HydrophobicContact CD2-CG 4.49Å; F368-F413 HydrophobicContact CE2-CD1 4.07Å; F368-F413 HydrophobicContact CE2-CD2 4.09Å; F368-F413 AromaticContact CE2-CE1 3.88Å; F368-F413 HydrophobicContact CE2-CE1 3.88Å; F368-F413 AromaticContact CE2-CE2 3.92Å; F368-F413 HydrophobicContact CE2-CE2 3.92Å; F368-F413 HydrophobicContact CE2-CG 4.17Å; F368-F413 AromaticContact CE2-CZ 3.82Å; F368-F413 HydrophobicContact CE2-CZ 3.82Å; F368-F413 AromaticContact CZ-CD1 3.86Å; F368-F413 HydrophobicContact CZ-CD1 3.86Å; F368-F413 AromaticContact CZ-CE1 3.6Å; F368-F413 HydrophobicContact CZ-CE1 3.6Å; F368-F413 HydrophobicContact CZ-CE2 4.48Å; F368-F413 HydrophobicContact CZ-CG 4.41Å; F368-F413 AromaticContact CZ-CZ 3.95Å; F368-F413 HydrophobicContact CZ-CZ 3.95Å
369	Q	88	Confident	79.2	Confident	64 Å²	64	64 Å²	64	30%	0.299	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	144.3	170.8	-173.1	177.3	7.5	0	0	110.8	T371 F394 Q395 K397	Q369-T371 PolarHBondContact O-N 3.07Å; Q369-T371 PolarHBondContact O-OG1 3.28Å; Q369-F394 CarbonylContact O-C 3.55Å; Q369-F394 WeakPolarHBondContact O-CA 3.45Å; Q369-Q395 PolarHBondContact N-O 3.32Å; Q369-Q395 PolarHBondContact O-N 3.07Å; Q369-K397 HydrophobicContact CB-CG 4.47Å
370	L	88.9	Confident	81.6	Confident	39 Å²	39	58.5 Å²	58.5	20%	0.204	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	120.7	174.1	-174.6	70.5	0	0	0	109.7	H391 G393 F394 R405	L370-H391 HydrophobicContact CD1-CB 3.97Å; L370-H391 HydrophobicContact CD2-CB 3.74Å; L370-H391 HydrophobicContact CG-CB 3.69Å; L370-G393 WeakPolarHBondContact CD1-O 3.49Å; L370-F394 HydrophobicContact CB-CD1 4.15Å; L370-F394 HydrophobicContact CB-CE1 3.89Å; L370-F394 HydrophobicContact CD1-CD1 4.44Å; L370-F394 HydrophobicContact CD1-CE1 4.11Å; L370-F394 HydrophobicContact CD1-CE2 4.34Å; L370-F394 HydrophobicContact CD1-CZ 4.05Å; L370-R405 VanDerWaalsContact CD1-NH2 3.31Å
371	T	88.2	Confident	83.7	Confident	26 Å²	26	56.7 Å²	56.7	16%	0.16	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.5	-167.4	-58.2	0	0	0	0	111.6	Q369 F373 H391 Q392 G393 Q395	Q369-T371 PolarHBondContact O-N 3.07Å; Q369-T371 PolarHBondContact O-OG1 3.28Å; T371-F373 HydrophobicContact CG2-CD1 4.38Å; T371-F373 HydrophobicContact CG2-CE1 3.97Å; T371-F373 HydrophobicContact CG2-CZ 4.06Å; T371-H391 WeakPolarHBondContact O-CA 3.11Å; T371-Q392 PolarHBondContact O-N 3.5Å; T371-G393 PolarHBondContact N-O 3.48Å; T371-Q395 HydrophobicContact CG2-CB 4.33Å
372	S	88	Confident	85.4	Confident	18 Å²	18	51.6 Å²	51.6	13%	0.126	25%	0.248	C	C	.	.			trans	-94.9	132.8	170.6	-62	0	0	0	0	110.2	S390 H391 Q392	S372-S390 WeakPolarHBondContact OG-CA 3.35Å; S372-H391 PolarHBondContact OG-N 2.92Å; S372-Q392 VanDerWaalsContact CA-OE1 3.27Å
373	F	90.5	Very high	87.3	Confident	8 Å²	8	49.6 Å²	49.6	4%	0.035	24%	0.238	C	C	.	.			trans	-113.9	137.7	179.6	-54.7	-82.7	0	0	0	111.5	T371 V377 L386 Q392 Q395 I402 L444	T371-F373 HydrophobicContact CG2-CD1 4.38Å; T371-F373 HydrophobicContact CG2-CE1 3.97Å; T371-F373 HydrophobicContact CG2-CZ 4.06Å; F373-V377 HydrophobicContact CB-CG1 4.39Å; F373-V377 HydrophobicContact CB-CG2 4.08Å; F373-V377 HydrophobicContact CD1-CG1 4.11Å; F373-V377 HydrophobicContact CD1-CG2 4.1Å; F373-V377 HydrophobicContact CD2-CG2 3.71Å; F373-V377 HydrophobicContact CE1-CG2 4.47Å; F373-V377 HydrophobicContact CE2-CG2 4.12Å; F373-V377 HydrophobicContact CG-CG1 4.29Å; F373-V377 HydrophobicContact CG-CG2 3.69Å; F373-V377 HydrophobicContact CZ-CG2 4.47Å; F373-L386 HydrophobicContact CD2-CD2 4.25Å; F373-L386 HydrophobicContact CE2-CD2 3.79Å; F373-Q392 HydrophobicContact CD2-CB 4.4Å; F373-Q392 PolarHBondContact O-NE2 3.31Å; F373-Q395 HydrophobicContact CE1-CB 4.25Å; F373-Q395 HydrophobicContact CZ-CB 4Å; F373-I402 HydrophobicContact CD1-CD1 4.26Å; F373-I402 HydrophobicContact CE1-CD1 3.59Å; F373-I402 HydrophobicContact CE1-CG1 3.95Å; F373-I402 HydrophobicContact CE1-CG2 4.48Å; F373-I402 HydrophobicContact CE2-CG2 4.08Å; F373-I402 HydrophobicContact CZ-CB 4.45Å; F373-I402 HydrophobicContact CZ-CD1 3.95Å; F373-I402 HydrophobicContact CZ-CG1 3.9Å; F373-I402 HydrophobicContact CZ-CG2 3.76Å; F373-L444 HydrophobicContact CD1-CD1 4.08Å; F373-L444 HydrophobicContact CE1-CD1 4.44Å
374	Y	87.2	Confident	88.7	Confident	41 Å²	41	48.9 Å²	48.9	16%	0.161	23%	0.231	C	C	.	.	S	Bend	trans	-100.6	17.6	178.6	-48.2	-80.5	0	0	0	112.9	T510 L513 H517 D552	Y374-T510 HydrophobicContact CD1-CG2 4.46Å; Y374-T510 WeakPolarHBondContact O-CG2 3.35Å; Y374-L513 HydrophobicContact CD1-CB 4.28Å; Y374-L513 HydrophobicContact CE1-CB 4.25Å; Y374-L513 HydrophobicContact CE1-CD1 4.42Å; Y374-H517 AromaticContact CZ-CD2 3.81Å; Y374-H517 AromaticContact CZ-NE2 3.77Å; Y374-H517 PolarHBondContact OH-CE1 3.19Å; Y374-H517 VanDerWaalsContact OH-CE1 3.3Å; Y374-H517 PolarHBondContact OH-NE2 3.48Å; Y374-H517 VanDerWaalsContact OH-NE2 3.09Å; Y374-D552 PolarHBondContact OH-OD2 3.47Å
375	R	88.7	Confident	89.4	Confident	130 Å²	130	41.8 Å²	41.8	49%	0.491	21%	0.208	S	C	.	.	S	Bend	trans	-150.4	160.1	174.7	61.7	178.6	-75.1	-179.1	2.1	109.1	F321 V377 L444	F321-R375 VanDerWaalsContact CE2-C 3.45Å; R375-V377 HydrophobicContact CG-CG1 4.11Å; R375-V377 PolarHBondContact O-N 3.22Å; R375-L444 HydrophobicContact CG-CD1 4.44Å
376	T	90.9	Very high	89.9	Confident	24 Å²	24	36.1 Å²	36.1	15%	0.147	18%	0.182	C	C	.	.			trans	-64.1	126.5	173.4	-50.8	0	0	0	0	109.2	E324 P385 V440	E324-T376 PolarHBondContact OE1-OG1 3.42Å; T376-P385 HydrophobicContact CG2-CB 4.18Å; T376-V440 HydrophobicContact CG2-CG1 3.9Å; T376-V440 HydrophobicContact CG2-CG2 4.32Å
377	V	92.4	Very high	90.1	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.012	19%	0.185	C	C	.	.			trans	-132	151.7	177.5	-63.6	0	0	0	0	109.1	F373 R375 P385 L386 I402 V440 P441 L444	F373-V377 HydrophobicContact CB-CG1 4.39Å; F373-V377 HydrophobicContact CB-CG2 4.08Å; F373-V377 HydrophobicContact CD1-CG1 4.11Å; F373-V377 HydrophobicContact CD1-CG2 4.1Å; F373-V377 HydrophobicContact CD2-CG2 3.71Å; F373-V377 HydrophobicContact CE1-CG2 4.47Å; F373-V377 HydrophobicContact CE2-CG2 4.12Å; F373-V377 HydrophobicContact CG-CG1 4.29Å; F373-V377 HydrophobicContact CG-CG2 3.69Å; F373-V377 HydrophobicContact CZ-CG2 4.47Å; R375-V377 HydrophobicContact CG-CG1 4.11Å; R375-V377 PolarHBondContact O-N 3.22Å; V377-P385 CarbonylContact O-C 3.58Å; V377-P385 WeakPolarHBondContact O-CA 3.45Å; V377-L386 HydrophobicContact CG2-CB 4.1Å; V377-L386 HydrophobicContact CG2-CD1 4.37Å; V377-L386 HydrophobicContact CG2-CD2 4.12Å; V377-L386 HydrophobicContact CG2-CG 4.43Å; V377-L386 PolarHBondContact O-N 2.8Å; V377-I402 HydrophobicContact CB-CD1 3.79Å; V377-I402 HydrophobicContact CG1-CD1 3.82Å; V377-I402 HydrophobicContact CG2-CD1 4.17Å; V377-I402 HydrophobicContact CG2-CG2 4.08Å; V377-V440 VanDerWaalsContact C-CG1 3.45Å; V377-P441 HydrophobicContact CG1-CG 4.31Å; V377-L444 HydrophobicContact CG1-CD1 3.57Å; V377-L444 HydrophobicContact CG1-CG 4.23Å
378	S	92.8	Very high	90.2	Very high	4 Å²	4	33.1 Å²	33.1	3%	0.028	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-113.7	155.8	-179.8	-76	0	0	0	0	111.4	N383 I384 V440 P441 T442	S378-N383 PolarHBondContact OG-O 3.2Å; S378-I384 WeakPolarHBondContact CA-O 3.44Å; S378-V440 WeakPolarHBondContact OG-CB 3.15Å; S378-V440 VanDerWaalsContact OG-CG1 3.23Å; S378-V440 WeakPolarHBondContact OG-CG1 2.71Å; S378-P441 PolarHBondContact N-O 3.32Å; S378-T442 WeakPolarHBondContact O-CA 3.15Å
379	C	92.3	Very high	89.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.168	C	C	.	.			trans	-76.7	135	175.8	174.8	0	0	0	0	111.2	V381 C382 N383 I384 L386 I402 C403 H404	C379-V381 PolarHBondContact O-N 3.32Å; C379-V381 PolarHBondContact SG-N 3.07Å; C379-V381 VanDerWaalsContact SG-N 3.4Å; C379-C382 VanDerWaalsContact CB-SG 3.58Å; C379-N383 WeakPolarHBondContact O-CA 3.46Å; C379-N383 PolarHBondContact O-N 3.11Å; C379-I384 PolarHBondContact N-O 3Å; C379-L386 HydrophobicContact CB-CD1 4.02Å; C379-I402 CarbonylContact C-O 3.57Å; C379-I402 WeakPolarHBondContact CA-O 3.38Å; C379-C403 VanDerWaalsContact SG-CA 3.59Å; C379-H404 WeakPolarHBondContact CB-CE1 2.96Å; C379-H404 WeakPolarHBondContact CB-ND1 3.26Å
380	I	89	Confident	89.7	Confident	73 Å²	73	32.4 Å²	32.4	37%	0.374	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.2	177	-164.5	167.7	0	0	0	113.5	A401 I402 C403 F413	I380-A401 HydrophobicContact CD1-CB 3.88Å; I380-I402 WeakPolarHBondContact CG2-O 3.33Å; I380-I402 PolarHBondContact N-O 2.95Å; I380-C403 HydrophobicContact CG2-CB 4.49Å; I380-F413 HydrophobicContact CG2-CD1 4.33Å; I380-F413 HydrophobicContact CG2-CE1 4.19Å
381	V	86.7	Confident	89.5	Confident	29 Å²	29	32 Å²	32	18%	0.176	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-51.7	-176	-179.8	0	0	0	0	111.6	I346 C379 C407 Y412 F413	I346-V381 HydrophobicContact CD1-CG1 4.49Å; I346-V381 HydrophobicContact CG2-CG1 4.13Å; C379-V381 PolarHBondContact O-N 3.32Å; C379-V381 PolarHBondContact SG-N 3.07Å; C379-V381 VanDerWaalsContact SG-N 3.4Å; V381-C407 HydrophobicContact CB-CB 3.98Å; V381-C407 HydrophobicContact CG1-CB 4.34Å; V381-C407 HydrophobicContact CG2-CB 4.13Å; V381-Y412 HydrophobicContact CG1-CD1 4.15Å; V381-F413 HydrophobicContact CG2-CD1 3.82Å; V381-F413 HydrophobicContact CG2-CE1 3.39Å; V381-F413 HydrophobicContact CG2-CZ 4.02Å
382	C	87.6	Confident	89.6	Confident	13 Å²	13	31.7 Å²	31.7	9%	0.088	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-5	-173.9	66.8	0	0	0	0	114	I346 C379 I384 H404	I346-C382 HydrophobicContact CD1-CB 3.82Å; I346-C382 HydrophobicContact CG1-CB 4.14Å; C379-C382 VanDerWaalsContact CB-SG 3.58Å; C382-I384 HydrophobicContact CB-CD1 4.25Å; C382-I384 HydrophobicContact CB-CG1 4.4Å; C382-I384 PolarHBondContact O-N 3.16Å; C382-H404 PolarHBondContact SG-CE1 3.34Å; C382-H404 PolarHBondContact SG-ND1 3.5Å
383	N	89.3	Confident	89.8	Confident	111 Å²	111	30.8 Å²	30.8	59%	0.594	16%	0.156	S	C	*	.			trans	57.9	11.2	-175.5	-154.4	34.2	0	0	0	115.8	S378 C379 T442	S378-N383 PolarHBondContact OG-O 3.2Å; C379-N383 WeakPolarHBondContact O-CA 3.46Å; C379-N383 PolarHBondContact O-N 3.11Å; N383-T442 WeakPolarHBondContact OD1-CG2 3.25Å
384	I	91.4	Very high	89.9	Confident	10 Å²	10	31.8 Å²	31.8	5%	0.051	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-84.6	139.9	177.4	-61.5	166.4	0	0	0	109.4	P338 N343 S378 C379 C382 H404	P338-I384 HydrophobicContact CB-CD1 3.9Å; P338-I384 HydrophobicContact CB-CG1 4.07Å; P338-I384 HydrophobicContact CG-CD1 4.39Å; P338-I384 HydrophobicContact CG-CG1 4.02Å; P338-I384 HydrophobicContact CG-CG2 4.37Å; P338-I384 WeakPolarHBondContact O-CG2 3.11Å; N343-I384 HydrophobicContact CB-CD1 3.92Å; S378-I384 WeakPolarHBondContact CA-O 3.44Å; C379-I384 PolarHBondContact N-O 3Å; C382-I384 HydrophobicContact CB-CD1 4.25Å; C382-I384 HydrophobicContact CB-CG1 4.4Å; C382-I384 PolarHBondContact O-N 3.16Å; I384-H404 PolarHBondContact O-CE1 2.85Å; I384-H404 PolarHBondContact O-NE2 3.47Å
385	P	93	Very high	90.2	Very high	25 Å²	25	30.5 Å²	30.5	16%	0.162	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-57.8	146.5	175.1	-27.1	36.2	0	0	0	113.8	T376 V377 H404	T376-P385 HydrophobicContact CG2-CB 4.18Å; V377-P385 CarbonylContact O-C 3.58Å; V377-P385 WeakPolarHBondContact O-CA 3.45Å; P385-H404 PolarHBondContact O-NE2 3.09Å; P385-H404 VanDerWaalsContact O-NE2 3.09Å
386	L	94	Very high	90.3	Very high	12 Å²	12	24.3 Å²	24.3	6%	0.063	13%	0.132	C	C	.	.	P	Polyproline II helix	trans	-80	138.3	169.3	-80.7	69.3	0	0	0	109.3	F373 V377 C379 Q392 I402	F373-L386 HydrophobicContact CD2-CD2 4.25Å; F373-L386 HydrophobicContact CE2-CD2 3.79Å; V377-L386 HydrophobicContact CG2-CB 4.1Å; V377-L386 HydrophobicContact CG2-CD1 4.37Å; V377-L386 HydrophobicContact CG2-CD2 4.12Å; V377-L386 HydrophobicContact CG2-CG 4.43Å; V377-L386 PolarHBondContact O-N 2.8Å; C379-L386 HydrophobicContact CB-CD1 4.02Å; L386-Q392 HydrophobicContact CB-CB 3.89Å; L386-Q392 HydrophobicContact CD2-CB 4.16Å; L386-I402 HydrophobicContact CD1-CG2 3.9Å; L386-I402 HydrophobicContact CD2-CG2 3.59Å; L386-I402 HydrophobicContact CG-CG2 4.44Å
387	L	92.5	Very high	90.2	Very high	39 Å²	39	28.7 Å²	28.7	20%	0.204	15%	0.149	C	C	.	.			trans	-107.3	152.3	-179.7	-63.7	175.7	0	0	0	111.2	V285 R328 A329 T332 Q392	V285-L387 HydrophobicContact CG1-CB 3.82Å; V285-L387 HydrophobicContact CG1-CD1 4.33Å; R328-L387 HydrophobicContact CB-CD2 4.08Å; R328-L387 HydrophobicContact CG-CD2 3.88Å; A329-L387 HydrophobicContact CB-CD1 4.23Å; A329-L387 HydrophobicContact CB-CD2 4.36Å; T332-L387 HydrophobicContact CG2-CD1 4.22Å; L387-Q392 VanDerWaalsContact O-CB 3.32Å; L387-Q392 WeakPolarHBondContact O-CB 3.39Å; L387-Q392 WeakPolarHBondContact O-CG 3.29Å
388	G	90.6	Very high	90	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.01	17%	0.17	C	C	.	.	S	Bend	trans	105.2	177.6	177.6	0	0	0	0	0	114.2	V285 Q392	V285-G388 WeakPolarHBondContact O-CA 3.37Å; G388-Q392 VanDerWaalsContact C-CG 3.41Å; G388-Q392 WeakPolarHBondContact O-CG 3.37Å; G388-Q392 PolarHBondContact O-NE2 3.07Å
389	F	86.1	Confident	89.8	Confident	31 Å²	31	33.6 Å²	33.6	14%	0.136	17%	0.17	C	C	.	.	S	Bend	trans	-106.9	-23.4	-179.2	-59.2	-52	0	0	0	115	G286 L287 R289 F290 F321 A322 T325 Q392	G286-F389 PolarHBondContact O-N 3.23Å; L287-F389 HydrophobicContact CD2-CD2 3.69Å; L287-F389 HydrophobicContact CD2-CE1 4.25Å; L287-F389 HydrophobicContact CD2-CE2 3.12Å; L287-F389 HydrophobicContact CD2-CG 4.46Å; L287-F389 HydrophobicContact CD2-CZ 3.45Å; L287-F389 VanDerWaalsContact CD2-CZ 3.45Å; L287-F389 HydrophobicContact CG-CE2 4.37Å; R289-F389 HydrophobicContact CG-CD2 4.12Å; R289-F389 HydrophobicContact CG-CE2 4.13Å; R289-F389 VanDerWaalsContact CZ-CE2 3.49Å; R289-F389 VanDerWaalsContact NH2-CD2 3.31Å; F290-F389 AromaticContact CD2-CE2 3.96Å; F290-F389 HydrophobicContact CD2-CE2 3.96Å; F290-F389 AromaticContact CE2-CE2 3.44Å; F290-F389 HydrophobicContact CE2-CE2 3.44Å; F290-F389 VanDerWaalsContact CE2-CE2 3.44Å; F290-F389 AromaticContact CE2-CZ 3.69Å; F290-F389 HydrophobicContact CE2-CZ 3.69Å; F290-F389 HydrophobicContact CZ-CE2 4.43Å; F321-F389 HydrophobicContact CD1-CD1 4.2Å; F321-F389 HydrophobicContact CD1-CE1 4.28Å; F321-F389 AromaticContact CE1-CD1 3.86Å; F321-F389 HydrophobicContact CE1-CD1 3.86Å; F321-F389 HydrophobicContact CE1-CE1 4.23Å; A322-F389 HydrophobicContact CB-CE1 4.16Å; A322-F389 HydrophobicContact CB-CZ 4.03Å; T325-F389 HydrophobicContact CG2-CD1 4.35Å; T325-F389 HydrophobicContact CG2-CE1 3.72Å; T325-F389 HydrophobicContact CG2-CZ 4.15Å; F389-Q392 VanDerWaalsContact C-NE2 3.29Å; F389-Q392 PolarHBondContact O-NE2 3.47Å
390	S	83.2	Confident	89.7	Confident	45 Å²	45	33.6 Å²	33.6	32%	0.315	17%	0.17	S	C	.	.	S	Bend	trans	-136.3	144.1	180	53.7	0	0	0	0	109.4	S372 Q392	S372-S390 WeakPolarHBondContact OG-CA 3.35Å; S390-Q392 PolarHBondContact O-N 2.83Å
391	H	84.3	Confident	89.9	Confident	30 Å²	30	30.2 Å²	30.2	14%	0.139	15%	0.154	C	C	.	.			trans	50.1	38.8	174.3	-54.3	-61.3	0	0	0	113.5	L370 T371 S372 G393 R405 R656	L370-H391 HydrophobicContact CD1-CB 3.97Å; L370-H391 HydrophobicContact CD2-CB 3.74Å; L370-H391 HydrophobicContact CG-CB 3.69Å; T371-H391 WeakPolarHBondContact O-CA 3.11Å; S372-H391 PolarHBondContact OG-N 2.92Å; H391-G393 PolarHBondContact O-N 3.37Å; H391-G393 VanDerWaalsContact O-N 3.14Å; H391-R405 PolarHBondContact O-NH2 2.81Å; H391-R656 PolarHBondContact CD2-NH1 3.37Å; H391-R656 VanDerWaalsContact CD2-NH1 3.26Å; H391-R656 PolarHBondContact CE1-NH1 3.01Å; H391-R656 VanDerWaalsContact CE1-NH1 3.31Å; H391-R656 PolarHBondContact NE2-NH1 3.48Å
392	Q	91	Very high	90.2	Very high	19 Å²	19	28.9 Å²	28.9	9%	0.089	15%	0.145	C	C	.	.			trans	-63.3	-22.9	-173.9	-57.6	95.9	-35	0	0	112.1	T371 S372 F373 L386 L387 G388 F389 S390	T371-Q392 PolarHBondContact O-N 3.5Å; S372-Q392 VanDerWaalsContact CA-OE1 3.27Å; F373-Q392 HydrophobicContact CD2-CB 4.4Å; F373-Q392 PolarHBondContact O-NE2 3.31Å; L386-Q392 HydrophobicContact CB-CB 3.89Å; L386-Q392 HydrophobicContact CD2-CB 4.16Å; L387-Q392 VanDerWaalsContact O-CB 3.32Å; L387-Q392 WeakPolarHBondContact O-CB 3.39Å; L387-Q392 WeakPolarHBondContact O-CG 3.29Å; G388-Q392 VanDerWaalsContact C-CG 3.41Å; G388-Q392 WeakPolarHBondContact O-CG 3.37Å; G388-Q392 PolarHBondContact O-NE2 3.07Å; F389-Q392 VanDerWaalsContact C-NE2 3.29Å; F389-Q392 PolarHBondContact O-NE2 3.47Å; S390-Q392 PolarHBondContact O-N 2.83Å
393	G	92	Very high	90.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.9	-159.2	177.2	0	0	0	0	0	111.5	L370 T371 H391 C403	L370-G393 WeakPolarHBondContact CD1-O 3.49Å; T371-G393 PolarHBondContact N-O 3.48Å; H391-G393 PolarHBondContact O-N 3.37Å; H391-G393 VanDerWaalsContact O-N 3.14Å; G393-C403 WeakPolarHBondContact CA-O 3.48Å
394	F	92.8	Very high	90.6	Very high	28 Å²	28	23.6 Å²	23.6	12%	0.123	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	142.6	-175.6	-64.8	-90.5	0	0	0	111.5	F368 Q369 L370 I402 C403 R405 K408	F368-F394 HydrophobicContact CB-CB 3.98Å; F368-F394 HydrophobicContact CB-CD1 4.21Å; F368-F394 HydrophobicContact CB-CG 4.36Å; F368-F394 HydrophobicContact CD1-CB 3.86Å; F368-F394 HydrophobicContact CG-CB 4.2Å; Q369-F394 CarbonylContact O-C 3.55Å; Q369-F394 WeakPolarHBondContact O-CA 3.45Å; L370-F394 HydrophobicContact CB-CD1 4.15Å; L370-F394 HydrophobicContact CB-CE1 3.89Å; L370-F394 HydrophobicContact CD1-CD1 4.44Å; L370-F394 HydrophobicContact CD1-CE1 4.11Å; L370-F394 HydrophobicContact CD1-CE2 4.34Å; L370-F394 HydrophobicContact CD1-CZ 4.05Å; F394-I402 CarbonylContact O-C 3.41Å; F394-I402 VanDerWaalsContact O-CA 3.25Å; F394-I402 WeakPolarHBondContact O-CA 3.41Å; F394-C403 PolarHBondContact N-O 3.24Å; F394-C403 PolarHBondContact O-N 3.3Å; F394-R405 HydrophobicContact CD2-CG 4.45Å; F394-R405 HydrophobicContact CE2-CB 4.24Å; F394-R405 HydrophobicContact CE2-CG 3.76Å; F394-K408 HydrophobicContact CB-CD 4.41Å; F394-K408 HydrophobicContact CD1-CD 3.83Å; F394-K408 HydrophobicContact CD2-CB 4.08Å; F394-K408 HydrophobicContact CD2-CD 3.47Å; F394-K408 VanDerWaalsContact CD2-CD 3.47Å; F394-K408 HydrophobicContact CD2-CG 4.38Å; F394-K408 HydrophobicContact CE1-CD 3.92Å; F394-K408 VanDerWaalsContact CE1-NZ 3.34Å; F394-K408 HydrophobicContact CE2-CB 4.31Å; F394-K408 HydrophobicContact CE2-CD 3.52Å; F394-K408 HydrophobicContact CG-CD 3.64Å; F394-K408 HydrophobicContact CZ-CD 3.77Å
395	Q	93.2	Very high	90.6	Very high	15 Å²	15	25.3 Å²	25.3	7%	0.07	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.7	166.5	-167.9	-177.7	13.8	0	0	109.6	Q369 T371 F373 A401 I402 L444 V445	Q369-Q395 PolarHBondContact N-O 3.32Å; Q369-Q395 PolarHBondContact O-N 3.07Å; T371-Q395 HydrophobicContact CG2-CB 4.33Å; F373-Q395 HydrophobicContact CE1-CB 4.25Å; F373-Q395 HydrophobicContact CZ-CB 4Å; Q395-A401 CarbonylContact C-O 3.55Å; Q395-A401 WeakPolarHBondContact CA-O 3.39Å; Q395-I402 HydrophobicContact CG-CG1 4.23Å; Q395-L444 PolarHBondContact NE2-O 3.41Å; Q395-V445 PolarHBondContact NE2-O 3.27Å
396	C	91.8	Very high	90.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	125.6	172.6	-176.4	0	0	0	0	111	H366 D367 F368 K398 C399 G400 A401	H366-C396 HydrophobicContact CB-CB 4.43Å; H366-C396 PolarHBondContact ND1-SG 2.97Å; D367-C396 PolarHBondContact N-SG 3.41Å; D367-C396 VanDerWaalsContact N-SG 3.37Å; D367-C396 CarbonylContact O-C 3.44Å; D367-C396 VanDerWaalsContact O-CA 3.22Å; D367-C396 WeakPolarHBondContact O-CA 3.33Å; F368-C396 HydrophobicContact CD1-CB 3.97Å; F368-C396 HydrophobicContact CE1-CB 3.89Å; C396-K398 PolarHBondContact O-N 3.24Å; C396-C399 VanDerWaalsContact SG-SG 3.67Å; C396-G400 VanDerWaalsContact O-CA 3.28Å; C396-G400 WeakPolarHBondContact O-CA 3.42Å; C396-G400 PolarHBondContact O-N 2.8Å; C396-A401 HydrophobicContact CB-CB 4.4Å; C396-A401 PolarHBondContact N-O 3.38Å
397	K	88.2	Confident	90.4	Very high	116 Å²	116	23.9 Å²	23.9	50%	0.504	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.7	177.2	-70.8	-171.4	174.1	-178.6	0	114.1	D367 Q369 P446	D367-K397 HydrophobicContact CB-CB 4.46Å; D367-K397 PolarHBondContact O-N 3Å; D367-K397 WeakPolarHBondContact OD2-CD 3.38Å; Q369-K397 HydrophobicContact CB-CG 4.47Å; K397-P446 WeakPolarHBondContact O-CB 3.48Å; K397-P446 WeakPolarHBondContact O-CG 3.36Å
398	K	88.2	Confident	90.3	Very high	104 Å²	104	25.7 Å²	25.7	45%	0.452	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-54.5	-174.9	-59.2	176	-175.4	170.1	0	112	Q365 D367 C396	Q365-K398 PolarHBondContact O-NZ 2.83Å; D367-K398 HydrophobicContact CB-CD 4.34Å; D367-K398 HydrophobicContact CB-CG 4.34Å; C396-K398 PolarHBondContact O-N 3.24Å
399	C	88	Confident	90.1	Very high	4 Å²	4	27.4 Å²	27.4	3%	0.027	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-6.3	-172.8	70.5	0	0	0	0	115.1	H366 C396 A401 P417 V419 F420 S443	H366-C399 PolarHBondContact CE1-SG 2.97Å; H366-C399 PolarHBondContact ND1-SG 3.33Å; C396-C399 VanDerWaalsContact SG-SG 3.67Å; C399-A401 PolarHBondContact O-N 3.4Å; C399-A401 VanDerWaalsContact SG-CB 3.51Å; C399-P417 HydrophobicContact CB-CG 3.6Å; C399-V419 WeakPolarHBondContact CA-O 3.35Å; C399-V419 WeakPolarHBondContact CB-O 3.28Å; C399-F420 WeakPolarHBondContact O-CD2 3.17Å; C399-S443 PolarHBondContact O-OG 2.87Å
400	G	90.7	Very high	90.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.			trans	79	-1.6	178.9	0	0	0	0	0	116	C396 S443 L444	C396-G400 VanDerWaalsContact O-CA 3.28Å; C396-G400 WeakPolarHBondContact O-CA 3.42Å; C396-G400 PolarHBondContact O-N 2.8Å; G400-S443 WeakPolarHBondContact O-CA 3.35Å; G400-S443 PolarHBondContact O-OG 3.42Å; G400-L444 CarbonylContact C-O 3.54Å; G400-L444 WeakPolarHBondContact CA-O 2.97Å; G400-L444 PolarHBondContact O-N 3.31Å
401	A	92.4	Very high	89.7	Confident	3 Å²	3	28.5 Å²	28.5	3%	0.025	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-59.2	139.9	-179.6	0	0	0	0	0	111.9	I380 Q395 C396 C399 S443	I380-A401 HydrophobicContact CD1-CB 3.88Å; Q395-A401 CarbonylContact C-O 3.55Å; Q395-A401 WeakPolarHBondContact CA-O 3.39Å; C396-A401 HydrophobicContact CB-CB 4.4Å; C396-A401 PolarHBondContact N-O 3.38Å; C399-A401 PolarHBondContact O-N 3.4Å; C399-A401 VanDerWaalsContact SG-CB 3.51Å; A401-S443 PolarHBondContact N-OG 2.9Å
402	I	93.4	Very high	89.2	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	137.2	-175	-60.4	171.1	0	0	0	110.1	F373 V377 C379 I380 L386 F394 Q395 T442 L444	F373-I402 HydrophobicContact CD1-CD1 4.26Å; F373-I402 HydrophobicContact CE1-CD1 3.59Å; F373-I402 HydrophobicContact CE1-CG1 3.95Å; F373-I402 HydrophobicContact CE1-CG2 4.48Å; F373-I402 HydrophobicContact CE2-CG2 4.08Å; F373-I402 HydrophobicContact CZ-CB 4.45Å; F373-I402 HydrophobicContact CZ-CD1 3.95Å; F373-I402 HydrophobicContact CZ-CG1 3.9Å; F373-I402 HydrophobicContact CZ-CG2 3.76Å; V377-I402 HydrophobicContact CB-CD1 3.79Å; V377-I402 HydrophobicContact CG1-CD1 3.82Å; V377-I402 HydrophobicContact CG2-CD1 4.17Å; V377-I402 HydrophobicContact CG2-CG2 4.08Å; C379-I402 CarbonylContact C-O 3.57Å; C379-I402 WeakPolarHBondContact CA-O 3.38Å; I380-I402 WeakPolarHBondContact CG2-O 3.33Å; I380-I402 PolarHBondContact N-O 2.95Å; L386-I402 HydrophobicContact CD1-CG2 3.9Å; L386-I402 HydrophobicContact CD2-CG2 3.59Å; L386-I402 HydrophobicContact CG-CG2 4.44Å; F394-I402 CarbonylContact O-C 3.41Å; F394-I402 VanDerWaalsContact O-CA 3.25Å; F394-I402 WeakPolarHBondContact O-CA 3.41Å; Q395-I402 HydrophobicContact CG-CG1 4.23Å; I402-T442 WeakPolarHBondContact CB-O 3.36Å; I402-T442 PolarHBondContact N-O 2.71Å; I402-L444 HydrophobicContact CD1-CB 4.18Å; I402-L444 HydrophobicContact CD1-CD1 4.02Å; I402-L444 HydrophobicContact CD1-CG 3.81Å
403	C	92.8	Very high	88.2	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	155	175.9	67.4	0	0	0	0	114	F368 C379 I380 G393 F394 C407 F413	F368-C403 VanDerWaalsContact CE1-SG 3.51Å; C379-C403 VanDerWaalsContact SG-CA 3.59Å; I380-C403 HydrophobicContact CG2-CB 4.49Å; G393-C403 WeakPolarHBondContact CA-O 3.48Å; F394-C403 PolarHBondContact N-O 3.24Å; F394-C403 PolarHBondContact O-N 3.3Å; C403-C407 HydrophobicContact CB-CB 4.45Å; C403-F413 HydrophobicContact CB-CE1 3.73Å; C403-F413 HydrophobicContact CB-CZ 3.9Å
404	H	93.6	Very high	87.4	Confident	13 Å²	13	36.4 Å²	36.4	6%	0.06	18%	0.181	C	C	.	.			trans	-70.4	162.4	172.5	-60.1	109.3	0	0	0	111.8	C379 C382 I384 P385 I406 C407 K408	C379-H404 WeakPolarHBondContact CB-CE1 2.96Å; C379-H404 WeakPolarHBondContact CB-ND1 3.26Å; C382-H404 PolarHBondContact SG-CE1 3.34Å; C382-H404 PolarHBondContact SG-ND1 3.5Å; I384-H404 PolarHBondContact O-CE1 2.85Å; I384-H404 PolarHBondContact O-NE2 3.47Å; P385-H404 PolarHBondContact O-NE2 3.09Å; P385-H404 VanDerWaalsContact O-NE2 3.09Å; H404-I406 VanDerWaalsContact C-N 3.34Å; H404-I406 PolarHBondContact O-N 3.47Å; H404-C407 HydrophobicContact CB-CB 4.2Å; H404-C407 PolarHBondContact O-N 3.39Å; H404-K408 WeakPolarHBondContact O-CB 3.22Å; H404-K408 PolarHBondContact O-N 3.09Å
405	R	91.7	Very high	86.8	Confident	46 Å²	46	40 Å²	40	17%	0.174	20%	0.201	C	C	.	.	H	α-helix	trans	-57.4	-45.9	169.9	-64.2	175.8	-178.3	-99	1.4	112.1	D197 L370 H391 F394 K408 A409	D197-R405 HydrophobicContact CB-CB 4.33Å; D197-R405 WeakPolarHBondContact OD2-CB 3.35Å; L370-R405 VanDerWaalsContact CD1-NH2 3.31Å; H391-R405 PolarHBondContact O-NH2 2.81Å; F394-R405 HydrophobicContact CD2-CG 4.45Å; F394-R405 HydrophobicContact CE2-CB 4.24Å; F394-R405 HydrophobicContact CE2-CG 3.76Å; R405-K408 PolarHBondContact O-N 3.05Å; R405-A409 PolarHBondContact O-N 3.01Å
406	I	91.6	Very high	86.5	Confident	8 Å²	8	39.4 Å²	39.4	4%	0.041	20%	0.199	C	C	.	.	H	α-helix	trans	-56.7	-55.1	174	-53.1	-179.8	0	0	0	110.3	D197 P340 H404 K408 A409 L410	D197-I406 HydrophobicContact CB-CG1 4.2Å; D197-I406 VanDerWaalsContact OD2-CG1 3.32Å; D197-I406 WeakPolarHBondContact OD2-CG1 3.46Å; P340-I406 HydrophobicContact CB-CD1 4.38Å; P340-I406 HydrophobicContact CG-CD1 4.18Å; H404-I406 VanDerWaalsContact C-N 3.34Å; H404-I406 PolarHBondContact O-N 3.47Å; I406-K408 VanDerWaalsContact C-N 3.29Å; I406-K408 PolarHBondContact O-N 3Å; I406-A409 WeakPolarHBondContact O-CB 3.33Å; I406-A409 PolarHBondContact O-N 3.19Å; I406-L410 PolarHBondContact O-N 3.3Å
407	C	90.9	Very high	86.1	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.6	-32.7	-177	-62.3	0	0	0	0	113.2	V381 C403 H404 A409 L410	V381-C407 HydrophobicContact CB-CB 3.98Å; V381-C407 HydrophobicContact CG1-CB 4.34Å; V381-C407 HydrophobicContact CG2-CB 4.13Å; C403-C407 HydrophobicContact CB-CB 4.45Å; H404-C407 HydrophobicContact CB-CB 4.2Å; H404-C407 PolarHBondContact O-N 3.39Å; C407-A409 VanDerWaalsContact C-N 3.33Å; C407-L410 PolarHBondContact O-N 3.41Å
408	K	90.2	Very high	85.8	Confident	76 Å²	76	38.4 Å²	38.4	33%	0.33	21%	0.211	S	C	.	.	H	α-helix	trans	-61.3	-41.5	172.6	-172.7	-178.3	172.4	-170.2	0	112.2	F368 F394 H404 R405 I406 L410 D411 F413	F368-K408 HydrophobicContact CB-CD 4.2Å; F368-K408 HydrophobicContact CD2-CG 4.49Å; F394-K408 HydrophobicContact CB-CD 4.41Å; F394-K408 HydrophobicContact CD1-CD 3.83Å; F394-K408 HydrophobicContact CD2-CB 4.08Å; F394-K408 HydrophobicContact CD2-CD 3.47Å; F394-K408 VanDerWaalsContact CD2-CD 3.47Å; F394-K408 HydrophobicContact CD2-CG 4.38Å; F394-K408 HydrophobicContact CE1-CD 3.92Å; F394-K408 VanDerWaalsContact CE1-NZ 3.34Å; F394-K408 HydrophobicContact CE2-CB 4.31Å; F394-K408 HydrophobicContact CE2-CD 3.52Å; F394-K408 HydrophobicContact CG-CD 3.64Å; F394-K408 HydrophobicContact CZ-CD 3.77Å; H404-K408 WeakPolarHBondContact O-CB 3.22Å; H404-K408 PolarHBondContact O-N 3.09Å; R405-K408 PolarHBondContact O-N 3.05Å; I406-K408 VanDerWaalsContact C-N 3.29Å; I406-K408 PolarHBondContact O-N 3Å; K408-L410 VanDerWaalsContact C-N 3.3Å; K408-L410 PolarHBondContact O-N 3.21Å; K408-D411 PolarHBondContact O-N 2.94Å; K408-F413 HydrophobicContact CB-CZ 4.44Å
409	A	86.8	Confident	85.5	Confident	38 Å²	38	38.3 Å²	38.3	31%	0.314	22%	0.219	S	C	.	.	H	α-helix	trans	-71.2	-23.6	-179.3	0	0	0	0	0	113.8	C195 R405 I406 C407 D411	C195-A409 HydrophobicContact CB-CB 3.34Å; R405-A409 PolarHBondContact O-N 3.01Å; I406-A409 WeakPolarHBondContact O-CB 3.33Å; I406-A409 PolarHBondContact O-N 3.19Å; C407-A409 VanDerWaalsContact C-N 3.33Å; A409-D411 PolarHBondContact O-N 3.06Å
410	L	85.2	Confident	85.1	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-12.1	174.9	-58	175.9	0	0	0	112.6	L194 V219 Y223 I346 I406 C407 K408 Y412	L194-L410 HydrophobicContact CD2-CD2 4.24Å; V219-L410 HydrophobicContact CG1-CD1 3.55Å; V219-L410 HydrophobicContact CG1-CD2 4.26Å; Y223-L410 HydrophobicContact CD1-CD2 4.13Å; Y223-L410 HydrophobicContact CD2-CB 4.43Å; Y223-L410 HydrophobicContact CD2-CD2 3.95Å; Y223-L410 HydrophobicContact CE2-CB 4.43Å; Y223-L410 VanDerWaalsContact CE2-O 3.3Å; Y223-L410 WeakPolarHBondContact CE2-O 3.34Å; Y223-L410 HydrophobicContact CG-CD2 3.68Å; Y223-L410 VanDerWaalsContact CZ-O 3.24Å; Y223-L410 PolarHBondContact OH-O 3Å; Y223-L410 VanDerWaalsContact OH-O 3.06Å; I346-L410 HydrophobicContact CD1-CD1 4.46Å; I406-L410 PolarHBondContact O-N 3.3Å; C407-L410 PolarHBondContact O-N 3.41Å; K408-L410 VanDerWaalsContact C-N 3.3Å; K408-L410 PolarHBondContact O-N 3.21Å; L410-Y412 PolarHBondContact O-N 2.92Å
411	D	75.4	Confident	83.8	Confident	96 Å²	96	45.1 Å²	45.1	51%	0.513	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	29.6	-179	-151.4	19.6	0	0	0	114.1	K408 A409 F413	K408-D411 PolarHBondContact O-N 2.94Å; A409-D411 PolarHBondContact O-N 3.06Å; D411-F413 VanDerWaalsContact C-N 3.3Å; D411-F413 PolarHBondContact O-N 3.44Å
412	Y	73.9	Confident	82.4	Confident	84 Å²	84	47.9 Å²	47.9	33%	0.329	28%	0.279	S	S	.	.			trans	-91.8	61.3	-177.8	-164.7	-102.3	0	0	0	110.3	I346 L350 V381 L410	I346-Y412 HydrophobicContact CG2-CD1 4.07Å; I346-Y412 HydrophobicContact CG2-CE1 4.29Å; L350-Y412 HydrophobicContact CD1-CE2 3.69Å; L350-Y412 WeakPolarHBondContact CD1-OH 3.4Å; L350-Y412 HydrophobicContact CD2-CE2 4.21Å; L350-Y412 HydrophobicContact CG-CE2 4.34Å; V381-Y412 HydrophobicContact CG1-CD1 4.15Å; L410-Y412 PolarHBondContact O-N 2.92Å
413	F	69.5	Low	80.5	Confident	38 Å²	38	50.7 Å²	50.7	17%	0.167	30%	0.299	C	S	.	.			trans	-113.4	144.7	179.8	-59.6	-78.1	0	0	0	111.1	F368 I380 V381 C403 K408 D411	F368-F413 HydrophobicContact CE2-CD1 4.07Å; F368-F413 HydrophobicContact CE2-CD2 4.09Å; F368-F413 AromaticContact CE2-CE1 3.88Å; F368-F413 HydrophobicContact CE2-CE1 3.88Å; F368-F413 AromaticContact CE2-CE2 3.92Å; F368-F413 HydrophobicContact CE2-CE2 3.92Å; F368-F413 HydrophobicContact CE2-CG 4.17Å; F368-F413 AromaticContact CE2-CZ 3.82Å; F368-F413 HydrophobicContact CE2-CZ 3.82Å; F368-F413 AromaticContact CZ-CD1 3.86Å; F368-F413 HydrophobicContact CZ-CD1 3.86Å; F368-F413 AromaticContact CZ-CE1 3.6Å; F368-F413 HydrophobicContact CZ-CE1 3.6Å; F368-F413 HydrophobicContact CZ-CE2 4.48Å; F368-F413 HydrophobicContact CZ-CG 4.41Å; F368-F413 AromaticContact CZ-CZ 3.95Å; F368-F413 HydrophobicContact CZ-CZ 3.95Å; I380-F413 HydrophobicContact CG2-CD1 4.33Å; I380-F413 HydrophobicContact CG2-CE1 4.19Å; V381-F413 HydrophobicContact CG2-CD1 3.82Å; V381-F413 HydrophobicContact CG2-CE1 3.39Å; V381-F413 HydrophobicContact CG2-CZ 4.02Å; C403-F413 HydrophobicContact CB-CE1 3.73Å; C403-F413 HydrophobicContact CB-CZ 3.9Å; K408-F413 HydrophobicContact CB-CZ 4.44Å; D411-F413 VanDerWaalsContact C-N 3.3Å; D411-F413 PolarHBondContact O-N 3.44Å
414	S	74.7	Confident	78.2	Confident	93 Å²	93	59.5 Å²	59.5	65%	0.65	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-65.9	161	159.4	50.9	0	0	0	0	110.1	H366 C416	H366-S414 PolarHBondContact CD2-O 3.09Å; H366-S414 PolarHBondContact NE2-O 3.08Å; S414-C416 PolarHBondContact O-N 3.2Å
415	N	81.2	Confident	75.1	Confident	104 Å²	104	63 Å²	63	56%	0.556	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-57.1	138.3	173.7	-74.8	-29.3	0	0	0	110.6	S363 P417	S363-N415 WeakPolarHBondContact CB-OD1 3.43Å; N415-P417 WeakPolarHBondContact O-CD 3.25Å
416	C	85.3	Confident	72	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.02	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-61.9	123.9	179.6	-173.9	0	0	0	0	109.9	R364 H366 S414 G418	R364-C416 HydrophobicContact CB-CB 4.33Å; R364-C416 WeakPolarHBondContact CB-O 3.39Å; R364-C416 WeakPolarHBondContact CD-O 3.49Å; R364-C416 WeakPolarHBondContact O-CB 3.36Å; R364-C416 PolarHBondContact O-N 2.92Å; H366-C416 HydrophobicContact CB-CB 4.4Å; H366-C416 WeakPolarHBondContact NE2-CA 3.34Å; S414-C416 PolarHBondContact O-N 3.2Å; C416-G418 PolarHBondContact O-N 3.27Å; C416-G418 VanDerWaalsContact O-N 3.09Å; C416-G418 PolarHBondContact SG-N 3.34Å
417	P	83.9	Confident	68.8	Low	56 Å²	56	75 Å²	75	36%	0.364	43%	0.427	S	S	.	.			trans	-64.3	-16.9	176.9	24.4	-32.1	0	0	0	112.1	C399 N415 V419	C399-P417 HydrophobicContact CB-CG 3.6Å; N415-P417 WeakPolarHBondContact O-CD 3.25Å; P417-V419 PolarHBondContact O-N 3.37Å; P417-V419 VanDerWaalsContact O-N 3.16Å
418	G	81.7	Confident	66	Low	38 Å²	38	79.2 Å²	79.2	39%	0.392	46%	0.455	S	S	.	.	S	Bend	trans	76.9	-12.5	-179.4	0	0	0	0	0	114.1	C416	C416-G418 PolarHBondContact O-N 3.27Å; C416-G418 VanDerWaalsContact O-N 3.09Å; C416-G418 PolarHBondContact SG-N 3.34Å
419	V	81.7	Confident	63.1	Low	102 Å²	102	83.9 Å²	83.9	62%	0.618	48%	0.478	S	S	*	.	S	Bend	trans	-125.9	148.7	178.1	-176.2	0	0	0	0	108.5	C399 P417 C421	C399-V419 WeakPolarHBondContact CA-O 3.35Å; C399-V419 WeakPolarHBondContact CB-O 3.28Å; P417-V419 PolarHBondContact O-N 3.37Å; P417-V419 VanDerWaalsContact O-N 3.16Å; V419-C421 PolarHBondContact O-N 2.83Å; V419-C421 VanDerWaalsContact O-N 3.1Å
420	F	80.9	Confident	60.3	Low	71 Å²	71	88.6 Å²	88.6	31%	0.311	50%	0.498	S	S	.	.			trans	-60.9	113	170.5	174.5	-107	0	0	0	110	C399 A422 S443 L444 V445	C399-F420 WeakPolarHBondContact O-CD2 3.17Å; F420-A422 HydrophobicContact CE1-CB 4.13Å; F420-A422 HydrophobicContact CZ-CB 4.17Å; F420-S443 WeakPolarHBondContact CE2-OG 3.48Å; F420-L444 WeakPolarHBondContact CE2-O 3.47Å; F420-V445 HydrophobicContact CD1-CG2 4.13Å; F420-V445 HydrophobicContact CE1-CG2 3.73Å; F420-V445 HydrophobicContact CE2-CG2 4.28Å; F420-V445 VanDerWaalsContact CE2-N 3.33Å; F420-V445 HydrophobicContact CZ-CG2 3.81Å
421	C	63	Low	57.7	Low	76 Å²	76	97 Å²	97	51%	0.514	54%	0.537	S	S	.	.			trans	-105.8	114.1	167.3	-68.2	0	0	0	0	107.4	V419 S423	V419-C421 PolarHBondContact O-N 2.83Å; V419-C421 VanDerWaalsContact O-N 3.1Å; C421-S423 PolarHBondContact O-N 2.85Å; C421-S423 VanDerWaalsContact O-N 3.13Å
422	A	62	Low	55.5	Low	61 Å²	61	100.5 Å²	100.5	50%	0.504	56%	0.556	S	S	.	*			trans	-57.6	120	167.4	0	0	0	0	0	107.9	F420 K424	F420-A422 HydrophobicContact CE1-CB 4.13Å; F420-A422 HydrophobicContact CZ-CB 4.17Å; A422-K424 PolarHBondContact O-N 3Å; A422-K424 VanDerWaalsContact O-N 3.14Å
423	S	55.5	Low	53.4	Low	59 Å²	59	100.4 Å²	100.4	41%	0.413	57%	0.572	S	S	.	*	S	Bend	trans	-53.3	120.1	173.6	43.7	0	0	0	0	109	C421	C421-S423 PolarHBondContact O-N 2.85Å; C421-S423 VanDerWaalsContact O-N 3.13Å
424	K	44.3	Very low	51.4	Low	186 Å²	186	102.4 Å²	102.4	81%	0.809	60%	0.604	S	S	*	*	S	Bend	trans	45.6	91.4	-174.6	-67	-177.9	-177.4	174.7	0	113.4	A422 F426	A422-K424 PolarHBondContact O-N 3Å; A422-K424 VanDerWaalsContact O-N 3.14Å; K424-F426 PolarHBondContact O-N 2.92Å
425	A	27.9	Very low	49.2	Very low	85 Å²	85	104.5 Å²	104.5	70%	0.702	62%	0.617	S	S	*	*			trans	-49.5	126	166.1	0	0	0	0	0	110.2	N427	A425-N427 PolarHBondContact O-N 2.87Å
426	F	26.7	Very low	46.6	Very low	192 Å²	192	102.6 Å²	102.6	84%	0.842	62%	0.622	S	S	*	*			trans	-44.9	105.8	163.8	-160.8	-94.5	0	0	0	108.2	K424 P428	K424-F426 PolarHBondContact O-N 2.92Å; F426-P428 VanDerWaalsContact O-CD 3.25Å; F426-P428 WeakPolarHBondContact O-CD 3.36Å
427	N	25	Very low	44.2	Very low	114 Å²	114	108.1 Å²	108.1	61%	0.61	66%	0.655	S	S	*	*			trans	-80	111.8	-179.7	-151.3	2.8	0	0	0	107	A425 E429	A425-N427 PolarHBondContact O-N 2.87Å; N427-E429 PolarHBondContact O-N 2.84Å
428	P	32.2	Very low	42.4	Very low	90 Å²	90	113.2 Å²	113.2	58%	0.584	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-7.6	-169.3	-17.6	31.6	0	0	0	114.7	F426	F426-P428 VanDerWaalsContact O-CD 3.25Å; F426-P428 WeakPolarHBondContact O-CD 3.36Å
429	E	27.6	Very low	41.7	Very low	173 Å²	173	118.3 Å²	118.3	81%	0.808	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-2.8	-172.9	-65.9	-171.6	166.1	0	0	115	N427	N427-E429 PolarHBondContact O-N 2.84Å
430	N	28	Very low	41.8	Very low	137 Å²	137	115.8 Å²	115.8	73%	0.733	68%	0.678	S	S	*	*			trans	-106.2	76.8	171.6	-77.4	-19.5	0	0	0	110.5	D432	N430-D432 VanDerWaalsContact C-N 3.29Å
431	Q	30.6	Very low	42.2	Very low	178 Å²	178	113.4 Å²	113.4	83%	0.832	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	3.5	175.6	-74.2	-170.9	10.7	0	0	114.6
432	D	29.4	Very low	43.5	Very low	170 Å²	170	110.7 Å²	110.7	91%	0.909	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	16.6	-174	-73.6	-30.4	0	0	0	115.8	N430	N430-D432 VanDerWaalsContact C-N 3.29Å
433	A	30.8	Very low	44.8	Very low	82 Å²	82	108.3 Å²	108.3	68%	0.678	63%	0.631	S	S	*	*	S	Bend	trans	-126.4	117.8	169.5	0	0	0	0	0	110.7	C435	A433-C435 PolarHBondContact O-N 2.98Å
434	G	28	Very low	46.4	Very low	80 Å²	80	107.2 Å²	107.2	83%	0.825	62%	0.62	S	S	*	*			trans	-44.7	135.3	-176.1	0	0	0	0	0	114.3	G436	G434-G436 PolarHBondContact O-N 3.24Å
435	C	27.9	Very low	48.4	Very low	138 Å²	138	103 Å²	103	93%	0.932	61%	0.609	S	S	*	*	S	Bend	trans	-58.1	127.5	177.3	62.8	0	0	0	0	111.5	A433	A433-C435 PolarHBondContact O-N 2.98Å
436	G	26.6	Very low	50.9	Low	64 Å²	64	100.1 Å²	100.1	66%	0.66	58%	0.583	S	S	*	*			trans	144.9	42.4	167.9	0	0	0	0	0	116.5	G434 N438	G434-G436 PolarHBondContact O-N 3.24Å; G436-N438 PolarHBondContact O-N 3.01Å
437	T	35.1	Very low	53.4	Low	118 Å²	118	95.4 Å²	95.4	72%	0.724	56%	0.561	S	S	*	*			trans	-82.7	103.1	161.8	54.4	0	0	0	0	108.3	E439	T437-E439 PolarHBondContact O-N 3.18Å
438	N	45.6	Very low	56	Low	164 Å²	164	94.8 Å²	94.8	88%	0.877	56%	0.561	S	S	*	*			trans	-64.5	52.9	171.1	-76.8	-31.2	0	0	0	111.9	G436 V440	G436-N438 PolarHBondContact O-N 3.01Å; N438-V440 PolarHBondContact O-N 3.09Å
439	E	66.5	Low	58.7	Low	144 Å²	144	91.1 Å²	91.1	67%	0.673	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-75.5	124.2	176.5	-72.7	-172.1	174.1	0	0	110	T437	T437-E439 PolarHBondContact O-N 3.18Å
440	V	84.6	Confident	61.5	Low	49 Å²	49	87.1 Å²	87.1	30%	0.297	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-71.7	128.6	177.3	-177.8	0	0	0	0	108.8	T376 V377 S378 N438	T376-V440 HydrophobicContact CG2-CG1 3.9Å; T376-V440 HydrophobicContact CG2-CG2 4.32Å; V377-V440 VanDerWaalsContact C-CG1 3.45Å; S378-V440 WeakPolarHBondContact OG-CB 3.15Å; S378-V440 VanDerWaalsContact OG-CG1 3.23Å; S378-V440 WeakPolarHBondContact OG-CG1 2.71Å; N438-V440 PolarHBondContact O-N 3.09Å
441	P	89.9	Confident	64.4	Low	22 Å²	22	81.1 Å²	81.1	14%	0.143	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-69	140.7	-174.4	29.9	-38.1	0	0	0	112.2	V377 S378 L444	V377-P441 HydrophobicContact CG1-CG 4.31Å; S378-P441 PolarHBondContact N-O 3.32Å; P441-L444 HydrophobicContact CB-CD2 4.13Å; P441-L444 HydrophobicContact CG-CD2 4Å
442	T	89.7	Confident	67.2	Low	19 Å²	19	72.9 Å²	72.9	12%	0.117	45%	0.448	C	S	.	.	S	Bend	trans	-100.9	-6.6	174.5	55.7	0	0	0	0	114	S378 N383 I402	S378-T442 WeakPolarHBondContact O-CA 3.15Å; N383-T442 WeakPolarHBondContact OD1-CG2 3.25Å; I402-T442 WeakPolarHBondContact CB-O 3.36Å; I402-T442 PolarHBondContact N-O 2.71Å
443	S	89.4	Confident	69.9	Low	11 Å²	11	66.3 Å²	66.3	8%	0.077	42%	0.419	C	S	.	.	B	Isolated β-bridge	trans	-142.9	138.9	174.1	-176.5	0	0	0	0	108.9	C399 G400 A401 F420	C399-S443 PolarHBondContact O-OG 2.87Å; G400-S443 WeakPolarHBondContact O-CA 3.35Å; G400-S443 PolarHBondContact O-OG 3.42Å; A401-S443 PolarHBondContact N-OG 2.9Å; F420-S443 WeakPolarHBondContact CE2-OG 3.48Å
444	L	89.3	Confident	72.6	Confident	36 Å²	36	63.6 Å²	63.6	19%	0.188	40%	0.395	C	S	.	.			trans	-125	154	172.5	-70.7	179.4	0	0	0	109	F373 R375 V377 Q395 G400 I402 F420 P441 P446	F373-L444 HydrophobicContact CD1-CD1 4.08Å; F373-L444 HydrophobicContact CE1-CD1 4.44Å; R375-L444 HydrophobicContact CG-CD1 4.44Å; V377-L444 HydrophobicContact CG1-CD1 3.57Å; V377-L444 HydrophobicContact CG1-CG 4.23Å; Q395-L444 PolarHBondContact NE2-O 3.41Å; G400-L444 CarbonylContact C-O 3.54Å; G400-L444 WeakPolarHBondContact CA-O 2.97Å; G400-L444 PolarHBondContact O-N 3.31Å; I402-L444 HydrophobicContact CD1-CB 4.18Å; I402-L444 HydrophobicContact CD1-CD1 4.02Å; I402-L444 HydrophobicContact CD1-CG 3.81Å; F420-L444 WeakPolarHBondContact CE2-O 3.47Å; P441-L444 HydrophobicContact CB-CD2 4.13Å; P441-L444 HydrophobicContact CG-CD2 4Å; L444-P446 WeakPolarHBondContact O-CD 3.32Å; L444-P446 VanDerWaalsContact O-N 3.15Å
445	V	85.3	Confident	75.6	Confident	97 Å²	97	64.4 Å²	64.4	59%	0.588	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-50.6	126.3	171.3	-178.5	0	0	0	0	107.9	Q395 F420 Y447	Q395-V445 PolarHBondContact NE2-O 3.27Å; F420-V445 HydrophobicContact CD1-CG2 4.13Å; F420-V445 HydrophobicContact CE1-CG2 3.73Å; F420-V445 HydrophobicContact CE2-CG2 4.28Å; F420-V445 VanDerWaalsContact CE2-N 3.33Å; F420-V445 HydrophobicContact CZ-CG2 3.81Å; V445-Y447 PolarHBondContact O-N 3.4Å; V445-Y447 VanDerWaalsContact O-N 3.07Å
446	P	81.8	Confident	78.5	Confident	24 Å²	24	58 Å²	58	16%	0.156	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-51	119	174.6	-27.7	34.9	0	0	0	109.9	K397 L444 V448	K397-P446 WeakPolarHBondContact O-CB 3.48Å; K397-P446 WeakPolarHBondContact O-CG 3.36Å; L444-P446 WeakPolarHBondContact O-CD 3.32Å; L444-P446 VanDerWaalsContact O-N 3.15Å; P446-V448 PolarHBondContact O-N 3.18Å
447	Y	78.1	Confident	81.5	Confident	93 Å²	93	59.8 Å²	59.8	37%	0.365	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-72.3	122	178.2	179.7	-102.4	0	0	0	108.5	V445 F452 H517	V445-Y447 PolarHBondContact O-N 3.4Å; V445-Y447 VanDerWaalsContact O-N 3.07Å; Y447-F452 HydrophobicContact CE1-CB 4.15Å; Y447-H517 PolarHBondContact OH-ND1 2.87Å; Y447-H517 PolarHBondContact OH-O 3.07Å; Y447-H517 VanDerWaalsContact OH-O 3.11Å
448	V	80.5	Confident	84.2	Confident	101 Å²	101	60 Å²	60	61%	0.612	32%	0.316	S	S	*	.			trans	-115.7	129.9	176	-172.5	0	0	0	0	107.1	P446 H522	P446-V448 PolarHBondContact O-N 3.18Å; V448-H522 PolarHBondContact O-CE1 2.71Å; V448-H522 PolarHBondContact O-NE2 3.34Å
449	S	87.2	Confident	86.4	Confident	14 Å²	14	52.7 Å²	52.7	10%	0.098	28%	0.276	C	S	.	.			trans	-140.1	147.4	174	173.9	0	0	0	0	108.8	Y451 F452 V454 A521	S449-Y451 VanDerWaalsContact C-N 3.28Å; S449-Y451 PolarHBondContact OG-N 2.9Å; S449-Y451 VanDerWaalsContact OG-N 3.09Å; S449-F452 WeakPolarHBondContact CB-O 3.39Å; S449-F452 WeakPolarHBondContact OG-CD2 3.22Å; S449-F452 PolarHBondContact OG-N 3.47Å; S449-V454 VanDerWaalsContact O-CG2 3.31Å; S449-V454 WeakPolarHBondContact O-CG2 3.31Å; S449-A521 CarbonylContact C-O 3.49Å; S449-A521 WeakPolarHBondContact CA-O 3.31Å; S449-A521 WeakPolarHBondContact CB-O 3.1Å; S449-A521 PolarHBondContact OG-O 3.21Å
450	E	86.5	Confident	87.6	Confident	88 Å²	88	51 Å²	51	41%	0.411	27%	0.267	S	S	.	.	S	Bend	trans	-76.3	-17.6	170.6	-68.9	-170.2	-172.7	0	0	112.7	K460 A521	E450-K460 IonicContact OE2-NZ 3.79Å; E450-K460 PolarHBondContact OE2-NZ 2.94Å; E450-A521 PolarHBondContact N-O 3.46Å
451	Y	89.7	Confident	87.9	Confident	12 Å²	12	52 Å²	52	5%	0.047	27%	0.27	C	S	.	.	S	Bend	trans	-124.2	-51.2	-171.4	-60.4	-73.1	0	0	0	112.6	S449 Q459 K460 F470 L524	S449-Y451 VanDerWaalsContact C-N 3.28Å; S449-Y451 PolarHBondContact OG-N 2.9Å; S449-Y451 VanDerWaalsContact OG-N 3.09Å; Y451-Q459 PolarHBondContact O-NE2 3.37Å; Y451-K460 HydrophobicContact CE1-CD 4.5Å; Y451-F470 HydrophobicContact CD1-CB 3.82Å; Y451-F470 AromaticContact CD1-CD2 3.71Å; Y451-F470 HydrophobicContact CD1-CD2 3.71Å; Y451-F470 HydrophobicContact CD1-CG 4.12Å; Y451-F470 AromaticContact CD2-CD2 3.91Å; Y451-F470 HydrophobicContact CD2-CD2 3.91Å; Y451-F470 HydrophobicContact CD2-CE2 4.23Å; Y451-F470 HydrophobicContact CE1-CB 4.27Å; Y451-F470 HydrophobicContact CE1-CD2 4.23Å; Y451-F470 HydrophobicContact CE2-CD2 4.43Å; Y451-F470 HydrophobicContact CG-CB 4.43Å; Y451-F470 AromaticContact CG-CD2 3.52Å; Y451-F470 HydrophobicContact CG-CD2 3.52Å; Y451-F470 HydrophobicContact CG-CE2 4.13Å; Y451-F470 HydrophobicContact CG-CG 4.24Å; Y451-L524 HydrophobicContact CE1-CD2 3.75Å; Y451-L524 HydrophobicContact CE2-CD2 4.48Å; Y451-L524 WeakPolarHBondContact OH-CG 3.38Å
452	F	89.7	Confident	87.9	Confident	5 Å²	5	52.6 Å²	52.6	2%	0.022	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	133.1	-176.7	-59.1	-76.5	0	0	0	111.6	Y447 S449 V454 F470 H517 F520 L545 A548 F549	Y447-F452 HydrophobicContact CE1-CB 4.15Å; S449-F452 WeakPolarHBondContact CB-O 3.39Å; S449-F452 WeakPolarHBondContact OG-CD2 3.22Å; S449-F452 PolarHBondContact OG-N 3.47Å; F452-V454 PolarHBondContact O-N 2.95Å; F452-F470 HydrophobicContact CE1-CE1 4.4Å; F452-F470 HydrophobicContact CE1-CZ 4.22Å; F452-F470 HydrophobicContact CE2-CZ 4.23Å; F452-F470 HydrophobicContact CZ-CE1 4.23Å; F452-F470 HydrophobicContact CZ-CE2 4.31Å; F452-F470 AromaticContact CZ-CZ 3.62Å; F452-F470 HydrophobicContact CZ-CZ 3.62Å; F452-H517 AromaticContact CD1-CE1 3.24Å; F452-H517 WeakPolarHBondContact CD1-CE1 3.48Å; F452-H517 AromaticContact CD1-ND1 3.6Å; F452-H517 AromaticContact CD2-ND1 3.65Å; F452-H517 AromaticContact CE1-CE1 3.69Å; F452-H517 AromaticContact CG-CE1 3.52Å; F452-H517 AromaticContact CG-ND1 3.4Å; F452-H517 WeakPolarHBondContact CG-ND1 3.44Å; F452-F520 HydrophobicContact CE2-CB 4.27Å; F452-F520 WeakPolarHBondContact CE2-O 3.17Å; F452-L545 HydrophobicContact CE1-CD1 4.42Å; F452-L545 HydrophobicContact CZ-CD1 3.73Å; F452-A548 HydrophobicContact CE1-CB 4.43Å; F452-F549 HydrophobicContact CE1-CB 4.14Å
453	G	85.9	Confident	87.8	Confident	31 Å²	31	56.8 Å²	56.8	32%	0.32	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	7.5	-179.7	0	0	0	0	0	114.9	D552 P554	G453-D552 VanDerWaalsContact CA-O 3.31Å; G453-D552 WeakPolarHBondContact CA-O 3.35Å; G453-P554 WeakPolarHBondContact O-CG 3.43Å
454	V	88.3	Confident	87.7	Confident	26 Å²	26	61.6 Å²	61.6	16%	0.158	33%	0.327	C	S	.	.			trans	-95.3	138.9	175.9	175.4	0	0	0	0	109.1	S449 F452 E458 Q459 P554	S449-V454 VanDerWaalsContact O-CG2 3.31Å; S449-V454 WeakPolarHBondContact O-CG2 3.31Å; F452-V454 PolarHBondContact O-N 2.95Å; V454-E458 HydrophobicContact CG1-CB 3.63Å; V454-Q459 VanDerWaalsContact CB-NE2 3.34Å; V454-Q459 PolarHBondContact O-NE2 2.87Å; V454-P554 WeakPolarHBondContact O-CD 3.14Å
455	K	89.4	Confident	87.7	Confident	97 Å²	97	61.5 Å²	61.5	42%	0.422	33%	0.329	S	S	.	.			trans	-63.5	153.6	-178.1	-59.7	-176.2	-173.1	162.2	0	111.3	E457 E458 Q459 P554	K455-E457 VanDerWaalsContact CB-OE2 3.3Å; K455-E457 WeakPolarHBondContact CB-OE2 3.33Å; K455-E457 PolarHBondContact O-N 3.38Å; K455-E458 HydrophobicContact CB-CB 4.45Å; K455-E458 HydrophobicContact CB-CG 4.29Å; K455-E458 IonicContact NZ-OE1 2.74Å; K455-E458 PolarHBondContact O-N 3.26Å; K455-Q459 WeakPolarHBondContact O-CG 3.01Å; K455-Q459 PolarHBondContact O-N 2.99Å; K455-P554 HydrophobicContact CG-CB 4.4Å; K455-P554 HydrophobicContact CG-CG 4.22Å
456	L	90.5	Very high	88	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.01	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-60.6	-35.2	-175.8	-165.2	65.8	0	0	0	112.4	E458 Q459 P468 L553 L592 H593 C596	L456-E458 VanDerWaalsContact C-N 3.27Å; L456-E458 PolarHBondContact O-N 2.95Å; L456-Q459 WeakPolarHBondContact O-CB 3.48Å; L456-Q459 PolarHBondContact O-N 3Å; L456-P468 HydrophobicContact CD1-CG 3.56Å; L456-L553 HydrophobicContact CD1-CD1 4.38Å; L456-L553 HydrophobicContact CD1-CD2 4.48Å; L456-L592 HydrophobicContact CD2-CB 4.17Å; L456-L592 HydrophobicContact CG-CB 4.45Å; L456-H593 HydrophobicContact CD2-CB 4.47Å; L456-C596 HydrophobicContact CD2-CB 4.29Å
457	E	89.3	Confident	88.5	Confident	103 Å²	103	61.4 Å²	61.4	48%	0.481	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-72.6	-20	178.8	-50.7	79	-173.7	0	0	113.3	K455 L592 H593	K455-E457 VanDerWaalsContact CB-OE2 3.3Å; K455-E457 WeakPolarHBondContact CB-OE2 3.33Å; K455-E457 PolarHBondContact O-N 3.38Å; E457-L592 HydrophobicContact CB-CD1 4.27Å; E457-L592 HydrophobicContact CG-CD1 4.21Å; E457-H593 IonicContact OE1-CD2 3.78Å; E457-H593 IonicContact OE1-NE2 3.62Å; E457-H593 PolarHBondContact OE1-NE2 3.41Å
458	E	91.2	Very high	89.3	Confident	123 Å²	123	57 Å²	57	58%	0.575	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-96.7	-2.2	-179.9	-65.7	169	-166.6	0	0	111.8	V454 K455 L456	V454-E458 HydrophobicContact CG1-CB 3.63Å; K455-E458 HydrophobicContact CB-CB 4.45Å; K455-E458 HydrophobicContact CB-CG 4.29Å; K455-E458 IonicContact NZ-OE1 2.74Å; K455-E458 PolarHBondContact O-N 3.26Å; L456-E458 VanDerWaalsContact C-N 3.27Å; L456-E458 PolarHBondContact O-N 2.95Å
459	Q	92.4	Very high	89.9	Confident	10 Å²	10	54.4 Å²	54.4	5%	0.047	28%	0.284	C	S	.	.	S	Bend	trans	-74.2	149.8	178.7	-63.9	-68.5	-32	0	0	112.1	Y451 V454 K455 L456 L461 P468	Y451-Q459 PolarHBondContact O-NE2 3.37Å; V454-Q459 VanDerWaalsContact CB-NE2 3.34Å; V454-Q459 PolarHBondContact O-NE2 2.87Å; K455-Q459 WeakPolarHBondContact O-CG 3.01Å; K455-Q459 PolarHBondContact O-N 2.99Å; L456-Q459 WeakPolarHBondContact O-CB 3.48Å; L456-Q459 PolarHBondContact O-N 3Å; Q459-L461 PolarHBondContact O-N 3.46Å; Q459-P468 HydrophobicContact CB-CB 3.95Å; Q459-P468 HydrophobicContact CB-CG 3.94Å; Q459-P468 HydrophobicContact CG-CB 4.26Å; Q459-P468 HydrophobicContact CG-CG 4.13Å
460	K	90.2	Very high	90.3	Very high	108 Å²	108	53.7 Å²	53.7	47%	0.47	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-69.2	118.6	168.5	-63.2	174.3	-177.3	163.9	0	109.4	E450 Y451 P468 I469	E450-K460 IonicContact OE2-NZ 3.79Å; E450-K460 PolarHBondContact OE2-NZ 2.94Å; Y451-K460 HydrophobicContact CE1-CD 4.5Å; K460-P468 WeakPolarHBondContact O-CA 3.05Å; K460-I469 HydrophobicContact CB-CD1 4.04Å; K460-I469 WeakPolarHBondContact O-CG1 3.49Å; K460-I469 PolarHBondContact O-N 3.13Å
461	L	92.4	Very high	90.7	Very high	71 Å²	71	49.6 Å²	49.6	37%	0.372	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-94.7	144.6	-176.1	-54.7	-179.5	0	0	0	112.4	Q459 P468 I469 L592	Q459-L461 PolarHBondContact O-N 3.46Å; L461-P468 HydrophobicContact CD2-CG 4.23Å; L461-I469 VanDerWaalsContact C-CG1 3.45Å; L461-I469 WeakPolarHBondContact O-CD1 3.27Å; L461-L592 HydrophobicContact CD1-CD2 3.75Å; L461-L592 HydrophobicContact CD2-CD2 4.25Å
462	D	89.5	Confident	90.9	Very high	33 Å²	33	49.2 Å²	49.2	18%	0.176	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-72.6	137.6	172.9	169.7	64	0	0	0	110	N464 S465 K466 V467 I469 T472	D462-N464 PolarHBondContact O-N 2.82Å; D462-N464 PolarHBondContact OD2-N 2.95Å; D462-N464 VanDerWaalsContact OD2-N 3.16Å; D462-S465 WeakPolarHBondContact CB-OG 3.28Å; D462-S465 WeakPolarHBondContact OD2-CB 3.42Å; D462-S465 PolarHBondContact OD2-N 3.23Å; D462-S465 PolarHBondContact OD2-OG 2.92Å; D462-K466 VanDerWaalsContact O-CA 3.26Å; D462-K466 WeakPolarHBondContact O-CA 3.22Å; D462-K466 PolarHBondContact O-N 3.01Å; D462-V467 WeakPolarHBondContact CB-O 3.26Å; D462-V467 PolarHBondContact N-O 3.35Å; D462-I469 HydrophobicContact CB-CG1 3.98Å; D462-T472 HydrophobicContact CB-CG2 4.34Å
463	S	87.6	Confident	91	Very high	107 Å²	107	49.4 Å²	49.4	75%	0.748	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.5	-173.4	55.6	0	0	0	0	113.2
464	N	87.4	Confident	91.4	Very high	113 Å²	113	48 Å²	48	60%	0.604	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-51.2	-173.5	-63.1	-22.6	0	0	0	111.8	D462	D462-N464 PolarHBondContact O-N 2.82Å; D462-N464 PolarHBondContact OD2-N 2.95Å; D462-N464 VanDerWaalsContact OD2-N 3.16Å
465	S	88.8	Confident	91.7	Very high	33 Å²	33	46.8 Å²	46.8	23%	0.231	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-18.5	-175.5	59.8	0	0	0	0	113.6	D462 V467	D462-S465 WeakPolarHBondContact CB-OG 3.28Å; D462-S465 WeakPolarHBondContact OD2-CB 3.42Å; D462-S465 PolarHBondContact OD2-N 3.23Å; D462-S465 PolarHBondContact OD2-OG 2.92Å; S465-V467 PolarHBondContact O-N 2.88Å; S465-V467 PolarHBondContact OG-N 3.44Å
466	K	90.7	Very high	91.9	Very high	115 Å²	115	46.8 Å²	46.8	50%	0.5	24%	0.24	S	C	.	.			trans	56.6	20.2	-168.4	-55.5	179.4	176.5	-178.6	0	113.8	D462 E591 L595	D462-K466 VanDerWaalsContact O-CA 3.26Å; D462-K466 WeakPolarHBondContact O-CA 3.22Å; D462-K466 PolarHBondContact O-N 3.01Å; K466-E591 IonicContact NZ-OE1 2.86Å; K466-L595 HydrophobicContact CB-CD1 4Å; K466-L595 HydrophobicContact CD-CD1 4.43Å
467	V	93.3	Very high	91.9	Very high	4 Å²	4	48 Å²	48	2%	0.024	25%	0.245	C	C	.	.	S	Bend	trans	-98.8	152	176.7	174.4	0	0	0	0	108.7	D462 S465 I469 L471 T472 L595 H599	D462-V467 WeakPolarHBondContact CB-O 3.26Å; D462-V467 PolarHBondContact N-O 3.35Å; S465-V467 PolarHBondContact O-N 2.88Å; S465-V467 PolarHBondContact OG-N 3.44Å; V467-I469 PolarHBondContact O-N 2.83Å; V467-L471 HydrophobicContact CG1-CB 4.4Å; V467-L471 HydrophobicContact CG1-CD2 3.85Å; V467-L471 HydrophobicContact CG1-CG 4.37Å; V467-T472 HydrophobicContact CB-CG2 3.91Å; V467-T472 HydrophobicContact CG1-CG2 3.89Å; V467-L595 HydrophobicContact CG2-CB 4.25Å; V467-H599 HydrophobicContact CG1-CB 4.2Å; V467-H599 HydrophobicContact CG2-CB 4.04Å
468	P	94.9	Very high	92.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-51.2	128.1	176.6	-29.9	35.7	0	0	0	113.2	L456 Q459 K460 L461 F470 L471 T472 F549 C596	L456-P468 HydrophobicContact CD1-CG 3.56Å; Q459-P468 HydrophobicContact CB-CB 3.95Å; Q459-P468 HydrophobicContact CB-CG 3.94Å; Q459-P468 HydrophobicContact CG-CB 4.26Å; Q459-P468 HydrophobicContact CG-CG 4.13Å; K460-P468 WeakPolarHBondContact O-CA 3.05Å; L461-P468 HydrophobicContact CD2-CG 4.23Å; P468-F470 PolarHBondContact O-N 2.92Å; P468-F470 VanDerWaalsContact O-N 3.14Å; P468-L471 HydrophobicContact CB-CB 4.43Å; P468-L471 WeakPolarHBondContact O-CB 3.42Å; P468-L471 PolarHBondContact O-N 3.36Å; P468-T472 PolarHBondContact O-N 3.22Å; P468-T472 VanDerWaalsContact O-N 3.13Å; P468-F549 HydrophobicContact CB-CZ 4.02Å; P468-F549 HydrophobicContact CG-CZ 4.44Å; P468-C596 WeakPolarHBondContact CD-SG 3.35Å
469	I	93.6	Very high	92.3	Very high	47 Å²	47	39.1 Å²	39.1	24%	0.241	20%	0.204	C	C	.	.	H	α-helix	trans	-57.7	-34.2	-176.6	-64.7	162.6	0	0	0	111.3	K460 L461 D462 V467 L471 T472 T473 L524	K460-I469 HydrophobicContact CB-CD1 4.04Å; K460-I469 WeakPolarHBondContact O-CG1 3.49Å; K460-I469 PolarHBondContact O-N 3.13Å; L461-I469 VanDerWaalsContact C-CG1 3.45Å; L461-I469 WeakPolarHBondContact O-CD1 3.27Å; D462-I469 HydrophobicContact CB-CG1 3.98Å; V467-I469 PolarHBondContact O-N 2.83Å; I469-L471 VanDerWaalsContact C-N 3.32Å; I469-L471 PolarHBondContact O-N 3.34Å; I469-T472 WeakPolarHBondContact CA-OG1 3.39Å; I469-T472 PolarHBondContact O-N 3.34Å; I469-T472 PolarHBondContact O-OG1 3.1Å; I469-T473 VanDerWaalsContact O-CB 3.26Å; I469-T473 WeakPolarHBondContact O-CB 3.37Å; I469-T473 PolarHBondContact O-N 2.66Å; I469-T473 PolarHBondContact O-OG1 3.24Å; I469-L524 HydrophobicContact CB-CD2 4.39Å; I469-L524 HydrophobicContact CG2-CD1 3.51Å; I469-L524 HydrophobicContact CG2-CD2 3.87Å; I469-L524 HydrophobicContact CG2-CG 4.36Å
470	F	94.2	Very high	92.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-42.3	177.7	-165.5	-81.5	0	0	0	112.1	Y451 F452 P468 C474 F520 L524 P525 L545 F549	Y451-F470 HydrophobicContact CD1-CB 3.82Å; Y451-F470 AromaticContact CD1-CD2 3.71Å; Y451-F470 HydrophobicContact CD1-CD2 3.71Å; Y451-F470 HydrophobicContact CD1-CG 4.12Å; Y451-F470 AromaticContact CD2-CD2 3.91Å; Y451-F470 HydrophobicContact CD2-CD2 3.91Å; Y451-F470 HydrophobicContact CD2-CE2 4.23Å; Y451-F470 HydrophobicContact CE1-CB 4.27Å; Y451-F470 HydrophobicContact CE1-CD2 4.23Å; Y451-F470 HydrophobicContact CE2-CD2 4.43Å; Y451-F470 HydrophobicContact CG-CB 4.43Å; Y451-F470 AromaticContact CG-CD2 3.52Å; Y451-F470 HydrophobicContact CG-CD2 3.52Å; Y451-F470 HydrophobicContact CG-CE2 4.13Å; Y451-F470 HydrophobicContact CG-CG 4.24Å; F452-F470 HydrophobicContact CE1-CE1 4.4Å; F452-F470 HydrophobicContact CE1-CZ 4.22Å; F452-F470 HydrophobicContact CE2-CZ 4.23Å; F452-F470 HydrophobicContact CZ-CE1 4.23Å; F452-F470 HydrophobicContact CZ-CE2 4.31Å; F452-F470 AromaticContact CZ-CZ 3.62Å; F452-F470 HydrophobicContact CZ-CZ 3.62Å; P468-F470 PolarHBondContact O-N 2.92Å; P468-F470 VanDerWaalsContact O-N 3.14Å; F470-C474 PolarHBondContact O-N 3.46Å; F470-C474 PolarHBondContact O-SG 3.48Å; F470-F520 HydrophobicContact CE2-CB 4.23Å; F470-F520 HydrophobicContact CZ-CB 4.38Å; F470-L524 HydrophobicContact CB-CD2 4.16Å; F470-L524 HydrophobicContact CD2-CD2 4.08Å; F470-P525 HydrophobicContact CE2-CG 4.4Å; F470-P525 HydrophobicContact CZ-CG 4.37Å; F470-L545 HydrophobicContact CE1-CD2 4.25Å; F470-L545 HydrophobicContact CE1-CG 3.97Å; F470-L545 HydrophobicContact CZ-CD1 4.09Å; F470-L545 HydrophobicContact CZ-CD2 3.82Å; F470-L545 HydrophobicContact CZ-CG 3.78Å; F470-F549 HydrophobicContact CB-CD2 4.4Å; F470-F549 HydrophobicContact CB-CE2 4.19Å; F470-F549 HydrophobicContact CD1-CB 3.86Å; F470-F549 HydrophobicContact CD1-CD1 4.31Å; F470-F549 AromaticContact CD1-CD2 3.6Å; F470-F549 HydrophobicContact CD1-CD2 3.6Å; F470-F549 HydrophobicContact CD1-CE2 4.23Å; F470-F549 AromaticContact CD1-CG 3.64Å; F470-F549 HydrophobicContact CD1-CG 3.64Å; F470-F549 HydrophobicContact CE1-CB 3.74Å; F470-F549 HydrophobicContact CE1-CD2 4.13Å; F470-F549 HydrophobicContact CE1-CG 4.06Å; F470-F549 HydrophobicContact CG-CD2 4.1Å; F470-F549 HydrophobicContact CG-CE2 4.37Å
471	L	94.9	Very high	92.4	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-69.7	-47.4	178.5	180	59.6	0	0	0	111	V467 P468 I469 T473 C474 T475 M546 F549 L550 I600	V467-L471 HydrophobicContact CG1-CB 4.4Å; V467-L471 HydrophobicContact CG1-CD2 3.85Å; V467-L471 HydrophobicContact CG1-CG 4.37Å; P468-L471 HydrophobicContact CB-CB 4.43Å; P468-L471 WeakPolarHBondContact O-CB 3.42Å; P468-L471 PolarHBondContact O-N 3.36Å; I469-L471 VanDerWaalsContact C-N 3.32Å; I469-L471 PolarHBondContact O-N 3.34Å; L471-T473 VanDerWaalsContact C-N 3.35Å; L471-T473 PolarHBondContact O-N 2.9Å; L471-C474 PolarHBondContact O-N 3.32Å; L471-T475 HydrophobicContact CD1-CG2 4.36Å; L471-T475 PolarHBondContact O-N 3.17Å; L471-T475 PolarHBondContact O-OG1 3.24Å; L471-T475 VanDerWaalsContact O-OG1 3.12Å; L471-M546 HydrophobicContact CD1-CG 3.72Å; L471-M546 HydrophobicContact CD1-SD 4.18Å; L471-F549 HydrophobicContact CB-CD1 4.36Å; L471-F549 HydrophobicContact CB-CE1 3.93Å; L471-L550 HydrophobicContact CD1-CD1 4.44Å; L471-L550 HydrophobicContact CD1-CD2 4.12Å; L471-L550 HydrophobicContact CD1-CG 4.39Å; L471-L550 HydrophobicContact CD2-CD2 4.22Å; L471-I600 HydrophobicContact CD2-CD1 4.38Å; L471-I600 HydrophobicContact CD2-CG1 4.12Å
472	T	94.1	Very high	92.3	Very high	4 Å²	4	37.5 Å²	37.5	3%	0.025	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-44.2	179.6	58.8	0	0	0	0	111.2	D462 V467 P468 I469 C474 T475 E476	D462-T472 HydrophobicContact CB-CG2 4.34Å; V467-T472 HydrophobicContact CB-CG2 3.91Å; V467-T472 HydrophobicContact CG1-CG2 3.89Å; P468-T472 PolarHBondContact O-N 3.22Å; P468-T472 VanDerWaalsContact O-N 3.13Å; I469-T472 WeakPolarHBondContact CA-OG1 3.39Å; I469-T472 PolarHBondContact O-N 3.34Å; I469-T472 PolarHBondContact O-OG1 3.1Å; T472-C474 VanDerWaalsContact C-N 3.34Å; T472-C474 PolarHBondContact O-N 3.03Å; T472-T475 WeakPolarHBondContact CA-OG1 3.48Å; T472-T475 PolarHBondContact O-N 3.1Å; T472-T475 PolarHBondContact O-OG1 3.01Å; T472-E476 WeakPolarHBondContact O-CB 3.37Å; T472-E476 WeakPolarHBondContact O-CG 3.09Å; T472-E476 PolarHBondContact O-N 3.38Å
473	T	92.8	Very high	92.4	Very high	9 Å²	9	39 Å²	39	6%	0.055	21%	0.207	C	C	.	.	H	α-helix	trans	-56.7	-47.4	175.6	-55.7	0	0	0	0	110.8	I469 L471 Q477 P525 L526	I469-T473 VanDerWaalsContact O-CB 3.26Å; I469-T473 WeakPolarHBondContact O-CB 3.37Å; I469-T473 PolarHBondContact O-N 2.66Å; I469-T473 PolarHBondContact O-OG1 3.24Å; L471-T473 VanDerWaalsContact C-N 3.35Å; L471-T473 PolarHBondContact O-N 2.9Å; T473-Q477 VanDerWaalsContact O-CG 3.31Å; T473-Q477 WeakPolarHBondContact O-CG 3.29Å; T473-Q477 PolarHBondContact O-N 2.86Å; T473-P525 HydrophobicContact CG2-CG 4.07Å; T473-P525 WeakPolarHBondContact CG2-O 3.4Å; T473-L526 HydrophobicContact CG2-CD2 3.91Å
474	C	93.8	Very high	92.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-47.4	179.2	-70.5	0	0	0	0	112	F470 L471 T472 Q477 I478 M546	F470-C474 PolarHBondContact O-N 3.46Å; F470-C474 PolarHBondContact O-SG 3.48Å; L471-C474 PolarHBondContact O-N 3.32Å; T472-C474 VanDerWaalsContact C-N 3.34Å; T472-C474 PolarHBondContact O-N 3.03Å; C474-Q477 PolarHBondContact O-N 3.43Å; C474-I478 WeakPolarHBondContact O-CB 3.29Å; C474-I478 WeakPolarHBondContact O-CD1 3.27Å; C474-I478 WeakPolarHBondContact O-CG1 3.41Å; C474-I478 PolarHBondContact O-N 2.99Å; C474-M546 HydrophobicContact CB-CB 3.94Å; C474-M546 HydrophobicContact CB-CG 4.12Å
475	T	94.5	Very high	92.6	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.012	16%	0.164	C	C	.	.	H	α-helix	trans	-64	-42.7	-180	48.3	0	0	0	0	111.7	L471 T472 Q477 I478 E479 M546 H599 H603	L471-T475 HydrophobicContact CD1-CG2 4.36Å; L471-T475 PolarHBondContact O-N 3.17Å; L471-T475 PolarHBondContact O-OG1 3.24Å; L471-T475 VanDerWaalsContact O-OG1 3.12Å; T472-T475 WeakPolarHBondContact CA-OG1 3.48Å; T472-T475 PolarHBondContact O-N 3.1Å; T472-T475 PolarHBondContact O-OG1 3.01Å; T475-Q477 PolarHBondContact O-N 3.31Å; T475-I478 PolarHBondContact O-N 3.42Å; T475-E479 WeakPolarHBondContact O-CB 3.48Å; T475-E479 WeakPolarHBondContact O-CG 3.45Å; T475-E479 PolarHBondContact O-N 3.33Å; T475-M546 HydrophobicContact CG2-SD 3.7Å; T475-H599 PolarHBondContact OG1-NE2 2.95Å; T475-H603 HydrophobicContact CG2-CB 4.05Å
476	E	93.5	Very high	92.6	Very high	97 Å²	97	32.1 Å²	32.1	45%	0.453	16%	0.156	S	C	.	.	H	α-helix	trans	-62.7	-43.6	178.8	-73.8	170	-174.6	0	0	111.9	T472 E479 K480	T472-E476 WeakPolarHBondContact O-CB 3.37Å; T472-E476 WeakPolarHBondContact O-CG 3.09Å; T472-E476 PolarHBondContact O-N 3.38Å; E476-E479 PolarHBondContact O-N 3.11Å; E476-K480 WeakPolarHBondContact O-CB 3.4Å; E476-K480 PolarHBondContact O-N 3.18Å
477	Q	91.6	Very high	92.3	Very high	27 Å²	27	31.1 Å²	31.1	13%	0.126	16%	0.155	C	C	.	.	H	α-helix	trans	-67	-39.6	176.8	-65.5	-48	-46.6	0	0	112.2	T473 C474 T475 L481 F542	T473-Q477 VanDerWaalsContact O-CG 3.31Å; T473-Q477 WeakPolarHBondContact O-CG 3.29Å; T473-Q477 PolarHBondContact O-N 2.86Å; C474-Q477 PolarHBondContact O-N 3.43Å; T475-Q477 PolarHBondContact O-N 3.31Å; Q477-L481 WeakPolarHBondContact O-CB 3.14Å; Q477-L481 VanDerWaalsContact O-CG 3.28Å; Q477-L481 WeakPolarHBondContact O-CG 3.23Å; Q477-L481 PolarHBondContact O-N 2.92Å; Q477-F542 HydrophobicContact CB-CD1 4.02Å; Q477-F542 HydrophobicContact CB-CD2 4.27Å; Q477-F542 HydrophobicContact CB-CE1 3.72Å; Q477-F542 HydrophobicContact CB-CE2 4.01Å; Q477-F542 HydrophobicContact CB-CG 4.29Å; Q477-F542 HydrophobicContact CB-CZ 3.74Å; Q477-F542 HydrophobicContact CG-CE1 3.82Å; Q477-F542 HydrophobicContact CG-CZ 3.83Å
478	I	94.1	Very high	91.8	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-48.3	175.8	-69.1	165.8	0	0	0	110.4	C474 T475 L481 A482 M500 I539 F542 A543 M546	C474-I478 WeakPolarHBondContact O-CB 3.29Å; C474-I478 WeakPolarHBondContact O-CD1 3.27Å; C474-I478 WeakPolarHBondContact O-CG1 3.41Å; C474-I478 PolarHBondContact O-N 2.99Å; T475-I478 PolarHBondContact O-N 3.42Å; I478-L481 PolarHBondContact O-N 3.27Å; I478-A482 WeakPolarHBondContact O-CB 3.49Å; I478-A482 PolarHBondContact O-N 2.85Å; I478-M500 HydrophobicContact CG2-CE 3.39Å; I478-M500 HydrophobicContact CG2-SD 4.41Å; I478-I539 HydrophobicContact CG2-CD1 4.31Å; I478-I539 HydrophobicContact CG2-CG1 4.16Å; I478-F542 HydrophobicContact CD1-CB 4.06Å; I478-F542 HydrophobicContact CG1-CB 3.56Å; I478-F542 HydrophobicContact CG1-CG 4.5Å; I478-A543 HydrophobicContact CD1-CB 4.26Å; I478-M546 HydrophobicContact CD1-SD 4.21Å
479	E	94.3	Very high	91.2	Very high	39 Å²	39	34 Å²	34	18%	0.182	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-41	-179.4	-71	175.1	-161.2	0	0	112.1	T475 E476 A482 T483 H603 F606	T475-E479 WeakPolarHBondContact O-CB 3.48Å; T475-E479 WeakPolarHBondContact O-CG 3.45Å; T475-E479 PolarHBondContact O-N 3.33Å; E476-E479 PolarHBondContact O-N 3.11Å; E479-A482 PolarHBondContact O-N 3.06Å; E479-T483 WeakPolarHBondContact O-CB 3.43Å; E479-T483 PolarHBondContact O-N 3.03Å; E479-T483 PolarHBondContact O-OG1 3.12Å; E479-H603 IonicContact OE1-CE1 3.65Å; E479-H603 IonicContact OE1-CG 3.21Å; E479-H603 IonicContact OE1-ND1 2.86Å; E479-H603 PolarHBondContact OE1-ND1 2.92Å; E479-F606 HydrophobicContact CB-CD1 4.46Å; E479-F606 HydrophobicContact CB-CE1 4.08Å; E479-F606 HydrophobicContact CB-CE2 4.14Å; E479-F606 HydrophobicContact CB-CZ 3.9Å; E479-F606 HydrophobicContact CG-CD1 3.64Å; E479-F606 HydrophobicContact CG-CD2 4.09Å; E479-F606 HydrophobicContact CG-CE1 3.72Å; E479-F606 HydrophobicContact CG-CE2 4.15Å; E479-F606 HydrophobicContact CG-CG 3.83Å; E479-F606 HydrophobicContact CG-CZ 3.98Å
480	K	92.2	Very high	90.4	Very high	103 Å²	103	35.6 Å²	35.6	45%	0.448	19%	0.188	S	C	.	.	H	α-helix	trans	-59.7	-55.9	174.2	-179	-178.1	173.1	-171.7	0	111.3	E476 A482 T483 E484	E476-K480 WeakPolarHBondContact O-CB 3.4Å; E476-K480 PolarHBondContact O-N 3.18Å; K480-A482 VanDerWaalsContact C-N 3.3Å; K480-A482 PolarHBondContact O-N 2.92Å; K480-T483 PolarHBondContact O-N 2.83Å; K480-T483 VanDerWaalsContact O-N 3.16Å; K480-E484 WeakPolarHBondContact CE-OE1 3.49Å; K480-E484 WeakPolarHBondContact CG-OE1 3.46Å; K480-E484 WeakPolarHBondContact O-CB 3.15Å; K480-E484 WeakPolarHBondContact O-CG 3.46Å; K480-E484 PolarHBondContact O-N 2.69Å
481	L	91.1	Very high	89.7	Confident	53 Å²	53	41.8 Å²	41.8	28%	0.277	22%	0.222	S	C	.	.	H	α-helix	trans	-62.1	-37.2	180	-69.7	173.9	0	0	0	112.2	Q477 I478 S485 I539 F542	Q477-L481 WeakPolarHBondContact O-CB 3.14Å; Q477-L481 VanDerWaalsContact O-CG 3.28Å; Q477-L481 WeakPolarHBondContact O-CG 3.23Å; Q477-L481 PolarHBondContact O-N 2.92Å; I478-L481 PolarHBondContact O-N 3.27Å; L481-S485 PolarHBondContact O-N 2.91Å; L481-I539 HydrophobicContact CB-CB 4.32Å; L481-I539 HydrophobicContact CB-CD1 4.15Å; L481-I539 HydrophobicContact CB-CG1 4.37Å; L481-I539 HydrophobicContact CD1-CB 4.13Å; L481-F542 HydrophobicContact CD1-CD2 3.89Å; L481-F542 HydrophobicContact CD1-CE2 3.97Å
482	A	92	Very high	88.7	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.6	-40.2	176.3	0	0	0	0	0	111.8	I478 E479 K480 S485 M500 I539 F606 H610	I478-A482 WeakPolarHBondContact O-CB 3.49Å; I478-A482 PolarHBondContact O-N 2.85Å; E479-A482 PolarHBondContact O-N 3.06Å; K480-A482 VanDerWaalsContact C-N 3.3Å; K480-A482 PolarHBondContact O-N 2.92Å; A482-S485 WeakPolarHBondContact O-CB 3.22Å; A482-S485 PolarHBondContact O-N 2.86Å; A482-S485 PolarHBondContact O-OG 2.84Å; A482-M500 HydrophobicContact CB-CG 4.47Å; A482-M500 HydrophobicContact CB-SD 3.93Å; A482-I539 HydrophobicContact CB-CD1 3.93Å; A482-F606 HydrophobicContact CB-CE1 3.94Å; A482-F606 HydrophobicContact CB-CZ 4.05Å; A482-H610 PolarHBondContact O-NE2 2.91Å
483	T	91.6	Very high	87.5	Confident	65 Å²	65	49.9 Å²	49.9	40%	0.399	27%	0.271	S	S	.	.	H	α-helix	trans	-69.8	-45.4	177.6	-57.8	0	0	0	0	111.3	E479 K480 S485 F486	E479-T483 WeakPolarHBondContact O-CB 3.43Å; E479-T483 PolarHBondContact O-N 3.03Å; E479-T483 PolarHBondContact O-OG1 3.12Å; K480-T483 PolarHBondContact O-N 2.83Å; K480-T483 VanDerWaalsContact O-N 3.16Å; T483-S485 PolarHBondContact O-N 3.4Å; T483-F486 PolarHBondContact O-N 3.22Å; T483-F486 VanDerWaalsContact O-N 3.15Å
484	E	89.6	Confident	86.3	Confident	77 Å²	77	55 Å²	55	36%	0.36	31%	0.305	S	S	.	.	H	α-helix	trans	-60.5	-27.9	175.6	-73.3	173.8	-179.3	0	0	112.5	K480 F486 I487 T488	K480-E484 WeakPolarHBondContact CE-OE1 3.49Å; K480-E484 WeakPolarHBondContact CG-OE1 3.46Å; K480-E484 WeakPolarHBondContact O-CB 3.15Å; K480-E484 WeakPolarHBondContact O-CG 3.46Å; K480-E484 PolarHBondContact O-N 2.69Å; E484-F486 VanDerWaalsContact C-N 3.29Å; E484-F486 PolarHBondContact O-N 3.08Å; E484-I487 PolarHBondContact O-N 3.35Å; E484-T488 WeakPolarHBondContact O-CB 3.18Å; E484-T488 PolarHBondContact O-N 3.1Å; E484-T488 PolarHBondContact O-OG1 3.3Å
485	S	89.5	Confident	85.5	Confident	13 Å²	13	57.5 Å²	57.5	9%	0.091	32%	0.318	C	S	.	.	H	α-helix	trans	-62.2	-33.8	176.4	80.8	0	0	0	0	113.3	L481 A482 T483 A489 V498	L481-S485 PolarHBondContact O-N 2.91Å; A482-S485 WeakPolarHBondContact O-CB 3.22Å; A482-S485 PolarHBondContact O-N 2.86Å; A482-S485 PolarHBondContact O-OG 2.84Å; T483-S485 PolarHBondContact O-N 3.4Å; S485-A489 WeakPolarHBondContact O-CB 3.36Å; S485-A489 PolarHBondContact O-N 3.07Å; S485-V498 PolarHBondContact OG-N 3.41Å; S485-V498 VanDerWaalsContact OG-N 3.15Å
486	F	87.7	Confident	84.6	Confident	17 Å²	17	64 Å²	64	8%	0.075	35%	0.349	C	S	.	.	H	α-helix	trans	-72.1	-40	174	-81.9	-76.3	0	0	0	111.9	T483 E484 T488 A489 S490 P497 H610 K613 L614 Y617	T483-F486 PolarHBondContact O-N 3.22Å; T483-F486 VanDerWaalsContact O-N 3.15Å; E484-F486 VanDerWaalsContact C-N 3.29Å; E484-F486 PolarHBondContact O-N 3.08Å; F486-T488 VanDerWaalsContact C-N 3.27Å; F486-T488 PolarHBondContact O-N 2.93Å; F486-A489 PolarHBondContact O-N 3.35Å; F486-S490 PolarHBondContact O-N 3.21Å; F486-S490 PolarHBondContact O-OG 3.39Å; F486-P497 HydrophobicContact CD1-CB 3.71Å; F486-P497 HydrophobicContact CD1-CG 3.49Å; F486-P497 VanDerWaalsContact CD1-CG 3.49Å; F486-P497 HydrophobicContact CD2-CB 4.26Å; F486-P497 HydrophobicContact CE1-CB 3.69Å; F486-P497 HydrophobicContact CE1-CG 3.53Å; F486-P497 HydrophobicContact CE2-CB 4.26Å; F486-P497 HydrophobicContact CG-CB 4Å; F486-P497 HydrophobicContact CG-CG 4.21Å; F486-P497 HydrophobicContact CZ-CB 3.97Å; F486-P497 HydrophobicContact CZ-CG 4.29Å; F486-H610 AromaticContact CD2-NE2 3.69Å; F486-H610 AromaticContact CE2-CD2 3.63Å; F486-H610 AromaticContact CE2-CE1 3.47Å; F486-H610 VanDerWaalsContact CE2-CE1 3.47Å; F486-H610 WeakPolarHBondContact CE2-CE1 3.14Å; F486-H610 AromaticContact CE2-NE2 3.23Å; F486-H610 WeakPolarHBondContact CE2-NE2 3.48Å; F486-K613 HydrophobicContact CD2-CD 4.17Å; F486-K613 HydrophobicContact CE1-CD 4.27Å; F486-K613 HydrophobicContact CE1-CG 3.92Å; F486-K613 HydrophobicContact CE2-CB 4.36Å; F486-K613 HydrophobicContact CE2-CD 3.87Å; F486-K613 HydrophobicContact CE2-CG 4.11Å; F486-K613 HydrophobicContact CG-CD 4.47Å; F486-K613 HydrophobicContact CZ-CB 3.95Å; F486-K613 HydrophobicContact CZ-CD 3.95Å; F486-K613 HydrophobicContact CZ-CG 3.68Å; F486-L614 HydrophobicContact CZ-CB 4.05Å; F486-Y617 HydrophobicContact CE1-CG 4.32Å
487	I	85.6	Confident	84.2	Confident	94 Å²	94	59.7 Å²	59.7	48%	0.482	33%	0.329	S	S	.	.	H	α-helix	trans	-63.1	-39.5	176.2	-58	173.6	0	0	0	110	E484 S490 N491	E484-I487 PolarHBondContact O-N 3.35Å; I487-S490 WeakPolarHBondContact CA-OG 3.09Å; I487-S490 PolarHBondContact O-OG 3.28Å; I487-N491 WeakPolarHBondContact O-CB 3.45Å; I487-N491 PolarHBondContact O-N 2.93Å; I487-N491 VanDerWaalsContact O-N 3.09Å; I487-N491 PolarHBondContact O-ND2 3.14Å
488	T	82.4	Confident	84	Confident	64 Å²	64	60.3 Å²	60.3	39%	0.393	33%	0.334	S	S	.	.	H	α-helix	trans	-67.7	-42.3	176.8	-53.5	0	0	0	0	111.2	E484 F486 N491 N492 I495	E484-T488 WeakPolarHBondContact O-CB 3.18Å; E484-T488 PolarHBondContact O-N 3.1Å; E484-T488 PolarHBondContact O-OG1 3.3Å; F486-T488 VanDerWaalsContact C-N 3.27Å; F486-T488 PolarHBondContact O-N 2.93Å; T488-N491 PolarHBondContact O-N 2.85Å; T488-N492 PolarHBondContact O-N 2.89Å; T488-I495 HydrophobicContact CG2-CD1 4.07Å
489	A	81.7	Confident	83.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-66.8	-35.9	176.7	0	0	0	0	0	112.9	S485 F486 N491 N492 I495 P497	S485-A489 WeakPolarHBondContact O-CB 3.36Å; S485-A489 PolarHBondContact O-N 3.07Å; F486-A489 PolarHBondContact O-N 3.35Å; A489-N491 VanDerWaalsContact C-N 3.34Å; A489-N492 CarbonylContact O-C 3.51Å; A489-N492 PolarHBondContact O-N 3.07Å; A489-I495 VanDerWaalsContact CB-O 3.26Å; A489-I495 WeakPolarHBondContact CB-O 3.38Å; A489-P497 HydrophobicContact CB-CB 4.5Å; A489-P497 HydrophobicContact CB-CG 3.68Å
490	S	77.1	Confident	83.3	Confident	81 Å²	81	60.8 Å²	60.8	57%	0.566	34%	0.338	S	S	*	.	H	α-helix	trans	-67.5	-35.6	174	59.9	0	0	0	0	112.2	F486 I487	F486-S490 PolarHBondContact O-N 3.21Å; F486-S490 PolarHBondContact O-OG 3.39Å; I487-S490 WeakPolarHBondContact CA-OG 3.09Å; I487-S490 PolarHBondContact O-OG 3.28Å
491	N	78.6	Confident	82.8	Confident	131 Å²	131	56.5 Å²	56.5	70%	0.701	32%	0.322	S	S	*	.	H	α-helix	trans	-77.4	-25.4	176.2	-68.1	-17.6	0	0	0	112.7	I487 T488 A489	I487-N491 WeakPolarHBondContact O-CB 3.45Å; I487-N491 PolarHBondContact O-N 2.93Å; I487-N491 VanDerWaalsContact O-N 3.09Å; I487-N491 PolarHBondContact O-ND2 3.14Å; T488-N491 PolarHBondContact O-N 2.85Å; A489-N491 VanDerWaalsContact C-N 3.34Å
492	N	74.6	Confident	82.5	Confident	68 Å²	68	59 Å²	59	36%	0.364	33%	0.334	S	S	.	.			trans	-141.7	96.9	179.6	-172.9	-11	0	0	0	111.6	T488 A489 C494 I495	T488-N492 PolarHBondContact O-N 2.89Å; A489-N492 CarbonylContact O-C 3.51Å; A489-N492 PolarHBondContact O-N 3.07Å; N492-C494 PolarHBondContact O-N 3.19Å; N492-C494 WeakPolarHBondContact OD1-CB 3.42Å; N492-C494 PolarHBondContact OD1-N 3.03Å; N492-I495 HydrophobicContact CB-CD1 4.2Å; N492-I495 HydrophobicContact CB-CG1 4.44Å; N492-I495 PolarHBondContact O-N 2.85Å
493	P	69.9	Low	82.3	Confident	108 Å²	108	59.3 Å²	59.3	70%	0.701	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-6.1	-176	24.9	-32.8	0	0	0	114.5	I495	P493-I495 VanDerWaalsContact C-N 3.27Å
494	C	68	Low	82.2	Confident	116 Å²	116	56.3 Å²	56.3	78%	0.784	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-15.4	169.6	-63.3	0	0	0	0	113.2	N492	N492-C494 PolarHBondContact O-N 3.19Å; N492-C494 WeakPolarHBondContact OD1-CB 3.42Å; N492-C494 PolarHBondContact OD1-N 3.03Å
495	I	75.4	Confident	82	Confident	52 Å²	52	57.6 Å²	57.6	27%	0.267	32%	0.323	S	S	.	.	S	Bend	trans	-103.4	127.6	-179.9	-58.7	175.8	0	0	0	108.4	T488 A489 N492 P493	T488-I495 HydrophobicContact CG2-CD1 4.07Å; A489-I495 VanDerWaalsContact CB-O 3.26Å; A489-I495 WeakPolarHBondContact CB-O 3.38Å; N492-I495 HydrophobicContact CB-CD1 4.2Å; N492-I495 HydrophobicContact CB-CG1 4.44Å; N492-I495 PolarHBondContact O-N 2.85Å; P493-I495 VanDerWaalsContact C-N 3.27Å
496	Q	76.1	Confident	81.7	Confident	140 Å²	140	61.1 Å²	61.1	65%	0.654	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-86.4	143	172.9	-70.3	-177.8	-12.6	0	0	110.1
497	P	84.3	Confident	81.4	Confident	6 Å²	6	64.9 Å²	64.9	4%	0.039	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-58.7	155.2	170.2	-12.4	23.7	0	0	0	110.7	F486 A489 D499 L614 Y617	F486-P497 HydrophobicContact CD1-CB 3.71Å; F486-P497 HydrophobicContact CD1-CG 3.49Å; F486-P497 VanDerWaalsContact CD1-CG 3.49Å; F486-P497 HydrophobicContact CD2-CB 4.26Å; F486-P497 HydrophobicContact CE1-CB 3.69Å; F486-P497 HydrophobicContact CE1-CG 3.53Å; F486-P497 HydrophobicContact CE2-CB 4.26Å; F486-P497 HydrophobicContact CG-CB 4Å; F486-P497 HydrophobicContact CG-CG 4.21Å; F486-P497 HydrophobicContact CZ-CB 3.97Å; F486-P497 HydrophobicContact CZ-CG 4.29Å; A489-P497 HydrophobicContact CB-CB 4.5Å; A489-P497 HydrophobicContact CB-CG 3.68Å; P497-D499 PolarHBondContact O-N 2.91Å; P497-L614 HydrophobicContact CB-CD1 4.02Å; P497-L614 HydrophobicContact CG-CD1 4.02Å; P497-Y617 HydrophobicContact CG-CD1 3.99Å; P497-Y617 HydrophobicContact CG-CE1 4.01Å; P497-Y617 HydrophobicContact CG-CG 4.46Å
498	V	87.8	Confident	81.4	Confident	40 Å²	40	61.1 Å²	61.1	24%	0.242	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-66.6	132.1	-172.5	172.5	0	0	0	0	111.5	S485 M500 V503 I539 H610	S485-V498 PolarHBondContact OG-N 3.41Å; S485-V498 VanDerWaalsContact OG-N 3.15Å; V498-M500 HydrophobicContact CG1-SD 4.37Å; V498-M500 PolarHBondContact O-N 3.01Å; V498-V503 HydrophobicContact CG1-CG2 3.46Å; V498-V503 VanDerWaalsContact CG1-CG2 3.46Å; V498-I539 HydrophobicContact CG1-CD1 4.14Å; V498-I539 HydrophobicContact CG1-CG2 4.2Å; V498-H610 PolarHBondContact O-CE1 3.23Å
499	D	86.9	Confident	81.6	Confident	49 Å²	49	60.5 Å²	60.5	26%	0.262	34%	0.343	S	S	.	.			trans	-80.9	99	168	-175.3	-19.9	0	0	0	110.3	P497 A501 M502 V503 Q611 L614	P497-D499 PolarHBondContact O-N 2.91Å; D499-A501 VanDerWaalsContact C-N 3.26Å; D499-A501 PolarHBondContact O-N 3.08Å; D499-A501 WeakPolarHBondContact OD1-CA 3.48Å; D499-A501 VanDerWaalsContact OD1-CB 3.25Å; D499-A501 WeakPolarHBondContact OD1-CB 3.3Å; D499-A501 PolarHBondContact OD1-N 2.92Å; D499-M502 HydrophobicContact CB-CB 4.07Å; D499-M502 HydrophobicContact CB-CG 4.08Å; D499-M502 HydrophobicContact CB-SD 4.31Å; D499-M502 WeakPolarHBondContact O-CB 3.47Å; D499-M502 PolarHBondContact O-N 3.04Å; D499-M502 VanDerWaalsContact O-N 3.13Å; D499-M502 PolarHBondContact OD1-N 3.47Å; D499-M502 VanDerWaalsContact OD1-N 3.1Å; D499-M502 WeakPolarHBondContact OD2-CG 3.11Å; D499-V503 WeakPolarHBondContact O-CG2 3.3Å; D499-V503 PolarHBondContact O-N 2.94Å; D499-Q611 PolarHBondContact OD1-NE2 3.4Å; D499-Q611 PolarHBondContact OD1-OE1 3.29Å; D499-L614 HydrophobicContact CB-CD2 4.17Å
500	M	87.7	Confident	81.8	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-60.4	-29.8	176.3	-70.4	-62.1	-72.9	0	0	113.9	I478 A482 V498 V503 Y504 I539 V607 H610 Q611	I478-M500 HydrophobicContact CG2-CE 3.39Å; I478-M500 HydrophobicContact CG2-SD 4.41Å; A482-M500 HydrophobicContact CB-CG 4.47Å; A482-M500 HydrophobicContact CB-SD 3.93Å; V498-M500 HydrophobicContact CG1-SD 4.37Å; V498-M500 PolarHBondContact O-N 3.01Å; M500-V503 PolarHBondContact O-N 3.42Å; M500-V503 HydrophobicContact SD-CG2 4.5Å; M500-Y504 HydrophobicContact CE-CD2 4.24Å; M500-Y504 HydrophobicContact CE-CE2 3.66Å; M500-Y504 WeakPolarHBondContact O-CD2 3.47Å; M500-Y504 PolarHBondContact O-N 2.94Å; M500-I539 HydrophobicContact SD-CD1 3.59Å; M500-I539 VanDerWaalsContact SD-CD1 3.59Å; M500-I539 HydrophobicContact SD-CG1 4.48Å; M500-V607 HydrophobicContact CB-CG1 3.9Å; M500-V607 HydrophobicContact CE-CG2 3.79Å; M500-H610 HydrophobicContact CG-CB 4.49Å; M500-Q611 HydrophobicContact CB-CG 4.45Å
501	A	81.5	Confident	82.1	Confident	13 Å²	13	64.1 Å²	64.1	11%	0.107	35%	0.347	C	S	.	.	H	α-helix	trans	-66.2	-41.7	174.8	0	0	0	0	0	110.4	D499 Q505 W646	D499-A501 VanDerWaalsContact C-N 3.26Å; D499-A501 PolarHBondContact O-N 3.08Å; D499-A501 WeakPolarHBondContact OD1-CA 3.48Å; D499-A501 VanDerWaalsContact OD1-CB 3.25Å; D499-A501 WeakPolarHBondContact OD1-CB 3.3Å; D499-A501 PolarHBondContact OD1-N 2.92Å; A501-Q505 WeakPolarHBondContact O-CB 3.22Å; A501-Q505 WeakPolarHBondContact O-CG 3.4Å; A501-Q505 PolarHBondContact O-N 3.05Å; A501-Q505 VanDerWaalsContact O-N 3.07Å; A501-W646 HydrophobicContact CB-CE3 4.25Å; A501-W646 HydrophobicContact CB-CZ3 4.03Å
502	M	84	Confident	82.5	Confident	106 Å²	106	58.5 Å²	58.5	52%	0.522	32%	0.317	S	S	.	.	H	α-helix	trans	-64.9	-42.3	172.8	-73.3	-171.1	69.1	0	0	112.4	D499 Y504 Q505 Q506	D499-M502 HydrophobicContact CB-CB 4.07Å; D499-M502 HydrophobicContact CB-CG 4.08Å; D499-M502 HydrophobicContact CB-SD 4.31Å; D499-M502 WeakPolarHBondContact O-CB 3.47Å; D499-M502 PolarHBondContact O-N 3.04Å; D499-M502 VanDerWaalsContact O-N 3.13Å; D499-M502 PolarHBondContact OD1-N 3.47Å; D499-M502 VanDerWaalsContact OD1-N 3.1Å; D499-M502 WeakPolarHBondContact OD2-CG 3.11Å; M502-Y504 PolarHBondContact O-N 3.23Å; M502-Q505 PolarHBondContact O-N 3.1Å; M502-Q506 WeakPolarHBondContact O-CG 3.27Å; M502-Q506 PolarHBondContact O-N 3.14Å; M502-Q506 VanDerWaalsContact O-N 3.15Å
503	V	88.5	Confident	83	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.03	31%	0.305	C	S	.	.	H	α-helix	trans	-55.4	-50.4	177.3	168.9	0	0	0	0	111	V498 D499 M500 Q506 I539 V540 A543	V498-V503 HydrophobicContact CG1-CG2 3.46Å; V498-V503 VanDerWaalsContact CG1-CG2 3.46Å; D499-V503 WeakPolarHBondContact O-CG2 3.3Å; D499-V503 PolarHBondContact O-N 2.94Å; M500-V503 PolarHBondContact O-N 3.42Å; M500-V503 HydrophobicContact SD-CG2 4.5Å; V503-Q506 PolarHBondContact O-N 2.69Å; V503-I539 HydrophobicContact CG1-CG1 4.37Å; V503-I539 HydrophobicContact CG2-CG2 4Å; V503-V540 HydrophobicContact CG1-CG2 4.41Å; V503-V540 HydrophobicContact CG2-CG2 4.16Å; V503-A543 HydrophobicContact CG1-CB 3.64Å
504	Y	89.3	Confident	83.8	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-70.1	-35.4	-179	-86.7	-70	0	0	0	113.2	M500 M502 Q506 A543 M546 K547 H603 V607 I649 F650	M500-Y504 HydrophobicContact CE-CD2 4.24Å; M500-Y504 HydrophobicContact CE-CE2 3.66Å; M500-Y504 WeakPolarHBondContact O-CD2 3.47Å; M500-Y504 PolarHBondContact O-N 2.94Å; M502-Y504 PolarHBondContact O-N 3.23Å; Y504-Q506 VanDerWaalsContact C-N 3.27Å; Y504-Q506 PolarHBondContact O-N 2.72Å; Y504-A543 HydrophobicContact CD1-CB 4.35Å; Y504-A543 HydrophobicContact CE1-CB 4.02Å; Y504-M546 HydrophobicContact CE1-CE 3.58Å; Y504-M546 WeakPolarHBondContact OH-CE 3.06Å; Y504-K547 HydrophobicContact CD1-CD 4.26Å; Y504-K547 PolarHBondContact O-NZ 3.32Å; Y504-H603 AromaticContact CE2-NE2 3.84Å; Y504-H603 AromaticContact CZ-NE2 3.6Å; Y504-H603 PolarHBondContact OH-CD2 2.86Å; Y504-H603 VanDerWaalsContact OH-CD2 3.3Å; Y504-H603 PolarHBondContact OH-NE2 2.92Å; Y504-V607 HydrophobicContact CD2-CG2 4.37Å; Y504-V607 HydrophobicContact CE2-CG2 3.74Å; Y504-I649 WeakPolarHBondContact O-CD1 3.28Å; Y504-F650 AromaticContact CD1-CE2 3.87Å; Y504-F650 HydrophobicContact CD1-CE2 3.87Å; Y504-F650 HydrophobicContact CD1-CZ 4.35Å; Y504-F650 AromaticContact CE1-CE2 3.87Å; Y504-F650 HydrophobicContact CE1-CE2 3.87Å; Y504-F650 AromaticContact CE1-CZ 3.9Å; Y504-F650 HydrophobicContact CE1-CZ 3.9Å
505	Q	85.4	Confident	84.7	Confident	105 Å²	105	50.5 Å²	50.5	49%	0.491	26%	0.257	S	S	.	.	H	α-helix	trans	-67.2	-23.3	177.9	-75.2	172.7	22.1	0	0	113.8	A501 M502 S507 I649	A501-Q505 WeakPolarHBondContact O-CB 3.22Å; A501-Q505 WeakPolarHBondContact O-CG 3.4Å; A501-Q505 PolarHBondContact O-N 3.05Å; A501-Q505 VanDerWaalsContact O-N 3.07Å; M502-Q505 PolarHBondContact O-N 3.1Å; Q505-S507 PolarHBondContact O-N 3.18Å; Q505-I649 HydrophobicContact CB-CD1 4.33Å; Q505-I649 HydrophobicContact CG-CD1 3.79Å
506	Q	83.2	Confident	85.3	Confident	86 Å²	86	48.4 Å²	48.4	40%	0.402	25%	0.246	S	C	.	.			trans	-70.3	113.6	176.2	-72.9	177.5	23.1	0	0	111.1	M502 V503 Y504 V540 K547	M502-Q506 WeakPolarHBondContact O-CG 3.27Å; M502-Q506 PolarHBondContact O-N 3.14Å; M502-Q506 VanDerWaalsContact O-N 3.15Å; V503-Q506 PolarHBondContact O-N 2.69Å; Y504-Q506 VanDerWaalsContact C-N 3.27Å; Y504-Q506 PolarHBondContact O-N 2.72Å; Q506-V540 HydrophobicContact CB-CG1 4.25Å; Q506-V540 VanDerWaalsContact OE1-CG1 3.22Å; Q506-K547 PolarHBondContact O-NZ 3.33Å
507	S	81.9	Confident	85.8	Confident	97 Å²	97	41.7 Å²	41.7	68%	0.678	22%	0.215	S	C	*	.	P	Polyproline II helix	trans	-82.8	136.5	170.4	-63.3	0	0	0	0	109.7	Q505	Q505-S507 PolarHBondContact O-N 3.18Å
508	A	84.3	Confident	85.8	Confident	14 Å²	14	46 Å²	46	12%	0.116	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-65.7	144.5	171.6	0	0	0	0	0	110.4	L513 Q544	A508-L513 HydrophobicContact CB-CD1 4.26Å; A508-L513 HydrophobicContact CB-CD2 3.53Å; A508-L513 HydrophobicContact CB-CG 3.53Å; A508-Q544 HydrophobicContact CB-CB 4.08Å; A508-Q544 HydrophobicContact CB-CG 3.81Å
509	L	86.5	Confident	85.7	Confident	52 Å²	52	46.3 Å²	46.3	27%	0.272	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-69.1	151.9	166.9	-60.8	167.3	0	0	0	108.7	D319 Y511 T512 L513	D319-L509 HydrophobicContact CB-CD2 3.88Å; L509-Y511 VanDerWaalsContact C-N 3.28Å; L509-Y511 HydrophobicContact CB-CD1 3.8Å; L509-Y511 HydrophobicContact CB-CE1 3.5Å; L509-Y511 VanDerWaalsContact CB-CE1 3.5Å; L509-Y511 HydrophobicContact CD1-CE1 3.45Å; L509-Y511 VanDerWaalsContact CD1-CE1 3.45Å; L509-Y511 VanDerWaalsContact CD1-OH 3.27Å; L509-Y511 WeakPolarHBondContact CD1-OH 3.48Å; L509-Y511 HydrophobicContact CG-CE1 4.06Å; L509-Y511 PolarHBondContact O-N 3.29Å; L509-T512 WeakPolarHBondContact O-CA 3.48Å; L509-T512 WeakPolarHBondContact O-CB 3.16Å; L509-T512 PolarHBondContact O-N 3.05Å; L509-L513 PolarHBondContact O-N 3.29Å
510	T	86.3	Confident	85.8	Confident	13 Å²	13	44.2 Å²	44.2	8%	0.08	23%	0.228	C	C	.	.	H	α-helix	trans	-58.2	-39.4	-174.8	-65.6	0	0	0	0	112.7	D319 F321 Y374 T512 L513 Q514	D319-T510 PolarHBondContact OD1-OG1 3Å; D319-T510 PolarHBondContact OD2-N 3.06Å; D319-T510 PolarHBondContact OD2-OG1 2.99Å; F321-T510 HydrophobicContact CB-CG2 3.95Å; F321-T510 HydrophobicContact CD1-CG2 3.56Å; F321-T510 VanDerWaalsContact CD1-OG1 3.3Å; F321-T510 WeakPolarHBondContact CD1-OG1 3.44Å; F321-T510 HydrophobicContact CE1-CG2 4.2Å; F321-T510 HydrophobicContact CG-CG2 3.82Å; Y374-T510 HydrophobicContact CD1-CG2 4.46Å; Y374-T510 WeakPolarHBondContact O-CG2 3.35Å; T510-T512 VanDerWaalsContact C-N 3.35Å; T510-T512 PolarHBondContact O-N 3.01Å; T510-L513 PolarHBondContact O-N 3.15Å; T510-Q514 PolarHBondContact O-N 3.14Å
511	Y	84.3	Confident	85.7	Confident	144 Å²	144	44.4 Å²	44.4	57%	0.565	23%	0.23	S	C	*	.	H	α-helix	trans	-67.7	-33.7	176.1	72.4	-95.3	0	0	0	112.8	L509 Q514 E515	L509-Y511 VanDerWaalsContact C-N 3.28Å; L509-Y511 HydrophobicContact CB-CD1 3.8Å; L509-Y511 HydrophobicContact CB-CE1 3.5Å; L509-Y511 VanDerWaalsContact CB-CE1 3.5Å; L509-Y511 HydrophobicContact CD1-CE1 3.45Å; L509-Y511 VanDerWaalsContact CD1-CE1 3.45Å; L509-Y511 VanDerWaalsContact CD1-OH 3.27Å; L509-Y511 WeakPolarHBondContact CD1-OH 3.48Å; L509-Y511 HydrophobicContact CG-CE1 4.06Å; L509-Y511 PolarHBondContact O-N 3.29Å; Y511-Q514 PolarHBondContact O-N 3.2Å; Y511-E515 WeakPolarHBondContact O-CB 3.39Å; Y511-E515 PolarHBondContact O-N 3.2Å
512	T	86.4	Confident	86	Confident	13 Å²	13	48.6 Å²	48.6	8%	0.08	25%	0.247	C	C	.	.	H	α-helix	trans	-67.9	-39.9	176.5	-52.7	0	0	0	0	110.5	L509 T510 E515 L516	L509-T512 WeakPolarHBondContact O-CA 3.48Å; L509-T512 WeakPolarHBondContact O-CB 3.16Å; L509-T512 PolarHBondContact O-N 3.05Å; T510-T512 VanDerWaalsContact C-N 3.35Å; T510-T512 PolarHBondContact O-N 3.01Å; T512-E515 PolarHBondContact O-N 3.17Å; T512-L516 HydrophobicContact CG2-CD1 4.33Å; T512-L516 WeakPolarHBondContact O-CB 3.2Å; T512-L516 VanDerWaalsContact O-CG 3.28Å; T512-L516 WeakPolarHBondContact O-CG 3.37Å; T512-L516 PolarHBondContact O-N 3.27Å
513	L	86.2	Confident	86.1	Confident	21 Å²	21	45.4 Å²	45.4	11%	0.11	24%	0.235	C	C	.	.	H	α-helix	trans	-60.8	-48.9	171.4	-71.7	176.6	0	0	0	110.8	Y374 A508 L509 T510 E515 L516 H517 A548	Y374-L513 HydrophobicContact CD1-CB 4.28Å; Y374-L513 HydrophobicContact CE1-CB 4.25Å; Y374-L513 HydrophobicContact CE1-CD1 4.42Å; A508-L513 HydrophobicContact CB-CD1 4.26Å; A508-L513 HydrophobicContact CB-CD2 3.53Å; A508-L513 HydrophobicContact CB-CG 3.53Å; L509-L513 PolarHBondContact O-N 3.29Å; T510-L513 PolarHBondContact O-N 3.15Å; L513-E515 VanDerWaalsContact C-N 3.3Å; L513-E515 PolarHBondContact O-N 3.32Å; L513-L516 PolarHBondContact O-N 3.42Å; L513-H517 WeakPolarHBondContact O-CB 3.18Å; L513-H517 PolarHBondContact O-CD2 2.93Å; L513-H517 PolarHBondContact O-N 3.33Å; L513-A548 HydrophobicContact CD2-CB 4.04Å
514	Q	86.7	Confident	86	Confident	57 Å²	57	46.8 Å²	46.8	27%	0.266	24%	0.242	S	C	.	.	H	α-helix	trans	-58	-41.8	178.5	-174.8	68.2	63.5	0	0	112.5	T510 Y511 N518	T510-Q514 PolarHBondContact O-N 3.14Å; Y511-Q514 PolarHBondContact O-N 3.2Å; Q514-N518 PolarHBondContact NE2-ND2 3.18Å; Q514-N518 PolarHBondContact NE2-OD1 3.01Å; Q514-N518 WeakPolarHBondContact O-CB 3.26Å; Q514-N518 PolarHBondContact O-N 3.33Å; Q514-N518 PolarHBondContact O-ND2 2.86Å; Q514-N518 PolarHBondContact O-OD1 2.93Å
515	E	86.8	Confident	85.8	Confident	46 Å²	46	46.7 Å²	46.7	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-59.9	-50.4	174.5	-179.8	-173.3	174.7	0	0	111.4	Y511 T512 L513 N518 T519 H535	Y511-E515 WeakPolarHBondContact O-CB 3.39Å; Y511-E515 PolarHBondContact O-N 3.2Å; T512-E515 PolarHBondContact O-N 3.17Å; L513-E515 VanDerWaalsContact C-N 3.3Å; L513-E515 PolarHBondContact O-N 3.32Å; E515-N518 PolarHBondContact O-N 3.04Å; E515-T519 WeakPolarHBondContact O-CB 3.16Å; E515-T519 PolarHBondContact O-N 3.43Å; E515-T519 PolarHBondContact O-OG1 2.82Å; E515-H535 IonicContact OE1-CD2 3.8Å
516	L	86.9	Confident	85.5	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.037	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-43.4	178.8	-72.7	176.5	0	0	0	112.2	T512 L513 N518 T519 F520 Q544 L545	T512-L516 HydrophobicContact CG2-CD1 4.33Å; T512-L516 WeakPolarHBondContact O-CB 3.2Å; T512-L516 VanDerWaalsContact O-CG 3.28Å; T512-L516 WeakPolarHBondContact O-CG 3.37Å; T512-L516 PolarHBondContact O-N 3.27Å; L513-L516 PolarHBondContact O-N 3.42Å; L516-N518 PolarHBondContact O-N 3.13Å; L516-T519 PolarHBondContact O-N 3.39Å; L516-F520 HydrophobicContact CD2-CD2 4.27Å; L516-F520 HydrophobicContact CD2-CE2 3.95Å; L516-F520 WeakPolarHBondContact O-CD2 3.31Å; L516-F520 PolarHBondContact O-N 2.98Å; L516-Q544 HydrophobicContact CD1-CB 4.27Å; L516-L545 HydrophobicContact CB-CD1 3.96Å
517	H	86.5	Confident	84.6	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.9	-43.8	175.1	-89.8	-81.9	0	0	0	112.1	Y374 Y447 F452 L513 A521 D552	Y374-H517 AromaticContact CZ-CD2 3.81Å; Y374-H517 AromaticContact CZ-NE2 3.77Å; Y374-H517 PolarHBondContact OH-CE1 3.19Å; Y374-H517 VanDerWaalsContact OH-CE1 3.3Å; Y374-H517 PolarHBondContact OH-NE2 3.48Å; Y374-H517 VanDerWaalsContact OH-NE2 3.09Å; Y447-H517 PolarHBondContact OH-ND1 2.87Å; Y447-H517 PolarHBondContact OH-O 3.07Å; Y447-H517 VanDerWaalsContact OH-O 3.11Å; F452-H517 AromaticContact CD1-CE1 3.24Å; F452-H517 WeakPolarHBondContact CD1-CE1 3.48Å; F452-H517 AromaticContact CD1-ND1 3.6Å; F452-H517 AromaticContact CD2-ND1 3.65Å; F452-H517 AromaticContact CE1-CE1 3.69Å; F452-H517 AromaticContact CG-CE1 3.52Å; F452-H517 AromaticContact CG-ND1 3.4Å; F452-H517 WeakPolarHBondContact CG-ND1 3.44Å; L513-H517 WeakPolarHBondContact O-CB 3.18Å; L513-H517 PolarHBondContact O-CD2 2.93Å; L513-H517 PolarHBondContact O-N 3.33Å; H517-A521 WeakPolarHBondContact O-CA 3.36Å; H517-A521 WeakPolarHBondContact O-CB 3.21Å; H517-A521 PolarHBondContact O-N 2.98Å; H517-D552 IonicContact CE1-OD2 3.97Å; H517-D552 PolarHBondContact CE1-OD2 3.03Å; H517-D552 IonicContact ND1-OD2 2.69Å; H517-D552 IonicContact NE2-OD2 3.36Å; H517-D552 PolarHBondContact NE2-OD2 3.21Å
518	N	85.4	Confident	83.4	Confident	95 Å²	95	45.1 Å²	45.1	51%	0.508	23%	0.233	S	C	.	.	H	α-helix	trans	-70.8	-37	179.4	-69.3	-10.4	0	0	0	111.7	Q514 E515 L516	Q514-N518 PolarHBondContact NE2-ND2 3.18Å; Q514-N518 PolarHBondContact NE2-OD1 3.01Å; Q514-N518 WeakPolarHBondContact O-CB 3.26Å; Q514-N518 PolarHBondContact O-N 3.33Å; Q514-N518 PolarHBondContact O-ND2 2.86Å; Q514-N518 PolarHBondContact O-OD1 2.93Å; E515-N518 PolarHBondContact O-N 3.04Å; L516-N518 PolarHBondContact O-N 3.13Å
519	T	85.1	Confident	82	Confident	47 Å²	47	47 Å²	47	29%	0.288	24%	0.241	S	C	.	.	H	α-helix	trans	-71.6	-43	-177.2	-53.5	0	0	0	0	111.4	E515 L516 C523	E515-T519 WeakPolarHBondContact O-CB 3.16Å; E515-T519 PolarHBondContact O-N 3.43Å; E515-T519 PolarHBondContact O-OG1 2.82Å; L516-T519 PolarHBondContact O-N 3.39Å; T519-C523 PolarHBondContact O-SG 3.37Å
520	F	89	Confident	80.3	Confident	5 Å²	5	49.8 Å²	49.8	2%	0.022	25%	0.253	C	S	.	.	S	Bend	trans	-107.1	16.9	-174.9	-58.2	-69.9	0	0	0	113.7	F452 F470 L516 H522 P525 L537 L545	F452-F520 HydrophobicContact CE2-CB 4.27Å; F452-F520 WeakPolarHBondContact CE2-O 3.17Å; F470-F520 HydrophobicContact CE2-CB 4.23Å; F470-F520 HydrophobicContact CZ-CB 4.38Å; L516-F520 HydrophobicContact CD2-CD2 4.27Å; L516-F520 HydrophobicContact CD2-CE2 3.95Å; L516-F520 WeakPolarHBondContact O-CD2 3.31Å; L516-F520 PolarHBondContact O-N 2.98Å; F520-H522 PolarHBondContact O-N 3.14Å; F520-P525 HydrophobicContact CD1-CB 3.96Å; F520-P525 HydrophobicContact CE1-CB 4Å; F520-P525 HydrophobicContact CG-CB 4.43Å; F520-P525 HydrophobicContact CZ-CB 4.49Å; F520-L537 HydrophobicContact CE1-CD1 3.88Å; F520-L537 HydrophobicContact CE2-CD1 3.86Å; F520-L537 HydrophobicContact CE2-CD2 4.18Å; F520-L537 HydrophobicContact CE2-CG 4.18Å; F520-L537 HydrophobicContact CZ-CD1 3.23Å; F520-L537 HydrophobicContact CZ-CD2 4.38Å; F520-L537 HydrophobicContact CZ-CG 3.96Å; F520-L545 HydrophobicContact CB-CD1 4.36Å; F520-L545 HydrophobicContact CD2-CD1 3.9Å; F520-L545 HydrophobicContact CD2-CD2 3.97Å; F520-L545 HydrophobicContact CE2-CD2 4.46Å; F520-L545 HydrophobicContact CG-CD1 4.44Å; F520-L545 HydrophobicContact CG-CD2 4.25Å
521	A	86	Confident	78.3	Confident	4 Å²	4	57.1 Å²	57.1	3%	0.033	29%	0.286	C	S	.	.	S	Bend	trans	-57	-34.3	177.9	0	0	0	0	0	112.7	S449 E450 H517	S449-A521 CarbonylContact C-O 3.49Å; S449-A521 WeakPolarHBondContact CA-O 3.31Å; S449-A521 WeakPolarHBondContact CB-O 3.1Å; S449-A521 PolarHBondContact OG-O 3.21Å; E450-A521 PolarHBondContact N-O 3.46Å; H517-A521 WeakPolarHBondContact O-CA 3.36Å; H517-A521 WeakPolarHBondContact O-CB 3.21Å; H517-A521 PolarHBondContact O-N 2.98Å
522	H	87	Confident	76.5	Confident	102 Å²	102	54.7 Å²	54.7	47%	0.472	29%	0.29	S	S	.	.	S	Bend	trans	-133.2	12.8	-171.4	-52.6	-70.6	0	0	0	113.2	V448 F520	V448-H522 PolarHBondContact O-CE1 2.71Å; V448-H522 PolarHBondContact O-NE2 3.34Å; F520-H522 PolarHBondContact O-N 3.14Å
523	C	86.8	Confident	74.7	Confident	39 Å²	39	56 Å²	56	26%	0.264	30%	0.299	S	S	.	.	S	Bend	trans	-143.9	152.4	177.8	64.2	0	0	0	0	111.6	T519 I529	T519-C523 PolarHBondContact O-SG 3.37Å; C523-I529 HydrophobicContact CB-CD1 4.17Å
524	L	86.3	Confident	73.2	Confident	34 Å²	34	59.2 Å²	59.2	18%	0.178	32%	0.32	C	S	.	.			trans	-75.8	144.9	175.4	-68.4	170.8	0	0	0	110.3	Y451 I469 F470 L526 I529	Y451-L524 HydrophobicContact CE1-CD2 3.75Å; Y451-L524 HydrophobicContact CE2-CD2 4.48Å; Y451-L524 WeakPolarHBondContact OH-CG 3.38Å; I469-L524 HydrophobicContact CB-CD2 4.39Å; I469-L524 HydrophobicContact CG2-CD1 3.51Å; I469-L524 HydrophobicContact CG2-CD2 3.87Å; I469-L524 HydrophobicContact CG2-CG 4.36Å; F470-L524 HydrophobicContact CB-CD2 4.16Å; F470-L524 HydrophobicContact CD2-CD2 4.08Å; L524-L526 HydrophobicContact CB-CD1 4.3Å; L524-L526 HydrophobicContact CB-CG 4.04Å; L524-L526 PolarHBondContact O-N 2.99Å; L524-I529 WeakPolarHBondContact O-CD1 3.15Å
525	P	84	Confident	72.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.318	C	S	.	.			trans	-77.7	69.9	177.9	34.5	-36.5	0	0	0	110.9	F470 T473 F520 L537 F542 L545	F470-P525 HydrophobicContact CE2-CG 4.4Å; F470-P525 HydrophobicContact CZ-CG 4.37Å; T473-P525 HydrophobicContact CG2-CG 4.07Å; T473-P525 WeakPolarHBondContact CG2-O 3.4Å; F520-P525 HydrophobicContact CD1-CB 3.96Å; F520-P525 HydrophobicContact CE1-CB 4Å; F520-P525 HydrophobicContact CG-CB 4.43Å; F520-P525 HydrophobicContact CZ-CB 4.49Å; P525-L537 HydrophobicContact CB-CD1 4.1Å; P525-F542 HydrophobicContact CB-CE1 3.95Å; P525-F542 HydrophobicContact CG-CE1 4.46Å; P525-F542 WeakPolarHBondContact O-CE1 3.47Å; P525-L545 HydrophobicContact CB-CD2 3.55Å; P525-L545 HydrophobicContact CG-CD2 3.7Å
526	L	80.2	Confident	71.3	Confident	74 Å²	74	60.4 Å²	60.4	39%	0.387	33%	0.333	S	S	.	.			trans	-88.5	147.5	177	-65.6	169.6	0	0	0	110.7	T473 L524 D528 I529	T473-L526 HydrophobicContact CG2-CD2 3.91Å; L524-L526 HydrophobicContact CB-CD1 4.3Å; L524-L526 HydrophobicContact CB-CG 4.04Å; L524-L526 PolarHBondContact O-N 2.99Å; L526-D528 PolarHBondContact O-N 3.04Å; L526-D528 VanDerWaalsContact O-N 3.12Å; L526-I529 PolarHBondContact O-N 3.48Å; L526-I529 VanDerWaalsContact O-N 3.17Å
527	P	63.2	Low	70.9	Confident	40 Å²	40	61 Å²	61	26%	0.26	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-54.7	-31.4	179.5	-24.9	33.5	0	0	0	113.8	I529 E530	P527-I529 PolarHBondContact O-N 2.86Å; P527-E530 WeakPolarHBondContact O-CB 3.07Å; P527-E530 WeakPolarHBondContact O-CG 3.1Å; P527-E530 PolarHBondContact O-N 2.83Å
528	D	58	Low	70.8	Confident	140 Å²	140	64.5 Å²	64.5	75%	0.749	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-69.2	-15.9	-175.8	-58.2	-35.4	0	0	0	113.8	L526 E530	L526-D528 PolarHBondContact O-N 3.04Å; L526-D528 VanDerWaalsContact O-N 3.12Å; D528-E530 PolarHBondContact O-N 3.31Å
529	I	55	Low	71	Confident	55 Å²	55	61 Å²	61	28%	0.282	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-79.8	-5.2	-179.9	-56.1	-176.5	0	0	0	112.2	C523 L524 L526 P527 Q531 S532	C523-I529 HydrophobicContact CB-CD1 4.17Å; L524-I529 WeakPolarHBondContact O-CD1 3.15Å; L526-I529 PolarHBondContact O-N 3.48Å; L526-I529 VanDerWaalsContact O-N 3.17Å; P527-I529 PolarHBondContact O-N 2.86Å; I529-Q531 PolarHBondContact O-N 3.03Å; I529-S532 PolarHBondContact O-N 3.13Å; I529-S532 PolarHBondContact O-OG 3.45Å
530	E	50	Low	71.2	Confident	109 Å²	109	59.8 Å²	59.8	51%	0.509	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-53.2	-16.8	-179.5	-80.2	176.9	-170.7	0	0	115.3	P527 D528 S532	P527-E530 WeakPolarHBondContact O-CB 3.07Å; P527-E530 WeakPolarHBondContact O-CG 3.1Å; P527-E530 PolarHBondContact O-N 2.83Å; D528-E530 PolarHBondContact O-N 3.31Å; E530-S532 PolarHBondContact O-N 2.86Å
531	Q	45	Very low	71.2	Confident	168 Å²	168	61.7 Å²	61.7	79%	0.785	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-78.2	-12.6	-175	-61	-177.4	11.4	0	0	114.9	I529	I529-Q531 PolarHBondContact O-N 3.03Å
532	S	46.2	Very low	71.6	Confident	93 Å²	93	61.7 Å²	61.7	65%	0.65	33%	0.334	S	S	*	.	S	Bend	trans	-113.7	-15.3	-169.1	68.5	0	0	0	0	116.6	I529 E530	I529-S532 PolarHBondContact O-N 3.13Å; I529-S532 PolarHBondContact O-OG 3.45Å; E530-S532 PolarHBondContact O-N 2.86Å
533	S	49.3	Very low	71.8	Confident	39 Å²	39	56.9 Å²	56.9	27%	0.273	31%	0.312	S	S	.	.			trans	-100.9	147.6	-175.9	66.6	0	0	0	0	113.2	H535	S533-H535 PolarHBondContact O-N 3.37Å; S533-H535 VanDerWaalsContact O-N 3.16Å; S533-H535 PolarHBondContact OG-O 2.96Å; S533-H535 VanDerWaalsContact OG-O 3.14Å
534	T	54.4	Low	72.1	Confident	89 Å²	89	55.9 Å²	55.9	55%	0.546	30%	0.303	S	S	.	.	S	Bend	trans	-65.1	-14	179.8	34.7	0	0	0	0	114.4
535	H	63.4	Low	72.4	Confident	48 Å²	48	54.2 Å²	54.2	22%	0.222	30%	0.295	C	S	.	.	S	Bend	trans	-144.5	122.3	-177.2	-67.2	-53.4	0	0	0	110.6	E515 S533 R541	E515-H535 IonicContact OE1-CD2 3.8Å; S533-H535 PolarHBondContact O-N 3.37Å; S533-H535 VanDerWaalsContact O-N 3.16Å; S533-H535 PolarHBondContact OG-O 2.96Å; S533-H535 VanDerWaalsContact OG-O 3.14Å; H535-R541 VanDerWaalsContact CB-CZ 3.44Å; H535-R541 VanDerWaalsContact CB-NH2 3.32Å
536	P	69.5	Low	72.9	Confident	80 Å²	80	54.4 Å²	54.4	52%	0.519	30%	0.296	S	S	.	.			trans	-66.9	148.3	-179.1	27	-33.6	0	0	0	111.6	D538 R541	P536-D538 PolarHBondContact O-N 2.96Å; P536-D538 VanDerWaalsContact O-N 3.14Å; P536-R541 PolarHBondContact O-NH1 3.4Å
537	L	78.7	Confident	73.5	Confident	20 Å²	20	51.6 Å²	51.6	11%	0.105	28%	0.28	C	S	.	.			trans	-71.1	99.9	173.7	-92.8	159.9	0	0	0	109.5	F520 P525 R541 F542 L545	F520-L537 HydrophobicContact CE1-CD1 3.88Å; F520-L537 HydrophobicContact CE2-CD1 3.86Å; F520-L537 HydrophobicContact CE2-CD2 4.18Å; F520-L537 HydrophobicContact CE2-CG 4.18Å; F520-L537 HydrophobicContact CZ-CD1 3.23Å; F520-L537 HydrophobicContact CZ-CD2 4.38Å; F520-L537 HydrophobicContact CZ-CG 3.96Å; P525-L537 HydrophobicContact CB-CD1 4.1Å; L537-R541 HydrophobicContact CD2-CB 3.97Å; L537-F542 HydrophobicContact CB-CD2 4.25Å; L537-F542 HydrophobicContact CB-CE2 3.68Å; L537-F542 HydrophobicContact CB-CZ 3.83Å; L537-F542 HydrophobicContact CD1-CE1 4.15Å; L537-F542 HydrophobicContact CD1-CZ 4.02Å; L537-F542 HydrophobicContact CD2-CD1 4.11Å; L537-F542 HydrophobicContact CD2-CD2 4.4Å; L537-F542 HydrophobicContact CD2-CE1 4.14Å; L537-F542 HydrophobicContact CD2-CE2 4.42Å; L537-F542 HydrophobicContact CD2-CG 4.24Å; L537-F542 HydrophobicContact CD2-CZ 4.28Å; L537-F542 HydrophobicContact CG-CE2 4.5Å; L537-F542 HydrophobicContact CG-CZ 4.29Å; L537-F542 WeakPolarHBondContact O-CE2 3.22Å; L537-L545 HydrophobicContact CD2-CD2 4.48Å
538	D	84.4	Confident	74.7	Confident	74 Å²	74	49.7 Å²	49.7	40%	0.396	27%	0.268	S	S	.	.			trans	-88.8	173.1	169	61.9	18.2	0	0	0	111.1	P536 V540 R541 F542	P536-D538 PolarHBondContact O-N 2.96Å; P536-D538 VanDerWaalsContact O-N 3.14Å; D538-V540 PolarHBondContact O-N 3.25Å; D538-V540 VanDerWaalsContact O-N 3.15Å; D538-V540 PolarHBondContact OD1-N 3.39Å; D538-R541 PolarHBondContact O-N 2.86Å; D538-R541 VanDerWaalsContact O-N 3.08Å; D538-R541 WeakPolarHBondContact OD1-CB 3.07Å; D538-R541 WeakPolarHBondContact OD1-CG 3.44Å; D538-R541 PolarHBondContact OD1-N 2.75Å; D538-F542 VanDerWaalsContact O-CD2 3.27Å; D538-F542 WeakPolarHBondContact O-CD2 3.28Å; D538-F542 PolarHBondContact O-N 3.13Å
539	I	88.6	Confident	76.4	Confident	20 Å²	20	43.1 Å²	43.1	10%	0.103	23%	0.233	C	C	.	.	H	α-helix	trans	-56.4	-32.1	180	-165.2	170.1	0	0	0	112.9	I478 L481 A482 V498 M500 V503 A543	I478-I539 HydrophobicContact CG2-CD1 4.31Å; I478-I539 HydrophobicContact CG2-CG1 4.16Å; L481-I539 HydrophobicContact CB-CB 4.32Å; L481-I539 HydrophobicContact CB-CD1 4.15Å; L481-I539 HydrophobicContact CB-CG1 4.37Å; L481-I539 HydrophobicContact CD1-CB 4.13Å; A482-I539 HydrophobicContact CB-CD1 3.93Å; V498-I539 HydrophobicContact CG1-CD1 4.14Å; V498-I539 HydrophobicContact CG1-CG2 4.2Å; M500-I539 HydrophobicContact SD-CD1 3.59Å; M500-I539 VanDerWaalsContact SD-CD1 3.59Å; M500-I539 HydrophobicContact SD-CG1 4.48Å; V503-I539 HydrophobicContact CG1-CG1 4.37Å; V503-I539 HydrophobicContact CG2-CG2 4Å; I539-A543 WeakPolarHBondContact O-CB 3.38Å; I539-A543 PolarHBondContact O-N 2.84Å
540	V	89.9	Confident	78.3	Confident	22 Å²	22	40.5 Å²	40.5	13%	0.133	22%	0.22	C	C	.	.	H	α-helix	trans	-68.7	-47	177	174.2	0	0	0	0	110.6	V503 Q506 D538 A543 Q544	V503-V540 HydrophobicContact CG1-CG2 4.41Å; V503-V540 HydrophobicContact CG2-CG2 4.16Å; Q506-V540 HydrophobicContact CB-CG1 4.25Å; Q506-V540 VanDerWaalsContact OE1-CG1 3.22Å; D538-V540 PolarHBondContact O-N 3.25Å; D538-V540 VanDerWaalsContact O-N 3.15Å; D538-V540 PolarHBondContact OD1-N 3.39Å; V540-A543 PolarHBondContact O-N 3.39Å; V540-Q544 HydrophobicContact CG1-CG 4.41Å; V540-Q544 WeakPolarHBondContact O-CB 3.33Å; V540-Q544 WeakPolarHBondContact O-CG 3.46Å; V540-Q544 PolarHBondContact O-N 2.85Å
541	R	90.4	Very high	80.1	Confident	46 Å²	46	38.5 Å²	38.5	17%	0.174	21%	0.208	C	C	.	.	H	α-helix	trans	-64.8	-38.7	176.8	-75.2	-173.4	172.4	105.9	8.5	112.1	H535 P536 L537 D538 Q544 L545	H535-R541 VanDerWaalsContact CB-CZ 3.44Å; H535-R541 VanDerWaalsContact CB-NH2 3.32Å; P536-R541 PolarHBondContact O-NH1 3.4Å; L537-R541 HydrophobicContact CD2-CB 3.97Å; D538-R541 PolarHBondContact O-N 2.86Å; D538-R541 VanDerWaalsContact O-N 3.08Å; D538-R541 WeakPolarHBondContact OD1-CB 3.07Å; D538-R541 WeakPolarHBondContact OD1-CG 3.44Å; D538-R541 PolarHBondContact OD1-N 2.75Å; R541-Q544 PolarHBondContact O-N 3.01Å; R541-L545 VanDerWaalsContact O-CB 3.27Å; R541-L545 WeakPolarHBondContact O-CB 3.4Å; R541-L545 PolarHBondContact O-N 3.32Å
542	F	92.6	Very high	82.2	Confident	4 Å²	4	31.5 Å²	31.5	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-60.3	-46.3	172.1	-80.9	-70.2	0	0	0	111.7	Q477 I478 L481 P525 L537 D538 Q544 L545 M546	Q477-F542 HydrophobicContact CB-CD1 4.02Å; Q477-F542 HydrophobicContact CB-CD2 4.27Å; Q477-F542 HydrophobicContact CB-CE1 3.72Å; Q477-F542 HydrophobicContact CB-CE2 4.01Å; Q477-F542 HydrophobicContact CB-CG 4.29Å; Q477-F542 HydrophobicContact CB-CZ 3.74Å; Q477-F542 HydrophobicContact CG-CE1 3.82Å; Q477-F542 HydrophobicContact CG-CZ 3.83Å; I478-F542 HydrophobicContact CD1-CB 4.06Å; I478-F542 HydrophobicContact CG1-CB 3.56Å; I478-F542 HydrophobicContact CG1-CG 4.5Å; L481-F542 HydrophobicContact CD1-CD2 3.89Å; L481-F542 HydrophobicContact CD1-CE2 3.97Å; P525-F542 HydrophobicContact CB-CE1 3.95Å; P525-F542 HydrophobicContact CG-CE1 4.46Å; P525-F542 WeakPolarHBondContact O-CE1 3.47Å; L537-F542 HydrophobicContact CB-CD2 4.25Å; L537-F542 HydrophobicContact CB-CE2 3.68Å; L537-F542 HydrophobicContact CB-CZ 3.83Å; L537-F542 HydrophobicContact CD1-CE1 4.15Å; L537-F542 HydrophobicContact CD1-CZ 4.02Å; L537-F542 HydrophobicContact CD2-CD1 4.11Å; L537-F542 HydrophobicContact CD2-CD2 4.4Å; L537-F542 HydrophobicContact CD2-CE1 4.14Å; L537-F542 HydrophobicContact CD2-CE2 4.42Å; L537-F542 HydrophobicContact CD2-CG 4.24Å; L537-F542 HydrophobicContact CD2-CZ 4.28Å; L537-F542 HydrophobicContact CG-CE2 4.5Å; L537-F542 HydrophobicContact CG-CZ 4.29Å; L537-F542 WeakPolarHBondContact O-CE2 3.22Å; D538-F542 VanDerWaalsContact O-CD2 3.27Å; D538-F542 WeakPolarHBondContact O-CD2 3.28Å; D538-F542 PolarHBondContact O-N 3.13Å; F542-Q544 VanDerWaalsContact C-N 3.32Å; F542-Q544 PolarHBondContact O-N 2.76Å; F542-L545 PolarHBondContact O-N 3.1Å; F542-M546 WeakPolarHBondContact O-CB 3.18Å; F542-M546 PolarHBondContact O-N 3.2Å
543	A	92.7	Very high	84.3	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.7	-39.1	175.8	0	0	0	0	0	111.9	I478 V503 Y504 I539 V540 K547	I478-A543 HydrophobicContact CD1-CB 4.26Å; V503-A543 HydrophobicContact CG1-CB 3.64Å; Y504-A543 HydrophobicContact CD1-CB 4.35Å; Y504-A543 HydrophobicContact CE1-CB 4.02Å; I539-A543 WeakPolarHBondContact O-CB 3.38Å; I539-A543 PolarHBondContact O-N 2.84Å; V540-A543 PolarHBondContact O-N 3.39Å; A543-K547 WeakPolarHBondContact O-CB 3.47Å; A543-K547 VanDerWaalsContact O-CE 3.27Å; A543-K547 WeakPolarHBondContact O-CE 3.44Å; A543-K547 WeakPolarHBondContact O-CG 3.47Å; A543-K547 PolarHBondContact O-N 3.43Å
544	Q	92.3	Very high	86.1	Confident	18 Å²	18	27.3 Å²	27.3	8%	0.084	15%	0.145	C	C	.	.	H	α-helix	trans	-63.9	-42.3	174.7	-71.3	169.6	0.6	0	0	112.2	A508 L516 V540 R541 F542 K547 A548	A508-Q544 HydrophobicContact CB-CB 4.08Å; A508-Q544 HydrophobicContact CB-CG 3.81Å; L516-Q544 HydrophobicContact CD1-CB 4.27Å; V540-Q544 HydrophobicContact CG1-CG 4.41Å; V540-Q544 WeakPolarHBondContact O-CB 3.33Å; V540-Q544 WeakPolarHBondContact O-CG 3.46Å; V540-Q544 PolarHBondContact O-N 2.85Å; R541-Q544 PolarHBondContact O-N 3.01Å; F542-Q544 VanDerWaalsContact C-N 3.32Å; F542-Q544 PolarHBondContact O-N 2.76Å; Q544-K547 PolarHBondContact O-N 2.95Å; Q544-A548 WeakPolarHBondContact O-CB 3.4Å; Q544-A548 PolarHBondContact O-N 3.4Å
545	L	92.4	Very high	87.7	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65	-46.5	177.9	-169.9	70	0	0	0	111.4	F452 F470 L516 F520 P525 L537 R541 F542 K547 A548 F549	F452-L545 HydrophobicContact CE1-CD1 4.42Å; F452-L545 HydrophobicContact CZ-CD1 3.73Å; F470-L545 HydrophobicContact CE1-CD2 4.25Å; F470-L545 HydrophobicContact CE1-CG 3.97Å; F470-L545 HydrophobicContact CZ-CD1 4.09Å; F470-L545 HydrophobicContact CZ-CD2 3.82Å; F470-L545 HydrophobicContact CZ-CG 3.78Å; L516-L545 HydrophobicContact CB-CD1 3.96Å; F520-L545 HydrophobicContact CB-CD1 4.36Å; F520-L545 HydrophobicContact CD2-CD1 3.9Å; F520-L545 HydrophobicContact CD2-CD2 3.97Å; F520-L545 HydrophobicContact CE2-CD2 4.46Å; F520-L545 HydrophobicContact CG-CD1 4.44Å; F520-L545 HydrophobicContact CG-CD2 4.25Å; P525-L545 HydrophobicContact CB-CD2 3.55Å; P525-L545 HydrophobicContact CG-CD2 3.7Å; L537-L545 HydrophobicContact CD2-CD2 4.48Å; R541-L545 VanDerWaalsContact O-CB 3.27Å; R541-L545 WeakPolarHBondContact O-CB 3.4Å; R541-L545 PolarHBondContact O-N 3.32Å; F542-L545 PolarHBondContact O-N 3.1Å; L545-K547 PolarHBondContact O-N 3.02Å; L545-A548 WeakPolarHBondContact O-CB 3.47Å; L545-A548 PolarHBondContact O-N 3.23Å; L545-A548 VanDerWaalsContact O-N 3.11Å; L545-F549 PolarHBondContact O-N 3.17Å
546	M	94	Very high	89	Confident	3 Å²	3	23.8 Å²	23.8	2%	0.015	13%	0.126	C	C	.	.	H	α-helix	trans	-59.6	-47	175.3	-170.1	-168.1	76.3	0	0	111.4	L471 C474 T475 I478 Y504 F542 A548 F549 L550 F650	L471-M546 HydrophobicContact CD1-CG 3.72Å; L471-M546 HydrophobicContact CD1-SD 4.18Å; C474-M546 HydrophobicContact CB-CB 3.94Å; C474-M546 HydrophobicContact CB-CG 4.12Å; T475-M546 HydrophobicContact CG2-SD 3.7Å; I478-M546 HydrophobicContact CD1-SD 4.21Å; Y504-M546 HydrophobicContact CE1-CE 3.58Å; Y504-M546 WeakPolarHBondContact OH-CE 3.06Å; F542-M546 WeakPolarHBondContact O-CB 3.18Å; F542-M546 PolarHBondContact O-N 3.2Å; M546-A548 VanDerWaalsContact C-N 3.26Å; M546-A548 PolarHBondContact O-N 2.62Å; M546-F549 PolarHBondContact O-N 3.09Å; M546-L550 HydrophobicContact CG-CD1 4.46Å; M546-L550 WeakPolarHBondContact O-CG 3.49Å; M546-L550 PolarHBondContact O-N 3.33Å; M546-L550 VanDerWaalsContact O-N 3.1Å; M546-F650 HydrophobicContact CE-CE1 4.06Å; M546-F650 HydrophobicContact CE-CZ 3.55Å
547	K	92.8	Very high	90.1	Very high	15 Å²	15	20.1 Å²	20.1	7%	0.065	10%	0.102	C	C	.	.	H	α-helix	trans	-62.3	-33.2	175.4	-71.4	-176.8	-69.1	-176.8	0	112.2	Y504 Q506 A543 Q544 L545 R551 I649 I653	Y504-K547 HydrophobicContact CD1-CD 4.26Å; Y504-K547 PolarHBondContact O-NZ 3.32Å; Q506-K547 PolarHBondContact O-NZ 3.33Å; A543-K547 WeakPolarHBondContact O-CB 3.47Å; A543-K547 VanDerWaalsContact O-CE 3.27Å; A543-K547 WeakPolarHBondContact O-CE 3.44Å; A543-K547 WeakPolarHBondContact O-CG 3.47Å; A543-K547 PolarHBondContact O-N 3.43Å; Q544-K547 PolarHBondContact O-N 2.95Å; L545-K547 PolarHBondContact O-N 3.02Å; K547-R551 VanDerWaalsContact O-CB 3.25Å; K547-R551 WeakPolarHBondContact O-CB 3.34Å; K547-R551 PolarHBondContact O-N 3.07Å; K547-R551 PolarHBondContact O-NH1 3.22Å; K547-I649 HydrophobicContact CD-CG2 4.03Å; K547-I653 HydrophobicContact CB-CD1 3.86Å; K547-I653 HydrophobicContact CD-CD1 3.95Å; K547-I653 HydrophobicContact CG-CD1 3.54Å
548	A	90	Very high	90.8	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.008	10%	0.098	C	C	.	.	H	α-helix	trans	-71.3	-46.5	177.1	0	0	0	0	0	111.9	F452 L513 Q544 L545 M546 L550 R551 D552	F452-A548 HydrophobicContact CE1-CB 4.43Å; L513-A548 HydrophobicContact CD2-CB 4.04Å; Q544-A548 WeakPolarHBondContact O-CB 3.4Å; Q544-A548 PolarHBondContact O-N 3.4Å; L545-A548 WeakPolarHBondContact O-CB 3.47Å; L545-A548 PolarHBondContact O-N 3.23Å; L545-A548 VanDerWaalsContact O-N 3.11Å; M546-A548 VanDerWaalsContact C-N 3.26Å; M546-A548 PolarHBondContact O-N 2.62Å; A548-L550 PolarHBondContact O-N 3.46Å; A548-R551 PolarHBondContact O-N 3.03Å; A548-D552 WeakPolarHBondContact O-CB 3.44Å; A548-D552 PolarHBondContact O-N 3.11Å; A548-D552 VanDerWaalsContact O-N 3.1Å
549	F	93.2	Very high	91.2	Very high	1 Å²	1	16 Å²	16	0%	0.004	8%	0.081	C	C	.	.	H	α-helix	trans	-53.7	-52.6	174.6	170.9	-100.7	0	0	0	111.8	F452 P468 F470 L471 L545 M546 R551 D552 L553	F452-F549 HydrophobicContact CE1-CB 4.14Å; P468-F549 HydrophobicContact CB-CZ 4.02Å; P468-F549 HydrophobicContact CG-CZ 4.44Å; F470-F549 HydrophobicContact CB-CD2 4.4Å; F470-F549 HydrophobicContact CB-CE2 4.19Å; F470-F549 HydrophobicContact CD1-CB 3.86Å; F470-F549 HydrophobicContact CD1-CD1 4.31Å; F470-F549 AromaticContact CD1-CD2 3.6Å; F470-F549 HydrophobicContact CD1-CD2 3.6Å; F470-F549 HydrophobicContact CD1-CE2 4.23Å; F470-F549 AromaticContact CD1-CG 3.64Å; F470-F549 HydrophobicContact CD1-CG 3.64Å; F470-F549 HydrophobicContact CE1-CB 3.74Å; F470-F549 HydrophobicContact CE1-CD2 4.13Å; F470-F549 HydrophobicContact CE1-CG 4.06Å; F470-F549 HydrophobicContact CG-CD2 4.1Å; F470-F549 HydrophobicContact CG-CE2 4.37Å; L471-F549 HydrophobicContact CB-CD1 4.36Å; L471-F549 HydrophobicContact CB-CE1 3.93Å; L545-F549 PolarHBondContact O-N 3.17Å; M546-F549 PolarHBondContact O-N 3.09Å; F549-R551 VanDerWaalsContact C-N 3.33Å; F549-R551 PolarHBondContact O-N 3.28Å; F549-D552 PolarHBondContact O-N 3.15Å; F549-L553 HydrophobicContact CE2-CD2 4.45Å; F549-L553 HydrophobicContact CZ-CD2 4.21Å
550	L	93.8	Very high	91.4	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-65.3	-33.9	-177.8	-66.8	175.5	0	0	0	113.5	L471 M546 A548 L553 V557 I600 F650 I653	L471-L550 HydrophobicContact CD1-CD1 4.44Å; L471-L550 HydrophobicContact CD1-CD2 4.12Å; L471-L550 HydrophobicContact CD1-CG 4.39Å; L471-L550 HydrophobicContact CD2-CD2 4.22Å; M546-L550 HydrophobicContact CG-CD1 4.46Å; M546-L550 WeakPolarHBondContact O-CG 3.49Å; M546-L550 PolarHBondContact O-N 3.33Å; M546-L550 VanDerWaalsContact O-N 3.1Å; A548-L550 PolarHBondContact O-N 3.46Å; L550-L553 HydrophobicContact CD2-CD1 4.47Å; L550-V557 HydrophobicContact CD2-CG2 3.93Å; L550-I600 HydrophobicContact CD1-CD1 3.89Å; L550-I600 HydrophobicContact CD1-CG1 4.33Å; L550-I600 HydrophobicContact CD2-CD1 3.72Å; L550-I600 HydrophobicContact CG-CD1 4.48Å; L550-F650 HydrophobicContact CD1-CE1 4.14Å; L550-I653 HydrophobicContact CB-CG2 3.39Å; L550-I653 HydrophobicContact CD1-CG2 4.15Å; L550-I653 HydrophobicContact CG-CG2 4.43Å
551	R	89.1	Confident	91.4	Very high	67 Å²	67	24.1 Å²	24.1	25%	0.253	12%	0.117	S	C	.	.	H	α-helix	trans	-74.4	-29.7	-179.5	-178.4	-177.7	61.9	-106.6	-2.6	112.6	K547 A548 F549	K547-R551 VanDerWaalsContact O-CB 3.25Å; K547-R551 WeakPolarHBondContact O-CB 3.34Å; K547-R551 PolarHBondContact O-N 3.07Å; K547-R551 PolarHBondContact O-NH1 3.22Å; A548-R551 PolarHBondContact O-N 3.03Å; F549-R551 VanDerWaalsContact C-N 3.33Å; F549-R551 PolarHBondContact O-N 3.28Å
552	D	88.5	Confident	91.6	Very high	21 Å²	21	24.1 Å²	24.1	11%	0.112	12%	0.117	C	C	.	.	H	α-helix	trans	-92.6	-0.5	-173.2	-72.5	8.9	0	0	0	113.2	Y374 G453 H517 A548 F549	Y374-D552 PolarHBondContact OH-OD2 3.47Å; G453-D552 VanDerWaalsContact CA-O 3.31Å; G453-D552 WeakPolarHBondContact CA-O 3.35Å; H517-D552 IonicContact CE1-OD2 3.97Å; H517-D552 PolarHBondContact CE1-OD2 3.03Å; H517-D552 IonicContact ND1-OD2 2.69Å; H517-D552 IonicContact NE2-OD2 3.36Å; H517-D552 PolarHBondContact NE2-OD2 3.21Å; A548-D552 WeakPolarHBondContact O-CB 3.44Å; A548-D552 PolarHBondContact O-N 3.11Å; A548-D552 VanDerWaalsContact O-N 3.1Å; F549-D552 PolarHBondContact O-N 3.15Å
553	L	90.3	Very high	91.6	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	12%	0.117	C	C	.	.			trans	-57.3	130.8	172	-67.7	173.5	0	0	0	110.4	L456 F549 L550 V555 V557	L456-L553 HydrophobicContact CD1-CD1 4.38Å; L456-L553 HydrophobicContact CD1-CD2 4.48Å; F549-L553 HydrophobicContact CE2-CD2 4.45Å; F549-L553 HydrophobicContact CZ-CD2 4.21Å; L550-L553 HydrophobicContact CD2-CD1 4.47Å; L553-V555 VanDerWaalsContact C-N 3.26Å; L553-V555 WeakPolarHBondContact CB-O 3.31Å; L553-V555 PolarHBondContact O-N 3.11Å; L553-V557 HydrophobicContact CD1-CG2 3.88Å
554	P	86.4	Confident	91.6	Very high	43 Å²	43	28.6 Å²	28.6	28%	0.279	14%	0.14	S	C	.	.	S	Bend	trans	-59.6	-37.2	178.2	-26.4	34.8	0	0	0	113.5	G453 V454 K455	G453-P554 WeakPolarHBondContact O-CG 3.43Å; V454-P554 WeakPolarHBondContact O-CD 3.14Å; K455-P554 HydrophobicContact CG-CB 4.4Å; K455-P554 HydrophobicContact CG-CG 4.22Å
555	V	89.1	Confident	91.6	Very high	55 Å²	55	31.7 Å²	31.7	33%	0.333	16%	0.157	S	C	.	.	S	Bend	trans	-115.4	119.8	169.6	-177	0	0	0	0	106.1	L553 P559	L553-V555 VanDerWaalsContact C-N 3.26Å; L553-V555 WeakPolarHBondContact CB-O 3.31Å; L553-V555 PolarHBondContact O-N 3.11Å; V555-P559 HydrophobicContact CG1-CB 3.74Å; V555-P559 HydrophobicContact CG1-CG 4.2Å
556	N	90.6	Very high	91.7	Very high	8 Å²	8	31.8 Å²	31.8	4%	0.043	16%	0.158	C	C	.	.			trans	-59	158.8	179.5	-81.5	30.1	0	0	0	111.7	I558 H593 I653 R656	N556-I558 WeakPolarHBondContact CB-O 3.37Å; N556-I558 CarbonylContact O-C 3.53Å; N556-I558 PolarHBondContact O-N 3.35Å; N556-H593 PolarHBondContact O-CE1 3.36Å; N556-H593 VanDerWaalsContact O-CE1 3.29Å; N556-H593 PolarHBondContact O-ND1 3.07Å; N556-I653 PolarHBondContact ND2-O 2.94Å; N556-R656 HydrophobicContact CB-CB 4.5Å; N556-R656 WeakPolarHBondContact ND2-CB 3.47Å
557	V	93.1	Very high	91.5	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.012	16%	0.163	C	C	.	.	S	Bend	trans	-53.1	-42.9	177	-179.1	0	0	0	0	111.4	L550 L553 P559 H593 C596 L597 I600 L654	L550-V557 HydrophobicContact CD2-CG2 3.93Å; L553-V557 HydrophobicContact CD1-CG2 3.88Å; V557-P559 WeakPolarHBondContact O-CD 3.45Å; V557-H593 WeakPolarHBondContact O-CB 3.49Å; V557-H593 PolarHBondContact O-ND1 2.97Å; V557-C596 HydrophobicContact CG1-CB 4.13Å; V557-L597 HydrophobicContact CG1-CB 3.92Å; V557-L597 HydrophobicContact CG1-CD1 4.08Å; V557-I600 HydrophobicContact CG1-CD1 4.24Å; V557-I600 HydrophobicContact CG2-CD1 4.01Å; V557-L654 HydrophobicContact CB-CD2 4.11Å; V557-L654 HydrophobicContact CG2-CD2 4.18Å
558	I	93.3	Very high	91.5	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.026	18%	0.179	C	C	.	.	S	Bend	trans	-92	107.7	162.8	-56.8	173.8	0	0	0	106.7	N556 F566 F585 L597 L654	N556-I558 WeakPolarHBondContact CB-O 3.37Å; N556-I558 CarbonylContact O-C 3.53Å; N556-I558 PolarHBondContact O-N 3.35Å; I558-F566 HydrophobicContact CD1-CD2 4.08Å; I558-F566 HydrophobicContact CD1-CE2 4.18Å; I558-F566 HydrophobicContact CG2-CB 4.42Å; I558-F585 HydrophobicContact CG2-CZ 4.24Å; I558-L597 HydrophobicContact CD1-CD1 4.35Å; I558-L597 HydrophobicContact CG1-CD1 4.12Å; I558-L597 HydrophobicContact CG1-CD2 4.26Å; I558-L654 HydrophobicContact CD1-CB 4.34Å
559	P	93.1	Very high	91.5	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.019	18%	0.18	C	C	.	.			trans	-65.2	151	-177.5	-16.7	29.6	0	0	0	111.9	V555 V557 E561 Y562	V555-P559 HydrophobicContact CG1-CB 3.74Å; V555-P559 HydrophobicContact CG1-CG 4.2Å; V557-P559 WeakPolarHBondContact O-CD 3.45Å; P559-E561 HydrophobicContact CB-CG 4.23Å; P559-E561 PolarHBondContact O-N 3.32Å; P559-E561 VanDerWaalsContact O-N 3.15Å; P559-Y562 HydrophobicContact CB-CD2 3.93Å; P559-Y562 HydrophobicContact CB-CE2 4.44Å; P559-Y562 HydrophobicContact CG-CD2 3.88Å; P559-Y562 HydrophobicContact CG-CE2 4.22Å; P559-Y562 PolarHBondContact O-N 2.89Å; P559-Y562 VanDerWaalsContact O-N 3.12Å
560	E	90.9	Very high	91.2	Very high	65 Å²	65	35 Å²	35	30%	0.304	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-59.7	-29	-175.8	-58.1	-173.5	177.4	0	0	112.7	Y562 Y563 R656 P658	E560-Y562 VanDerWaalsContact C-N 3.33Å; E560-Y562 PolarHBondContact O-N 3.18Å; E560-Y563 WeakPolarHBondContact O-CB 3.42Å; E560-Y563 PolarHBondContact O-N 3.27Å; E560-R656 HydrophobicContact CG-CG 4.3Å; E560-R656 WeakPolarHBondContact OE1-CD 3.34Å; E560-R656 IonicContact OE1-CZ 2.7Å; E560-R656 IonicContact OE1-NE 3.59Å; E560-R656 PolarHBondContact OE1-NE 2.94Å; E560-R656 IonicContact OE1-NH2 3.55Å; E560-P658 HydrophobicContact CB-CB 4.32Å; E560-P658 WeakPolarHBondContact OE2-CA 3.28Å
561	E	91.5	Very high	90.9	Very high	148 Å²	148	39 Å²	39	69%	0.692	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-69.4	-27.7	-179.8	69	-162.1	161.1	0	0	113.4	P559 Y563	P559-E561 HydrophobicContact CB-CG 4.23Å; P559-E561 PolarHBondContact O-N 3.32Å; P559-E561 VanDerWaalsContact O-N 3.15Å; E561-Y563 VanDerWaalsContact C-N 3.35Å
562	Y	93.8	Very high	90.7	Very high	46 Å²	46	38 Å²	38	18%	0.18	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-92.9	6.3	177.3	-62.7	-88.2	0	0	0	112.8	P559 E560 L564 D565 F566 S588 L589 P590	P559-Y562 HydrophobicContact CB-CD2 3.93Å; P559-Y562 HydrophobicContact CB-CE2 4.44Å; P559-Y562 HydrophobicContact CG-CD2 3.88Å; P559-Y562 HydrophobicContact CG-CE2 4.22Å; P559-Y562 PolarHBondContact O-N 2.89Å; P559-Y562 VanDerWaalsContact O-N 3.12Å; E560-Y562 VanDerWaalsContact C-N 3.33Å; E560-Y562 PolarHBondContact O-N 3.18Å; Y562-L564 PolarHBondContact O-N 3.43Å; Y562-D565 PolarHBondContact O-N 3.44Å; Y562-F566 WeakPolarHBondContact O-CB 3.41Å; Y562-F566 PolarHBondContact O-N 3.47Å; Y562-S588 WeakPolarHBondContact CE1-O 3.5Å; Y562-S588 VanDerWaalsContact CZ-O 3.29Å; Y562-S588 PolarHBondContact OH-O 2.9Å; Y562-L589 HydrophobicContact CD1-CD2 4.11Å; Y562-L589 HydrophobicContact CD2-CD2 3.82Å; Y562-L589 HydrophobicContact CE2-CD2 4.3Å; Y562-L589 HydrophobicContact CG-CD2 3.72Å; Y562-P590 HydrophobicContact CE2-CG 4.49Å
563	Y	93.4	Very high	90.4	Very high	6 Å²	6	48.7 Å²	48.7	2%	0.024	24%	0.242	C	C	.	.	H	α-helix	trans	-59.2	-42.9	-176.1	169.8	-106	0	0	0	113	E560 E561 F566 C567 V655 P657 L661 D664 H672	E560-Y563 WeakPolarHBondContact O-CB 3.42Å; E560-Y563 PolarHBondContact O-N 3.27Å; E561-Y563 VanDerWaalsContact C-N 3.35Å; Y563-F566 HydrophobicContact CD2-CD1 4.46Å; Y563-F566 WeakPolarHBondContact O-CB 3.46Å; Y563-F566 PolarHBondContact O-N 3.28Å; Y563-C567 VanDerWaalsContact CE2-SG 3.59Å; Y563-C567 VanDerWaalsContact CZ-SG 3.54Å; Y563-C567 PolarHBondContact O-N 3.48Å; Y563-C567 PolarHBondContact O-SG 3.46Å; Y563-V655 HydrophobicContact CD2-CG1 4.04Å; Y563-V655 HydrophobicContact CE2-CG1 3.88Å; Y563-P657 HydrophobicContact CD1-CB 4.1Å; Y563-P657 HydrophobicContact CD2-CB 4.1Å; Y563-P657 HydrophobicContact CD2-CG 4.12Å; Y563-P657 HydrophobicContact CE1-CB 3.79Å; Y563-P657 HydrophobicContact CE1-CG 4.28Å; Y563-P657 HydrophobicContact CE2-CB 3.81Å; Y563-P657 HydrophobicContact CE2-CG 3.52Å; Y563-P657 HydrophobicContact CG-CB 4.23Å; Y563-L661 HydrophobicContact CD1-CD1 4.02Å; Y563-L661 HydrophobicContact CE1-CB 4.38Å; Y563-L661 HydrophobicContact CE1-CD1 3.92Å; Y563-D664 WeakPolarHBondContact OH-CB 3.37Å; Y563-D664 PolarHBondContact OH-OD2 3.35Å; Y563-H672 AromaticContact CE2-CE1 3.93Å; Y563-H672 AromaticContact CE2-NE2 3.69Å; Y563-H672 AromaticContact CZ-NE2 3.75Å; Y563-H672 PolarHBondContact OH-NE2 2.91Å
564	L	92.1	Very high	90.1	Very high	92 Å²	92	52 Å²	52	48%	0.482	26%	0.259	S	S	.	.	H	α-helix	trans	-67.9	-39.1	179.4	-66.6	178.5	0	0	0	111.8	Y562 C567 S568 L661	Y562-L564 PolarHBondContact O-N 3.43Å; L564-C567 PolarHBondContact O-N 2.86Å; L564-S568 PolarHBondContact O-N 2.89Å; L564-L661 HydrophobicContact CD2-CD1 3.99Å
565	D	92.4	Very high	89.7	Confident	83 Å²	83	56.1 Å²	56.1	44%	0.444	28%	0.278	S	S	.	.	H	α-helix	trans	-64.4	-42.6	175.4	-63.7	-23.3	0	0	0	110.7	Y562 C567 S568 F585	Y562-D565 PolarHBondContact O-N 3.44Å; D565-C567 PolarHBondContact O-N 3.49Å; D565-S568 WeakPolarHBondContact O-CB 3.36Å; D565-S568 PolarHBondContact O-N 3.37Å; D565-S568 VanDerWaalsContact O-N 3.14Å; D565-S568 PolarHBondContact O-OG 2.95Å; D565-F585 HydrophobicContact CB-CD2 4.08Å; D565-F585 HydrophobicContact CB-CE2 4.25Å
566	F	93.7	Very high	89.4	Confident	1 Å²	1	58.3 Å²	58.3	0%	0.004	29%	0.288	C	S	.	.	H	α-helix	trans	-57.8	-46.8	171.2	164.4	-102.4	0	0	0	111.7	I558 Y562 Y563 S568 L569 F585 V655 H672 A675 L676 L679	I558-F566 HydrophobicContact CD1-CD2 4.08Å; I558-F566 HydrophobicContact CD1-CE2 4.18Å; I558-F566 HydrophobicContact CG2-CB 4.42Å; Y562-F566 WeakPolarHBondContact O-CB 3.41Å; Y562-F566 PolarHBondContact O-N 3.47Å; Y563-F566 HydrophobicContact CD2-CD1 4.46Å; Y563-F566 WeakPolarHBondContact O-CB 3.46Å; Y563-F566 PolarHBondContact O-N 3.28Å; F566-S568 PolarHBondContact O-N 2.77Å; F566-L569 HydrophobicContact CD2-CD1 4.49Å; F566-L569 WeakPolarHBondContact O-CB 3.47Å; F566-L569 PolarHBondContact O-N 3.4Å; F566-F585 HydrophobicContact CB-CE2 3.81Å; F566-F585 HydrophobicContact CB-CZ 3.81Å; F566-F585 HydrophobicContact CD2-CZ 4.37Å; F566-V655 HydrophobicContact CD1-CG1 4.4Å; F566-V655 HydrophobicContact CE1-CG1 3.95Å; F566-V655 HydrophobicContact CE1-CG2 3.71Å; F566-V655 HydrophobicContact CZ-CG2 3.74Å; F566-H672 HydrophobicContact CE1-CB 4.36Å; F566-A675 HydrophobicContact CD2-CB 4.05Å; F566-A675 HydrophobicContact CE1-CB 4.03Å; F566-A675 HydrophobicContact CE2-CB 3.49Å; F566-A675 VanDerWaalsContact CE2-CB 3.49Å; F566-A675 HydrophobicContact CZ-CB 3.48Å; F566-A675 VanDerWaalsContact CZ-CB 3.48Å; F566-A675 WeakPolarHBondContact O-CB 3.31Å; F566-L676 HydrophobicContact CE2-CD2 4.12Å; F566-L676 HydrophobicContact CE2-CG 4.28Å; F566-L676 HydrophobicContact CZ-CD2 4.15Å; F566-L676 HydrophobicContact CZ-CG 3.96Å; F566-L679 HydrophobicContact CD2-CD1 3.99Å; F566-L679 HydrophobicContact CE2-CD1 3.82Å
567	C	91.5	Very high	89.2	Confident	19 Å²	19	63.4 Å²	63.4	13%	0.128	31%	0.311	C	S	.	.	H	α-helix	trans	-63.7	-29.1	177	-74.5	0	0	0	0	113	Y563 L564 D565 L569 A570 T671	Y563-C567 VanDerWaalsContact CE2-SG 3.59Å; Y563-C567 VanDerWaalsContact CZ-SG 3.54Å; Y563-C567 PolarHBondContact O-N 3.48Å; Y563-C567 PolarHBondContact O-SG 3.46Å; L564-C567 PolarHBondContact O-N 2.86Å; D565-C567 PolarHBondContact O-N 3.49Å; C567-L569 PolarHBondContact O-N 3.01Å; C567-A570 WeakPolarHBondContact O-CB 3.44Å; C567-A570 PolarHBondContact O-N 3.39Å; C567-A570 VanDerWaalsContact O-N 3.17Å; C567-T671 HydrophobicContact CB-CG2 4.13Å
568	S	91	Very high	88.8	Confident	57 Å²	57	65.8 Å²	65.8	40%	0.399	32%	0.321	S	S	.	.	H	α-helix	trans	-61.8	-30.9	178.3	84	0	0	0	0	112.4	L564 D565 F566 A570 N571	L564-S568 PolarHBondContact O-N 2.89Å; D565-S568 WeakPolarHBondContact O-CB 3.36Å; D565-S568 PolarHBondContact O-N 3.37Å; D565-S568 VanDerWaalsContact O-N 3.14Å; D565-S568 PolarHBondContact O-OG 2.95Å; F566-S568 PolarHBondContact O-N 2.77Å; S568-A570 PolarHBondContact O-N 3.26Å; S568-A570 VanDerWaalsContact O-N 3.16Å; S568-N571 PolarHBondContact O-N 2.98Å; S568-N571 VanDerWaalsContact O-N 3.1Å
569	L	90.5	Very high	88.4	Confident	5 Å²	5	70 Å²	70	3%	0.026	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-59.5	-27.7	177	-59.5	177	0	0	0	112.7	F566 C567 N571 I572 A581 V582 F585 A675 L679	F566-L569 HydrophobicContact CD2-CD1 4.49Å; F566-L569 WeakPolarHBondContact O-CB 3.47Å; F566-L569 PolarHBondContact O-N 3.4Å; C567-L569 PolarHBondContact O-N 3.01Å; L569-N571 PolarHBondContact O-N 3.23Å; L569-I572 HydrophobicContact CD2-CD1 4.37Å; L569-A581 HydrophobicContact CD2-CB 4.08Å; L569-V582 HydrophobicContact CD1-CG2 4.44Å; L569-V582 HydrophobicContact CD2-CG2 4.26Å; L569-F585 HydrophobicContact CD1-CB 4.3Å; L569-F585 HydrophobicContact CD1-CD1 3.92Å; L569-F585 HydrophobicContact CD1-CE1 4.4Å; L569-F585 HydrophobicContact CD1-CG 3.99Å; L569-F585 HydrophobicContact CD2-CB 4.23Å; L569-A675 HydrophobicContact CB-CB 4.2Å; L569-L679 HydrophobicContact CD1-CD2 3.79Å; L569-L679 HydrophobicContact CD1-CG 4.09Å
570	A	88	Confident	88.2	Confident	7 Å²	7	77 Å²	77	6%	0.058	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-69.7	-20.6	-179.8	0	0	0	0	0	113.9	C567 S568 T671 R674 A675	C567-A570 WeakPolarHBondContact O-CB 3.44Å; C567-A570 PolarHBondContact O-N 3.39Å; C567-A570 VanDerWaalsContact O-N 3.17Å; S568-A570 PolarHBondContact O-N 3.26Å; S568-A570 VanDerWaalsContact O-N 3.16Å; A570-T671 HydrophobicContact CB-CG2 3.6Å; A570-T671 VanDerWaalsContact CB-O 3.23Å; A570-T671 WeakPolarHBondContact CB-O 3.4Å; A570-R674 HydrophobicContact CB-CB 3.93Å; A570-R674 PolarHBondContact O-NH1 3.29Å; A570-A675 HydrophobicContact CB-CB 4.22Å
571	N	86.9	Confident	88.1	Confident	85 Å²	85	75.2 Å²	75.2	46%	0.455	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-92.4	-8.5	-174.6	-69.3	-25.4	0	0	0	113.2	S568 L569	S568-N571 PolarHBondContact O-N 2.98Å; S568-N571 VanDerWaalsContact O-N 3.1Å; L569-N571 PolarHBondContact O-N 3.23Å
572	I	84.5	Confident	88	Confident	45 Å²	45	68.2 Å²	68.2	23%	0.231	33%	0.334	C	S	.	.			trans	-84.1	122	-176	-51.1	177	0	0	0	109	L569 E577 K578 A581	L569-I572 HydrophobicContact CD2-CD1 4.37Å; I572-E577 HydrophobicContact CG2-CB 3.94Å; I572-K578 HydrophobicContact CB-CB 4.44Å; I572-K578 HydrophobicContact CG2-CB 3.9Å; I572-A581 HydrophobicContact CD1-CB 3.18Å
573	R	81.7	Confident	87.8	Confident	246 Å²	246	69.1 Å²	69.1	93%	0.928	34%	0.34	S	S	*	.			trans	-99.1	-32.5	-175.4	-62.6	-176.2	-177.1	-173.7	0.6	113.5
574	N	83.7	Confident	87.8	Confident	70 Å²	70	71.5 Å²	71.5	37%	0.374	36%	0.361	S	S	.	.			trans	-78.7	133.1	-178.1	-175.7	-0.2	0	0	0	110.3	D576 E577 K578	N574-D576 PolarHBondContact OD1-N 3.33Å; N574-E577 HydrophobicContact CB-CB 4.03Å; N574-E577 HydrophobicContact CB-CG 4.05Å; N574-K578 WeakPolarHBondContact O-CB 3.49Å; N574-K578 PolarHBondContact O-N 3.44Å
575	I	79.2	Confident	87.8	Confident	130 Å²	130	67.6 Å²	67.6	67%	0.667	34%	0.34	S	S	*	.	H	α-helix	trans	-63.6	-48.3	-175.4	-61.2	173.1	0	0	0	110.7	E577 K578 E579	I575-E577 PolarHBondContact O-N 2.94Å; I575-K578 WeakPolarHBondContact O-CB 3.32Å; I575-K578 PolarHBondContact O-N 3.23Å; I575-K578 VanDerWaalsContact O-N 3.17Å; I575-E579 PolarHBondContact O-N 3.17Å
576	D	81.9	Confident	87.8	Confident	102 Å²	102	64 Å²	64	55%	0.545	32%	0.321	S	S	.	.	H	α-helix	trans	-66.2	-38.2	-178.4	-57.1	-30.3	0	0	0	112.3	N574 K578 K580	N574-D576 PolarHBondContact OD1-N 3.33Å; D576-K578 VanDerWaalsContact C-N 3.34Å; D576-K580 WeakPolarHBondContact O-CG 3.45Å; D576-K580 PolarHBondContact O-N 3.49Å
577	E	86.5	Confident	87.7	Confident	114 Å²	114	71.5 Å²	71.5	53%	0.533	36%	0.356	S	S	.	.	H	α-helix	trans	-70.4	-34.8	175.5	-69.1	174.6	-174.4	0	0	111.5	I572 N574 I575 A581	I572-E577 HydrophobicContact CG2-CB 3.94Å; N574-E577 HydrophobicContact CB-CB 4.03Å; N574-E577 HydrophobicContact CB-CG 4.05Å; I575-E577 PolarHBondContact O-N 2.94Å; E577-A581 WeakPolarHBondContact O-CB 3.46Å; E577-A581 PolarHBondContact O-N 3.48Å
578	K	84.9	Confident	87.7	Confident	53 Å²	53	72.8 Å²	72.8	23%	0.23	37%	0.366	C	S	.	.	H	α-helix	trans	-65.9	-44.9	178.3	-179.2	-172.7	178.3	-162.6	0	110.5	I572 N574 I575 D576 A581 V582 A678	I572-K578 HydrophobicContact CB-CB 4.44Å; I572-K578 HydrophobicContact CG2-CB 3.9Å; N574-K578 WeakPolarHBondContact O-CB 3.49Å; N574-K578 PolarHBondContact O-N 3.44Å; I575-K578 WeakPolarHBondContact O-CB 3.32Å; I575-K578 PolarHBondContact O-N 3.23Å; I575-K578 VanDerWaalsContact O-N 3.17Å; D576-K578 VanDerWaalsContact C-N 3.34Å; K578-A581 PolarHBondContact O-N 3.35Å; K578-V582 WeakPolarHBondContact O-CB 3.3Å; K578-V582 VanDerWaalsContact O-CG2 3.27Å; K578-V582 WeakPolarHBondContact O-CG2 3.21Å; K578-V582 PolarHBondContact O-N 3.35Å; K578-A678 HydrophobicContact CD-CB 4.29Å; K578-A678 HydrophobicContact CG-CB 4.22Å
579	E	85.7	Confident	87.9	Confident	93 Å²	93	70.5 Å²	70.5	44%	0.435	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-48.9	176	-165.4	-172.4	161.8	0	0	111.3	I575 A581 V582 H583 T682	I575-E579 PolarHBondContact O-N 3.17Å; E579-A581 VanDerWaalsContact C-N 3.32Å; E579-A581 PolarHBondContact O-N 3.15Å; E579-V582 PolarHBondContact O-N 2.98Å; E579-H583 PolarHBondContact O-CD2 3.09Å; E579-H583 PolarHBondContact O-N 3.41Å; E579-H583 IonicContact OE1-NE2 2.7Å; E579-T682 HydrophobicContact CG-CG2 4.2Å
580	K	88.1	Confident	88	Confident	151 Å²	151	72.6 Å²	72.6	66%	0.657	36%	0.363	S	S	*	.	H	α-helix	trans	-58.4	-42	175.3	-72.8	174.1	-176.9	172.8	0	112.8	D576 H583 A584	D576-K580 WeakPolarHBondContact O-CG 3.45Å; D576-K580 PolarHBondContact O-N 3.49Å; K580-H583 PolarHBondContact O-N 3.02Å; K580-A584 WeakPolarHBondContact O-CB 3.37Å; K580-A584 PolarHBondContact O-N 3.13Å
581	A	89.3	Confident	88.2	Confident	27 Å²	27	77.6 Å²	77.6	22%	0.223	39%	0.385	C	S	.	.	H	α-helix	trans	-70.1	-36.5	178.7	0	0	0	0	0	112.6	L569 I572 E577 K578 E579 A584 F585	L569-A581 HydrophobicContact CD2-CB 4.08Å; I572-A581 HydrophobicContact CD1-CB 3.18Å; E577-A581 WeakPolarHBondContact O-CB 3.46Å; E577-A581 PolarHBondContact O-N 3.48Å; K578-A581 PolarHBondContact O-N 3.35Å; E579-A581 VanDerWaalsContact C-N 3.32Å; E579-A581 PolarHBondContact O-N 3.15Å; A581-A584 PolarHBondContact O-N 3Å; A581-F585 WeakPolarHBondContact O-CB 3.4Å; A581-F585 PolarHBondContact O-N 3.44Å
582	V	90.1	Very high	88.5	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-63	-46.9	172.4	164.8	0	0	0	0	110.3	L569 K578 E579 A584 F585 L586 A678 L679 T682	L569-V582 HydrophobicContact CD1-CG2 4.44Å; L569-V582 HydrophobicContact CD2-CG2 4.26Å; K578-V582 WeakPolarHBondContact O-CB 3.3Å; K578-V582 VanDerWaalsContact O-CG2 3.27Å; K578-V582 WeakPolarHBondContact O-CG2 3.21Å; K578-V582 PolarHBondContact O-N 3.35Å; E579-V582 PolarHBondContact O-N 2.98Å; V582-A584 PolarHBondContact O-N 3.03Å; V582-F585 PolarHBondContact O-N 3.07Å; V582-L586 HydrophobicContact CG1-CD1 3.89Å; V582-L586 HydrophobicContact CG1-CG 4.37Å; V582-L586 VanDerWaalsContact O-CG 3.29Å; V582-L586 WeakPolarHBondContact O-CG 3.4Å; V582-L586 PolarHBondContact O-N 2.74Å; V582-A678 HydrophobicContact CG2-CB 4.26Å; V582-L679 HydrophobicContact CG1-CD2 3.84Å; V582-L679 HydrophobicContact CG2-CD2 4.28Å; V582-T682 HydrophobicContact CG1-CG2 3.94Å
583	H	89.6	Confident	89	Confident	65 Å²	65	73.2 Å²	73.2	30%	0.301	36%	0.361	S	S	.	.	H	α-helix	trans	-61.4	-44.8	175.8	-76.8	-64.2	0	0	0	112.3	E579 K580 F585 L586 E587	E579-H583 PolarHBondContact O-CD2 3.09Å; E579-H583 PolarHBondContact O-N 3.41Å; E579-H583 IonicContact OE1-NE2 2.7Å; K580-H583 PolarHBondContact O-N 3.02Å; H583-F585 VanDerWaalsContact C-N 3.3Å; H583-F585 PolarHBondContact O-N 2.73Å; H583-L586 PolarHBondContact O-N 2.74Å; H583-L586 VanDerWaalsContact O-N 3.17Å; H583-E587 WeakPolarHBondContact O-CB 3.3Å; H583-E587 WeakPolarHBondContact O-CG 3.43Å; H583-E587 PolarHBondContact O-N 2.96Å
584	A	91.5	Very high	89.5	Confident	56 Å²	56	65 Å²	65	46%	0.463	33%	0.331	S	S	.	.	H	α-helix	trans	-61.2	-37.4	175.8	0	0	0	0	0	112.6	K580 A581 V582 S588	K580-A584 WeakPolarHBondContact O-CB 3.37Å; K580-A584 PolarHBondContact O-N 3.13Å; A581-A584 PolarHBondContact O-N 3Å; V582-A584 PolarHBondContact O-N 3.03Å; A584-S588 PolarHBondContact O-N 2.82Å
585	F	93.9	Very high	90	Very high	10 Å²	10	63.1 Å²	63.1	4%	0.044	32%	0.32	C	S	.	.	H	α-helix	trans	-67.8	-42	173.5	171.4	-98.7	0	0	0	112.1	I558 D565 F566 L569 A581 V582 H583 E587 S588 L589 L597 L679	I558-F585 HydrophobicContact CG2-CZ 4.24Å; D565-F585 HydrophobicContact CB-CD2 4.08Å; D565-F585 HydrophobicContact CB-CE2 4.25Å; F566-F585 HydrophobicContact CB-CE2 3.81Å; F566-F585 HydrophobicContact CB-CZ 3.81Å; F566-F585 HydrophobicContact CD2-CZ 4.37Å; L569-F585 HydrophobicContact CD1-CB 4.3Å; L569-F585 HydrophobicContact CD1-CD1 3.92Å; L569-F585 HydrophobicContact CD1-CE1 4.4Å; L569-F585 HydrophobicContact CD1-CG 3.99Å; L569-F585 HydrophobicContact CD2-CB 4.23Å; A581-F585 WeakPolarHBondContact O-CB 3.4Å; A581-F585 PolarHBondContact O-N 3.44Å; V582-F585 PolarHBondContact O-N 3.07Å; H583-F585 VanDerWaalsContact C-N 3.3Å; H583-F585 PolarHBondContact O-N 2.73Å; F585-E587 VanDerWaalsContact C-N 3.32Å; F585-E587 PolarHBondContact O-N 3.18Å; F585-S588 PolarHBondContact O-N 2.85Å; F585-S588 PolarHBondContact O-OG 2.81Å; F585-L589 HydrophobicContact CD1-CD1 4.45Å; F585-L589 HydrophobicContact CE1-CD1 3.85Å; F585-L589 HydrophobicContact CE1-CG 4.42Å; F585-L589 HydrophobicContact CE2-CD2 4.5Å; F585-L589 HydrophobicContact CZ-CD1 4.09Å; F585-L589 HydrophobicContact CZ-CD2 4.23Å; F585-L589 HydrophobicContact CZ-CG 4.33Å; F585-L589 PolarHBondContact O-N 2.84Å; F585-L597 HydrophobicContact CE1-CD2 4.48Å; F585-L679 HydrophobicContact CD1-CD2 3.84Å; F585-L679 HydrophobicContact CE1-CD1 4.3Å; F585-L679 HydrophobicContact CE1-CD2 4.08Å
586	L	91.4	Very high	90.7	Very high	8 Å²	8	57 Å²	57	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-65.2	-37.4	176.8	-69.4	169.6	0	0	0	111.7	V582 H583 S588 L589 R594 L597 F683	V582-L586 HydrophobicContact CG1-CD1 3.89Å; V582-L586 HydrophobicContact CG1-CG 4.37Å; V582-L586 VanDerWaalsContact O-CG 3.29Å; V582-L586 WeakPolarHBondContact O-CG 3.4Å; V582-L586 PolarHBondContact O-N 2.74Å; H583-L586 PolarHBondContact O-N 2.74Å; H583-L586 VanDerWaalsContact O-N 3.17Å; L586-S588 VanDerWaalsContact C-N 3.32Å; L586-L589 PolarHBondContact O-N 3.32Å; L586-R594 HydrophobicContact CB-CG 4.31Å; L586-R594 WeakPolarHBondContact O-CD 3.35Å; L586-R594 VanDerWaalsContact O-CG 3.28Å; L586-R594 WeakPolarHBondContact O-CG 3.24Å; L586-L597 HydrophobicContact CD2-CD2 3.93Å; L586-F683 HydrophobicContact CD1-CE1 3.99Å; L586-F683 HydrophobicContact CD1-CE2 4.26Å; L586-F683 HydrophobicContact CD1-CZ 3.41Å; L586-F683 VanDerWaalsContact CD1-CZ 3.41Å; L586-F683 HydrophobicContact CD2-CE2 4.45Å; L586-F683 HydrophobicContact CD2-CZ 3.88Å; L586-F683 HydrophobicContact CG-CZ 4.29Å
587	E	91.2	Very high	91.3	Very high	158 Å²	158	52.1 Å²	52.1	74%	0.738	26%	0.263	S	S	*	.	H	α-helix	trans	-69.3	-27	174.7	-74.3	-179.7	176.7	0	0	113.2	H583 F585 L589	H583-E587 WeakPolarHBondContact O-CB 3.3Å; H583-E587 WeakPolarHBondContact O-CG 3.43Å; H583-E587 PolarHBondContact O-N 2.96Å; F585-E587 VanDerWaalsContact C-N 3.32Å; F585-E587 PolarHBondContact O-N 3.18Å; E587-L589 VanDerWaalsContact C-N 3.34Å
588	S	93	Very high	91.5	Very high	47 Å²	47	48.4 Å²	48.4	33%	0.329	25%	0.246	S	C	.	.	H	α-helix	trans	-76.9	-22.1	177.9	77.2	0	0	0	0	113.3	Y562 A584 F585 L586	Y562-S588 WeakPolarHBondContact CE1-O 3.5Å; Y562-S588 VanDerWaalsContact CZ-O 3.29Å; Y562-S588 PolarHBondContact OH-O 2.9Å; A584-S588 PolarHBondContact O-N 2.82Å; F585-S588 PolarHBondContact O-N 2.85Å; F585-S588 PolarHBondContact O-OG 2.81Å; L586-S588 VanDerWaalsContact C-N 3.32Å
589	L	93.7	Very high	91.9	Very high	9 Å²	9	47.6 Å²	47.6	5%	0.047	24%	0.243	C	C	.	.	S	Bend	trans	-72.6	147.1	176.9	-68.3	175.7	0	0	0	111.9	Y562 F585 L586 E587 R594 L597	Y562-L589 HydrophobicContact CD1-CD2 4.11Å; Y562-L589 HydrophobicContact CD2-CD2 3.82Å; Y562-L589 HydrophobicContact CE2-CD2 4.3Å; Y562-L589 HydrophobicContact CG-CD2 3.72Å; F585-L589 HydrophobicContact CD1-CD1 4.45Å; F585-L589 HydrophobicContact CE1-CD1 3.85Å; F585-L589 HydrophobicContact CE1-CG 4.42Å; F585-L589 HydrophobicContact CE2-CD2 4.5Å; F585-L589 HydrophobicContact CZ-CD1 4.09Å; F585-L589 HydrophobicContact CZ-CD2 4.23Å; F585-L589 HydrophobicContact CZ-CG 4.33Å; F585-L589 PolarHBondContact O-N 2.84Å; L586-L589 PolarHBondContact O-N 3.32Å; E587-L589 VanDerWaalsContact C-N 3.34Å; L589-R594 HydrophobicContact CB-CB 4.22Å; L589-L597 HydrophobicContact CD1-CD2 3.86Å
590	P	93.8	Very high	92.3	Very high	49 Å²	49	43.3 Å²	43.3	32%	0.318	22%	0.223	S	C	.	.			trans	-55.2	146	170.2	-23.6	33.1	0	0	0	112.2	Y562 L592 H593 R594	Y562-P590 HydrophobicContact CE2-CG 4.49Å; P590-L592 VanDerWaalsContact C-N 3.35Å; P590-L592 PolarHBondContact O-N 3.32Å; P590-H593 HydrophobicContact CB-CB 4.4Å; P590-H593 WeakPolarHBondContact O-CB 3.48Å; P590-H593 PolarHBondContact O-N 3.1Å; P590-R594 PolarHBondContact O-N 3.42Å
591	E	91.5	Very high	92.5	Very high	111 Å²	111	36.1 Å²	36.1	52%	0.519	19%	0.192	S	C	.	.	H	α-helix	trans	-51.5	-48.9	-170.8	-174.6	-175.9	176.4	0	0	113.1	K466 H593 R594 L595	K466-E591 IonicContact NZ-OE1 2.86Å; E591-H593 PolarHBondContact O-N 3.11Å; E591-R594 WeakPolarHBondContact O-CB 3.38Å; E591-R594 PolarHBondContact O-N 2.74Å; E591-L595 HydrophobicContact CG-CD1 4.03Å; E591-L595 HydrophobicContact CG-CG 4.47Å; E591-L595 VanDerWaalsContact O-CG 3.3Å; E591-L595 WeakPolarHBondContact O-CG 3.33Å; E591-L595 PolarHBondContact O-N 3Å
592	L	93	Very high	92.6	Very high	35 Å²	35	38.6 Å²	38.6	18%	0.183	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-39.1	-179.2	-68.1	176.5	0	0	0	112.6	L456 E457 L461 P590 L595 C596	L456-L592 HydrophobicContact CD2-CB 4.17Å; L456-L592 HydrophobicContact CG-CB 4.45Å; E457-L592 HydrophobicContact CB-CD1 4.27Å; E457-L592 HydrophobicContact CG-CD1 4.21Å; L461-L592 HydrophobicContact CD1-CD2 3.75Å; L461-L592 HydrophobicContact CD2-CD2 4.25Å; P590-L592 VanDerWaalsContact C-N 3.35Å; P590-L592 PolarHBondContact O-N 3.32Å; L592-L595 PolarHBondContact O-N 2.96Å; L592-C596 WeakPolarHBondContact O-CB 3.45Å; L592-C596 PolarHBondContact O-N 3.33Å; L592-C596 PolarHBondContact O-SG 3.36Å
593	H	94.5	Very high	92.7	Very high	3 Å²	3	38.7 Å²	38.7	1%	0.014	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-44.7	176.7	-77.1	-95.4	0	0	0	111.1	L456 E457 N556 V557 P590 E591 C596 L597	L456-H593 HydrophobicContact CD2-CB 4.47Å; E457-H593 IonicContact OE1-CD2 3.78Å; E457-H593 IonicContact OE1-NE2 3.62Å; E457-H593 PolarHBondContact OE1-NE2 3.41Å; N556-H593 PolarHBondContact O-CE1 3.36Å; N556-H593 VanDerWaalsContact O-CE1 3.29Å; N556-H593 PolarHBondContact O-ND1 3.07Å; V557-H593 WeakPolarHBondContact O-CB 3.49Å; V557-H593 PolarHBondContact O-ND1 2.97Å; P590-H593 HydrophobicContact CB-CB 4.4Å; P590-H593 WeakPolarHBondContact O-CB 3.48Å; P590-H593 PolarHBondContact O-N 3.1Å; E591-H593 PolarHBondContact O-N 3.11Å; H593-C596 PolarHBondContact O-N 3.34Å; H593-L597 VanDerWaalsContact O-CB 3.32Å; H593-L597 WeakPolarHBondContact O-CB 3.39Å; H593-L597 PolarHBondContact O-N 2.9Å
594	R	93.6	Very high	92.8	Very high	74 Å²	74	35.6 Å²	35.6	28%	0.279	19%	0.188	S	C	.	.	H	α-helix	trans	-58.4	-51.2	174.3	-175.6	-170.3	66.3	80.5	1.8	111.3	L586 L589 P590 E591 C596 L597 I598	L586-R594 HydrophobicContact CB-CG 4.31Å; L586-R594 WeakPolarHBondContact O-CD 3.35Å; L586-R594 VanDerWaalsContact O-CG 3.28Å; L586-R594 WeakPolarHBondContact O-CG 3.24Å; L589-R594 HydrophobicContact CB-CB 4.22Å; P590-R594 PolarHBondContact O-N 3.42Å; E591-R594 WeakPolarHBondContact O-CB 3.38Å; E591-R594 PolarHBondContact O-N 2.74Å; R594-C596 PolarHBondContact O-N 2.87Å; R594-L597 PolarHBondContact O-N 3.39Å; R594-I598 HydrophobicContact CG-CD1 3.97Å; R594-I598 VanDerWaalsContact NH1-CD1 3.31Å; R594-I598 VanDerWaalsContact O-CG1 3.22Å; R594-I598 WeakPolarHBondContact O-CG1 3.42Å; R594-I598 PolarHBondContact O-N 2.85Å
595	L	93	Very high	92.6	Very high	31 Å²	31	33.4 Å²	33.4	16%	0.162	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-42	-179.8	-70.6	175	0	0	0	112.5	K466 V467 E591 L592 I598 H599	K466-L595 HydrophobicContact CB-CD1 4Å; K466-L595 HydrophobicContact CD-CD1 4.43Å; V467-L595 HydrophobicContact CG2-CB 4.25Å; E591-L595 HydrophobicContact CG-CD1 4.03Å; E591-L595 HydrophobicContact CG-CG 4.47Å; E591-L595 VanDerWaalsContact O-CG 3.3Å; E591-L595 WeakPolarHBondContact O-CG 3.33Å; E591-L595 PolarHBondContact O-N 3Å; L592-L595 PolarHBondContact O-N 2.96Å; L595-I598 PolarHBondContact O-N 3.09Å; L595-H599 WeakPolarHBondContact O-CB 3.27Å; L595-H599 PolarHBondContact O-N 3.28Å
596	C	94.2	Very high	92.5	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.007	18%	0.178	C	C	.	.	H	α-helix	trans	-64.9	-40.5	176.2	-69	0	0	0	0	112	L456 P468 V557 L592 H593 R594 H599 I600	L456-C596 HydrophobicContact CD2-CB 4.29Å; P468-C596 WeakPolarHBondContact CD-SG 3.35Å; V557-C596 HydrophobicContact CG1-CB 4.13Å; L592-C596 WeakPolarHBondContact O-CB 3.45Å; L592-C596 PolarHBondContact O-N 3.33Å; L592-C596 PolarHBondContact O-SG 3.36Å; H593-C596 PolarHBondContact O-N 3.34Å; R594-C596 PolarHBondContact O-N 2.87Å; C596-H599 PolarHBondContact O-N 3.48Å; C596-I600 WeakPolarHBondContact O-CD1 3.46Å; C596-I600 VanDerWaalsContact O-CG1 3.23Å; C596-I600 WeakPolarHBondContact O-CG1 3.29Å; C596-I600 PolarHBondContact O-N 3.25Å
597	L	93.8	Very high	92.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.7	-45.4	177.2	-170.6	61.3	0	0	0	111.2	V557 I558 F585 L586 L589 H593 R594 I600 F601 L654	V557-L597 HydrophobicContact CG1-CB 3.92Å; V557-L597 HydrophobicContact CG1-CD1 4.08Å; I558-L597 HydrophobicContact CD1-CD1 4.35Å; I558-L597 HydrophobicContact CG1-CD1 4.12Å; I558-L597 HydrophobicContact CG1-CD2 4.26Å; F585-L597 HydrophobicContact CE1-CD2 4.48Å; L586-L597 HydrophobicContact CD2-CD2 3.93Å; L589-L597 HydrophobicContact CD1-CD2 3.86Å; H593-L597 VanDerWaalsContact O-CB 3.32Å; H593-L597 WeakPolarHBondContact O-CB 3.39Å; H593-L597 PolarHBondContact O-N 2.9Å; R594-L597 PolarHBondContact O-N 3.39Å; L597-I600 PolarHBondContact O-N 3.39Å; L597-F601 HydrophobicContact CD1-CD2 3.89Å; L597-F601 HydrophobicContact CD1-CE2 3.42Å; L597-F601 VanDerWaalsContact CD1-CE2 3.42Å; L597-F601 HydrophobicContact CD1-CZ 4.39Å; L597-F601 HydrophobicContact CD2-CE2 4.28Å; L597-F601 HydrophobicContact CG-CD2 3.83Å; L597-F601 HydrophobicContact CG-CE2 3.65Å; L597-F601 VanDerWaalsContact O-CD2 3.23Å; L597-F601 WeakPolarHBondContact O-CD2 3.5Å; L597-F601 PolarHBondContact O-N 3.49Å; L597-L654 HydrophobicContact CD1-CD1 4.28Å
598	I	92	Very high	92.1	Very high	35 Å²	35	28.4 Å²	28.4	18%	0.179	15%	0.147	C	C	.	.	H	α-helix	trans	-58.6	-48.2	175.3	-66.7	167.4	0	0	0	110.5	R594 L595 I600 F601 N602 F683	R594-I598 HydrophobicContact CG-CD1 3.97Å; R594-I598 VanDerWaalsContact NH1-CD1 3.31Å; R594-I598 VanDerWaalsContact O-CG1 3.22Å; R594-I598 WeakPolarHBondContact O-CG1 3.42Å; R594-I598 PolarHBondContact O-N 2.85Å; L595-I598 PolarHBondContact O-N 3.09Å; I598-I600 VanDerWaalsContact C-N 3.33Å; I598-I600 PolarHBondContact O-N 2.52Å; I598-F601 PolarHBondContact O-N 2.88Å; I598-N602 WeakPolarHBondContact O-CB 3.38Å; I598-N602 VanDerWaalsContact O-CG 3.27Å; I598-N602 PolarHBondContact O-N 2.93Å; I598-F683 HydrophobicContact CB-CE1 4.31Å; I598-F683 HydrophobicContact CD1-CE1 4.48Å; I598-F683 HydrophobicContact CG1-CE1 3.62Å; I598-F683 HydrophobicContact CG1-CZ 3.72Å; I598-F683 HydrophobicContact CG2-CE1 4.26Å
599	H	93.8	Very high	91.9	Very high	37 Å²	37	30 Å²	30	17%	0.171	15%	0.152	C	C	.	.	H	α-helix	trans	-57.5	-44.5	178.5	-176.1	81.7	0	0	0	112.5	V467 T475 L595 C596 N602 H603	V467-H599 HydrophobicContact CG1-CB 4.2Å; V467-H599 HydrophobicContact CG2-CB 4.04Å; T475-H599 PolarHBondContact OG1-NE2 2.95Å; L595-H599 WeakPolarHBondContact O-CB 3.27Å; L595-H599 PolarHBondContact O-N 3.28Å; C596-H599 PolarHBondContact O-N 3.48Å; H599-N602 PolarHBondContact O-N 2.93Å; H599-H603 PolarHBondContact O-N 3.41Å
600	I	93.6	Very high	91.6	Very high	2 Å²	2	30 Å²	30	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-64.1	-44.3	178.2	-66.9	163.2	0	0	0	110.8	L471 L550 V557 C596 L597 I598 H603 L604 F650 L654	L471-I600 HydrophobicContact CD2-CD1 4.38Å; L471-I600 HydrophobicContact CD2-CG1 4.12Å; L550-I600 HydrophobicContact CD1-CD1 3.89Å; L550-I600 HydrophobicContact CD1-CG1 4.33Å; L550-I600 HydrophobicContact CD2-CD1 3.72Å; L550-I600 HydrophobicContact CG-CD1 4.48Å; V557-I600 HydrophobicContact CG1-CD1 4.24Å; V557-I600 HydrophobicContact CG2-CD1 4.01Å; C596-I600 WeakPolarHBondContact O-CD1 3.46Å; C596-I600 VanDerWaalsContact O-CG1 3.23Å; C596-I600 WeakPolarHBondContact O-CG1 3.29Å; C596-I600 PolarHBondContact O-N 3.25Å; L597-I600 PolarHBondContact O-N 3.39Å; I598-I600 VanDerWaalsContact C-N 3.33Å; I598-I600 PolarHBondContact O-N 2.52Å; I600-H603 WeakPolarHBondContact O-CB 3.49Å; I600-H603 PolarHBondContact O-N 2.83Å; I600-L604 HydrophobicContact CG2-CD1 4.4Å; I600-L604 WeakPolarHBondContact O-CG 3.47Å; I600-L604 PolarHBondContact O-N 3.02Å; I600-F650 HydrophobicContact CG2-CD1 3.88Å; I600-F650 HydrophobicContact CG2-CE1 3.65Å; I600-L654 HydrophobicContact CD1-CD2 3.9Å; I600-L654 HydrophobicContact CG2-CD1 4.37Å
601	F	92	Very high	91.3	Very high	1 Å²	1	27.7 Å²	27.7	0%	0.004	14%	0.136	C	C	.	.	H	α-helix	trans	-68.8	-34.7	178.8	-79.6	-63.9	0	0	0	113	L597 I598 H603 L604 G605 L647 L676 L679 F680 F683	L597-F601 HydrophobicContact CD1-CD2 3.89Å; L597-F601 HydrophobicContact CD1-CE2 3.42Å; L597-F601 VanDerWaalsContact CD1-CE2 3.42Å; L597-F601 HydrophobicContact CD1-CZ 4.39Å; L597-F601 HydrophobicContact CD2-CE2 4.28Å; L597-F601 HydrophobicContact CG-CD2 3.83Å; L597-F601 HydrophobicContact CG-CE2 3.65Å; L597-F601 VanDerWaalsContact O-CD2 3.23Å; L597-F601 WeakPolarHBondContact O-CD2 3.5Å; L597-F601 PolarHBondContact O-N 3.49Å; I598-F601 PolarHBondContact O-N 2.88Å; F601-H603 VanDerWaalsContact C-N 3.35Å; F601-L604 HydrophobicContact CD1-CD1 4.05Å; F601-L604 HydrophobicContact CE1-CD1 4.38Å; F601-L604 CarbonylContact O-C 3.56Å; F601-L604 PolarHBondContact O-N 3.49Å; F601-G605 PolarHBondContact O-N 2.96Å; F601-L647 HydrophobicContact CE1-CD2 4.23Å; F601-L676 HydrophobicContact CZ-CD2 4.08Å; F601-L679 HydrophobicContact CE1-CB 4.37Å; F601-L679 HydrophobicContact CE2-CB 3.8Å; F601-L679 HydrophobicContact CE2-CD1 4.02Å; F601-L679 HydrophobicContact CZ-CB 3.64Å; F601-L679 HydrophobicContact CZ-CD1 4.03Å; F601-F680 HydrophobicContact CD1-CB 4.06Å; F601-F680 AromaticContact CD1-CD2 3.75Å; F601-F680 HydrophobicContact CD1-CD2 3.75Å; F601-F680 HydrophobicContact CD1-CG 4.38Å; F601-F680 HydrophobicContact CE1-CB 3.95Å; F601-F680 HydrophobicContact CE1-CD2 4.38Å; F601-F683 HydrophobicContact CB-CB 4.2Å; F601-F683 HydrophobicContact CB-CD2 3.51Å; F601-F683 HydrophobicContact CB-CE2 4.12Å; F601-F683 HydrophobicContact CB-CG 3.97Å; F601-F683 HydrophobicContact CD1-CD2 4.49Å; F601-F683 AromaticContact CD2-CD2 3.72Å; F601-F683 HydrophobicContact CD2-CD2 3.72Å; F601-F683 AromaticContact CD2-CE2 3.56Å; F601-F683 HydrophobicContact CD2-CE2 3.56Å; F601-F683 HydrophobicContact CE2-CE2 4.21Å; F601-F683 AromaticContact CG-CD2 3.68Å; F601-F683 HydrophobicContact CG-CD2 3.68Å; F601-F683 HydrophobicContact CG-CE2 4.04Å
602	N	91.2	Very high	91	Very high	78 Å²	78	25.4 Å²	25.4	42%	0.417	13%	0.128	S	C	.	.	H	α-helix	trans	-61.2	-44.1	171.4	-71.9	-13.5	0	0	0	111.3	I598 H599 L604 G605 F606	I598-N602 WeakPolarHBondContact O-CB 3.38Å; I598-N602 VanDerWaalsContact O-CG 3.27Å; I598-N602 PolarHBondContact O-N 2.93Å; H599-N602 PolarHBondContact O-N 2.93Å; N602-L604 VanDerWaalsContact C-N 3.34Å; N602-L604 PolarHBondContact O-N 2.86Å; N602-G605 WeakPolarHBondContact O-CA 3.39Å; N602-G605 PolarHBondContact O-N 2.63Å; N602-G605 VanDerWaalsContact O-N 3.1Å; N602-F606 PolarHBondContact O-N 3.42Å
603	H	92.9	Very high	90.7	Very high	3 Å²	3	29 Å²	29	1%	0.014	14%	0.142	C	C	.	.	H	α-helix	trans	-61.3	-41.2	173.1	-179.4	70.1	0	0	0	112	T475 E479 Y504 H599 I600 F601 G605 F606 V607	T475-H603 HydrophobicContact CG2-CB 4.05Å; E479-H603 IonicContact OE1-CE1 3.65Å; E479-H603 IonicContact OE1-CG 3.21Å; E479-H603 IonicContact OE1-ND1 2.86Å; E479-H603 PolarHBondContact OE1-ND1 2.92Å; Y504-H603 AromaticContact CE2-NE2 3.84Å; Y504-H603 AromaticContact CZ-NE2 3.6Å; Y504-H603 PolarHBondContact OH-CD2 2.86Å; Y504-H603 VanDerWaalsContact OH-CD2 3.3Å; Y504-H603 PolarHBondContact OH-NE2 2.92Å; H599-H603 PolarHBondContact O-N 3.41Å; I600-H603 WeakPolarHBondContact O-CB 3.49Å; I600-H603 PolarHBondContact O-N 2.83Å; F601-H603 VanDerWaalsContact C-N 3.35Å; H603-G605 VanDerWaalsContact C-N 3.27Å; H603-G605 PolarHBondContact O-N 3.38Å; H603-F606 WeakPolarHBondContact O-CB 3.26Å; H603-F606 PolarHBondContact O-N 2.91Å; H603-V607 WeakPolarHBondContact O-CG2 3.37Å; H603-V607 PolarHBondContact O-N 3.09Å
604	L	90.6	Very high	90.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.8	-31.4	173.9	-68.4	-179.8	0	0	0	112.7	I600 F601 N602 V607 L608 W646 L647 F650 F680	I600-L604 HydrophobicContact CG2-CD1 4.4Å; I600-L604 WeakPolarHBondContact O-CG 3.47Å; I600-L604 PolarHBondContact O-N 3.02Å; F601-L604 HydrophobicContact CD1-CD1 4.05Å; F601-L604 HydrophobicContact CE1-CD1 4.38Å; F601-L604 CarbonylContact O-C 3.56Å; F601-L604 PolarHBondContact O-N 3.49Å; N602-L604 VanDerWaalsContact C-N 3.34Å; N602-L604 PolarHBondContact O-N 2.86Å; L604-V607 PolarHBondContact O-N 3.3Å; L604-L608 PolarHBondContact O-N 3.5Å; L604-W646 HydrophobicContact CD2-CB 4.49Å; L604-L647 HydrophobicContact CD1-CD2 4.27Å; L604-F650 HydrophobicContact CD1-CD1 4.45Å; L604-F650 HydrophobicContact CD1-CD2 4.25Å; L604-F650 HydrophobicContact CD1-CG 4.17Å; L604-F650 HydrophobicContact CD2-CD2 3.86Å; L604-F650 HydrophobicContact CD2-CE2 3.53Å; L604-F650 HydrophobicContact CD2-CZ 3.92Å; L604-F650 HydrophobicContact CG-CE2 4.5Å; L604-F680 HydrophobicContact CB-CD2 4.38Å; L604-F680 HydrophobicContact CB-CE2 3.83Å
605	G	87.8	Confident	89.5	Confident	9 Å²	9	27.9 Å²	27.9	9%	0.093	14%	0.139	C	C	.	.	H	α-helix	trans	-63.4	-45.7	170.1	0	0	0	0	0	111.6	F601 N602 H603 V607 L608 N609	F601-G605 PolarHBondContact O-N 2.96Å; N602-G605 WeakPolarHBondContact O-CA 3.39Å; N602-G605 PolarHBondContact O-N 2.63Å; N602-G605 VanDerWaalsContact O-N 3.1Å; H603-G605 VanDerWaalsContact C-N 3.27Å; H603-G605 PolarHBondContact O-N 3.38Å; G605-V607 VanDerWaalsContact C-N 3.32Å; G605-V607 PolarHBondContact O-N 3.29Å; G605-L608 PolarHBondContact O-N 2.84Å; G605-N609 PolarHBondContact O-N 3.39Å
606	F	91.2	Very high	88.9	Confident	48 Å²	48	28.9 Å²	28.9	21%	0.211	15%	0.149	C	C	.	.	H	α-helix	trans	-55.8	-46.3	170.6	171	-85	0	0	0	111.6	E479 A482 N602 H603 L608 N609 H610	E479-F606 HydrophobicContact CB-CD1 4.46Å; E479-F606 HydrophobicContact CB-CE1 4.08Å; E479-F606 HydrophobicContact CB-CE2 4.14Å; E479-F606 HydrophobicContact CB-CZ 3.9Å; E479-F606 HydrophobicContact CG-CD1 3.64Å; E479-F606 HydrophobicContact CG-CD2 4.09Å; E479-F606 HydrophobicContact CG-CE1 3.72Å; E479-F606 HydrophobicContact CG-CE2 4.15Å; E479-F606 HydrophobicContact CG-CG 3.83Å; E479-F606 HydrophobicContact CG-CZ 3.98Å; A482-F606 HydrophobicContact CB-CE1 3.94Å; A482-F606 HydrophobicContact CB-CZ 4.05Å; N602-F606 PolarHBondContact O-N 3.42Å; H603-F606 WeakPolarHBondContact O-CB 3.26Å; H603-F606 PolarHBondContact O-N 2.91Å; F606-L608 PolarHBondContact O-N 3.32Å; F606-N609 PolarHBondContact O-N 3.42Å; F606-H610 HydrophobicContact CE1-CB 4.3Å; F606-H610 WeakPolarHBondContact O-CB 3.44Å; F606-H610 PolarHBondContact O-N 2.97Å
607	V	89.3	Confident	88.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.8	-44.5	178.8	171.9	0	0	0	0	111.4	M500 Y504 H603 L604 G605 H610 Q611	M500-V607 HydrophobicContact CB-CG1 3.9Å; M500-V607 HydrophobicContact CE-CG2 3.79Å; Y504-V607 HydrophobicContact CD2-CG2 4.37Å; Y504-V607 HydrophobicContact CE2-CG2 3.74Å; H603-V607 WeakPolarHBondContact O-CG2 3.37Å; H603-V607 PolarHBondContact O-N 3.09Å; L604-V607 PolarHBondContact O-N 3.3Å; G605-V607 VanDerWaalsContact C-N 3.32Å; G605-V607 PolarHBondContact O-N 3.29Å; V607-H610 PolarHBondContact O-N 3.15Å; V607-Q611 VanDerWaalsContact O-CG 3.25Å; V607-Q611 WeakPolarHBondContact O-CG 3.42Å; V607-Q611 PolarHBondContact O-N 3.47Å
608	L	86.5	Confident	87.6	Confident	23 Å²	23	35.1 Å²	35.1	12%	0.12	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-46	176.3	174.5	64.2	0	0	0	111.4	L604 G605 F606 H610 Q611 N612 W646 F680	L604-L608 PolarHBondContact O-N 3.5Å; G605-L608 PolarHBondContact O-N 2.84Å; F606-L608 PolarHBondContact O-N 3.32Å; L608-H610 PolarHBondContact O-N 2.74Å; L608-Q611 PolarHBondContact O-N 3.03Å; L608-N612 PolarHBondContact O-N 2.7Å; L608-N612 PolarHBondContact O-ND2 3.01Å; L608-W646 HydrophobicContact CB-CZ2 4.27Å; L608-W646 HydrophobicContact CD1-CH2 4.38Å; L608-W646 HydrophobicContact CD1-CZ2 3.87Å; L608-F680 HydrophobicContact CB-CZ 4.25Å; L608-F680 HydrophobicContact CD2-CE1 3.87Å; L608-F680 HydrophobicContact CD2-CZ 3.85Å
609	N	87.6	Confident	86.9	Confident	82 Å²	82	36.2 Å²	36.2	44%	0.439	19%	0.188	S	C	.	.	H	α-helix	trans	-63.8	-40.3	178.1	-73.1	-19.9	0	0	0	112.2	G605 F606 N612 K613	G605-N609 PolarHBondContact O-N 3.39Å; F606-N609 PolarHBondContact O-N 3.42Å; N609-N612 PolarHBondContact O-N 3.25Å; N609-K613 WeakPolarHBondContact O-CB 3.49Å; N609-K613 PolarHBondContact O-N 2.8Å
610	H	88.6	Confident	85.6	Confident	9 Å²	9	39.5 Å²	39.5	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-60.2	-45.8	174	-176.4	-69.8	0	0	0	111.5	A482 F486 V498 M500 F606 V607 L608 N612 K613 L614	A482-H610 PolarHBondContact O-NE2 2.91Å; F486-H610 AromaticContact CD2-NE2 3.69Å; F486-H610 AromaticContact CE2-CD2 3.63Å; F486-H610 AromaticContact CE2-CE1 3.47Å; F486-H610 VanDerWaalsContact CE2-CE1 3.47Å; F486-H610 WeakPolarHBondContact CE2-CE1 3.14Å; F486-H610 AromaticContact CE2-NE2 3.23Å; F486-H610 WeakPolarHBondContact CE2-NE2 3.48Å; V498-H610 PolarHBondContact O-CE1 3.23Å; M500-H610 HydrophobicContact CG-CB 4.49Å; F606-H610 HydrophobicContact CE1-CB 4.3Å; F606-H610 WeakPolarHBondContact O-CB 3.44Å; F606-H610 PolarHBondContact O-N 2.97Å; V607-H610 PolarHBondContact O-N 3.15Å; L608-H610 PolarHBondContact O-N 2.74Å; H610-N612 PolarHBondContact O-N 3.25Å; H610-K613 WeakPolarHBondContact O-CB 3.48Å; H610-K613 PolarHBondContact O-N 3.45Å; H610-L614 PolarHBondContact O-N 3.31Å
611	Q	86.5	Confident	83.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-40.2	176.8	-71.1	-66.9	-67.8	0	0	112.6	D499 M500 V607 L608 K613 L614 K615 W646	D499-Q611 PolarHBondContact OD1-NE2 3.4Å; D499-Q611 PolarHBondContact OD1-OE1 3.29Å; M500-Q611 HydrophobicContact CB-CG 4.45Å; V607-Q611 VanDerWaalsContact O-CG 3.25Å; V607-Q611 WeakPolarHBondContact O-CG 3.42Å; V607-Q611 PolarHBondContact O-N 3.47Å; L608-Q611 PolarHBondContact O-N 3.03Å; Q611-K613 VanDerWaalsContact C-N 3.35Å; Q611-L614 PolarHBondContact O-N 3.04Å; Q611-K615 PolarHBondContact O-N 3.12Å; Q611-W646 HydrophobicContact CG-CH2 4.35Å; Q611-W646 HydrophobicContact CG-CZ3 4.4Å
612	N	84.9	Confident	81.7	Confident	63 Å²	63	46.6 Å²	46.6	34%	0.337	26%	0.257	S	S	.	.	H	α-helix	trans	-62.2	-41.9	173.8	-72.2	-24.9	0	0	0	111.6	L608 N609 H610 K615 S616	L608-N612 PolarHBondContact O-N 2.7Å; L608-N612 PolarHBondContact O-ND2 3.01Å; N609-N612 PolarHBondContact O-N 3.25Å; H610-N612 PolarHBondContact O-N 3.25Å; N612-K615 WeakPolarHBondContact O-CB 3.15Å; N612-K615 PolarHBondContact O-N 3.18Å; N612-S616 PolarHBondContact O-N 3.08Å
613	K	86.2	Confident	79.3	Confident	110 Å²	110	47.4 Å²	47.4	48%	0.478	27%	0.268	S	S	.	.	H	α-helix	trans	-65.6	-37.1	174.5	-173.2	178.5	178.6	176.1	0	112.5	F486 N609 H610 Q611 K615 S616 Y617	F486-K613 HydrophobicContact CD2-CD 4.17Å; F486-K613 HydrophobicContact CE1-CD 4.27Å; F486-K613 HydrophobicContact CE1-CG 3.92Å; F486-K613 HydrophobicContact CE2-CB 4.36Å; F486-K613 HydrophobicContact CE2-CD 3.87Å; F486-K613 HydrophobicContact CE2-CG 4.11Å; F486-K613 HydrophobicContact CG-CD 4.47Å; F486-K613 HydrophobicContact CZ-CB 3.95Å; F486-K613 HydrophobicContact CZ-CD 3.95Å; F486-K613 HydrophobicContact CZ-CG 3.68Å; N609-K613 WeakPolarHBondContact O-CB 3.49Å; N609-K613 PolarHBondContact O-N 2.8Å; H610-K613 WeakPolarHBondContact O-CB 3.48Å; H610-K613 PolarHBondContact O-N 3.45Å; Q611-K613 VanDerWaalsContact C-N 3.35Å; K613-K615 VanDerWaalsContact C-N 3.33Å; K613-S616 PolarHBondContact O-N 3.31Å; K613-S616 PolarHBondContact O-OG 3.26Å; K613-Y617 WeakPolarHBondContact O-CB 3.41Å; K613-Y617 PolarHBondContact O-N 2.82Å
614	L	84.1	Confident	76.7	Confident	6 Å²	6	52.8 Å²	52.8	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-41.8	175	176.9	61.1	0	0	0	110.3	F486 P497 D499 H610 Q611 Y617 L618	F486-L614 HydrophobicContact CZ-CB 4.05Å; P497-L614 HydrophobicContact CB-CD1 4.02Å; P497-L614 HydrophobicContact CG-CD1 4.02Å; D499-L614 HydrophobicContact CB-CD2 4.17Å; H610-L614 PolarHBondContact O-N 3.31Å; Q611-L614 PolarHBondContact O-N 3.04Å; L614-Y617 PolarHBondContact O-N 3.26Å; L614-L618 HydrophobicContact CD1-CD1 4.12Å; L614-L618 HydrophobicContact CD1-CG 4.14Å; L614-L618 HydrophobicContact CG-CD1 4.05Å; L614-L618 HydrophobicContact CG-CG 4.46Å; L614-L618 WeakPolarHBondContact O-CB 3.43Å; L614-L618 VanDerWaalsContact O-CG 3.28Å; L614-L618 WeakPolarHBondContact O-CG 3.42Å; L614-L618 PolarHBondContact O-N 2.92Å
615	K	80.6	Confident	73.8	Confident	47 Å²	47	58.9 Å²	58.9	20%	0.204	33%	0.334	C	S	.	.	H	α-helix	trans	-60.4	-48	175.9	-175.8	-179.4	-179.3	178.6	0	111.9	Q611 N612 K613 L618 S619 I637 N641	Q611-K615 PolarHBondContact O-N 3.12Å; N612-K615 WeakPolarHBondContact O-CB 3.15Å; N612-K615 PolarHBondContact O-N 3.18Å; K613-K615 VanDerWaalsContact C-N 3.33Å; K615-L618 PolarHBondContact O-N 3.09Å; K615-S619 PolarHBondContact O-N 3.08Å; K615-S619 PolarHBondContact O-OG 2.94Å; K615-I637 HydrophobicContact CD-CG2 4.38Å; K615-I637 HydrophobicContact CG-CG2 4.18Å; K615-N641 VanDerWaalsContact CD-OD1 3.26Å; K615-N641 WeakPolarHBondContact CD-OD1 3.37Å; K615-N641 PolarHBondContact NZ-ND2 3.19Å; K615-N641 PolarHBondContact NZ-OD1 2.83Å
616	S	80.5	Confident	71.2	Confident	53 Å²	53	66.6 Å²	66.6	37%	0.371	37%	0.372	S	S	.	.	H	α-helix	trans	-62	-43.3	177.1	67.4	0	0	0	0	111.6	N612 K613 L618 S619 D620	N612-S616 PolarHBondContact O-N 3.08Å; K613-S616 PolarHBondContact O-N 3.31Å; K613-S616 PolarHBondContact O-OG 3.26Å; S616-L618 VanDerWaalsContact C-N 3.34Å; S616-L618 PolarHBondContact O-N 3.5Å; S616-S619 WeakPolarHBondContact CA-OG 3.37Å; S616-S619 PolarHBondContact O-N 3.23Å; S616-S619 PolarHBondContact O-OG 3.33Å; S616-D620 WeakPolarHBondContact O-CB 3.37Å; S616-D620 PolarHBondContact O-N 3.01Å
617	Y	80.8	Confident	68.2	Low	72 Å²	72	72.4 Å²	72.4	28%	0.282	41%	0.405	S	S	.	.	H	α-helix	trans	-58.6	-43.6	175.7	-175.9	-92	0	0	0	112.3	F486 P497 K613 L614 S621	F486-Y617 HydrophobicContact CE1-CG 4.32Å; P497-Y617 HydrophobicContact CG-CD1 3.99Å; P497-Y617 HydrophobicContact CG-CE1 4.01Å; P497-Y617 HydrophobicContact CG-CG 4.46Å; K613-Y617 WeakPolarHBondContact O-CB 3.41Å; K613-Y617 PolarHBondContact O-N 2.82Å; L614-Y617 PolarHBondContact O-N 3.26Å; Y617-S621 WeakPolarHBondContact O-CB 3.39Å; Y617-S621 PolarHBondContact O-N 2.84Å; Y617-S621 VanDerWaalsContact O-N 3.1Å; Y617-S621 PolarHBondContact O-OG 2.7Å
618	L	78.9	Confident	65.3	Low	60 Å²	60	82.9 Å²	82.9	31%	0.314	45%	0.445	S	S	.	.	H	α-helix	trans	-69.9	-39.4	178	-69.4	174.3	0	0	0	112.2	L614 K615 S616 S621 S622	L614-L618 HydrophobicContact CD1-CD1 4.12Å; L614-L618 HydrophobicContact CD1-CG 4.14Å; L614-L618 HydrophobicContact CG-CD1 4.05Å; L614-L618 HydrophobicContact CG-CG 4.46Å; L614-L618 WeakPolarHBondContact O-CB 3.43Å; L614-L618 VanDerWaalsContact O-CG 3.28Å; L614-L618 WeakPolarHBondContact O-CG 3.42Å; L614-L618 PolarHBondContact O-N 2.92Å; K615-L618 PolarHBondContact O-N 3.09Å; S616-L618 VanDerWaalsContact C-N 3.34Å; S616-L618 PolarHBondContact O-N 3.5Å; L618-S621 PolarHBondContact O-OG 3.22Å; L618-S622 PolarHBondContact O-N 2.73Å
619	S	76.4	Confident	62.4	Low	58 Å²	58	87.6 Å²	87.6	41%	0.406	48%	0.48	S	S	.	.	H	α-helix	trans	-64.7	-43.2	175.4	53.4	0	0	0	0	111.9	K615 S616 S621 S622	K615-S619 PolarHBondContact O-N 3.08Å; K615-S619 PolarHBondContact O-OG 2.94Å; S616-S619 WeakPolarHBondContact CA-OG 3.37Å; S616-S619 PolarHBondContact O-N 3.23Å; S616-S619 PolarHBondContact O-OG 3.33Å; S619-S621 PolarHBondContact O-N 3.19Å; S619-S622 PolarHBondContact O-N 3.05Å; S619-S622 PolarHBondContact O-OG 3.49Å
620	D	67.5	Low	59.6	Low	106 Å²	106	89.8 Å²	89.8	57%	0.567	49%	0.491	S	S	*	.	H	α-helix	trans	-66.5	-40	-179.1	-65	-14.3	0	0	0	111.1	S616 S622 S623	S616-D620 WeakPolarHBondContact O-CB 3.37Å; S616-D620 PolarHBondContact O-N 3.01Å; D620-S622 PolarHBondContact O-N 3.11Å; D620-S623 PolarHBondContact O-N 3.42Å; D620-S623 PolarHBondContact O-OG 3.44Å
621	S	56.6	Low	56.7	Low	58 Å²	58	95.3 Å²	95.3	41%	0.406	53%	0.531	S	S	.	.	H	α-helix	trans	-64.2	-25.1	178.6	72	0	0	0	0	114.5	Y617 L618 S619 S623	Y617-S621 WeakPolarHBondContact O-CB 3.39Å; Y617-S621 PolarHBondContact O-N 2.84Å; Y617-S621 VanDerWaalsContact O-N 3.1Å; Y617-S621 PolarHBondContact O-OG 2.7Å; L618-S621 PolarHBondContact O-OG 3.22Å; S619-S621 PolarHBondContact O-N 3.19Å; S621-S623 VanDerWaalsContact C-N 3.29Å; S621-S623 PolarHBondContact O-N 3.32Å
622	S	48	Very low	54.1	Low	94 Å²	94	102.8 Å²	102.8	66%	0.657	56%	0.564	S	S	*	*	H	α-helix	trans	-73.3	-19.1	179.5	72.3	0	0	0	0	113.5	L618 S619 D620	L618-S622 PolarHBondContact O-N 2.73Å; S619-S622 PolarHBondContact O-N 3.05Å; S619-S622 PolarHBondContact O-OG 3.49Å; D620-S622 PolarHBondContact O-N 3.11Å
623	S	39	Very low	51.5	Low	94 Å²	94	102.7 Å²	102.7	66%	0.657	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-18.4	-178.1	66.1	0	0	0	0	114.6	D620 S621	D620-S623 PolarHBondContact O-N 3.42Å; D620-S623 PolarHBondContact O-OG 3.44Å; S621-S623 VanDerWaalsContact C-N 3.29Å; S621-S623 PolarHBondContact O-N 3.32Å
624	V	39.5	Very low	48.8	Very low	116 Å²	116	105.3 Å²	105.3	70%	0.703	58%	0.582	S	S	*	*	S	Bend	trans	-107.9	-4.5	-172.5	-175.5	0	0	0	0	114.1
625	N	30.3	Very low	46.6	Very low	129 Å²	129	108.5 Å²	108.5	69%	0.69	61%	0.605	S	S	*	*			trans	-128.8	79.3	-178.7	-79.4	-53.5	0	0	0	113.7	N627	N625-N627 VanDerWaalsContact C-N 3.27Å; N625-N627 PolarHBondContact O-N 2.87Å
626	L	32.2	Very low	44.7	Very low	170 Å²	170	108.8 Å²	108.8	89%	0.89	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	83.7	160.5	-71.5	165.1	0	0	0	109.1
627	N	28.2	Very low	42.9	Very low	171 Å²	171	109.5 Å²	109.5	91%	0.914	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	173.7	38.5	154.7	-85.7	-23.5	0	0	0	113.6	N625	N625-N627 VanDerWaalsContact C-N 3.27Å; N625-N627 PolarHBondContact O-N 2.87Å
628	R	28.7	Very low	41	Very low	219 Å²	219	111.1 Å²	111.1	83%	0.826	63%	0.625	S	S	*	*			trans	-134.6	91.3	168	-156.7	179.5	-84	-151.2	-0.1	110.9	N630	R628-N630 PolarHBondContact O-N 2.85Å
629	S	25.4	Very low	39.5	Very low	123 Å²	123	112.8 Å²	112.8	86%	0.86	64%	0.638	S	S	*	*			trans	-69.6	72.9	167.5	42.9	0	0	0	0	110.7
630	N	29.4	Very low	38.1	Very low	127 Å²	127	111.7 Å²	111.7	68%	0.679	63%	0.627	S	S	*	*			trans	-116.8	104	153.5	-94.2	-9.9	0	0	0	106.6	R628 F632	R628-N630 PolarHBondContact O-N 2.85Å; N630-F632 VanDerWaalsContact C-N 3.27Å; N630-F632 PolarHBondContact O-N 3.09Å
631	S	27.2	Very low	37.3	Very low	125 Å²	125	110.5 Å²	110.5	87%	0.874	62%	0.621	S	S	*	*			trans	-63	86.2	171.8	54.3	0	0	0	0	109.7	S633	S631-S633 PolarHBondContact O-N 3.3Å
632	F	31.1	Very low	37.5	Very low	158 Å²	158	114.3 Å²	114.3	69%	0.693	63%	0.63	S	S	*	*			trans	-68.4	107.7	152.4	-97.1	-88.4	0	0	0	106.2	N630 E634	N630-F632 VanDerWaalsContact C-N 3.27Å; N630-F632 PolarHBondContact O-N 3.09Å; F632-E634 PolarHBondContact O-N 3.16Å
633	S	30.7	Very low	38.2	Very low	61 Å²	61	110.7 Å²	110.7	43%	0.427	61%	0.606	S	S	.	*			trans	-58.7	132.7	175.2	50.8	0	0	0	0	109.4	S631 S635 S636	S631-S633 PolarHBondContact O-N 3.3Å; S633-S635 WeakPolarHBondContact CB-OG 3.4Å; S633-S635 PolarHBondContact O-N 3.45Å; S633-S635 PolarHBondContact OG-OG 2.82Å; S633-S636 PolarHBondContact O-N 2.9Å
634	E	31	Very low	39.6	Very low	164 Å²	164	108.7 Å²	108.7	77%	0.766	59%	0.59	S	S	*	*	H	α-helix	trans	-45.5	-24.3	173.2	-138	172.6	177.8	0	0	113.4	F632 S636 N638	F632-E634 PolarHBondContact O-N 3.16Å; E634-S636 PolarHBondContact O-N 2.97Å; E634-N638 PolarHBondContact O-N 3.08Å
635	S	37.6	Very low	41.2	Very low	73 Å²	73	104.8 Å²	104.8	51%	0.51	57%	0.567	S	S	.	*	H	α-helix	trans	-62.8	-32.5	172.3	58.6	0	0	0	0	114.6	S633 V639	S633-S635 WeakPolarHBondContact CB-OG 3.4Å; S633-S635 PolarHBondContact O-N 3.45Å; S633-S635 PolarHBondContact OG-OG 2.82Å; S635-V639 WeakPolarHBondContact O-CG2 3.49Å
636	S	39.7	Very low	43.4	Very low	53 Å²	53	98.8 Å²	98.8	37%	0.371	53%	0.534	S	S	.	.	H	α-helix	trans	-74.2	-36.1	-179.5	-59.4	0	0	0	0	111.6	S633 E634 N638 V639 L640	S633-S636 PolarHBondContact O-N 2.9Å; E634-S636 PolarHBondContact O-N 2.97Å; S636-N638 VanDerWaalsContact C-N 3.32Å; S636-N638 PolarHBondContact O-N 2.9Å; S636-V639 PolarHBondContact O-N 3.49Å; S636-L640 WeakPolarHBondContact O-CD1 3.35Å
637	I	43.4	Very low	45.9	Very low	69 Å²	69	90.8 Å²	90.8	35%	0.354	49%	0.492	S	S	.	.	H	α-helix	trans	-69.3	-30.9	179	-64.8	172.5	0	0	0	111.4	K615 V639	K615-I637 HydrophobicContact CD-CG2 4.38Å; K615-I637 HydrophobicContact CG-CG2 4.18Å; I637-V639 VanDerWaalsContact C-N 3.34Å
638	N	40.9	Very low	48.5	Very low	106 Å²	106	84 Å²	84	57%	0.567	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-14	176.5	-77.9	-23.8	0	0	0	114.3	E634 S636	E634-N638 PolarHBondContact O-N 3.08Å; S636-N638 VanDerWaalsContact C-N 3.32Å; S636-N638 PolarHBondContact O-N 2.9Å
639	V	47.3	Very low	51.1	Low	95 Å²	95	75 Å²	75	58%	0.576	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-20.9	177.6	173.7	0	0	0	0	112.3	S635 S636 I637 N641	S635-V639 WeakPolarHBondContact O-CG2 3.49Å; S636-V639 PolarHBondContact O-N 3.49Å; I637-V639 VanDerWaalsContact C-N 3.34Å; V639-N641 VanDerWaalsContact C-N 3.33Å; V639-N641 PolarHBondContact O-N 3.15Å
640	L	46.6	Very low	54.2	Low	34 Å²	34	69.2 Å²	69.2	18%	0.178	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-26.5	-179.2	-85.6	101.4	0	0	0	114.5	S636 K642	S636-L640 WeakPolarHBondContact O-CD1 3.35Å; L640-K642 VanDerWaalsContact C-N 3.33Å; L640-K642 PolarHBondContact O-N 3.16Å
641	N	50.5	Low	57	Low	82 Å²	82	63.7 Å²	63.7	44%	0.439	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-3.5	-171	-84.9	31.5	0	0	0	115.3	K615 V639	K615-N641 VanDerWaalsContact CD-OD1 3.26Å; K615-N641 WeakPolarHBondContact CD-OD1 3.37Å; K615-N641 PolarHBondContact NZ-ND2 3.19Å; K615-N641 PolarHBondContact NZ-OD1 2.83Å; V639-N641 VanDerWaalsContact C-N 3.33Å; V639-N641 PolarHBondContact O-N 3.15Å
642	K	61	Low	59.7	Low	138 Å²	138	62.7 Å²	62.7	60%	0.6	33%	0.334	S	S	*	.			trans	-96.7	126.3	-175.5	-66.2	-169.6	178	-173.8	0	109.4	L640 T644 P645 W646	L640-K642 VanDerWaalsContact C-N 3.33Å; L640-K642 PolarHBondContact O-N 3.16Å; K642-T644 PolarHBondContact O-N 3.09Å; K642-P645 WeakPolarHBondContact O-CD 3.33Å; K642-W646 WeakPolarHBondContact O-CH2 3.47Å
643	A	62	Low	62.4	Low	18 Å²	18	55.6 Å²	55.6	15%	0.149	30%	0.303	C	S	.	.	S	Bend	trans	-59.4	-15.3	169.9	0	0	0	0	0	113.4	P645 W646 L647 F680	A643-P645 VanDerWaalsContact C-CD 3.48Å; A643-W646 VanDerWaalsContact CA-CE2 3.49Å; A643-W646 VanDerWaalsContact CA-CZ2 3.47Å; A643-W646 HydrophobicContact CB-CZ2 4.31Å; A643-W646 PolarHBondContact O-NE1 3.3Å; A643-L647 HydrophobicContact CB-CD1 3.64Å; A643-L647 HydrophobicContact CB-CG 4.14Å; A643-L647 WeakPolarHBondContact O-CB 2.99Å; A643-L647 VanDerWaalsContact O-CG 3.25Å; A643-L647 WeakPolarHBondContact O-CG 2.97Å; A643-L647 PolarHBondContact O-N 2.98Å; A643-F680 HydrophobicContact CB-CD1 3.99Å; A643-F680 HydrophobicContact CB-CE1 3.72Å
644	T	69.7	Low	65.3	Low	52 Å²	52	52.8 Å²	52.8	32%	0.319	28%	0.283	S	S	.	.	H	α-helix	trans	-52.6	-42.7	-173.4	-43.8	0	0	0	0	115.4	K642 M648 M673	K642-T644 PolarHBondContact O-N 3.09Å; T644-M648 VanDerWaalsContact O-CB 3.25Å; T644-M648 WeakPolarHBondContact O-CB 3.23Å; T644-M648 PolarHBondContact O-N 3.48Å; T644-M673 HydrophobicContact CG2-CE 3.88Å
645	P	71.7	Confident	68.1	Low	34 Å²	34	45.4 Å²	45.4	22%	0.221	25%	0.249	C	C	.	.	H	α-helix	trans	-66.1	-43.9	-175.3	-21.1	34.2	0	0	0	114	K642 A643 I649	K642-P645 WeakPolarHBondContact O-CD 3.33Å; A643-P645 VanDerWaalsContact C-CD 3.48Å; P645-I649 WeakPolarHBondContact O-CG1 3.3Å; P645-I649 PolarHBondContact O-N 2.82Å
646	W	77.2	Confident	70.5	Confident	3 Å²	3	43.8 Å²	43.8	1%	0.011	23%	0.232	C	C	.	.	H	α-helix	trans	-79.9	-37.9	177.1	44.9	91.9	0	0	0	112	A501 L604 L608 Q611 K642 A643 M648 I649 F650	A501-W646 HydrophobicContact CB-CE3 4.25Å; A501-W646 HydrophobicContact CB-CZ3 4.03Å; L604-W646 HydrophobicContact CD2-CB 4.49Å; L608-W646 HydrophobicContact CB-CZ2 4.27Å; L608-W646 HydrophobicContact CD1-CH2 4.38Å; L608-W646 HydrophobicContact CD1-CZ2 3.87Å; Q611-W646 HydrophobicContact CG-CH2 4.35Å; Q611-W646 HydrophobicContact CG-CZ3 4.4Å; K642-W646 WeakPolarHBondContact O-CH2 3.47Å; A643-W646 VanDerWaalsContact CA-CE2 3.49Å; A643-W646 VanDerWaalsContact CA-CZ2 3.47Å; A643-W646 HydrophobicContact CB-CZ2 4.31Å; A643-W646 PolarHBondContact O-NE1 3.3Å; W646-M648 PolarHBondContact O-N 3.34Å; W646-I649 WeakPolarHBondContact O-CA 3.5Å; W646-I649 WeakPolarHBondContact O-CB 3.46Å; W646-I649 PolarHBondContact O-N 2.9Å; W646-F650 WeakPolarHBondContact O-CD2 3.5Å; W646-F650 PolarHBondContact O-N 3.18Å
647	L	83.9	Confident	72.9	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-56.7	-35	171.8	-70.7	178.8	0	0	0	111.7	F601 L604 A643 I649 F650 R651 M673 L676 E677 F680	F601-L647 HydrophobicContact CE1-CD2 4.23Å; L604-L647 HydrophobicContact CD1-CD2 4.27Å; A643-L647 HydrophobicContact CB-CD1 3.64Å; A643-L647 HydrophobicContact CB-CG 4.14Å; A643-L647 WeakPolarHBondContact O-CB 2.99Å; A643-L647 VanDerWaalsContact O-CG 3.25Å; A643-L647 WeakPolarHBondContact O-CG 2.97Å; A643-L647 PolarHBondContact O-N 2.98Å; L647-I649 VanDerWaalsContact C-N 3.35Å; L647-I649 PolarHBondContact O-N 2.98Å; L647-F650 PolarHBondContact O-N 2.69Å; L647-R651 WeakPolarHBondContact O-CB 3.5Å; L647-R651 PolarHBondContact O-N 3.02Å; L647-M673 HydrophobicContact CB-CE 3.71Å; L647-M673 HydrophobicContact CB-SD 4.46Å; L647-L676 HydrophobicContact CD2-CB 4.37Å; L647-E677 HydrophobicContact CD1-CG 3.74Å; L647-F680 HydrophobicContact CD1-CD1 4.5Å; L647-F680 HydrophobicContact CD2-CB 4.35Å; L647-F680 HydrophobicContact CD2-CG 4.46Å
648	M	83	Confident	75.1	Confident	28 Å²	28	38.8 Å²	38.8	14%	0.138	20%	0.203	C	C	.	.	H	α-helix	trans	-64	-37.1	173.7	-173	62.3	56.1	0	0	113.2	T644 W646 R651 M673	T644-M648 VanDerWaalsContact O-CB 3.25Å; T644-M648 WeakPolarHBondContact O-CB 3.23Å; T644-M648 PolarHBondContact O-N 3.48Å; W646-M648 PolarHBondContact O-N 3.34Å; M648-R651 WeakPolarHBondContact O-CB 3.49Å; M648-M673 HydrophobicContact CB-SD 4.42Å; M648-M673 HydrophobicContact CE-CE 4.06Å; M648-M673 HydrophobicContact CE-CG 3.71Å; M648-M673 HydrophobicContact CE-SD 3.52Å; M648-M673 VanDerWaalsContact CE-SD 3.52Å; M648-M673 HydrophobicContact SD-SD 4.24Å
649	I	85.1	Confident	77.4	Confident	32 Å²	32	36.6 Å²	36.6	16%	0.164	19%	0.187	C	C	.	.	H	α-helix	trans	-71.9	-47.2	177.7	-64.2	161.1	0	0	0	109.3	Y504 Q505 K547 P645 W646 L647 R651 Q652 I653	Y504-I649 WeakPolarHBondContact O-CD1 3.28Å; Q505-I649 HydrophobicContact CB-CD1 4.33Å; Q505-I649 HydrophobicContact CG-CD1 3.79Å; K547-I649 HydrophobicContact CD-CG2 4.03Å; P645-I649 WeakPolarHBondContact O-CG1 3.3Å; P645-I649 PolarHBondContact O-N 2.82Å; W646-I649 WeakPolarHBondContact O-CA 3.5Å; W646-I649 WeakPolarHBondContact O-CB 3.46Å; W646-I649 PolarHBondContact O-N 2.9Å; L647-I649 VanDerWaalsContact C-N 3.35Å; L647-I649 PolarHBondContact O-N 2.98Å; I649-R651 VanDerWaalsContact C-N 3.26Å; I649-R651 PolarHBondContact O-N 3.33Å; I649-Q652 WeakPolarHBondContact O-CB 3.42Å; I649-Q652 PolarHBondContact O-N 3.34Å; I649-I653 HydrophobicContact CG2-CD1 4.09Å
650	F	89.1	Confident	79.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.7	-24	178.2	-82.4	-94.2	0	0	0	112.8	Y504 M546 L550 I600 L604 W646 L647 Q652 I653 L654	Y504-F650 AromaticContact CD1-CE2 3.87Å; Y504-F650 HydrophobicContact CD1-CE2 3.87Å; Y504-F650 HydrophobicContact CD1-CZ 4.35Å; Y504-F650 AromaticContact CE1-CE2 3.87Å; Y504-F650 HydrophobicContact CE1-CE2 3.87Å; Y504-F650 AromaticContact CE1-CZ 3.9Å; Y504-F650 HydrophobicContact CE1-CZ 3.9Å; M546-F650 HydrophobicContact CE-CE1 4.06Å; M546-F650 HydrophobicContact CE-CZ 3.55Å; L550-F650 HydrophobicContact CD1-CE1 4.14Å; I600-F650 HydrophobicContact CG2-CD1 3.88Å; I600-F650 HydrophobicContact CG2-CE1 3.65Å; L604-F650 HydrophobicContact CD1-CD1 4.45Å; L604-F650 HydrophobicContact CD1-CD2 4.25Å; L604-F650 HydrophobicContact CD1-CG 4.17Å; L604-F650 HydrophobicContact CD2-CD2 3.86Å; L604-F650 HydrophobicContact CD2-CE2 3.53Å; L604-F650 HydrophobicContact CD2-CZ 3.92Å; L604-F650 HydrophobicContact CG-CE2 4.5Å; W646-F650 WeakPolarHBondContact O-CD2 3.5Å; W646-F650 PolarHBondContact O-N 3.18Å; L647-F650 PolarHBondContact O-N 2.69Å; F650-Q652 VanDerWaalsContact C-N 3.26Å; F650-Q652 PolarHBondContact O-N 3.35Å; F650-I653 PolarHBondContact O-N 3.31Å; F650-L654 HydrophobicContact CB-CD1 4.08Å; F650-L654 HydrophobicContact CB-CG 4.31Å; F650-L654 HydrophobicContact CD1-CD1 4.08Å; F650-L654 HydrophobicContact CD1-CD2 4.44Å; F650-L654 HydrophobicContact CD1-CG 4.13Å; F650-L654 WeakPolarHBondContact O-CB 3.36Å; F650-L654 WeakPolarHBondContact O-CG 3.2Å; F650-L654 PolarHBondContact O-N 3.42Å
651	R	88.8	Confident	81.5	Confident	12 Å²	12	37.5 Å²	37.5	5%	0.045	19%	0.185	C	C	.	.	H	α-helix	trans	-54.9	-42.6	167.2	-178.2	-170.7	175.3	-90.4	4.5	111.9	L647 M648 I649 I653 V655 I665 H672 L676	L647-R651 WeakPolarHBondContact O-CB 3.5Å; L647-R651 PolarHBondContact O-N 3.02Å; M648-R651 WeakPolarHBondContact O-CB 3.49Å; I649-R651 VanDerWaalsContact C-N 3.26Å; I649-R651 PolarHBondContact O-N 3.33Å; R651-I653 PolarHBondContact O-N 3.42Å; R651-V655 WeakPolarHBondContact O-CB 3.11Å; R651-V655 PolarHBondContact O-N 2.92Å; R651-I665 PolarHBondContact NH1-O 3.18Å; R651-I665 PolarHBondContact NH2-O 2.95Å; R651-H672 HydrophobicContact CG-CB 4.02Å; R651-H672 VanDerWaalsContact CZ-ND1 3.27Å; R651-H672 VanDerWaalsContact NE-CB 3.34Å; R651-H672 PolarHBondContact NE-ND1 3.08Å; R651-H672 PolarHBondContact NH2-CE1 3.16Å; R651-H672 PolarHBondContact NH2-ND1 3.34Å; R651-L676 HydrophobicContact CB-CD1 3.67Å; R651-L676 HydrophobicContact CG-CD1 4.21Å
652	Q	83.7	Confident	83.3	Confident	103 Å²	103	34.3 Å²	34.3	48%	0.481	17%	0.168	S	C	.	.	H	α-helix	trans	-73.7	-14.9	-179.7	-61.2	-177.9	6.2	0	0	113	I649 F650	I649-Q652 WeakPolarHBondContact O-CB 3.42Å; I649-Q652 PolarHBondContact O-N 3.34Å; F650-Q652 VanDerWaalsContact C-N 3.26Å; F650-Q652 PolarHBondContact O-N 3.35Å
653	I	88.4	Confident	84.7	Confident	10 Å²	10	28.2 Å²	28.2	5%	0.051	14%	0.142	C	C	.	.	H	α-helix	trans	-100.9	-49.4	-175.9	-61.5	170	0	0	0	110.3	K547 L550 N556 I649 F650 R651	K547-I653 HydrophobicContact CB-CD1 3.86Å; K547-I653 HydrophobicContact CD-CD1 3.95Å; K547-I653 HydrophobicContact CG-CD1 3.54Å; L550-I653 HydrophobicContact CB-CG2 3.39Å; L550-I653 HydrophobicContact CD1-CG2 4.15Å; L550-I653 HydrophobicContact CG-CG2 4.43Å; N556-I653 PolarHBondContact ND2-O 2.94Å; I649-I653 HydrophobicContact CG2-CD1 4.09Å; F650-I653 PolarHBondContact O-N 3.31Å; R651-I653 PolarHBondContact O-N 3.42Å
654	L	91.1	Very high	85.9	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-84.1	-35.3	-174	-57.4	179.8	0	0	0	112.5	V557 I558 L597 I600 F650	V557-L654 HydrophobicContact CB-CD2 4.11Å; V557-L654 HydrophobicContact CG2-CD2 4.18Å; I558-L654 HydrophobicContact CD1-CB 4.34Å; L597-L654 HydrophobicContact CD1-CD1 4.28Å; I600-L654 HydrophobicContact CD1-CD2 3.9Å; I600-L654 HydrophobicContact CG2-CD1 4.37Å; F650-L654 HydrophobicContact CB-CD1 4.08Å; F650-L654 HydrophobicContact CB-CG 4.31Å; F650-L654 HydrophobicContact CD1-CD1 4.08Å; F650-L654 HydrophobicContact CD1-CD2 4.44Å; F650-L654 HydrophobicContact CD1-CG 4.13Å; F650-L654 WeakPolarHBondContact O-CB 3.36Å; F650-L654 WeakPolarHBondContact O-CG 3.2Å; F650-L654 PolarHBondContact O-N 3.42Å
655	V	89.1	Confident	86.6	Confident	9 Å²	9	28.6 Å²	28.6	6%	0.055	14%	0.139	C	C	.	.			trans	-100.9	113.1	-173.1	-172.9	0	0	0	0	110.5	Y563 F566 R651 L676	Y563-V655 HydrophobicContact CD2-CG1 4.04Å; Y563-V655 HydrophobicContact CE2-CG1 3.88Å; F566-V655 HydrophobicContact CD1-CG1 4.4Å; F566-V655 HydrophobicContact CE1-CG1 3.95Å; F566-V655 HydrophobicContact CE1-CG2 3.71Å; F566-V655 HydrophobicContact CZ-CG2 3.74Å; R651-V655 WeakPolarHBondContact O-CB 3.11Å; R651-V655 PolarHBondContact O-N 2.92Å; V655-L676 HydrophobicContact CG2-CD2 4.46Å
656	R	88	Confident	87.2	Confident	39 Å²	39	27 Å²	27	15%	0.147	13%	0.129	C	C	.	.			trans	-126.3	104.4	169.3	175.7	176.4	172	160.1	4.8	108.5	H391 N556 E560	H391-R656 PolarHBondContact CD2-NH1 3.37Å; H391-R656 VanDerWaalsContact CD2-NH1 3.26Å; H391-R656 PolarHBondContact CE1-NH1 3.01Å; H391-R656 VanDerWaalsContact CE1-NH1 3.31Å; H391-R656 PolarHBondContact NE2-NH1 3.48Å; N556-R656 HydrophobicContact CB-CB 4.5Å; N556-R656 WeakPolarHBondContact ND2-CB 3.47Å; E560-R656 HydrophobicContact CG-CG 4.3Å; E560-R656 WeakPolarHBondContact OE1-CD 3.34Å; E560-R656 IonicContact OE1-CZ 2.7Å; E560-R656 IonicContact OE1-NE 3.59Å; E560-R656 PolarHBondContact OE1-NE 2.94Å; E560-R656 IonicContact OE1-NH2 3.55Å
657	P	90	Very high	87.4	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.15	C	C	.	.			trans	-59.1	152.7	170.1	-18.9	32.8	0	0	0	110	Y563 L661 I665	Y563-P657 HydrophobicContact CD1-CB 4.1Å; Y563-P657 HydrophobicContact CD2-CB 4.1Å; Y563-P657 HydrophobicContact CD2-CG 4.12Å; Y563-P657 HydrophobicContact CE1-CB 3.79Å; Y563-P657 HydrophobicContact CE1-CG 4.28Å; Y563-P657 HydrophobicContact CE2-CB 3.81Å; Y563-P657 HydrophobicContact CE2-CG 3.52Å; Y563-P657 HydrophobicContact CG-CB 4.23Å; P657-L661 HydrophobicContact CB-CB 4.05Å; P657-L661 WeakPolarHBondContact CB-O 3.25Å; P657-I665 VanDerWaalsContact CD-CG1 3.45Å; P657-I665 HydrophobicContact CG-CD1 4.22Å; P657-I665 HydrophobicContact CG-CG1 3.54Å
658	P	89.8	Confident	87.3	Confident	17 Å²	17	31.8 Å²	31.8	11%	0.11	16%	0.156	C	C	.	.			trans	-57.9	153	172.1	28.4	-36.1	0	0	0	110	E560 H660 L661 I662	E560-P658 HydrophobicContact CB-CB 4.32Å; E560-P658 WeakPolarHBondContact OE2-CA 3.28Å; P658-H660 VanDerWaalsContact CB-CE1 3.47Å; P658-H660 WeakPolarHBondContact CB-CE1 3.25Å; P658-H660 WeakPolarHBondContact CG-CE1 3.34Å; P658-H660 PolarHBondContact O-N 3.42Å; P658-L661 HydrophobicContact CG-CB 4.08Å; P658-L661 HydrophobicContact CG-CD1 3.82Å; P658-L661 HydrophobicContact CG-CG 4.02Å; P658-L661 CarbonylContact O-C 3.23Å; P658-L661 WeakPolarHBondContact O-CA 3.1Å; P658-L661 PolarHBondContact O-N 2.98Å; P658-I662 PolarHBondContact O-N 3.24Å
659	W	89.2	Confident	87.3	Confident	61 Å²	61	32.3 Å²	32.3	23%	0.231	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-49.9	-40.5	-171.4	-179.3	-115	0	0	0	113.6	N196 D197 Y198 L661 I662	N196-W659 PolarHBondContact O-NE1 3.13Å; D197-W659 WeakPolarHBondContact OD1-CZ2 3.46Å; Y198-W659 AromaticContact CD2-CE2 3.75Å; Y198-W659 HydrophobicContact CD2-CH2 4.28Å; Y198-W659 AromaticContact CD2-CZ2 3.58Å; Y198-W659 HydrophobicContact CD2-CZ2 3.58Å; Y198-W659 AromaticContact CD2-NE1 3.93Å; Y198-W659 HydrophobicContact CE2-CD2 4.33Å; Y198-W659 AromaticContact CE2-CE2 3.92Å; Y198-W659 HydrophobicContact CE2-CZ2 4.11Å; Y198-W659 WeakPolarHBondContact CE2-O 3.29Å; Y198-W659 PolarHBondContact OH-O 2.67Å; Y198-W659 VanDerWaalsContact OH-O 3.08Å; W659-L661 PolarHBondContact O-N 3.31Å; W659-I662 HydrophobicContact CE3-CB 4.26Å; W659-I662 HydrophobicContact CE3-CG1 4.35Å; W659-I662 HydrophobicContact CE3-CG2 4.32Å; W659-I662 HydrophobicContact CZ3-CB 4.44Å; W659-I662 HydrophobicContact CZ3-CG1 4.23Å; W659-I662 HydrophobicContact CZ3-CG2 4.24Å; W659-I662 WeakPolarHBondContact O-CB 3.5Å; W659-I662 WeakPolarHBondContact O-CG2 3.25Å; W659-I662 PolarHBondContact O-N 3.46Å
660	H	89.1	Confident	87.2	Confident	110 Å²	110	36.3 Å²	36.3	51%	0.509	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-69.8	-12	-180	65.6	-84.4	0	0	0	115.1	I191 Y198 P658	I191-H660 HydrophobicContact CD1-CB 3.47Å; I191-H660 VanDerWaalsContact CD1-CB 3.47Å; Y198-H660 PolarHBondContact OH-O 3.48Å; P658-H660 VanDerWaalsContact CB-CE1 3.47Å; P658-H660 WeakPolarHBondContact CB-CE1 3.25Å; P658-H660 WeakPolarHBondContact CG-CE1 3.34Å; P658-H660 PolarHBondContact O-N 3.42Å
661	L	91.2	Very high	87.2	Confident	38 Å²	38	38.3 Å²	38.3	20%	0.199	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-115.3	14.3	174.8	-59.8	179	0	0	0	112.2	Y563 L564 P657 P658 W659 T663 D664	Y563-L661 HydrophobicContact CD1-CD1 4.02Å; Y563-L661 HydrophobicContact CE1-CB 4.38Å; Y563-L661 HydrophobicContact CE1-CD1 3.92Å; L564-L661 HydrophobicContact CD2-CD1 3.99Å; P657-L661 HydrophobicContact CB-CB 4.05Å; P657-L661 WeakPolarHBondContact CB-O 3.25Å; P658-L661 HydrophobicContact CG-CB 4.08Å; P658-L661 HydrophobicContact CG-CD1 3.82Å; P658-L661 HydrophobicContact CG-CG 4.02Å; P658-L661 CarbonylContact O-C 3.23Å; P658-L661 WeakPolarHBondContact O-CA 3.1Å; P658-L661 PolarHBondContact O-N 2.98Å; W659-L661 PolarHBondContact O-N 3.31Å; L661-T663 PolarHBondContact O-N 3.1Å; L661-D664 VanDerWaalsContact O-CB 3.25Å; L661-D664 WeakPolarHBondContact O-CB 3.36Å; L661-D664 PolarHBondContact O-N 2.57Å
662	I	89	Confident	87.3	Confident	15 Å²	15	37.9 Å²	37.9	8%	0.077	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-26.4	-175.9	-160.3	66.5	0	0	0	112.5	Y198 V284 P658 W659 D664 I665	Y198-I662 HydrophobicContact CD2-CG2 4.17Å; Y198-I662 HydrophobicContact CE2-CG2 3.35Å; V284-I662 HydrophobicContact CG2-CG2 4.02Å; P658-I662 PolarHBondContact O-N 3.24Å; W659-I662 HydrophobicContact CE3-CB 4.26Å; W659-I662 HydrophobicContact CE3-CG1 4.35Å; W659-I662 HydrophobicContact CE3-CG2 4.32Å; W659-I662 HydrophobicContact CZ3-CB 4.44Å; W659-I662 HydrophobicContact CZ3-CG1 4.23Å; W659-I662 HydrophobicContact CZ3-CG2 4.24Å; W659-I662 WeakPolarHBondContact O-CB 3.5Å; W659-I662 WeakPolarHBondContact O-CG2 3.25Å; W659-I662 PolarHBondContact O-N 3.46Å; I662-D664 PolarHBondContact O-N 3.25Å; I662-I665 HydrophobicContact CD1-CD1 3.55Å; I662-I665 HydrophobicContact CD1-CG1 4.27Å; I662-I665 HydrophobicContact CG1-CD1 4.3Å; I662-I665 WeakPolarHBondContact O-CB 3.45Å; I662-I665 WeakPolarHBondContact O-CG1 3.35Å; I662-I665 PolarHBondContact O-N 2.83Å; I662-I665 VanDerWaalsContact O-N 3.12Å
663	T	88.9	Confident	87.6	Confident	10 Å²	10	33.6 Å²	33.6	6%	0.061	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-28.7	173	43.7	0	0	0	0	113.5	P189 Y198 V284 L661 I665 A666	P189-T663 HydrophobicContact CB-CG2 4.21Å; P189-T663 HydrophobicContact CG-CG2 4.13Å; Y198-T663 HydrophobicContact CE1-CG2 4.18Å; V284-T663 HydrophobicContact CG2-CG2 4.13Å; L661-T663 PolarHBondContact O-N 3.1Å; T663-I665 PolarHBondContact O-N 2.84Å; T663-A666 WeakPolarHBondContact O-CB 3.28Å; T663-A666 PolarHBondContact O-N 3.47Å
664	D	88.4	Confident	87.6	Confident	52 Å²	52	38.4 Å²	38.4	28%	0.278	19%	0.189	S	C	.	.	H	α-helix	trans	-63.8	-24.5	177.7	-68	-3	0	0	0	111.9	Y563 L661 I662 A666 M667 G668	Y563-D664 WeakPolarHBondContact OH-CB 3.37Å; Y563-D664 PolarHBondContact OH-OD2 3.35Å; L661-D664 VanDerWaalsContact O-CB 3.25Å; L661-D664 WeakPolarHBondContact O-CB 3.36Å; L661-D664 PolarHBondContact O-N 2.57Å; I662-D664 PolarHBondContact O-N 3.25Å; D664-A666 PolarHBondContact O-N 3.29Å; D664-M667 PolarHBondContact O-N 2.77Å; D664-G668 VanDerWaalsContact O-CA 3.25Å; D664-G668 WeakPolarHBondContact O-CA 3.41Å; D664-G668 PolarHBondContact O-N 2.83Å
665	I	84.8	Confident	87.5	Confident	26 Å²	26	38.4 Å²	38.4	13%	0.133	19%	0.189	C	C	.	.	H	α-helix	trans	-57.3	-33.7	173.1	-62.7	-170.6	0	0	0	110.8	C288 R651 P657 I662 T663	C288-I665 HydrophobicContact CB-CG2 3.97Å; R651-I665 PolarHBondContact NH1-O 3.18Å; R651-I665 PolarHBondContact NH2-O 2.95Å; P657-I665 VanDerWaalsContact CD-CG1 3.45Å; P657-I665 HydrophobicContact CG-CD1 4.22Å; P657-I665 HydrophobicContact CG-CG1 3.54Å; I662-I665 HydrophobicContact CD1-CD1 3.55Å; I662-I665 HydrophobicContact CD1-CG1 4.27Å; I662-I665 HydrophobicContact CG1-CD1 4.3Å; I662-I665 WeakPolarHBondContact O-CB 3.45Å; I662-I665 WeakPolarHBondContact O-CG1 3.35Å; I662-I665 PolarHBondContact O-N 2.83Å; I662-I665 VanDerWaalsContact O-N 3.12Å; T663-I665 PolarHBondContact O-N 2.84Å
666	A	83.6	Confident	87.6	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-73.2	-42.6	-176.1	0	0	0	0	0	113	A279 A283 V291 T663 D664	A279-A666 HydrophobicContact CB-CB 4.11Å; A283-A666 HydrophobicContact CB-CB 4.22Å; V291-A666 HydrophobicContact CG1-CB 4.17Å; T663-A666 WeakPolarHBondContact O-CB 3.28Å; T663-A666 PolarHBondContact O-N 3.47Å; D664-A666 PolarHBondContact O-N 3.29Å
667	M	81.4	Confident	87.7	Confident	91 Å²	91	39.4 Å²	39.4	45%	0.448	20%	0.195	S	C	.	.	H	α-helix	trans	-113.6	-22.8	-171.3	-62.5	-56.6	-64.9	0	0	114.4	T276 H280 D664 M669	T276-M667 HydrophobicContact CG2-CE 4.25Å; T276-M667 HydrophobicContact CG2-CG 4.33Å; T276-M667 HydrophobicContact CG2-SD 3.95Å; H280-M667 WeakPolarHBondContact CE1-CG 3.47Å; D664-M667 PolarHBondContact O-N 2.77Å; M667-M669 PolarHBondContact O-N 3.5Å
668	G	81.6	Confident	87.5	Confident	14 Å²	14	39.4 Å²	39.4	14%	0.144	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	24.1	177.4	0	0	0	0	0	114.1	D664 D670 T671 H672	D664-G668 VanDerWaalsContact O-CA 3.25Å; D664-G668 WeakPolarHBondContact O-CA 3.41Å; D664-G668 PolarHBondContact O-N 2.83Å; G668-D670 PolarHBondContact O-N 3.26Å; G668-T671 PolarHBondContact O-N 2.84Å; G668-H672 PolarHBondContact O-CD2 2.96Å; G668-H672 PolarHBondContact O-N 2.84Å
669	M	82.6	Confident	87.5	Confident	38 Å²	38	38.6 Å²	38.6	19%	0.187	19%	0.189	C	C	.	.	H	α-helix	trans	-57.8	-49.2	-178.2	-73.9	-168.1	-72.8	0	0	111.4	I295 M667 T671 H672 M673	I295-M669 HydrophobicContact CD1-CE 4.2Å; M667-M669 PolarHBondContact O-N 3.5Å; M669-T671 PolarHBondContact O-N 2.94Å; M669-H672 PolarHBondContact O-N 2.83Å; M669-M673 WeakPolarHBondContact O-CB 3.11Å; M669-M673 VanDerWaalsContact O-CG 3.22Å; M669-M673 WeakPolarHBondContact O-CG 3.31Å; M669-M673 PolarHBondContact O-N 2.72Å
670	D	83.9	Confident	87.4	Confident	117 Å²	117	36.3 Å²	36.3	63%	0.626	18%	0.181	S	C	*	.	H	α-helix	trans	-68.5	-34.1	-177	-58.8	-59	0	0	0	112.8	G668 R674	G668-D670 PolarHBondContact O-N 3.26Å; D670-R674 WeakPolarHBondContact O-CB 3.31Å; D670-R674 VanDerWaalsContact O-CG 3.32Å; D670-R674 WeakPolarHBondContact O-CG 3.45Å; D670-R674 PolarHBondContact O-N 3.31Å; D670-R674 PolarHBondContact O-NE 2.72Å
671	T	89.3	Confident	87.1	Confident	42 Å²	42	33.4 Å²	33.4	26%	0.258	17%	0.173	S	C	.	.	H	α-helix	trans	-67.2	-49.1	175.9	-54	0	0	0	0	110.3	C567 A570 G668 M669 M673 R674 A675	C567-T671 HydrophobicContact CB-CG2 4.13Å; A570-T671 HydrophobicContact CB-CG2 3.6Å; A570-T671 VanDerWaalsContact CB-O 3.23Å; A570-T671 WeakPolarHBondContact CB-O 3.4Å; G668-T671 PolarHBondContact O-N 2.84Å; M669-T671 PolarHBondContact O-N 2.94Å; T671-M673 VanDerWaalsContact C-N 3.33Å; T671-M673 PolarHBondContact O-N 2.91Å; T671-R674 PolarHBondContact O-N 3.1Å; T671-A675 WeakPolarHBondContact O-CB 3.05Å; T671-A675 PolarHBondContact O-N 3.37Å
672	H	90.6	Very high	86.6	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.009	17%	0.168	C	C	.	.	H	α-helix	trans	-66.2	-38.4	-179.1	-60.1	-173.3	0	0	0	111.3	Y563 F566 R651 G668 M669 A675 L676	Y563-H672 AromaticContact CE2-CE1 3.93Å; Y563-H672 AromaticContact CE2-NE2 3.69Å; Y563-H672 AromaticContact CZ-NE2 3.75Å; Y563-H672 PolarHBondContact OH-NE2 2.91Å; F566-H672 HydrophobicContact CE1-CB 4.36Å; R651-H672 HydrophobicContact CG-CB 4.02Å; R651-H672 VanDerWaalsContact CZ-ND1 3.27Å; R651-H672 VanDerWaalsContact NE-CB 3.34Å; R651-H672 PolarHBondContact NE-ND1 3.08Å; R651-H672 PolarHBondContact NH2-CE1 3.16Å; R651-H672 PolarHBondContact NH2-ND1 3.34Å; G668-H672 PolarHBondContact O-CD2 2.96Å; G668-H672 PolarHBondContact O-N 2.84Å; M669-H672 PolarHBondContact O-N 2.83Å; H672-A675 PolarHBondContact O-N 2.91Å; H672-L676 WeakPolarHBondContact O-CB 3.21Å; H672-L676 VanDerWaalsContact O-CG 3.3Å; H672-L676 WeakPolarHBondContact O-CG 3.05Å; H672-L676 PolarHBondContact O-N 2.82Å
673	M	89	Confident	86	Confident	13 Å²	13	32.4 Å²	32.4	6%	0.064	17%	0.168	C	C	.	.	H	α-helix	trans	-65.7	-45.9	177.9	-72.2	-58.6	-60.7	0	0	111.5	T644 L647 M648 M669 T671 A675 L676 E677	T644-M673 HydrophobicContact CG2-CE 3.88Å; L647-M673 HydrophobicContact CB-CE 3.71Å; L647-M673 HydrophobicContact CB-SD 4.46Å; M648-M673 HydrophobicContact CB-SD 4.42Å; M648-M673 HydrophobicContact CE-CE 4.06Å; M648-M673 HydrophobicContact CE-CG 3.71Å; M648-M673 HydrophobicContact CE-SD 3.52Å; M648-M673 VanDerWaalsContact CE-SD 3.52Å; M648-M673 HydrophobicContact SD-SD 4.24Å; M669-M673 WeakPolarHBondContact O-CB 3.11Å; M669-M673 VanDerWaalsContact O-CG 3.22Å; M669-M673 WeakPolarHBondContact O-CG 3.31Å; M669-M673 PolarHBondContact O-N 2.72Å; T671-M673 VanDerWaalsContact C-N 3.33Å; T671-M673 PolarHBondContact O-N 2.91Å; M673-A675 VanDerWaalsContact C-N 3.32Å; M673-A675 PolarHBondContact O-N 2.77Å; M673-L676 PolarHBondContact O-N 2.82Å; M673-E677 WeakPolarHBondContact O-CB 3.26Å; M673-E677 VanDerWaalsContact O-CG 3.25Å; M673-E677 WeakPolarHBondContact O-CG 3.23Å; M673-E677 PolarHBondContact O-N 3.16Å
674	R	88.1	Confident	84.9	Confident	112 Å²	112	33.2 Å²	33.2	42%	0.423	17%	0.173	S	C	.	.	H	α-helix	trans	-61.6	-38.8	175.3	-77	-176	-71.6	150.7	-8.5	112.7	A570 D670 T671 A678	A570-R674 HydrophobicContact CB-CB 3.93Å; A570-R674 PolarHBondContact O-NH1 3.29Å; D670-R674 WeakPolarHBondContact O-CB 3.31Å; D670-R674 VanDerWaalsContact O-CG 3.32Å; D670-R674 WeakPolarHBondContact O-CG 3.45Å; D670-R674 PolarHBondContact O-N 3.31Å; D670-R674 PolarHBondContact O-NE 2.72Å; T671-R674 PolarHBondContact O-N 3.1Å; R674-A678 WeakPolarHBondContact O-CB 3.43Å; R674-A678 PolarHBondContact O-N 3.09Å
675	A	90.5	Very high	83.4	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.3	-42	175.1	0	0	0	0	0	112.4	F566 L569 A570 T671 H672 M673 A678 L679	F566-A675 HydrophobicContact CD2-CB 4.05Å; F566-A675 HydrophobicContact CE1-CB 4.03Å; F566-A675 HydrophobicContact CE2-CB 3.49Å; F566-A675 VanDerWaalsContact CE2-CB 3.49Å; F566-A675 HydrophobicContact CZ-CB 3.48Å; F566-A675 VanDerWaalsContact CZ-CB 3.48Å; F566-A675 WeakPolarHBondContact O-CB 3.31Å; L569-A675 HydrophobicContact CB-CB 4.2Å; A570-A675 HydrophobicContact CB-CB 4.22Å; T671-A675 WeakPolarHBondContact O-CB 3.05Å; T671-A675 PolarHBondContact O-N 3.37Å; H672-A675 PolarHBondContact O-N 2.91Å; M673-A675 VanDerWaalsContact C-N 3.32Å; M673-A675 PolarHBondContact O-N 2.77Å; A675-A678 WeakPolarHBondContact O-CB 3.37Å; A675-A678 PolarHBondContact O-N 3.05Å; A675-L679 WeakPolarHBondContact O-CG 3.04Å; A675-L679 PolarHBondContact O-N 2.7Å
676	L	91.5	Very high	81.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66.4	-40.2	174.8	-74.7	171.5	0	0	0	112.4	F566 F601 L647 R651 V655 H672 M673 A678 L679 F680	F566-L676 HydrophobicContact CE2-CD2 4.12Å; F566-L676 HydrophobicContact CE2-CG 4.28Å; F566-L676 HydrophobicContact CZ-CD2 4.15Å; F566-L676 HydrophobicContact CZ-CG 3.96Å; F601-L676 HydrophobicContact CZ-CD2 4.08Å; L647-L676 HydrophobicContact CD2-CB 4.37Å; R651-L676 HydrophobicContact CB-CD1 3.67Å; R651-L676 HydrophobicContact CG-CD1 4.21Å; V655-L676 HydrophobicContact CG2-CD2 4.46Å; H672-L676 WeakPolarHBondContact O-CB 3.21Å; H672-L676 VanDerWaalsContact O-CG 3.3Å; H672-L676 WeakPolarHBondContact O-CG 3.05Å; H672-L676 PolarHBondContact O-N 2.82Å; M673-L676 PolarHBondContact O-N 2.82Å; L676-A678 VanDerWaalsContact C-N 3.26Å; L676-A678 PolarHBondContact O-N 2.93Å; L676-L679 PolarHBondContact O-N 3.21Å; L676-F680 VanDerWaalsContact O-CB 3.3Å; L676-F680 WeakPolarHBondContact O-CB 3.12Å; L676-F680 PolarHBondContact O-N 2.98Å
677	E	88.2	Confident	79.1	Confident	70 Å²	70	44.4 Å²	44.4	33%	0.327	23%	0.23	S	C	.	.	H	α-helix	trans	-63.3	-36.1	173.2	-74	170.1	177.9	0	0	110.7	L647 M673 F680 S681	L647-E677 HydrophobicContact CD1-CG 3.74Å; M673-E677 WeakPolarHBondContact O-CB 3.26Å; M673-E677 VanDerWaalsContact O-CG 3.25Å; M673-E677 WeakPolarHBondContact O-CG 3.23Å; M673-E677 PolarHBondContact O-N 3.16Å; E677-F680 PolarHBondContact O-N 2.74Å; E677-S681 WeakPolarHBondContact O-CB 2.93Å; E677-S681 PolarHBondContact O-N 3.19Å; E677-S681 PolarHBondContact O-OG 2.84Å; E677-S681 VanDerWaalsContact O-OG 3.13Å
678	A	87.3	Confident	76.7	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.1	-49.6	173.8	0	0	0	0	0	112.7	K578 V582 R674 A675 L676 T682	K578-A678 HydrophobicContact CD-CB 4.29Å; K578-A678 HydrophobicContact CG-CB 4.22Å; V582-A678 HydrophobicContact CG2-CB 4.26Å; R674-A678 WeakPolarHBondContact O-CB 3.43Å; R674-A678 PolarHBondContact O-N 3.09Å; A675-A678 WeakPolarHBondContact O-CB 3.37Å; A675-A678 PolarHBondContact O-N 3.05Å; L676-A678 VanDerWaalsContact C-N 3.26Å; L676-A678 PolarHBondContact O-N 2.93Å; A678-T682 PolarHBondContact O-OG1 3.25Å
679	L	89.5	Confident	74	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-47	175.2	-67.2	173.9	0	0	0	111.2	F566 L569 V582 F585 F601 A675 L676 T682 F683	F566-L679 HydrophobicContact CD2-CD1 3.99Å; F566-L679 HydrophobicContact CE2-CD1 3.82Å; L569-L679 HydrophobicContact CD1-CD2 3.79Å; L569-L679 HydrophobicContact CD1-CG 4.09Å; V582-L679 HydrophobicContact CG1-CD2 3.84Å; V582-L679 HydrophobicContact CG2-CD2 4.28Å; F585-L679 HydrophobicContact CD1-CD2 3.84Å; F585-L679 HydrophobicContact CE1-CD1 4.3Å; F585-L679 HydrophobicContact CE1-CD2 4.08Å; F601-L679 HydrophobicContact CE1-CB 4.37Å; F601-L679 HydrophobicContact CE2-CB 3.8Å; F601-L679 HydrophobicContact CE2-CD1 4.02Å; F601-L679 HydrophobicContact CZ-CB 3.64Å; F601-L679 HydrophobicContact CZ-CD1 4.03Å; A675-L679 WeakPolarHBondContact O-CG 3.04Å; A675-L679 PolarHBondContact O-N 2.7Å; L676-L679 PolarHBondContact O-N 3.21Å; L679-T682 PolarHBondContact O-N 3.03Å; L679-F683 WeakPolarHBondContact O-CD2 3.43Å
680	F	87.8	Confident	71.3	Confident	12 Å²	12	56.3 Å²	56.3	5%	0.053	29%	0.287	C	S	.	.	H	α-helix	trans	-65.5	-42.5	-175.3	-177.4	-115.5	0	0	0	113.4	F601 L604 L608 A643 L647 L676 E677 T682 F683 V684	F601-F680 HydrophobicContact CD1-CB 4.06Å; F601-F680 AromaticContact CD1-CD2 3.75Å; F601-F680 HydrophobicContact CD1-CD2 3.75Å; F601-F680 HydrophobicContact CD1-CG 4.38Å; F601-F680 HydrophobicContact CE1-CB 3.95Å; F601-F680 HydrophobicContact CE1-CD2 4.38Å; L604-F680 HydrophobicContact CB-CD2 4.38Å; L604-F680 HydrophobicContact CB-CE2 3.83Å; L608-F680 HydrophobicContact CB-CZ 4.25Å; L608-F680 HydrophobicContact CD2-CE1 3.87Å; L608-F680 HydrophobicContact CD2-CZ 3.85Å; A643-F680 HydrophobicContact CB-CD1 3.99Å; A643-F680 HydrophobicContact CB-CE1 3.72Å; L647-F680 HydrophobicContact CD1-CD1 4.5Å; L647-F680 HydrophobicContact CD2-CB 4.35Å; L647-F680 HydrophobicContact CD2-CG 4.46Å; L676-F680 VanDerWaalsContact O-CB 3.3Å; L676-F680 WeakPolarHBondContact O-CB 3.12Å; L676-F680 PolarHBondContact O-N 2.98Å; E677-F680 PolarHBondContact O-N 2.74Å; F680-T682 VanDerWaalsContact C-N 3.32Å; F680-T682 PolarHBondContact O-N 3.44Å; F680-F683 PolarHBondContact O-N 3.35Å; F680-F683 VanDerWaalsContact O-N 3.12Å; F680-V684 HydrophobicContact CD1-CG2 4.06Å; F680-V684 HydrophobicContact CD2-CG2 3.93Å; F680-V684 HydrophobicContact CE1-CG2 3.6Å; F680-V684 HydrophobicContact CE2-CG2 3.48Å; F680-V684 VanDerWaalsContact CE2-CG2 3.48Å; F680-V684 HydrophobicContact CG-CG2 4.23Å; F680-V684 HydrophobicContact CZ-CG2 3.31Å; F680-V684 WeakPolarHBondContact O-CG2 3.05Å; F680-V684 PolarHBondContact O-N 3.06Å; F680-V684 VanDerWaalsContact O-N 3.07Å
681	S	82.7	Confident	68.6	Low	50 Å²	50	55.2 Å²	55.2	35%	0.35	29%	0.289	S	S	.	.	H	α-helix	trans	-56.1	-46.4	177.9	-70.8	0	0	0	0	111.8	E677 F683 V684 D685	E677-S681 WeakPolarHBondContact O-CB 2.93Å; E677-S681 PolarHBondContact O-N 3.19Å; E677-S681 PolarHBondContact O-OG 2.84Å; E677-S681 VanDerWaalsContact O-OG 3.13Å; S681-F683 PolarHBondContact O-N 3.36Å; S681-V684 PolarHBondContact O-N 3.34Å; S681-D685 PolarHBondContact O-N 3.15Å; S681-D685 VanDerWaalsContact O-N 3.11Å
682	T	80.4	Confident	65.6	Low	13 Å²	13	61 Å²	61	8%	0.08	31%	0.313	C	S	.	.	H	α-helix	trans	-59.6	-30.6	179.1	-54	0	0	0	0	113	E579 V582 A678 L679 F680	E579-T682 HydrophobicContact CG-CG2 4.2Å; V582-T682 HydrophobicContact CG1-CG2 3.94Å; A678-T682 PolarHBondContact O-OG1 3.25Å; L679-T682 PolarHBondContact O-N 3.03Å; F680-T682 VanDerWaalsContact C-N 3.32Å; F680-T682 PolarHBondContact O-N 3.44Å
683	F	75.2	Confident	62.4	Low	18 Å²	18	71.6 Å²	71.6	8%	0.079	35%	0.354	C	S	.	.	H	α-helix	trans	-84.8	-31.3	178.4	-67.4	-60.6	0	0	0	114.2	L586 I598 F601 L679 F680 S681	L586-F683 HydrophobicContact CD1-CE1 3.99Å; L586-F683 HydrophobicContact CD1-CE2 4.26Å; L586-F683 HydrophobicContact CD1-CZ 3.41Å; L586-F683 VanDerWaalsContact CD1-CZ 3.41Å; L586-F683 HydrophobicContact CD2-CE2 4.45Å; L586-F683 HydrophobicContact CD2-CZ 3.88Å; L586-F683 HydrophobicContact CG-CZ 4.29Å; I598-F683 HydrophobicContact CB-CE1 4.31Å; I598-F683 HydrophobicContact CD1-CE1 4.48Å; I598-F683 HydrophobicContact CG1-CE1 3.62Å; I598-F683 HydrophobicContact CG1-CZ 3.72Å; I598-F683 HydrophobicContact CG2-CE1 4.26Å; F601-F683 HydrophobicContact CB-CB 4.2Å; F601-F683 HydrophobicContact CB-CD2 3.51Å; F601-F683 HydrophobicContact CB-CE2 4.12Å; F601-F683 HydrophobicContact CB-CG 3.97Å; F601-F683 HydrophobicContact CD1-CD2 4.49Å; F601-F683 AromaticContact CD2-CD2 3.72Å; F601-F683 HydrophobicContact CD2-CD2 3.72Å; F601-F683 AromaticContact CD2-CE2 3.56Å; F601-F683 HydrophobicContact CD2-CE2 3.56Å; F601-F683 HydrophobicContact CE2-CE2 4.21Å; F601-F683 AromaticContact CG-CD2 3.68Å; F601-F683 HydrophobicContact CG-CD2 3.68Å; F601-F683 HydrophobicContact CG-CE2 4.04Å; L679-F683 WeakPolarHBondContact O-CD2 3.43Å; F680-F683 PolarHBondContact O-N 3.35Å; F680-F683 VanDerWaalsContact O-N 3.12Å; S681-F683 PolarHBondContact O-N 3.36Å
684	V	66.8	Low	59.3	Low	28 Å²	28	77.8 Å²	77.8	17%	0.17	39%	0.393	C	S	.	.	H	α-helix	trans	-75.2	-34.6	178.8	176.2	0	0	0	0	111.5	F680 S681 F686 V687 S688	F680-V684 HydrophobicContact CD1-CG2 4.06Å; F680-V684 HydrophobicContact CD2-CG2 3.93Å; F680-V684 HydrophobicContact CE1-CG2 3.6Å; F680-V684 HydrophobicContact CE2-CG2 3.48Å; F680-V684 VanDerWaalsContact CE2-CG2 3.48Å; F680-V684 HydrophobicContact CG-CG2 4.23Å; F680-V684 HydrophobicContact CZ-CG2 3.31Å; F680-V684 WeakPolarHBondContact O-CG2 3.05Å; F680-V684 PolarHBondContact O-N 3.06Å; F680-V684 VanDerWaalsContact O-N 3.07Å; S681-V684 PolarHBondContact O-N 3.34Å; V684-F686 VanDerWaalsContact C-N 3.28Å; V684-F686 PolarHBondContact O-N 2.93Å; V684-V687 PolarHBondContact O-N 2.98Å; V684-V687 VanDerWaalsContact O-N 3.16Å; V684-S688 PolarHBondContact O-N 3.3Å; V684-S688 PolarHBondContact O-OG 3.15Å
685	D	55.9	Low	56.2	Low	92 Å²	92	77 Å²	77	49%	0.492	41%	0.405	S	S	.	.	H	α-helix	trans	-64.9	-34.6	176.3	-65.3	-25.6	0	0	0	111.1	S681 V687 S688 E689	S681-D685 PolarHBondContact O-N 3.15Å; S681-D685 VanDerWaalsContact O-N 3.11Å; D685-V687 PolarHBondContact O-N 2.97Å; D685-S688 PolarHBondContact O-N 2.86Å; D685-E689 PolarHBondContact O-N 2.89Å; D685-E689 VanDerWaalsContact O-N 3.13Å
686	F	40.7	Very low	53	Low	132 Å²	132	85.6 Å²	85.6	58%	0.579	45%	0.445	S	S	*	.	H	α-helix	trans	-60.8	-24.8	173.8	-123.8	-85.3	0	0	0	114.2	V684	V684-F686 VanDerWaalsContact C-N 3.28Å; V684-F686 PolarHBondContact O-N 2.93Å
687	V	38.1	Very low	49.7	Very low	89 Å²	89	91.9 Å²	91.9	54%	0.539	48%	0.483	S	S	.	.	H	α-helix	trans	-86.3	-18.7	176.3	-177.6	0	0	0	0	111.5	V684 D685	V684-V687 PolarHBondContact O-N 2.98Å; V684-V687 VanDerWaalsContact O-N 3.16Å; D685-V687 PolarHBondContact O-N 2.97Å
688	S	31.2	Very low	46.6	Very low	65 Å²	65	97.3 Å²	97.3	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-93.5	-36.8	-174.7	-56	0	0	0	0	112.5	V684 D685 E690 S691	V684-S688 PolarHBondContact O-N 3.3Å; V684-S688 PolarHBondContact O-OG 3.15Å; D685-S688 PolarHBondContact O-N 2.86Å; S688-E690 PolarHBondContact O-N 3.34Å; S688-S691 PolarHBondContact O-N 3.33Å; S688-S691 PolarHBondContact O-OG 3.27Å
689	E	24.4	Very low	43.4	Very low	156 Å²	156	104.5 Å²	104.5	73%	0.729	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-72.7	-23.3	-176.2	-73.3	-167.4	159.4	0	0	115.1	D685 S691	D685-E689 PolarHBondContact O-N 2.89Å; D685-E689 VanDerWaalsContact O-N 3.13Å; E689-S691 PolarHBondContact O-N 2.69Å; E689-S691 VanDerWaalsContact O-N 3.07Å
690	E	26.2	Very low	40.1	Very low	171 Å²	171	110.4 Å²	110.4	80%	0.799	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-70.2	-1	173.6	-72.3	-167.4	160.7	0	0	113.4	S688	S688-E690 PolarHBondContact O-N 3.34Å
691	S	28	Very low	36.9	Very low	94 Å²	94	119 Å²	119	66%	0.657	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-103.1	-1.8	179.5	70.1	0	0	0	0	116.5	S688 E689	S688-S691 PolarHBondContact O-N 3.33Å; S688-S691 PolarHBondContact O-OG 3.27Å; E689-S691 PolarHBondContact O-N 2.69Å; E689-S691 VanDerWaalsContact O-N 3.07Å
692	E	24.7	Very low	34.1	Very low	165 Å²	165	121.6 Å²	121.6	77%	0.771	65%	0.65	S	S	*	*	S	Bend	trans	-114.8	-1.4	-176.6	-79.6	-168.1	161.8	0	0	117.4
693	Y	23.9	Very low	31.3	Very low	224 Å²	224	129.9 Å²	129.9	88%	0.878	69%	0.688	S	S	*	*	S	Bend	trans	-106.4	68.1	170.2	-85.1	-86.5	0	0	0	112.7
694	T	24.7	Very low	28.9	Very low	143 Å²	143	135 Å²	135	88%	0.877	73%	0.726	S	S	*	*			trans	-155	61.2	150.4	-7.3	0	0	0	0	110.9
695	S	23.2	Very low	26.7	Very low	95 Å²	95	142.2 Å²	142.2	66%	0.664	76%	0.758	S	S	*	*			trans	-113.6	133.8	154.3	56.9	0	0	0	0	107.6
696	Q	21.5	Very low	25.2	Very low	181 Å²	181	143.8 Å²	143.8	85%	0.846	77%	0.77	S	S	*	*			trans	83.2	119.5	-170	-46.3	170	21.3	0	0	111.7
697	T	23.3	Very low	24.2	Very low	131 Å²	131	144.2 Å²	144.2	80%	0.804	78%	0.778	S	S	*	*			cis	-165.3	152.7	34.8	-30.8	0	0	0	0	110.9
698	K	22.1	Very low	23.4	Very low	185 Å²	185	146.4 Å²	146.4	80%	0.804	79%	0.786	S	S	*	*			trans	-28.7	144.6	169.6	-63.4	166.8	176.1	175.9	0	119
699	N	20.2	Very low	23	Very low	150 Å²	150	147.8 Å²	147.8	80%	0.802	80%	0.796	S	S	*	*			trans	30.4	117.6	135.9	-62.4	-8.4	0	0	0	118.8
700	S	22.1	Very low	22.9	Very low	124 Å²	124	147.3 Å²	147.3	87%	0.867	80%	0.798	S	S	*	*				170.6	153.6	106.5	38.7	0	0	0	0	112.2
701	E	20.2	Very low	22.8	Very low	193 Å²	193	146.9 Å²	146.9	90%	0.902	80%	0.801	S	S	*	*			trans	-57.7	141.8	-177	-60.6	151.4	157.3	0	0	114.6
702	A	23.8	Very low	22.6	Very low	104 Å²	104	150 Å²	150	86%	0.86	81%	0.805	S	S	*	*			trans	173.3	148.4	130.5	0	0	0	0	0	112.6
703	Q	21.4	Very low	22.6	Very low	188 Å²	188	150.6 Å²	150.6	88%	0.879	80%	0.8	S	S	*	*			trans	-66.5	147.6	-177	-62.3	153.4	-21.2	0	0	114.1
704	S	23.7	Very low	22.6	Very low	124 Å²	124	145.3 Å²	145.3	87%	0.867	79%	0.787	S	S	*	*				171.5	149.4	125.7	47.4	0	0	0	0	113.2
705	H	21.4	Very low	22.7	Very low	181 Å²	181	147.9 Å²	147.9	84%	0.838	78%	0.782	S	S	*	*			trans	-55.5	152.9	179.2	-81.4	-115.1	0	0	0	115.3
706	V	24.7	Very low	22.7	Very low	125 Å²	125	149 Å²	149	76%	0.758	78%	0.779	S	S	*	*				159.3	128	117.4	163.2	0	0	0	0	112
707	L	20.5	Very low	22.8	Very low	141 Å²	141	144.7 Å²	144.7	74%	0.738	77%	0.769	S	S	*	*			trans	23.9	132.2	153.9	-75.6	92.2	0	0	0	124.3
708	D	21	Very low	22.9	Very low	134 Å²	134	147.9 Å²	147.9	72%	0.717	77%	0.773	S	S	*	*				70.8	125.4	129.8	-74.5	-15.8	0	0	0	123.8
709	S	21.9	Very low	23.1	Very low	95 Å²	95	144.2 Å²	144.2	66%	0.664	77%	0.77	S	S	*	*			trans	62.6	101.2	143	53.2	0	0	0	0	118.1
710	N	23.4	Very low	23.4	Very low	145 Å²	145	144.5 Å²	144.5	78%	0.775	77%	0.766	S	S	*	*				-175.9	122.1	121.5	-89.4	-38.1	0	0	0	111.6	Q712	N710-Q712 PolarHBondContact O-N 3.38Å
711	L	24.3	Very low	23.5	Very low	163 Å²	163	146 Å²	146	85%	0.853	76%	0.758	S	S	*	*			trans	13.8	87.1	149.4	-66.2	158.7	0	0	0	117
712	Q	22.9	Very low	23.7	Very low	158 Å²	158	145.6 Å²	145.6	74%	0.738	76%	0.756	S	S	*	*			trans	-128.8	92.5	157.3	-81.3	-178.6	-19.3	0	0	108.4	N710 N714	N710-Q712 PolarHBondContact O-N 3.38Å; Q712-N714 PolarHBondContact O-N 3.1Å
713	R	24.1	Very low	23.7	Very low	179 Å²	179	148.4 Å²	148.4	68%	0.675	75%	0.751	S	S	*	*			trans	-79.2	70	168	-161.3	-174.7	-68.1	-176.9	-1	107.1	Y715	R713-Y715 PolarHBondContact O-N 3.26Å
714	N	24.9	Very low	23.7	Very low	113 Å²	113	146.2 Å²	146.2	60%	0.604	74%	0.744	S	S	*	*			trans	-66.8	113.5	177.4	-75	-19	0	0	0	109.3	Q712 I716	Q712-N714 PolarHBondContact O-N 3.1Å; N714-I716 PolarHBondContact O-N 3.28Å
715	Y	26.8	Very low	23.7	Very low	197 Å²	197	145.8 Å²	145.8	77%	0.773	74%	0.741	S	S	*	*			trans	-63.2	113.6	164.6	-84.6	-92.9	0	0	0	108.4	R713 S717	R713-Y715 PolarHBondContact O-N 3.26Å; Y715-S717 PolarHBondContact O-N 3.18Å
716	I	23.4	Very low	23.8	Very low	117 Å²	117	147.6 Å²	147.6	60%	0.6	74%	0.74	S	S	*	*			trans	-66.7	113.8	-179.5	-62.5	169	0	0	0	108.5	N714 F721	N714-I716 PolarHBondContact O-N 3.28Å; I716-F721 HydrophobicContact CD1-CE2 4.28Å; I716-F721 HydrophobicContact CG2-CD2 3.99Å; I716-F721 HydrophobicContact CG2-CE2 4.2Å
717	S	22.5	Very low	23.6	Very low	91 Å²	91	150.8 Å²	150.8	64%	0.636	74%	0.74	S	S	*	*			trans	-63	145.4	172.4	179.5	0	0	0	0	111.6	Y715 S719	Y715-S717 PolarHBondContact O-N 3.18Å; S717-S719 PolarHBondContact O-N 2.99Å
718	F	26.3	Very low	23.7	Very low	199 Å²	199	151.9 Å²	151.9	87%	0.873	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-3.5	-163.7	-167.9	-104.4	0	0	0	115.9
719	S	26.1	Very low	23.8	Very low	107 Å²	107	149.5 Å²	149.5	75%	0.748	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-2.1	-177.6	54.3	0	0	0	0	115.5	S717	S717-S719 PolarHBondContact O-N 2.99Å
720	Q	26.4	Very low	23.8	Very low	156 Å²	156	153.3 Å²	153.3	73%	0.729	76%	0.755	S	S	*	*	S	Bend	trans	-113.9	3.8	177.5	-80.6	-176.5	-12.5	0	0	115.5	E722	Q720-E722 PolarHBondContact O-N 2.78Å
721	F	24.1	Very low	23.7	Very low	156 Å²	156	155.8 Å²	155.8	68%	0.684	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	1.7	179.6	-116.3	-85.8	0	0	0	115.3	I716	I716-F721 HydrophobicContact CD1-CE2 4.28Å; I716-F721 HydrophobicContact CG2-CD2 3.99Å; I716-F721 HydrophobicContact CG2-CE2 4.2Å
722	E	23.5	Very low	23.6	Very low	184 Å²	184	156.7 Å²	156.7	86%	0.86	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	5.4	177.5	-125.3	-173.4	-176	0	0	114.8	Q720	Q720-E722 PolarHBondContact O-N 2.78Å
723	H	24.5	Very low	23.5	Very low	163 Å²	163	154.9 Å²	154.9	76%	0.755	76%	0.758	S	S	*	*	S	Bend	trans	-136.7	13.7	-173.5	-120.8	-77.4	0	0	0	118.4
724	I	22.3	Very low	23.2	Very low	142 Å²	142	151.9 Å²	151.9	73%	0.728	77%	0.765	S	S	*	*			trans	-121.5	62.1	172.9	-47.2	179.4	0	0	0	110.4
725	S	23	Very low	23.1	Very low	115 Å²	115	152 Å²	152	80%	0.804	78%	0.775	S	S	*	*			trans	-121.5	50.6	152.9	39.3	0	0	0	0	109.2
726	R	23	Very low	22.8	Very low	220 Å²	220	152 Å²	152	83%	0.83	78%	0.782	S	S	*	*			trans	-149.7	71.8	166.8	-73.3	-166.2	-176	157.2	3.3	111.5
727	Y	21.5	Very low	22.9	Very low	192 Å²	192	151.9 Å²	151.9	75%	0.753	79%	0.791	S	S	*	*			trans	-146.4	97.9	156.9	-100.6	-88.2	0	0	0	107.3
728	Q	22.1	Very low	22.9	Very low	164 Å²	164	156 Å²	156	77%	0.766	80%	0.804	S	S	*	*				89.9	93.3	108.7	-79.5	-172.7	-5.5	0	0	112.8
729	G	23.4	Very low	23	Very low	83 Å²	83	151.2 Å²	151.2	86%	0.856	80%	0.796	S	S	*	*			trans	-115.2	122.7	149.5	0	0	0	0	0	107.3
730	E	22.2	Very low	23.5	Very low	175 Å²	175	151.2 Å²	151.2	82%	0.818	79%	0.793	S	S	*	*			trans	-72.4	162.9	-161.8	-69.8	167.5	132.5	0	0	115.6	H732	E730-H732 PolarHBondContact O-N 3.36Å
731	K	20	Very low	23.5	Very low	197 Å²	197	154.1 Å²	154.1	86%	0.857	80%	0.799	S	S	*	*			trans	-55.6	122.3	169.1	-65.4	167.1	174	174	0	110.8
732	H	22.4	Very low	23.6	Very low	183 Å²	183	152.2 Å²	152.2	85%	0.847	80%	0.802	S	S	*	*			trans	-126.4	126.2	146.8	-90	-77	0	0	0	110	E730	E730-H732 PolarHBondContact O-N 3.36Å
733	T	20.3	Very low	23.8	Very low	119 Å²	119	148.9 Å²	148.9	73%	0.73	80%	0.795	S	S	*	*			trans	-65.1	139	179.5	44.2	0	0	0	0	112.1
734	S	18.6	Very low	24.2	Very low	116 Å²	116	148.6 Å²	148.6	81%	0.811	80%	0.799	S	S	*	*			trans	-4.1	117.8	149.9	48.5	0	0	0	0	117.6
735	S	23.2	Very low	25.3	Very low	116 Å²	116	146.7 Å²	146.7	81%	0.811	79%	0.793	S	S	*	*			trans	-150.7	122.5	137	47.2	0	0	0	0	109.3
736	E	20	Very low	26.7	Very low	197 Å²	197	147.4 Å²	147.4	92%	0.921	79%	0.793	S	S	*	*			trans	-75.2	127.9	175.4	-67	168.6	146.2	0	0	109.4
737	S	25.9	Very low	28.5	Very low	115 Å²	115	139.8 Å²	139.8	80%	0.804	78%	0.777	S	S	*	*			trans	-147.2	112.5	155.8	61.2	0	0	0	0	109.3
738	I	22.2	Very low	30.8	Very low	176 Å²	176	131.2 Å²	131.2	90%	0.903	75%	0.745	S	S	*	*			trans	-68.3	126.8	178.4	-63.9	157.1	0	0	0	109.1
739	S	27.6	Very low	33.1	Very low	99 Å²	99	127.1 Å²	127.1	69%	0.692	73%	0.731	S	S	*	*			trans	-146	138.9	160.7	-174.9	0	0	0	0	109.9
740	P	36.4	Very low	35.3	Very low	107 Å²	107	127.4 Å²	127.4	70%	0.695	71%	0.712	S	S	*	*			trans	-101.2	101.5	-157	35.5	-25.3	0	0	0	111.9
741	Y	27.8	Very low	37.5	Very low	218 Å²	218	125.9 Å²	125.9	86%	0.855	71%	0.709	S	S	*	*			trans	-139	133.5	152	-72.1	-76.3	0	0	0	109.5	T743	Y741-T743 PolarHBondContact O-N 3.22Å
742	P	26.9	Very low	40.1	Very low	115 Å²	115	118.4 Å²	118.4	75%	0.747	68%	0.68	S	S	*	*			trans	-73.8	125.4	-166.8	29	-33	0	0	0	112.4
743	T	26.8	Very low	42.6	Very low	115 Å²	115	114.3 Å²	114.3	71%	0.706	67%	0.67	S	S	*	*			trans	62	95.4	132.3	-35.2	0	0	0	0	118.4	Y741 V745	Y741-T743 PolarHBondContact O-N 3.22Å; T743-V745 PolarHBondContact O-N 2.74Å
744	N	32.3	Very low	45.6	Very low	157 Å²	157	110.7 Å²	110.7	84%	0.84	65%	0.648	S	S	*	*			trans	35.6	71.1	139.1	-67.8	-21.2	0	0	0	117.2
745	V	45.5	Very low	48.5	Very low	101 Å²	101	106.3 Å²	106.3	61%	0.612	62%	0.618	S	S	*	*			trans	-86.3	108.2	153.1	-177.3	0	0	0	0	106.6	T743 A747	T743-V745 PolarHBondContact O-N 2.74Å; V745-A747 PolarHBondContact O-N 3.39Å
746	V	53.3	Low	51.1	Low	131 Å²	131	105.5 Å²	105.5	79%	0.794	61%	0.61	S	S	*	*			trans	-61.9	110.2	173.4	-178.9	0	0	0	0	107.5
747	A	61.1	Low	53.9	Low	60 Å²	60	101.4 Å²	101.4	50%	0.496	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-63.4	136.3	175.6	0	0	0	0	0	109.5	V745 T749	V745-A747 PolarHBondContact O-N 3.39Å; A747-T749 PolarHBondContact O-N 3.2Å
748	P	69.4	Low	56.8	Low	12 Å²	12	96.3 Å²	96.3	8%	0.078	56%	0.563	C	S	.	*	P	Polyproline II helix	trans	-63.5	136.8	176.8	26.1	-32.7	0	0	0	110.1	T752 R824 Y827 P833 P834	P748-T752 HydrophobicContact CB-CG2 4.5Å; P748-R824 HydrophobicContact CB-CB 3.8Å; P748-Y827 HydrophobicContact CG-CD2 4.08Å; P748-P833 WeakPolarHBondContact O-CB 3.18Å; P748-P833 VanDerWaalsContact O-CG 3.29Å; P748-P833 WeakPolarHBondContact O-CG 3.46Å; P748-P834 WeakPolarHBondContact CG-O 3.44Å
749	T	71	Confident	59.6	Low	77 Å²	77	91.4 Å²	91.4	47%	0.472	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-98.6	166.1	171.1	64.4	0	0	0	0	110.4	A747 N751 T752	A747-T749 PolarHBondContact O-N 3.2Å; T749-N751 PolarHBondContact O-N 3.38Å; T749-N751 PolarHBondContact OG1-N 3.11Å; T749-T752 PolarHBondContact N-OG1 3.31Å; T749-T752 WeakPolarHBondContact O-CB 3.35Å; T749-T752 PolarHBondContact O-N 2.88Å; T749-T752 PolarHBondContact O-OG1 3.36Å; T749-T752 PolarHBondContact OG1-OG1 2.91Å
750	I	68.9	Low	62.1	Low	89 Å²	89	91.2 Å²	91.2	46%	0.456	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-17.7	173.8	-59.2	176.4	0	0	0	111.9	R824 P833	I750-R824 PolarHBondContact O-NH1 3.03Å; I750-R824 PolarHBondContact O-NH2 3.14Å; I750-R824 VanDerWaalsContact O-NH2 3.07Å; I750-P833 HydrophobicContact CG1-CG 4.35Å
751	N	68.6	Low	64.3	Low	143 Å²	143	88.5 Å²	88.5	77%	0.765	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	3.7	177.4	-64.4	-34.4	0	0	0	113.7	T749 P753	T749-N751 PolarHBondContact O-N 3.38Å; T749-N751 PolarHBondContact OG1-N 3.11Å; N751-P753 VanDerWaalsContact O-CD 3.24Å; N751-P753 WeakPolarHBondContact O-CD 3.45Å
752	T	74.4	Confident	67.2	Low	40 Å²	40	78.2 Å²	78.2	25%	0.245	48%	0.479	C	S	.	.			trans	-77.3	114.1	179.9	-54.1	0	0	0	0	109.8	P748 T749 R824	P748-T752 HydrophobicContact CB-CG2 4.5Å; T749-T752 PolarHBondContact N-OG1 3.31Å; T749-T752 WeakPolarHBondContact O-CB 3.35Å; T749-T752 PolarHBondContact O-N 2.88Å; T749-T752 PolarHBondContact O-OG1 3.36Å; T749-T752 PolarHBondContact OG1-OG1 2.91Å; T752-R824 WeakPolarHBondContact O-CD 3.44Å
753	P	74.4	Confident	69.9	Low	98 Å²	98	79.3 Å²	79.3	64%	0.636	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-67.3	150.4	177.3	27.9	-33.2	0	0	0	110.8	N751 G825	N751-P753 VanDerWaalsContact O-CD 3.24Å; N751-P753 WeakPolarHBondContact O-CD 3.45Å; P753-G825 WeakPolarHBondContact O-CA 3.4Å; P753-G825 PolarHBondContact O-N 3.1Å
754	P	83.5	Confident	72.4	Confident	42 Å²	42	81.2 Å²	81.2	27%	0.273	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-51.4	135	168.4	-33.2	40.4	0	0	0	113.3	I759 H823	P754-I759 HydrophobicContact CB-CD1 3.88Å; P754-I759 HydrophobicContact CB-CG1 3.98Å; P754-H823 HydrophobicContact CG-CB 4.37Å
755	S	78.8	Confident	74.9	Confident	25 Å²	25	75.5 Å²	75.5	18%	0.175	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-73.4	139.8	174.1	95.2	0	0	0	0	110.6	T757 S758 I759 G825 D826	S755-T757 PolarHBondContact O-N 2.95Å; S755-S758 PolarHBondContact O-N 3.06Å; S755-S758 WeakPolarHBondContact OG-CB 3.46Å; S755-S758 PolarHBondContact OG-N 3.33Å; S755-I759 WeakPolarHBondContact O-CG1 3.46Å; S755-I759 PolarHBondContact O-N 3.44Å; S755-G825 PolarHBondContact N-O 3.44Å; S755-D826 WeakPolarHBondContact CB-OD1 3.3Å; S755-D826 PolarHBondContact OG-OD1 3.05Å
756	P	78.2	Confident	76.8	Confident	98 Å²	98	70.8 Å²	70.8	64%	0.636	41%	0.411	S	S	*	.	H	α-helix	trans	-57.6	-34	176	-25.6	34.1	0	0	0	113.3	T760	P756-T760 WeakPolarHBondContact O-CB 3.39Å; P756-T760 PolarHBondContact O-N 3.03Å; P756-T760 VanDerWaalsContact O-N 3.07Å; P756-T760 PolarHBondContact O-OG1 3.1Å
757	T	80.1	Confident	77.9	Confident	112 Å²	112	69.7 Å²	69.7	69%	0.687	40%	0.397	S	S	*	.	H	α-helix	trans	-66	-45.8	177.6	-48.7	0	0	0	0	111.1	S755 T760 A761	S755-T757 PolarHBondContact O-N 2.95Å; T757-T760 PolarHBondContact O-N 3.38Å; T757-A761 WeakPolarHBondContact O-CB 3.36Å; T757-A761 PolarHBondContact O-N 2.96Å
758	S	85.1	Confident	78.6	Confident	8 Å²	8	72.1 Å²	72.1	6%	0.056	40%	0.402	C	S	.	.	H	α-helix	trans	-64.6	-43.1	177.3	176.9	0	0	0	0	111.8	S755 T760 A761 N762 H823 D826 F828	S755-S758 PolarHBondContact O-N 3.06Å; S755-S758 WeakPolarHBondContact OG-CB 3.46Å; S755-S758 PolarHBondContact OG-N 3.33Å; S758-T760 VanDerWaalsContact C-N 3.33Å; S758-T760 PolarHBondContact O-N 3.35Å; S758-A761 PolarHBondContact O-N 2.88Å; S758-N762 VanDerWaalsContact O-CB 3.24Å; S758-N762 WeakPolarHBondContact O-CB 3.44Å; S758-N762 PolarHBondContact O-N 2.93Å; S758-H823 PolarHBondContact OG-NE2 2.99Å; S758-D826 WeakPolarHBondContact CB-OD1 3.39Å; S758-D826 PolarHBondContact OG-O 2.75Å; S758-F828 WeakPolarHBondContact OG-CE2 3.4Å
759	I	81.9	Confident	79.1	Confident	72 Å²	72	73.7 Å²	73.7	37%	0.369	41%	0.408	S	S	.	.	H	α-helix	trans	-56.5	-48.8	174.1	-64.8	168.9	0	0	0	110.6	P754 S755 K763	P754-I759 HydrophobicContact CB-CD1 3.88Å; P754-I759 HydrophobicContact CB-CG1 3.98Å; S755-I759 WeakPolarHBondContact O-CG1 3.46Å; S755-I759 PolarHBondContact O-N 3.44Å; I759-K763 VanDerWaalsContact O-CB 3.3Å; I759-K763 WeakPolarHBondContact O-CB 3.46Å; I759-K763 PolarHBondContact O-N 2.91Å
760	T	79.9	Confident	79.2	Confident	96 Å²	96	73.6 Å²	73.6	59%	0.589	40%	0.402	S	S	*	.	H	α-helix	trans	-68.2	-42.5	-175.5	-51.6	0	0	0	0	111.7	P756 T757 S758 K763 K764	P756-T760 WeakPolarHBondContact O-CB 3.39Å; P756-T760 PolarHBondContact O-N 3.03Å; P756-T760 VanDerWaalsContact O-N 3.07Å; P756-T760 PolarHBondContact O-OG1 3.1Å; T757-T760 PolarHBondContact O-N 3.38Å; S758-T760 VanDerWaalsContact C-N 3.33Å; S758-T760 PolarHBondContact O-N 3.35Å; T760-K763 PolarHBondContact O-N 3.31Å; T760-K764 PolarHBondContact O-N 3.44Å; T760-K764 VanDerWaalsContact O-N 3.12Å
761	A	82.4	Confident	80	Confident	49 Å²	49	70.4 Å²	70.4	41%	0.405	38%	0.384	S	S	.	.	H	α-helix	trans	-62.2	-47.9	176.2	0	0	0	0	0	111.6	T757 S758 K763 K764 D765 L840	T757-A761 WeakPolarHBondContact O-CB 3.36Å; T757-A761 PolarHBondContact O-N 2.96Å; S758-A761 PolarHBondContact O-N 2.88Å; A761-K763 PolarHBondContact O-N 2.92Å; A761-K764 PolarHBondContact O-N 3.23Å; A761-D765 PolarHBondContact O-N 3.05Å; A761-D765 VanDerWaalsContact O-N 3.07Å; A761-L840 HydrophobicContact CB-CD2 4.17Å
762	N	87.8	Confident	80.9	Confident	3 Å²	3	65.1 Å²	65.1	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-65	-38.8	179.1	-171.4	56.2	0	0	0	112.3	S758 K764 D765 L766 F806 F828 L840 V841	S758-N762 VanDerWaalsContact O-CB 3.24Å; S758-N762 WeakPolarHBondContact O-CB 3.44Å; S758-N762 PolarHBondContact O-N 2.93Å; N762-K764 VanDerWaalsContact C-N 3.35Å; N762-K764 PolarHBondContact O-N 3.35Å; N762-D765 PolarHBondContact O-N 3.42Å; N762-L766 WeakPolarHBondContact ND2-CD1 3.32Å; N762-L766 WeakPolarHBondContact O-CB 2.95Å; N762-L766 WeakPolarHBondContact O-CG 3.25Å; N762-L766 PolarHBondContact O-N 2.96Å; N762-F806 WeakPolarHBondContact ND2-CE2 3.5Å; N762-F806 WeakPolarHBondContact ND2-CZ 3.49Å; N762-F828 HydrophobicContact CB-CE2 4.01Å; N762-F828 HydrophobicContact CB-CZ 3.71Å; N762-F828 WeakPolarHBondContact ND2-CZ 3.45Å; N762-L840 HydrophobicContact CB-CD2 4.12Å; N762-V841 WeakPolarHBondContact ND2-CG2 3.48Å; N762-V841 WeakPolarHBondContact OD1-CB 3.39Å; N762-V841 WeakPolarHBondContact OD1-CG2 3.38Å; N762-V841 PolarHBondContact OD1-N 3.18Å
763	K	83.7	Confident	81.3	Confident	137 Å²	137	66 Å²	66	60%	0.596	35%	0.353	S	S	*	.	H	α-helix	trans	-61.8	-40.7	175	-174.2	175.7	-178.6	176.9	0	112.3	I759 T760 A761 Q767	I759-K763 VanDerWaalsContact O-CB 3.3Å; I759-K763 WeakPolarHBondContact O-CB 3.46Å; I759-K763 PolarHBondContact O-N 2.91Å; T760-K763 PolarHBondContact O-N 3.31Å; A761-K763 PolarHBondContact O-N 2.92Å; K763-Q767 VanDerWaalsContact O-CG 3.31Å; K763-Q767 WeakPolarHBondContact O-CG 3.36Å; K763-Q767 PolarHBondContact O-N 3.06Å
764	K	79.9	Confident	81.7	Confident	155 Å²	155	61.9 Å²	61.9	67%	0.674	33%	0.328	S	S	*	.	H	α-helix	trans	-66.9	-39.6	177.4	-173.4	-178.8	178.4	-176.3	0	111.7	T760 A761 N762	T760-K764 PolarHBondContact O-N 3.44Å; T760-K764 VanDerWaalsContact O-N 3.12Å; A761-K764 PolarHBondContact O-N 3.23Å; N762-K764 VanDerWaalsContact C-N 3.35Å; N762-K764 PolarHBondContact O-N 3.35Å
765	D	85.5	Confident	81.4	Confident	38 Å²	38	66.4 Å²	66.4	20%	0.203	35%	0.35	C	S	.	.	H	α-helix	trans	-70.8	-49.8	179.4	-178	71.8	0	0	0	112.4	A761 N762 Q767 N768 Q769 L840 S842	A761-D765 PolarHBondContact O-N 3.05Å; A761-D765 VanDerWaalsContact O-N 3.07Å; N762-D765 PolarHBondContact O-N 3.42Å; D765-Q767 PolarHBondContact O-N 3.49Å; D765-Q767 VanDerWaalsContact O-N 3.17Å; D765-N768 WeakPolarHBondContact O-CB 3.41Å; D765-N768 PolarHBondContact O-N 3.14Å; D765-Q769 PolarHBondContact O-N 3Å; D765-Q769 PolarHBondContact OD1-NE2 2.78Å; D765-Q769 PolarHBondContact OD2-NE2 3.47Å; D765-L840 HydrophobicContact CB-CD1 4.46Å; D765-S842 VanDerWaalsContact CG-OG 3.31Å; D765-S842 WeakPolarHBondContact OD2-CB 3.3Å; D765-S842 PolarHBondContact OD2-OG 3.47Å
766	L	85.5	Confident	81.3	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-58	-32.7	-179.8	-77.6	175.5	0	0	0	113.5	N762 N768 Q769 W771 Y772 F806 V841	N762-L766 WeakPolarHBondContact ND2-CD1 3.32Å; N762-L766 WeakPolarHBondContact O-CB 2.95Å; N762-L766 WeakPolarHBondContact O-CG 3.25Å; N762-L766 PolarHBondContact O-N 2.96Å; L766-N768 PolarHBondContact O-N 3.16Å; L766-Q769 PolarHBondContact O-N 3.28Å; L766-Q769 VanDerWaalsContact O-N 3.08Å; L766-W771 HydrophobicContact CD2-CH2 3.82Å; L766-W771 HydrophobicContact CD2-CZ3 3.86Å; L766-Y772 HydrophobicContact CB-CD1 3.84Å; L766-Y772 HydrophobicContact CB-CD2 4.46Å; L766-Y772 HydrophobicContact CB-CE1 3.94Å; L766-Y772 HydrophobicContact CB-CG 4.08Å; L766-Y772 HydrophobicContact CD1-CD2 4.41Å; L766-Y772 HydrophobicContact CD1-CE2 4.12Å; L766-Y772 HydrophobicContact CD2-CD2 3.93Å; L766-Y772 HydrophobicContact CD2-CE2 4.46Å; L766-Y772 HydrophobicContact CD2-CG 3.98Å; L766-Y772 WeakPolarHBondContact O-CD1 3.25Å; L766-F806 HydrophobicContact CD1-CD1 3.94Å; L766-F806 HydrophobicContact CD1-CE1 3.29Å; L766-F806 HydrophobicContact CD1-CE2 4.24Å; L766-F806 HydrophobicContact CD1-CZ 3.47Å; L766-F806 VanDerWaalsContact CD1-CZ 3.47Å; L766-V841 HydrophobicContact CD1-CB 4.49Å; L766-V841 HydrophobicContact CD1-CG2 4.48Å; L766-V841 HydrophobicContact CD2-CB 3.99Å; L766-V841 HydrophobicContact CD2-CG1 3.97Å; L766-V841 HydrophobicContact CG-CB 4.47Å
767	Q	75.4	Confident	81.2	Confident	108 Å²	108	64.1 Å²	64.1	51%	0.505	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.9	174.7	-78.3	176.5	3.8	0	0	112.9	K763 D765 R869	K763-Q767 VanDerWaalsContact O-CG 3.31Å; K763-Q767 WeakPolarHBondContact O-CG 3.36Å; K763-Q767 PolarHBondContact O-N 3.06Å; D765-Q767 PolarHBondContact O-N 3.49Å; D765-Q767 VanDerWaalsContact O-N 3.17Å; Q767-R869 PolarHBondContact O-NH2 3.17Å
768	N	76.6	Confident	80.9	Confident	111 Å²	111	62 Å²	62	59%	0.594	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-12.6	179.2	-63.5	-31.7	0	0	0	113.4	D765 L766	D765-N768 WeakPolarHBondContact O-CB 3.41Å; D765-N768 PolarHBondContact O-N 3.14Å; L766-N768 PolarHBondContact O-N 3.16Å
769	Q	79.9	Confident	80.3	Confident	45 Å²	45	66.6 Å²	66.6	21%	0.21	34%	0.336	C	S	.	.			trans	-82	124.1	-177	-59.9	-59.4	-24.7	0	0	111.9	D765 L766 W771 Y772 R869	D765-Q769 PolarHBondContact O-N 3Å; D765-Q769 PolarHBondContact OD1-NE2 2.78Å; D765-Q769 PolarHBondContact OD2-NE2 3.47Å; L766-Q769 PolarHBondContact O-N 3.28Å; L766-Q769 VanDerWaalsContact O-N 3.08Å; Q769-W771 HydrophobicContact CB-CD2 4.07Å; Q769-W771 HydrophobicContact CB-CE3 4.36Å; Q769-W771 HydrophobicContact CB-CH2 4.02Å; Q769-W771 HydrophobicContact CB-CZ2 3.7Å; Q769-W771 HydrophobicContact CB-CZ3 4.32Å; Q769-W771 HydrophobicContact CG-CH2 3.88Å; Q769-W771 HydrophobicContact CG-CZ2 3.5Å; Q769-W771 PolarHBondContact O-N 2.79Å; Q769-Y772 PolarHBondContact O-N 2.91Å; Q769-R869 PolarHBondContact O-NH1 3.41Å; Q769-R869 VanDerWaalsContact O-NH1 3.14Å
770	E	73.2	Confident	80	Confident	74 Å²	74	67.7 Å²	67.7	35%	0.346	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-30.3	-176.4	-59.8	-152.4	150	0	0	114	Y772 S868 R869 R870	E770-Y772 PolarHBondContact O-N 3.17Å; E770-S868 PolarHBondContact OE2-OG 2.98Å; E770-S868 VanDerWaalsContact OE2-OG 3.08Å; E770-R869 PolarHBondContact O-N 2.83Å; E770-R870 IonicContact OE1-CZ 3.41Å; E770-R870 IonicContact OE1-NH1 3.35Å; E770-R870 PolarHBondContact OE1-NH1 2.78Å
771	W	85.6	Confident	80	Confident	22 Å²	22	63.3 Å²	63.3	8%	0.083	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-4.8	176.3	48.2	-102.2	0	0	0	112.9	L766 Q769 F793 L794 V795 V841 V845 P866	L766-W771 HydrophobicContact CD2-CH2 3.82Å; L766-W771 HydrophobicContact CD2-CZ3 3.86Å; Q769-W771 HydrophobicContact CB-CD2 4.07Å; Q769-W771 HydrophobicContact CB-CE3 4.36Å; Q769-W771 HydrophobicContact CB-CH2 4.02Å; Q769-W771 HydrophobicContact CB-CZ2 3.7Å; Q769-W771 HydrophobicContact CB-CZ3 4.32Å; Q769-W771 HydrophobicContact CG-CH2 3.88Å; Q769-W771 HydrophobicContact CG-CZ2 3.5Å; Q769-W771 PolarHBondContact O-N 2.79Å; W771-F793 HydrophobicContact CB-CE2 4.02Å; W771-F793 HydrophobicContact CD2-CE2 4.32Å; W771-F793 AromaticContact CG-CE2 3.89Å; W771-F793 HydrophobicContact CG-CE2 3.89Å; W771-L794 WeakPolarHBondContact O-CA 3.47Å; W771-V795 HydrophobicContact CE3-CB 3.57Å; W771-V795 HydrophobicContact CE3-CG2 3.42Å; W771-V795 VanDerWaalsContact CE3-CG2 3.42Å; W771-V795 HydrophobicContact CH2-CG2 4.41Å; W771-V795 HydrophobicContact CZ3-CB 3.5Å; W771-V795 HydrophobicContact CZ3-CG1 4.15Å; W771-V795 HydrophobicContact CZ3-CG2 3.34Å; W771-V795 PolarHBondContact O-N 3.48Å; W771-V841 HydrophobicContact CH2-CG1 4.14Å; W771-V841 HydrophobicContact CZ3-CG1 4.29Å; W771-V845 HydrophobicContact CH2-CB 4.22Å; W771-V845 HydrophobicContact CH2-CG2 3.75Å; W771-V845 HydrophobicContact CZ2-CB 4.04Å; W771-V845 HydrophobicContact CZ2-CG1 4.1Å; W771-V845 HydrophobicContact CZ2-CG2 4.06Å; W771-V845 HydrophobicContact CZ3-CG2 4.01Å; W771-P866 HydrophobicContact CB-CB 3.83Å; W771-P866 HydrophobicContact CG-CB 4.37Å
772	Y	86.5	Confident	79.7	Confident	33 Å²	33	66.5 Å²	66.5	13%	0.129	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-90.2	111.8	176.4	174.8	-113.7	0	0	0	110.8	L766 Q769 E770 V795 D797 F806 R869	L766-Y772 HydrophobicContact CB-CD1 3.84Å; L766-Y772 HydrophobicContact CB-CD2 4.46Å; L766-Y772 HydrophobicContact CB-CE1 3.94Å; L766-Y772 HydrophobicContact CB-CG 4.08Å; L766-Y772 HydrophobicContact CD1-CD2 4.41Å; L766-Y772 HydrophobicContact CD1-CE2 4.12Å; L766-Y772 HydrophobicContact CD2-CD2 3.93Å; L766-Y772 HydrophobicContact CD2-CE2 4.46Å; L766-Y772 HydrophobicContact CD2-CG 3.98Å; L766-Y772 WeakPolarHBondContact O-CD1 3.25Å; Q769-Y772 PolarHBondContact O-N 2.91Å; E770-Y772 PolarHBondContact O-N 3.17Å; Y772-V795 CarbonylContact C-O 3.56Å; Y772-V795 WeakPolarHBondContact CA-O 3.48Å; Y772-V795 HydrophobicContact CD2-CB 4.48Å; Y772-V795 HydrophobicContact CD2-CG1 4.26Å; Y772-D797 VanDerWaalsContact CE2-OD1 3.3Å; Y772-D797 WeakPolarHBondContact CE2-OD1 3.42Å; Y772-D797 PolarHBondContact OH-OD1 3.49Å; Y772-D797 PolarHBondContact OH-OD2 3.14Å; Y772-F806 HydrophobicContact CE2-CD1 4.14Å; Y772-F806 HydrophobicContact CE2-CE1 4.14Å; Y772-R869 WeakPolarHBondContact O-CD 3.06Å; Y772-R869 PolarHBondContact O-NH1 3.29Å
773	W	83.6	Confident	79.1	Confident	58 Å²	58	73.3 Å²	73.3	22%	0.22	35%	0.346	C	S	.	.			trans	-94.3	-5.7	-175.5	-75.9	70.2	0	0	0	114.1	I776 L784 V795 V867 S868 R869	W773-I776 HydrophobicContact CB-CB 4.2Å; W773-I776 HydrophobicContact CB-CG2 3.69Å; W773-I776 HydrophobicContact CD2-CD1 4.09Å; W773-I776 HydrophobicContact CE3-CD1 3.46Å; W773-I776 VanDerWaalsContact CE3-CD1 3.46Å; W773-I776 HydrophobicContact CZ3-CD1 3.97Å; W773-L784 HydrophobicContact CD2-CD1 4.43Å; W773-L784 HydrophobicContact CE3-CD1 4Å; W773-L784 HydrophobicContact CH2-CD1 3.47Å; W773-L784 VanDerWaalsContact CH2-CD1 3.47Å; W773-L784 HydrophobicContact CH2-CD2 3.79Å; W773-L784 HydrophobicContact CH2-CG 4.3Å; W773-L784 HydrophobicContact CZ2-CD1 3.97Å; W773-L784 HydrophobicContact CZ2-CD2 4.46Å; W773-L784 HydrophobicContact CZ3-CD1 3.49Å; W773-L784 VanDerWaalsContact CZ3-CD1 3.49Å; W773-L784 HydrophobicContact CZ3-CD2 4.41Å; W773-V795 PolarHBondContact N-O 3.28Å; W773-V867 HydrophobicContact CZ2-CG1 3.84Å; W773-V867 PolarHBondContact NE1-O 3.23Å; W773-S868 WeakPolarHBondContact CZ2-O 3.31Å; W773-R869 HydrophobicContact CD2-CB 3.83Å; W773-R869 HydrophobicContact CE3-CB 4.17Å; W773-R869 HydrophobicContact CG-CB 4.17Å; W773-R869 VanDerWaalsContact CZ2-CA 3.46Å; W773-R869 HydrophobicContact CZ2-CB 4.2Å
774	G	83.1	Confident	78.8	Confident	11 Å²	11	68.7 Å²	68.7	11%	0.113	33%	0.327	C	S	.	.			trans	63.5	-140.6	-175.7	0	0	0	0	0	112.2	I776 R796 D797	G774-I776 VanDerWaalsContact C-N 3.34Å; G774-I776 PolarHBondContact O-N 3.47Å; G774-R796 WeakPolarHBondContact O-CA 3.11Å; G774-D797 PolarHBondContact O-N 2.96Å
775	D	76.9	Confident	78.7	Confident	137 Å²	137	61.3 Å²	61.3	73%	0.733	30%	0.295	S	S	*	.	S	Bend	trans	-76.5	81.8	177.8	-168.3	18.5	0	0	0	111.1	D797	D775-D797 PolarHBondContact N-OD2 2.8Å
776	I	76.9	Confident	78	Confident	11 Å²	11	62.6 Å²	62.6	6%	0.056	31%	0.305	C	S	.	.			trans	-107.4	138.6	172.7	-175.3	167.8	0	0	0	110.3	W773 G774 E780 V781 L784 R796	W773-I776 HydrophobicContact CB-CB 4.2Å; W773-I776 HydrophobicContact CB-CG2 3.69Å; W773-I776 HydrophobicContact CD2-CD1 4.09Å; W773-I776 HydrophobicContact CE3-CD1 3.46Å; W773-I776 VanDerWaalsContact CE3-CD1 3.46Å; W773-I776 HydrophobicContact CZ3-CD1 3.97Å; G774-I776 VanDerWaalsContact C-N 3.34Å; G774-I776 PolarHBondContact O-N 3.47Å; I776-E780 HydrophobicContact CD1-CB 3.81Å; I776-E780 HydrophobicContact CG1-CB 3.67Å; I776-E780 WeakPolarHBondContact CG1-OE2 3.24Å; I776-V781 HydrophobicContact CB-CG2 4.47Å; I776-V781 HydrophobicContact CD1-CG2 3.95Å; I776-V781 HydrophobicContact CG1-CG2 3.99Å; I776-V781 HydrophobicContact CG2-CG2 3.69Å; I776-L784 HydrophobicContact CD1-CD1 3.49Å; I776-L784 VanDerWaalsContact CD1-CD1 3.49Å; I776-R796 HydrophobicContact CG2-CB 3.45Å; I776-R796 VanDerWaalsContact CG2-CB 3.45Å; I776-R796 HydrophobicContact CG2-CG 4.37Å
777	T	75.8	Confident	77	Confident	64 Å²	64	68.5 Å²	68.5	39%	0.393	34%	0.336	S	S	.	.			trans	-70.5	153.5	179.5	63.7	0	0	0	0	112	E779 E780 V781	T777-E779 PolarHBondContact O-N 3.25Å; T777-E780 PolarHBondContact N-OE2 2.9Å; T777-E780 VanDerWaalsContact N-OE2 3.08Å; T777-E780 PolarHBondContact O-N 3.08Å; T777-E780 WeakPolarHBondContact OG1-CB 3.18Å; T777-E780 WeakPolarHBondContact OG1-CG 3.38Å; T777-E780 PolarHBondContact OG1-N 3.16Å; T777-E780 PolarHBondContact OG1-OE2 3.17Å; T777-V781 WeakPolarHBondContact O-CG2 3.16Å; T777-V781 PolarHBondContact O-N 2.83Å; T777-V781 VanDerWaalsContact O-N 3.1Å
778	Q	73.7	Confident	76.8	Confident	67 Å²	67	64 Å²	64	31%	0.313	32%	0.315	S	S	.	.	H	α-helix	trans	-62.2	-32.2	176.9	-175	176.9	-12.8	0	0	111.6	R782	Q778-R782 WeakPolarHBondContact O-CB 3.47Å; Q778-R782 PolarHBondContact O-N 3.3Å
779	E	73.2	Confident	76.2	Confident	106 Å²	106	64.9 Å²	64.9	50%	0.495	32%	0.316	S	S	.	.	H	α-helix	trans	-63.2	-49.1	175.8	-72.1	54.3	-121.3	0	0	111.6	T777 V781 R782 E783	T777-E779 PolarHBondContact O-N 3.25Å; E779-V781 VanDerWaalsContact C-N 3.35Å; E779-V781 PolarHBondContact O-N 3.12Å; E779-R782 WeakPolarHBondContact O-CB 3.37Å; E779-R782 PolarHBondContact O-N 3.45Å; E779-R782 IonicContact OE1-CZ 3.02Å; E779-R782 IonicContact OE1-NH1 3.2Å; E779-R782 IonicContact OE1-NH2 3.03Å; E779-R782 PolarHBondContact OE1-NH2 3.11Å; E779-E783 PolarHBondContact O-N 3.02Å
780	E	74.8	Confident	75.9	Confident	94 Å²	94	65.1 Å²	65.1	44%	0.439	32%	0.319	S	S	.	.	H	α-helix	trans	-64.8	-40	178.7	-72.2	165.8	139.7	0	0	111.4	I776 T777 R782 E783 L784	I776-E780 HydrophobicContact CD1-CB 3.81Å; I776-E780 HydrophobicContact CG1-CB 3.67Å; I776-E780 WeakPolarHBondContact CG1-OE2 3.24Å; T777-E780 PolarHBondContact N-OE2 2.9Å; T777-E780 VanDerWaalsContact N-OE2 3.08Å; T777-E780 PolarHBondContact O-N 3.08Å; T777-E780 WeakPolarHBondContact OG1-CB 3.18Å; T777-E780 WeakPolarHBondContact OG1-CG 3.38Å; T777-E780 PolarHBondContact OG1-N 3.16Å; T777-E780 PolarHBondContact OG1-OE2 3.17Å; E780-R782 VanDerWaalsContact C-N 3.32Å; E780-R782 PolarHBondContact O-N 3.03Å; E780-E783 PolarHBondContact O-N 3.1Å; E780-L784 WeakPolarHBondContact O-CB 3.5Å; E780-L784 WeakPolarHBondContact O-CG 3.36Å; E780-L784 PolarHBondContact O-N 3.36Å
781	V	79.5	Confident	76	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.03	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-41.3	173.2	171.9	0	0	0	0	111.4	I776 T777 E779 L784 M785 L794 V809	I776-V781 HydrophobicContact CB-CG2 4.47Å; I776-V781 HydrophobicContact CD1-CG2 3.95Å; I776-V781 HydrophobicContact CG1-CG2 3.99Å; I776-V781 HydrophobicContact CG2-CG2 3.69Å; T777-V781 WeakPolarHBondContact O-CG2 3.16Å; T777-V781 PolarHBondContact O-N 2.83Å; T777-V781 VanDerWaalsContact O-N 3.1Å; E779-V781 VanDerWaalsContact C-N 3.35Å; E779-V781 PolarHBondContact O-N 3.12Å; V781-L784 PolarHBondContact O-N 2.77Å; V781-M785 HydrophobicContact CG1-CG 4.08Å; V781-M785 VanDerWaalsContact O-CB 3.31Å; V781-M785 WeakPolarHBondContact O-CB 3.44Å; V781-M785 WeakPolarHBondContact O-CG 3.43Å; V781-M785 PolarHBondContact O-N 2.93Å; V781-L794 HydrophobicContact CG1-CD1 4.42Å; V781-L794 HydrophobicContact CG1-CD2 4.38Å; V781-L794 HydrophobicContact CG2-CD1 4.12Å; V781-V809 HydrophobicContact CG1-CB 4.33Å; V781-V809 HydrophobicContact CG1-CG1 3.83Å; V781-V809 HydrophobicContact CG1-CG2 4.21Å
782	R	77.1	Confident	75.9	Confident	115 Å²	115	62 Å²	62	43%	0.434	30%	0.304	S	S	.	.	H	α-helix	trans	-59.8	-49.4	176.8	-165.5	-172.4	-47.6	109.5	5.8	110.2	Q778 E779 E780 M785 T786	Q778-R782 WeakPolarHBondContact O-CB 3.47Å; Q778-R782 PolarHBondContact O-N 3.3Å; E779-R782 WeakPolarHBondContact O-CB 3.37Å; E779-R782 PolarHBondContact O-N 3.45Å; E779-R782 IonicContact OE1-CZ 3.02Å; E779-R782 IonicContact OE1-NH1 3.2Å; E779-R782 IonicContact OE1-NH2 3.03Å; E779-R782 PolarHBondContact OE1-NH2 3.11Å; E780-R782 VanDerWaalsContact C-N 3.32Å; E780-R782 PolarHBondContact O-N 3.03Å; R782-M785 PolarHBondContact O-N 3.11Å; R782-T786 PolarHBondContact O-N 2.99Å; R782-T786 VanDerWaalsContact O-N 3.1Å; R782-T786 PolarHBondContact O-OG1 3.47Å
783	E	75.4	Confident	75.9	Confident	146 Å²	146	60.5 Å²	60.5	68%	0.682	30%	0.299	S	S	*	.	H	α-helix	trans	-59.2	-47.6	177.3	-167.5	-177.9	168.6	0	0	111.5	E779 E780 M785 T786	E779-E783 PolarHBondContact O-N 3.02Å; E780-E783 PolarHBondContact O-N 3.1Å; E783-M785 VanDerWaalsContact C-N 3.32Å; E783-M785 PolarHBondContact O-N 2.87Å; E783-T786 WeakPolarHBondContact CA-OG1 3.43Å; E783-T786 WeakPolarHBondContact O-CB 3.5Å; E783-T786 PolarHBondContact O-N 2.72Å; E783-T786 PolarHBondContact O-OG1 2.95Å
784	L	76.7	Confident	76.2	Confident	40 Å²	40	57.8 Å²	57.8	21%	0.209	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-35.6	180	-75.5	167	0	0	0	113.7	W773 I776 E780 V781	W773-L784 HydrophobicContact CD2-CD1 4.43Å; W773-L784 HydrophobicContact CE3-CD1 4Å; W773-L784 HydrophobicContact CH2-CD1 3.47Å; W773-L784 VanDerWaalsContact CH2-CD1 3.47Å; W773-L784 HydrophobicContact CH2-CD2 3.79Å; W773-L784 HydrophobicContact CH2-CG 4.3Å; W773-L784 HydrophobicContact CZ2-CD1 3.97Å; W773-L784 HydrophobicContact CZ2-CD2 4.46Å; W773-L784 HydrophobicContact CZ3-CD1 3.49Å; W773-L784 VanDerWaalsContact CZ3-CD1 3.49Å; W773-L784 HydrophobicContact CZ3-CD2 4.41Å; I776-L784 HydrophobicContact CD1-CD1 3.49Å; I776-L784 VanDerWaalsContact CD1-CD1 3.49Å; E780-L784 WeakPolarHBondContact O-CB 3.5Å; E780-L784 WeakPolarHBondContact O-CG 3.36Å; E780-L784 PolarHBondContact O-N 3.36Å; V781-L784 PolarHBondContact O-N 2.77Å
785	M	77.2	Confident	76.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-92.8	-4.6	-176	-61.5	-77	-81.1	0	0	113.3	V781 R782 E783 L788 L794 V809 R811 N816 V867	V781-M785 HydrophobicContact CG1-CG 4.08Å; V781-M785 VanDerWaalsContact O-CB 3.31Å; V781-M785 WeakPolarHBondContact O-CB 3.44Å; V781-M785 WeakPolarHBondContact O-CG 3.43Å; V781-M785 PolarHBondContact O-N 2.93Å; R782-M785 PolarHBondContact O-N 3.11Å; E783-M785 VanDerWaalsContact C-N 3.32Å; E783-M785 PolarHBondContact O-N 2.87Å; M785-L788 HydrophobicContact CB-CD1 4.4Å; M785-L788 PolarHBondContact O-N 3.08Å; M785-L788 HydrophobicContact SD-CD1 3.66Å; M785-L794 HydrophobicContact CG-CD2 4.39Å; M785-L794 HydrophobicContact SD-CD2 4.12Å; M785-V809 HydrophobicContact CE-CG1 4.3Å; M785-R811 HydrophobicContact CE-CB 3.67Å; M785-R811 PolarHBondContact O-NE 3.47Å; M785-R811 PolarHBondContact O-NH1 3.12Å; M785-N816 WeakPolarHBondContact CB-ND2 3.41Å; M785-N816 WeakPolarHBondContact CB-OD1 3.42Å; M785-V867 HydrophobicContact SD-CG2 3.88Å
786	T	71	Confident	77	Confident	65 Å²	65	51.2 Å²	51.2	40%	0.399	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	138.2	173	-36.8	0	0	0	0	109.1	R782 E783 L788	R782-T786 PolarHBondContact O-N 2.99Å; R782-T786 VanDerWaalsContact O-N 3.1Å; R782-T786 PolarHBondContact O-OG1 3.47Å; E783-T786 WeakPolarHBondContact CA-OG1 3.43Å; E783-T786 WeakPolarHBondContact O-CB 3.5Å; E783-T786 PolarHBondContact O-N 2.72Å; E783-T786 PolarHBondContact O-OG1 2.95Å; T786-L788 PolarHBondContact O-N 3.46Å; T786-L788 VanDerWaalsContact O-N 3.17Å
787	D	65.9	Low	77.4	Confident	126 Å²	126	52.7 Å²	52.7	67%	0.674	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	16.7	179.3	-46.2	-37.1	0	0	0	116.2	R873	D787-R873 PolarHBondContact O-NH1 2.85Å; D787-R873 PolarHBondContact O-NH2 3.33Å
788	L	69.3	Low	77.4	Confident	13 Å²	13	50.6 Å²	50.6	7%	0.068	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-88.4	148.9	169.9	-64.2	-177.2	0	0	0	111.8	M785 T786 Y792 R811 V867 R873 F898	M785-L788 HydrophobicContact CB-CD1 4.4Å; M785-L788 PolarHBondContact O-N 3.08Å; M785-L788 HydrophobicContact SD-CD1 3.66Å; T786-L788 PolarHBondContact O-N 3.46Å; T786-L788 VanDerWaalsContact O-N 3.17Å; L788-Y792 HydrophobicContact CB-CD2 4.02Å; L788-Y792 HydrophobicContact CB-CG 4.15Å; L788-Y792 HydrophobicContact CD1-CD1 4.06Å; L788-Y792 HydrophobicContact CD1-CG 3.9Å; L788-Y792 HydrophobicContact CD2-CD1 4.31Å; L788-Y792 HydrophobicContact CD2-CD2 4.43Å; L788-Y792 HydrophobicContact CD2-CE1 4.32Å; L788-Y792 HydrophobicContact CD2-CE2 4.42Å; L788-Y792 HydrophobicContact CD2-CG 4.35Å; L788-Y792 HydrophobicContact CG-CG 4.39Å; L788-R811 HydrophobicContact CB-CG 4.15Å; L788-R811 WeakPolarHBondContact O-CG 3.35Å; L788-R811 PolarHBondContact O-NE 2.89Å; L788-R811 VanDerWaalsContact O-NE 3.14Å; L788-V867 HydrophobicContact CD1-CG2 3.96Å; L788-R873 VanDerWaalsContact CD2-CZ 3.5Å; L788-F898 HydrophobicContact CD2-CZ 4.48Å
789	Q	64.5	Low	76.8	Confident	130 Å²	130	51.1 Å²	51.1	61%	0.607	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-72.8	162.2	172.1	-168.3	174.5	16.9	0	0	111.1	Y792 R811	Q789-Y792 HydrophobicContact CB-CD2 4.45Å; Q789-Y792 HydrophobicContact CB-CE2 4.29Å; Q789-Y792 VanDerWaalsContact O-CD2 3.29Å; Q789-Y792 WeakPolarHBondContact O-CD2 3.45Å; Q789-R811 WeakPolarHBondContact O-CB 3.46Å; Q789-R811 WeakPolarHBondContact O-CG 3.32Å
790	D	75	Confident	75.7	Confident	51 Å²	51	48.5 Å²	48.5	27%	0.273	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	137.6	173	-63.4	-6.9	0	0	0	111.8	R811 W812 R813 G814 W865	D790-R811 CarbonylContact C-O 3.53Å; D790-R811 VanDerWaalsContact CA-O 3.27Å; D790-R811 WeakPolarHBondContact CA-O 3.41Å; D790-W812 HydrophobicContact CB-CE3 4.33Å; D790-W812 VanDerWaalsContact OD1-C 3.29Å; D790-W812 WeakPolarHBondContact OD1-CA 3.36Å; D790-R813 WeakPolarHBondContact OD1-CA 3.41Å; D790-R813 PolarHBondContact OD1-N 3.18Å; D790-R813 WeakPolarHBondContact OD2-CA 3.22Å; D790-R813 PolarHBondContact OD2-N 3.32Å; D790-G814 PolarHBondContact OD1-N 3.29Å; D790-G814 VanDerWaalsContact OD1-N 3.15Å; D790-W865 WeakPolarHBondContact O-CZ3 3.3Å
791	G	74.9	Confident	74.4	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.01	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	103.1	-9.1	-179.9	0	0	0	0	0	115.1	R811 I864 W865	G791-R811 PolarHBondContact N-O 2.93Å; G791-I864 PolarHBondContact O-N 2.83Å; G791-W865 PolarHBondContact O-N 3.5Å
792	Y	82	Confident	73	Confident	29 Å²	29	52.6 Å²	52.6	11%	0.114	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	139.1	167.9	-81.6	-91.2	0	0	0	111.1	L788 Q789 V810 R811 W865 V867 F898	L788-Y792 HydrophobicContact CB-CD2 4.02Å; L788-Y792 HydrophobicContact CB-CG 4.15Å; L788-Y792 HydrophobicContact CD1-CD1 4.06Å; L788-Y792 HydrophobicContact CD1-CG 3.9Å; L788-Y792 HydrophobicContact CD2-CD1 4.31Å; L788-Y792 HydrophobicContact CD2-CD2 4.43Å; L788-Y792 HydrophobicContact CD2-CE1 4.32Å; L788-Y792 HydrophobicContact CD2-CE2 4.42Å; L788-Y792 HydrophobicContact CD2-CG 4.35Å; L788-Y792 HydrophobicContact CG-CG 4.39Å; Q789-Y792 HydrophobicContact CB-CD2 4.45Å; Q789-Y792 HydrophobicContact CB-CE2 4.29Å; Q789-Y792 VanDerWaalsContact O-CD2 3.29Å; Q789-Y792 WeakPolarHBondContact O-CD2 3.45Å; Y792-V810 CarbonylContact O-C 3.54Å; Y792-V810 WeakPolarHBondContact O-CA 3.27Å; Y792-R811 PolarHBondContact O-N 2.66Å; Y792-W865 CarbonylContact C-O 3.42Å; Y792-W865 VanDerWaalsContact CA-O 3.26Å; Y792-W865 WeakPolarHBondContact CA-O 3.4Å; Y792-W865 HydrophobicContact CD1-CB 3.55Å; Y792-W865 HydrophobicContact CD1-CG 4.5Å; Y792-W865 HydrophobicContact CD2-CB 4.3Å; Y792-W865 HydrophobicContact CD2-CD2 4.44Å; Y792-W865 AromaticContact CD2-CE3 3.85Å; Y792-W865 HydrophobicContact CD2-CE3 3.85Å; Y792-W865 HydrophobicContact CE1-CB 3.5Å; Y792-W865 VanDerWaalsContact CE1-CB 3.5Å; Y792-W865 HydrophobicContact CE1-CG 4.11Å; Y792-W865 HydrophobicContact CE2-CB 4.29Å; Y792-W865 HydrophobicContact CE2-CD2 4.08Å; Y792-W865 AromaticContact CE2-CE3 3.77Å; Y792-W865 HydrophobicContact CE2-CE3 3.77Å; Y792-W865 HydrophobicContact CE2-CG 4.32Å; Y792-W865 HydrophobicContact CE2-CZ3 4.47Å; Y792-W865 HydrophobicContact CG-CB 3.98Å; Y792-V867 HydrophobicContact CD1-CG2 3.81Å; Y792-V867 HydrophobicContact CG-CG2 4.4Å; Y792-F898 AromaticContact CE1-CE2 3.65Å; Y792-F898 HydrophobicContact CE1-CE2 3.65Å; Y792-F898 AromaticContact CE1-CZ 3.95Å; Y792-F898 HydrophobicContact CE1-CZ 3.95Å
793	F	88	Confident	71.7	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.009	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	157.1	-178.8	74.3	-84.7	0	0	0	114.5	W771 L808 V809 V810 V845 L863 W865 P866 V867	W771-F793 HydrophobicContact CB-CE2 4.02Å; W771-F793 HydrophobicContact CD2-CE2 4.32Å; W771-F793 AromaticContact CG-CE2 3.89Å; W771-F793 HydrophobicContact CG-CE2 3.89Å; F793-L808 HydrophobicContact CB-CD1 4.24Å; F793-L808 HydrophobicContact CD2-CD1 3.95Å; F793-L808 HydrophobicContact CG-CD1 4.5Å; F793-V809 CarbonylContact C-O 3.49Å; F793-V809 WeakPolarHBondContact CA-O 3.48Å; F793-V809 WeakPolarHBondContact CB-O 3.41Å; F793-V810 HydrophobicContact CB-CG1 4.38Å; F793-V810 HydrophobicContact CB-CG2 4.12Å; F793-V845 HydrophobicContact CD2-CG1 4.49Å; F793-V845 HydrophobicContact CE2-CG1 3.61Å; F793-V845 HydrophobicContact CZ-CG1 4.06Å; F793-L863 HydrophobicContact CB-CD2 3.74Å; F793-L863 HydrophobicContact CD1-CB 3.66Å; F793-L863 HydrophobicContact CD1-CD2 4.18Å; F793-L863 HydrophobicContact CD1-CG 4.39Å; F793-L863 HydrophobicContact CD2-CD1 4.3Å; F793-L863 HydrophobicContact CD2-CD2 4.42Å; F793-L863 HydrophobicContact CE1-CB 3.76Å; F793-L863 HydrophobicContact CE2-CD1 4.46Å; F793-L863 HydrophobicContact CG-CB 4.12Å; F793-L863 HydrophobicContact CG-CD1 4.44Å; F793-L863 HydrophobicContact CG-CD2 3.86Å; F793-L863 HydrophobicContact CG-CG 4.36Å; F793-L863 HydrophobicContact CZ-CB 4.3Å; F793-W865 VanDerWaalsContact CD1-O 3.31Å; F793-W865 WeakPolarHBondContact CD1-O 3.19Å; F793-W865 PolarHBondContact N-O 2.86Å; F793-P866 HydrophobicContact CE1-CB 4.11Å; F793-P866 HydrophobicContact CE2-CB 4.4Å; F793-P866 HydrophobicContact CZ-CB 3.86Å; F793-V867 PolarHBondContact O-N 3.05Å
794	L	89.4	Confident	71	Confident	0 Å²	0	48 Å²	48	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	159.3	169.5	62.1	86.8	0	0	0	110.9	W771 V781 M785 R796 V809 V867	W771-L794 WeakPolarHBondContact O-CA 3.47Å; V781-L794 HydrophobicContact CG1-CD1 4.42Å; V781-L794 HydrophobicContact CG1-CD2 4.38Å; V781-L794 HydrophobicContact CG2-CD1 4.12Å; M785-L794 HydrophobicContact CG-CD2 4.39Å; M785-L794 HydrophobicContact SD-CD2 4.12Å; L794-R796 HydrophobicContact CD1-CB 4.43Å; L794-V809 HydrophobicContact CD1-CB 3.97Å; L794-V809 HydrophobicContact CD1-CG2 3.78Å; L794-V809 HydrophobicContact CG-CB 4.14Å; L794-V809 HydrophobicContact CG-CG2 4.49Å; L794-V809 PolarHBondContact N-O 3.35Å; L794-V809 PolarHBondContact O-N 3.2Å; L794-V867 HydrophobicContact CB-CB 4.27Å; L794-V867 HydrophobicContact CD2-CB 4.28Å; L794-V867 HydrophobicContact CD2-CG1 4.3Å
795	V	89.7	Confident	70.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.9	172.3	179.6	0	0	0	0	109.4	W771 Y772 W773 F806 T807 L808 I821 V841 V845	W771-V795 HydrophobicContact CE3-CB 3.57Å; W771-V795 HydrophobicContact CE3-CG2 3.42Å; W771-V795 VanDerWaalsContact CE3-CG2 3.42Å; W771-V795 HydrophobicContact CH2-CG2 4.41Å; W771-V795 HydrophobicContact CZ3-CB 3.5Å; W771-V795 HydrophobicContact CZ3-CG1 4.15Å; W771-V795 HydrophobicContact CZ3-CG2 3.34Å; W771-V795 PolarHBondContact O-N 3.48Å; Y772-V795 CarbonylContact C-O 3.56Å; Y772-V795 WeakPolarHBondContact CA-O 3.48Å; Y772-V795 HydrophobicContact CD2-CB 4.48Å; Y772-V795 HydrophobicContact CD2-CG1 4.26Å; W773-V795 PolarHBondContact N-O 3.28Å; V795-F806 HydrophobicContact CG1-CB 4.21Å; V795-T807 WeakPolarHBondContact CA-O 3.27Å; V795-L808 HydrophobicContact CG2-CB 4.33Å; V795-L808 HydrophobicContact CG2-CD1 3.74Å; V795-I821 HydrophobicContact CG1-CD1 4.44Å; V795-V841 HydrophobicContact CG1-CG1 4.27Å; V795-V845 HydrophobicContact CG2-CG2 3.96Å
796	R	87.7	Confident	71.4	Confident	10 Å²	10	47.3 Å²	47.3	4%	0.038	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	165.1	176.8	66	173.3	-174.6	104.1	-7.6	111.6	G774 I776 L794 S799 F806 T807 V809	G774-R796 WeakPolarHBondContact O-CA 3.11Å; I776-R796 HydrophobicContact CG2-CB 3.45Å; I776-R796 VanDerWaalsContact CG2-CB 3.45Å; I776-R796 HydrophobicContact CG2-CG 4.37Å; L794-R796 HydrophobicContact CD1-CB 4.43Å; R796-S799 PolarHBondContact NH1-OG 2.86Å; R796-S799 VanDerWaalsContact NH1-OG 3.08Å; R796-F806 WeakPolarHBondContact O-CA 3.37Å; R796-T807 PolarHBondContact N-O 2.68Å; R796-T807 PolarHBondContact O-N 2.93Å; R796-V809 HydrophobicContact CG-CG2 4.37Å
797	D	84.2	Confident	72.3	Confident	42 Å²	42	44.8 Å²	44.8	23%	0.225	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	142.5	166.8	-61.2	-16.8	0	0	0	109.2	Y772 G774 D775 S799	Y772-D797 VanDerWaalsContact CE2-OD1 3.3Å; Y772-D797 WeakPolarHBondContact CE2-OD1 3.42Å; Y772-D797 PolarHBondContact OH-OD1 3.49Å; Y772-D797 PolarHBondContact OH-OD2 3.14Å; G774-D797 PolarHBondContact O-N 2.96Å; D775-D797 PolarHBondContact N-OD2 2.8Å; D797-S799 PolarHBondContact O-N 3.34Å
798	A	75.8	Confident	73.4	Confident	20 Å²	20	38.8 Å²	38.8	17%	0.165	25%	0.253	C	S	.	.			trans	-69.2	123	175.8	0	0	0	0	0	109.2	G800 A805	A798-G800 PolarHBondContact O-N 2.97Å; A798-A805 HydrophobicContact CB-CB 3.64Å; A798-A805 WeakPolarHBondContact CB-O 3.17Å; A798-A805 PolarHBondContact N-O 2.9Å
799	S	60.7	Low	74.3	Confident	78 Å²	78	38.2 Å²	38.2	55%	0.545	25%	0.249	S	C	.	.	S	Bend	trans	-67.4	102	178.8	42.1	0	0	0	0	110.2	R796 D797	R796-S799 PolarHBondContact NH1-OG 2.86Å; R796-S799 VanDerWaalsContact NH1-OG 3.08Å; D797-S799 PolarHBondContact O-N 3.34Å
800	G	52	Low	75.4	Confident	52 Å²	52	32 Å²	32	54%	0.536	22%	0.22	S	C	.	.	S	Bend	trans	140.1	94.8	174	0	0	0	0	0	113.4	A798 S802	A798-G800 PolarHBondContact O-N 2.97Å; G800-S802 PolarHBondContact O-N 2.97Å; G800-S802 PolarHBondContact O-OG 2.89Å
801	S	46.2	Very low	75.8	Confident	130 Å²	130	31 Å²	31	91%	0.909	21%	0.213	S	C	*	.	S	Bend	trans	38.6	6.3	165.2	-59.5	0	0	0	0	121
802	S	50.4	Low	75.7	Confident	55 Å²	55	33.2 Å²	33.2	39%	0.385	22%	0.221	S	C	.	.			trans	-112.4	89.5	179.3	-59.7	0	0	0	0	108.1	G800 A804 A805	G800-S802 PolarHBondContact O-N 2.97Å; G800-S802 PolarHBondContact O-OG 2.89Å; S802-A804 PolarHBondContact O-N 2.81Å; S802-A805 PolarHBondContact O-N 3.04Å; S802-A805 VanDerWaalsContact O-N 3.17Å
803	S	49.7	Very low	75.2	Confident	129 Å²	129	41.3 Å²	41.3	90%	0.902	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	3.9	179.4	59.9	0	0	0	0	115.1
804	A	60.7	Low	74.4	Confident	34 Å²	34	43 Å²	43	28%	0.281	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-0	-178.4	0	0	0	0	0	114.4	S802	S802-A804 PolarHBondContact O-N 2.81Å
805	A	75.6	Confident	73.7	Confident	11 Å²	11	48.4 Å²	48.4	9%	0.091	30%	0.298	C	S	.	.			trans	-100.9	129.8	179.8	0	0	0	0	0	111.2	A798 S802	A798-A805 HydrophobicContact CB-CB 3.64Å; A798-A805 WeakPolarHBondContact CB-O 3.17Å; A798-A805 PolarHBondContact N-O 2.9Å; S802-A805 PolarHBondContact O-N 3.04Å; S802-A805 VanDerWaalsContact O-N 3.17Å
806	F	87	Confident	73.3	Confident	15 Å²	15	50.2 Å²	50.2	7%	0.066	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	153.4	-179.9	-55.7	-79.1	0	0	0	111.1	N762 L766 Y772 V795 R796 I821 F828 V841	N762-F806 WeakPolarHBondContact ND2-CE2 3.5Å; N762-F806 WeakPolarHBondContact ND2-CZ 3.49Å; L766-F806 HydrophobicContact CD1-CD1 3.94Å; L766-F806 HydrophobicContact CD1-CE1 3.29Å; L766-F806 HydrophobicContact CD1-CE2 4.24Å; L766-F806 HydrophobicContact CD1-CZ 3.47Å; L766-F806 VanDerWaalsContact CD1-CZ 3.47Å; Y772-F806 HydrophobicContact CE2-CD1 4.14Å; Y772-F806 HydrophobicContact CE2-CE1 4.14Å; V795-F806 HydrophobicContact CG1-CB 4.21Å; R796-F806 WeakPolarHBondContact O-CA 3.37Å; F806-I821 HydrophobicContact CB-CB 4.11Å; F806-I821 HydrophobicContact CB-CD1 4.11Å; F806-I821 PolarHBondContact O-N 2.87Å; F806-F828 HydrophobicContact CD2-CE1 4.19Å; F806-F828 AromaticContact CE2-CE1 3.92Å; F806-F828 HydrophobicContact CE2-CE1 3.92Å; F806-V841 HydrophobicContact CD2-CG2 3.74Å; F806-V841 HydrophobicContact CE2-CG2 4.08Å; F806-V841 HydrophobicContact CG-CG2 4.24Å
807	T	89.6	Confident	73	Confident	13 Å²	13	51.9 Å²	51.9	8%	0.08	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	123.8	175.8	-54.2	0	0	0	0	110.5	V795 R796 V809 L818 N819	V795-T807 WeakPolarHBondContact CA-O 3.27Å; R796-T807 PolarHBondContact N-O 2.68Å; R796-T807 PolarHBondContact O-N 2.93Å; T807-V809 HydrophobicContact CG2-CG2 4.49Å; T807-L818 HydrophobicContact CG2-CB 4.07Å; T807-L818 HydrophobicContact CG2-CD2 3.76Å; T807-N819 CarbonylContact C-O 3.57Å; T807-N819 WeakPolarHBondContact CA-O 3.37Å
808	L	89.9	Confident	73	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	118.4	171.4	170.9	67.6	0	0	0	109.9	F793 V795 V810 N819 I821 F830 L853 L863	F793-L808 HydrophobicContact CB-CD1 4.24Å; F793-L808 HydrophobicContact CD2-CD1 3.95Å; F793-L808 HydrophobicContact CG-CD1 4.5Å; V795-L808 HydrophobicContact CG2-CB 4.33Å; V795-L808 HydrophobicContact CG2-CD1 3.74Å; L808-V810 HydrophobicContact CD1-CG2 4.22Å; L808-V810 HydrophobicContact CD2-CG2 4.2Å; L808-V810 HydrophobicContact CG-CG2 3.88Å; L808-N819 HydrophobicContact CB-CB 4.29Å; L808-N819 PolarHBondContact N-O 3.37Å; L808-N819 PolarHBondContact O-N 3.44Å; L808-N819 PolarHBondContact O-ND2 2.89Å; L808-I821 HydrophobicContact CB-CD1 4.21Å; L808-F830 HydrophobicContact CB-CE1 4.2Å; L808-F830 HydrophobicContact CD2-CE1 3.71Å; L808-F830 HydrophobicContact CD2-CZ 3.69Å; L808-L853 HydrophobicContact CD2-CD1 4.35Å; L808-L863 HydrophobicContact CD1-CD1 4.24Å; L808-L863 HydrophobicContact CD1-CD2 4.28Å; L808-L863 HydrophobicContact CD2-CD1 4.04Å; L808-L863 HydrophobicContact CD2-CD2 4.18Å
809	V	88.3	Confident	73.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.1	177.6	-165.8	0	0	0	0	109.5	V781 M785 F793 L794 R796 T807 N816 K817 L818	V781-V809 HydrophobicContact CG1-CB 4.33Å; V781-V809 HydrophobicContact CG1-CG1 3.83Å; V781-V809 HydrophobicContact CG1-CG2 4.21Å; M785-V809 HydrophobicContact CE-CG1 4.3Å; F793-V809 CarbonylContact C-O 3.49Å; F793-V809 WeakPolarHBondContact CA-O 3.48Å; F793-V809 WeakPolarHBondContact CB-O 3.41Å; L794-V809 HydrophobicContact CD1-CB 3.97Å; L794-V809 HydrophobicContact CD1-CG2 3.78Å; L794-V809 HydrophobicContact CG-CB 4.14Å; L794-V809 HydrophobicContact CG-CG2 4.49Å; L794-V809 PolarHBondContact N-O 3.35Å; L794-V809 PolarHBondContact O-N 3.2Å; R796-V809 HydrophobicContact CG-CG2 4.37Å; T807-V809 HydrophobicContact CG2-CG2 4.49Å; V809-N816 HydrophobicContact CG1-CB 4.11Å; V809-K817 CarbonylContact C-O 3.53Å; V809-K817 VanDerWaalsContact CA-O 3.26Å; V809-K817 WeakPolarHBondContact CA-O 3.43Å; V809-L818 HydrophobicContact CG1-CD2 4.44Å; V809-L818 HydrophobicContact CG2-CD2 3.81Å
810	V	86.7	Confident	74.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	133.9	179.6	-166.9	0	0	0	0	110.7	Y792 F793 L808 K817 L861 L863	Y792-V810 CarbonylContact O-C 3.54Å; Y792-V810 WeakPolarHBondContact O-CA 3.27Å; F793-V810 HydrophobicContact CB-CG1 4.38Å; F793-V810 HydrophobicContact CB-CG2 4.12Å; L808-V810 HydrophobicContact CD1-CG2 4.22Å; L808-V810 HydrophobicContact CD2-CG2 4.2Å; L808-V810 HydrophobicContact CG-CG2 3.88Å; V810-K817 PolarHBondContact N-O 2.92Å; V810-K817 PolarHBondContact O-N 3.39Å; V810-L861 HydrophobicContact CB-CD2 4.17Å; V810-L861 HydrophobicContact CG1-CD1 4.49Å; V810-L861 HydrophobicContact CG1-CD2 3.81Å; V810-L861 HydrophobicContact CG1-CG 4.31Å; V810-L861 HydrophobicContact CG2-CD2 4.17Å; V810-L863 HydrophobicContact CB-CD2 4.35Å; V810-L863 HydrophobicContact CG1-CD2 4.01Å; V810-L863 HydrophobicContact CG2-CD2 3.38Å
811	R	82.6	Confident	76.1	Confident	31 Å²	31	52.3 Å²	52.3	12%	0.117	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	124.7	171.6	-167	68.8	170.6	170.8	3.4	109.3	M785 L788 Q789 D790 G791 Y792 G814 L815 N816	M785-R811 HydrophobicContact CE-CB 3.67Å; M785-R811 PolarHBondContact O-NE 3.47Å; M785-R811 PolarHBondContact O-NH1 3.12Å; L788-R811 HydrophobicContact CB-CG 4.15Å; L788-R811 WeakPolarHBondContact O-CG 3.35Å; L788-R811 PolarHBondContact O-NE 2.89Å; L788-R811 VanDerWaalsContact O-NE 3.14Å; Q789-R811 WeakPolarHBondContact O-CB 3.46Å; Q789-R811 WeakPolarHBondContact O-CG 3.32Å; D790-R811 CarbonylContact C-O 3.53Å; D790-R811 VanDerWaalsContact CA-O 3.27Å; D790-R811 WeakPolarHBondContact CA-O 3.41Å; G791-R811 PolarHBondContact N-O 2.93Å; Y792-R811 PolarHBondContact O-N 2.66Å; R811-G814 VanDerWaalsContact CZ-C 3.42Å; R811-G814 PolarHBondContact NH1-O 3.28Å; R811-G814 PolarHBondContact NH2-O 3.22Å; R811-L815 CarbonylContact C-O 3.42Å; R811-L815 WeakPolarHBondContact CA-O 3.36Å; R811-N816 WeakPolarHBondContact CD-OD1 3.1Å; R811-N816 PolarHBondContact NH1-OD1 3.38Å
812	W	74.1	Confident	77.9	Confident	46 Å²	46	49.5 Å²	49.5	17%	0.174	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	129.1	178	-176	-88.4	0	0	0	112	D790 G814 L815 K817 N860 L861	D790-W812 HydrophobicContact CB-CE3 4.33Å; D790-W812 VanDerWaalsContact OD1-C 3.29Å; D790-W812 WeakPolarHBondContact OD1-CA 3.36Å; W812-G814 PolarHBondContact O-N 2.89Å; W812-L815 PolarHBondContact N-O 3.48Å; W812-L815 WeakPolarHBondContact O-CB 3.37Å; W812-L815 PolarHBondContact O-N 3.27Å; W812-K817 HydrophobicContact CB-CD 3.94Å; W812-K817 HydrophobicContact CB-CG 4.33Å; W812-K817 HydrophobicContact CG-CD 4.3Å; W812-N860 HydrophobicContact CH2-CB 4.35Å; W812-L861 HydrophobicContact CB-CD1 3.71Å; W812-L861 HydrophobicContact CD2-CB 4.38Å; W812-L861 HydrophobicContact CD2-CD1 3.63Å; W812-L861 HydrophobicContact CD2-CG 4.08Å; W812-L861 HydrophobicContact CE3-CB 3.99Å; W812-L861 HydrophobicContact CE3-CD1 3.73Å; W812-L861 HydrophobicContact CE3-CG 3.66Å; W812-L861 HydrophobicContact CG-CD1 3.65Å; W812-L861 HydrophobicContact CH2-CB 4.36Å; W812-L861 HydrophobicContact CZ3-CB 3.99Å; W812-L861 HydrophobicContact CZ3-CG 4.13Å
813	R	71.3	Confident	79.6	Confident	199 Å²	199	47.7 Å²	47.7	75%	0.751	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	41	45.1	-168.3	-65.4	-176.2	175	-179.9	-3.1	113.4	D790 L815	D790-R813 WeakPolarHBondContact OD1-CA 3.41Å; D790-R813 PolarHBondContact OD1-N 3.18Å; D790-R813 WeakPolarHBondContact OD2-CA 3.22Å; D790-R813 PolarHBondContact OD2-N 3.32Å; R813-L815 PolarHBondContact O-N 3.39Å
814	G	70.3	Confident	81.2	Confident	38 Å²	38	44.2 Å²	44.2	39%	0.392	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	7.5	-179	0	0	0	0	0	115.6	D790 R811 W812	D790-G814 PolarHBondContact OD1-N 3.29Å; D790-G814 VanDerWaalsContact OD1-N 3.15Å; R811-G814 VanDerWaalsContact CZ-C 3.42Å; R811-G814 PolarHBondContact NH1-O 3.28Å; R811-G814 PolarHBondContact NH2-O 3.22Å; W812-G814 PolarHBondContact O-N 2.89Å
815	L	75.8	Confident	82.3	Confident	113 Å²	113	43.2 Å²	43.2	59%	0.592	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	153.7	176.3	-60.7	173.5	0	0	0	111.1	R811 W812 R813	R811-L815 CarbonylContact C-O 3.42Å; R811-L815 WeakPolarHBondContact CA-O 3.36Å; W812-L815 PolarHBondContact N-O 3.48Å; W812-L815 WeakPolarHBondContact O-CB 3.37Å; W812-L815 PolarHBondContact O-N 3.27Å; R813-L815 PolarHBondContact O-N 3.39Å
816	N	81	Confident	82.7	Confident	38 Å²	38	45.7 Å²	45.7	20%	0.203	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	104.9	174.8	-60.4	-21.7	0	0	0	109.3	M785 V809 R811	M785-N816 WeakPolarHBondContact CB-ND2 3.41Å; M785-N816 WeakPolarHBondContact CB-OD1 3.42Å; V809-N816 HydrophobicContact CG1-CB 4.11Å; R811-N816 WeakPolarHBondContact CD-OD1 3.1Å; R811-N816 PolarHBondContact NH1-OD1 3.38Å
817	K	81	Confident	82.6	Confident	46 Å²	46	46 Å²	46	20%	0.2	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	127.1	177.7	-67.1	-169.6	174.1	178.2	0	110.9	V809 V810 W812 C858 L861	V809-K817 CarbonylContact C-O 3.53Å; V809-K817 VanDerWaalsContact CA-O 3.26Å; V809-K817 WeakPolarHBondContact CA-O 3.43Å; V810-K817 PolarHBondContact N-O 2.92Å; V810-K817 PolarHBondContact O-N 3.39Å; W812-K817 HydrophobicContact CB-CD 3.94Å; W812-K817 HydrophobicContact CB-CG 4.33Å; W812-K817 HydrophobicContact CG-CD 4.3Å; K817-C858 PolarHBondContact NZ-SG 3.41Å; K817-L861 HydrophobicContact CD-CD1 3.96Å
818	L	83.6	Confident	82.5	Confident	56 Å²	56	45.5 Å²	45.5	29%	0.293	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.5	179.6	-66.8	146.4	0	0	0	108.5	T807 V809	T807-L818 HydrophobicContact CG2-CB 4.07Å; T807-L818 HydrophobicContact CG2-CD2 3.76Å; V809-L818 HydrophobicContact CG1-CD2 4.44Å; V809-L818 HydrophobicContact CG2-CD2 3.81Å
819	N	84	Confident	82.2	Confident	16 Å²	16	45.8 Å²	45.8	9%	0.086	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119.1	176.7	-58.3	-88.1	0	0	0	108.7	T807 L808 F830	T807-N819 CarbonylContact C-O 3.57Å; T807-N819 WeakPolarHBondContact CA-O 3.37Å; L808-N819 HydrophobicContact CB-CB 4.29Å; L808-N819 PolarHBondContact N-O 3.37Å; L808-N819 PolarHBondContact O-N 3.44Å; L808-N819 PolarHBondContact O-ND2 2.89Å; N819-F830 HydrophobicContact CB-CD1 3.94Å; N819-F830 HydrophobicContact CB-CE1 4.04Å
820	R	85	Confident	81.8	Confident	126 Å²	126	47 Å²	47	48%	0.475	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	138	178.2	-171.7	170.8	-175.8	156.7	0.7	110.2	Y822	R820-Y822 HydrophobicContact CB-CE2 4.31Å; R820-Y822 HydrophobicContact CG-CE2 4.29Å
821	I	86.3	Confident	81.2	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.2	173.7	-56.7	172.6	0	0	0	107.7	V795 F806 L808 F828 G829 F830 V841 L844	V795-I821 HydrophobicContact CG1-CD1 4.44Å; F806-I821 HydrophobicContact CB-CB 4.11Å; F806-I821 HydrophobicContact CB-CD1 4.11Å; F806-I821 PolarHBondContact O-N 2.87Å; L808-I821 HydrophobicContact CB-CD1 4.21Å; I821-F828 HydrophobicContact CG2-CB 4.21Å; I821-F828 HydrophobicContact CG2-CD1 4.17Å; I821-G829 CarbonylContact C-O 3.51Å; I821-G829 WeakPolarHBondContact CA-O 3.45Å; I821-F830 HydrophobicContact CD1-CE1 4.44Å; I821-F830 HydrophobicContact CG1-CD1 4.19Å; I821-F830 HydrophobicContact CG1-CE1 3.8Å; I821-V841 HydrophobicContact CD1-CG1 3.92Å; I821-V841 HydrophobicContact CG2-CG2 4.47Å; I821-L844 HydrophobicContact CD1-CD2 4.22Å; I821-L844 HydrophobicContact CG1-CD2 4.15Å; I821-L844 HydrophobicContact CG2-CD2 3.66Å
822	Y	83.8	Confident	81	Confident	72 Å²	72	50.6 Å²	50.6	28%	0.282	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	143.3	176.7	-63.3	-90.6	0	0	0	110.5	R820 F828 G829 F830 D832	R820-Y822 HydrophobicContact CB-CE2 4.31Å; R820-Y822 HydrophobicContact CG-CE2 4.29Å; Y822-F828 WeakPolarHBondContact O-CA 3.43Å; Y822-G829 PolarHBondContact N-O 3.33Å; Y822-G829 PolarHBondContact O-N 3.19Å; Y822-G829 VanDerWaalsContact O-N 3.12Å; Y822-F830 WeakPolarHBondContact CE2-O 3.22Å; Y822-D832 HydrophobicContact CD1-CB 3.67Å; Y822-D832 HydrophobicContact CD2-CB 4.22Å; Y822-D832 HydrophobicContact CE1-CB 3.83Å; Y822-D832 HydrophobicContact CE2-CB 4.38Å; Y822-D832 HydrophobicContact CG-CB 3.87Å
823	H	86.3	Confident	80.8	Confident	17 Å²	17	50.7 Å²	50.7	8%	0.079	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	115.4	177.4	-176.5	-166.8	0	0	0	109.1	P754 S758 G825 F828	P754-H823 HydrophobicContact CG-CB 4.37Å; S758-H823 PolarHBondContact OG-NE2 2.99Å; H823-G825 PolarHBondContact NE2-O 3.35Å; H823-F828 HydrophobicContact CB-CD1 3.9Å; H823-F828 HydrophobicContact CB-CE1 3.65Å; H823-F828 HydrophobicContact CB-CZ 4.4Å; H823-F828 AromaticContact CD2-CE1 3.59Å; H823-F828 AromaticContact CD2-CE2 3.83Å; H823-F828 AromaticContact CD2-CZ 3.47Å; H823-F828 VanDerWaalsContact CD2-CZ 3.47Å; H823-F828 WeakPolarHBondContact CD2-CZ 3.48Å; H823-F828 AromaticContact CE1-CE1 3.93Å; H823-F828 AromaticContact CE1-CZ 3.44Å; H823-F828 VanDerWaalsContact CE1-CZ 3.44Å; H823-F828 WeakPolarHBondContact CE1-CZ 3.43Å; H823-F828 AromaticContact CG-CD1 3.99Å; H823-F828 AromaticContact CG-CE1 3.38Å; H823-F828 AromaticContact CG-CZ 3.64Å; H823-F828 AromaticContact ND1-CE1 3.63Å; H823-F828 AromaticContact ND1-CZ 3.64Å; H823-F828 AromaticContact NE2-CE1 3.94Å; H823-F828 AromaticContact NE2-CE2 3.69Å; H823-F828 AromaticContact NE2-CZ 3.36Å; H823-F828 WeakPolarHBondContact NE2-CZ 3.19Å
824	R	82.6	Confident	81.1	Confident	56 Å²	56	41.4 Å²	41.4	21%	0.211	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	125.3	178	-57.5	-66.6	-175.3	169.7	6.6	109.9	P748 I750 T752 D826 Y827 D832 P833 P834	P748-R824 HydrophobicContact CB-CB 3.8Å; I750-R824 PolarHBondContact O-NH1 3.03Å; I750-R824 PolarHBondContact O-NH2 3.14Å; I750-R824 VanDerWaalsContact O-NH2 3.07Å; T752-R824 WeakPolarHBondContact O-CD 3.44Å; R824-D826 PolarHBondContact O-N 3.09Å; R824-Y827 PolarHBondContact N-O 3.03Å; R824-Y827 PolarHBondContact O-N 3.37Å; R824-D832 IonicContact CZ-OD1 3.66Å; R824-D832 IonicContact CZ-OD2 2.81Å; R824-D832 IonicContact NE-OD1 3.64Å; R824-D832 PolarHBondContact NE-OD1 3.06Å; R824-D832 IonicContact NE-OD2 3.26Å; R824-D832 IonicContact NH2-OD1 3.78Å; R824-D832 PolarHBondContact NH2-OD1 3.46Å; R824-D832 IonicContact NH2-OD2 3.39Å; R824-D832 PolarHBondContact NH2-OD2 3Å; R824-P833 HydrophobicContact CG-CB 4.4Å; R824-P834 HydrophobicContact CB-CG 3.9Å; R824-P834 HydrophobicContact CG-CG 4.08Å
825	G	84.1	Confident	81.2	Confident	12 Å²	12	47.7 Å²	47.7	12%	0.124	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	-120.8	-173.6	0	0	0	0	0	111.2	P753 S755 H823	P753-G825 WeakPolarHBondContact O-CA 3.4Å; P753-G825 PolarHBondContact O-N 3.1Å; S755-G825 PolarHBondContact N-O 3.44Å; H823-G825 PolarHBondContact NE2-O 3.35Å
826	D	82.8	Confident	81.2	Confident	63 Å²	63	45.3 Å²	45.3	34%	0.337	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-1	177.6	-70.5	-34.1	0	0	0	114.4	S755 S758 R824 R839	S755-D826 WeakPolarHBondContact CB-OD1 3.3Å; S755-D826 PolarHBondContact OG-OD1 3.05Å; S758-D826 WeakPolarHBondContact CB-OD1 3.39Å; S758-D826 PolarHBondContact OG-O 2.75Å; R824-D826 PolarHBondContact O-N 3.09Å; D826-R839 WeakPolarHBondContact O-CA 3.47Å
827	Y	85.3	Confident	80.8	Confident	23 Å²	23	47.3 Å²	47.3	9%	0.09	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	147	-164	-57.2	-79.7	0	0	0	113.8	P748 R824 P834 P836 C838 R839	P748-Y827 HydrophobicContact CG-CD2 4.08Å; R824-Y827 PolarHBondContact N-O 3.03Å; R824-Y827 PolarHBondContact O-N 3.37Å; Y827-P834 WeakPolarHBondContact O-CG 3.49Å; Y827-P836 VanDerWaalsContact CD1-C 3.48Å; Y827-P836 VanDerWaalsContact CD1-CA 3.4Å; Y827-P836 HydrophobicContact CD1-CB 4.04Å; Y827-P836 HydrophobicContact CD2-CB 3.98Å; Y827-P836 VanDerWaalsContact CE1-C 3.49Å; Y827-P836 HydrophobicContact CE1-CB 3.79Å; Y827-P836 HydrophobicContact CE2-CB 3.74Å; Y827-P836 HydrophobicContact CG-CB 4.12Å; Y827-C838 CarbonylContact C-O 3.56Å; Y827-C838 VanDerWaalsContact CA-O 3.26Å; Y827-C838 WeakPolarHBondContact CA-O 3.45Å; Y827-R839 HydrophobicContact CD1-CG 3.95Å; Y827-R839 HydrophobicContact CE1-CG 3.87Å
828	F	87	Confident	80.9	Confident	1 Å²	1	45.4 Å²	45.4	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	141.5	178.7	-65.5	-91.8	0	0	0	111.2	S758 N762 F806 I821 Y822 H823 C838 R839 V841 L844	S758-F828 WeakPolarHBondContact OG-CE2 3.4Å; N762-F828 HydrophobicContact CB-CE2 4.01Å; N762-F828 HydrophobicContact CB-CZ 3.71Å; N762-F828 WeakPolarHBondContact ND2-CZ 3.45Å; F806-F828 HydrophobicContact CD2-CE1 4.19Å; F806-F828 AromaticContact CE2-CE1 3.92Å; F806-F828 HydrophobicContact CE2-CE1 3.92Å; I821-F828 HydrophobicContact CG2-CB 4.21Å; I821-F828 HydrophobicContact CG2-CD1 4.17Å; Y822-F828 WeakPolarHBondContact O-CA 3.43Å; H823-F828 HydrophobicContact CB-CD1 3.9Å; H823-F828 HydrophobicContact CB-CE1 3.65Å; H823-F828 HydrophobicContact CB-CZ 4.4Å; H823-F828 AromaticContact CD2-CE1 3.59Å; H823-F828 AromaticContact CD2-CE2 3.83Å; H823-F828 AromaticContact CD2-CZ 3.47Å; H823-F828 VanDerWaalsContact CD2-CZ 3.47Å; H823-F828 WeakPolarHBondContact CD2-CZ 3.48Å; H823-F828 AromaticContact CE1-CE1 3.93Å; H823-F828 AromaticContact CE1-CZ 3.44Å; H823-F828 VanDerWaalsContact CE1-CZ 3.44Å; H823-F828 WeakPolarHBondContact CE1-CZ 3.43Å; H823-F828 AromaticContact CG-CD1 3.99Å; H823-F828 AromaticContact CG-CE1 3.38Å; H823-F828 AromaticContact CG-CZ 3.64Å; H823-F828 AromaticContact ND1-CE1 3.63Å; H823-F828 AromaticContact ND1-CZ 3.64Å; H823-F828 AromaticContact NE2-CE1 3.94Å; H823-F828 AromaticContact NE2-CE2 3.69Å; H823-F828 AromaticContact NE2-CZ 3.36Å; H823-F828 WeakPolarHBondContact NE2-CZ 3.19Å; F828-C838 PolarHBondContact N-O 3.21Å; F828-R839 VanDerWaalsContact CD2-O 3.28Å; F828-R839 WeakPolarHBondContact CD2-O 3.47Å; F828-R839 WeakPolarHBondContact CE2-O 3.41Å; F828-V841 HydrophobicContact CD1-CG2 3.57Å; F828-V841 HydrophobicContact CE1-CG2 3.79Å; F828-V841 HydrophobicContact CG-CG2 4.03Å; F828-V841 HydrophobicContact CZ-CG2 4.42Å; F828-L844 HydrophobicContact CB-CD2 4.43Å
829	G	83.4	Confident	80.9	Confident	7 Å²	7	49.5 Å²	49.5	7%	0.072	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	173.3	178	0	0	0	0	0	113.4	I821 Y822	I821-G829 CarbonylContact C-O 3.51Å; I821-G829 WeakPolarHBondContact CA-O 3.45Å; Y822-G829 PolarHBondContact N-O 3.33Å; Y822-G829 PolarHBondContact O-N 3.19Å; Y822-G829 VanDerWaalsContact O-N 3.12Å
830	F	80.7	Confident	81	Confident	25 Å²	25	50.3 Å²	50.3	11%	0.11	24%	0.244	C	C	.	.	S	Bend	trans	-88.2	-10.5	178.1	-56	-77.4	0	0	0	113.6	L808 N819 I821 Y822 L844 C848 L853 L855	L808-F830 HydrophobicContact CB-CE1 4.2Å; L808-F830 HydrophobicContact CD2-CE1 3.71Å; L808-F830 HydrophobicContact CD2-CZ 3.69Å; N819-F830 HydrophobicContact CB-CD1 3.94Å; N819-F830 HydrophobicContact CB-CE1 4.04Å; I821-F830 HydrophobicContact CD1-CE1 4.44Å; I821-F830 HydrophobicContact CG1-CD1 4.19Å; I821-F830 HydrophobicContact CG1-CE1 3.8Å; Y822-F830 WeakPolarHBondContact CE2-O 3.22Å; F830-L844 HydrophobicContact CD2-CD1 4.13Å; F830-L844 HydrophobicContact CD2-CD2 4.4Å; F830-L844 HydrophobicContact CE1-CD2 4.31Å; F830-L844 HydrophobicContact CE2-CD1 3.59Å; F830-L844 HydrophobicContact CE2-CD2 3.84Å; F830-L844 HydrophobicContact CE2-CG 3.69Å; F830-L844 HydrophobicContact CZ-CD1 4.32Å; F830-L844 HydrophobicContact CZ-CD2 3.81Å; F830-L844 HydrophobicContact CZ-CG 3.89Å; F830-C848 WeakPolarHBondContact CE2-SG 3.47Å; F830-L853 HydrophobicContact CD2-CD2 3.85Å; F830-L853 HydrophobicContact CE1-CD2 4.5Å; F830-L853 HydrophobicContact CE2-CD2 3.58Å; F830-L853 HydrophobicContact CG-CD2 4.46Å; F830-L853 HydrophobicContact CZ-CD2 3.92Å; F830-L855 HydrophobicContact CB-CD1 4Å; F830-L855 HydrophobicContact CB-CD2 3.78Å; F830-L855 HydrophobicContact CB-CG 4.39Å
831	T	75.2	Confident	81.1	Confident	57 Å²	57	44.3 Å²	44.3	35%	0.35	22%	0.222	S	C	.	.	S	Bend	trans	-105.5	148.2	177.1	-22.2	0	0	0	0	109.6	P833 P834	T831-P833 CarbonylContact O-C 3.36Å; T831-P834 VanDerWaalsContact O-CA 3.28Å; T831-P834 WeakPolarHBondContact O-CA 3.22Å
832	D	78.2	Confident	81	Confident	49 Å²	49	45 Å²	45	26%	0.262	23%	0.227	S	C	.	.	S	Bend	trans	-111.7	116.9	173.9	-164	16.3	0	0	0	110.4	Y822 R824	Y822-D832 HydrophobicContact CD1-CB 3.67Å; Y822-D832 HydrophobicContact CD2-CB 4.22Å; Y822-D832 HydrophobicContact CE1-CB 3.83Å; Y822-D832 HydrophobicContact CE2-CB 4.38Å; Y822-D832 HydrophobicContact CG-CB 3.87Å; R824-D832 IonicContact CZ-OD1 3.66Å; R824-D832 IonicContact CZ-OD2 2.81Å; R824-D832 IonicContact NE-OD1 3.64Å; R824-D832 PolarHBondContact NE-OD1 3.06Å; R824-D832 IonicContact NE-OD2 3.26Å; R824-D832 IonicContact NH2-OD1 3.78Å; R824-D832 PolarHBondContact NH2-OD1 3.46Å; R824-D832 IonicContact NH2-OD2 3.39Å; R824-D832 PolarHBondContact NH2-OD2 3Å
833	P	68.6	Low	81	Confident	49 Å²	49	45.8 Å²	45.8	32%	0.318	23%	0.233	S	C	.	.	S	Bend	cis	-76.6	152.6	-2.4	32.6	-30.4	0	0	0	112.2	P748 I750 R824 T831	P748-P833 WeakPolarHBondContact O-CB 3.18Å; P748-P833 VanDerWaalsContact O-CG 3.29Å; P748-P833 WeakPolarHBondContact O-CG 3.46Å; I750-P833 HydrophobicContact CG1-CG 4.35Å; R824-P833 HydrophobicContact CG-CB 4.4Å; T831-P833 CarbonylContact O-C 3.36Å
834	P	77.7	Confident	81	Confident	3 Å²	3	45.3 Å²	45.3	2%	0.019	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-67.9	142.8	178.8	27.9	-33.5	0	0	0	110.9	P748 R824 Y827 T831	P748-P834 WeakPolarHBondContact CG-O 3.44Å; R824-P834 HydrophobicContact CB-CG 3.9Å; R824-P834 HydrophobicContact CG-CG 4.08Å; Y827-P834 WeakPolarHBondContact O-CG 3.49Å; T831-P834 VanDerWaalsContact O-CA 3.28Å; T831-P834 WeakPolarHBondContact O-CA 3.22Å
835	Y	72.9	Confident	81	Confident	170 Å²	170	42.7 Å²	42.7	67%	0.667	22%	0.221	S	C	*	.	P	Polyproline II helix	trans	-58.8	142.6	169.5	-70	-78.3	0	0	0	109.9	S837	Y835-S837 PolarHBondContact O-N 2.84Å
836	P	75.3	Confident	80.6	Confident	64 Å²	64	46.6 Å²	46.6	42%	0.416	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	53.6	-178.8	31.3	-35.7	0	0	0	112.6	Y827	Y827-P836 VanDerWaalsContact CD1-C 3.48Å; Y827-P836 VanDerWaalsContact CD1-CA 3.4Å; Y827-P836 HydrophobicContact CD1-CB 4.04Å; Y827-P836 HydrophobicContact CD2-CB 3.98Å; Y827-P836 VanDerWaalsContact CE1-C 3.49Å; Y827-P836 HydrophobicContact CE1-CB 3.79Å; Y827-P836 HydrophobicContact CE2-CB 3.74Å; Y827-P836 HydrophobicContact CG-CB 4.12Å
837	S	72.7	Confident	80.3	Confident	79 Å²	79	48.2 Å²	48.2	55%	0.552	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-43.5	-175.7	57.5	0	0	0	0	113.5	Y835	Y835-S837 PolarHBondContact O-N 2.84Å
838	C	84.1	Confident	79.8	Confident	6 Å²	6	47.3 Å²	47.3	4%	0.041	24%	0.238	C	C	.	.			trans	-113.8	124.3	-174.2	-59.3	0	0	0	0	110.3	Y827 F828 E843 L844	Y827-C838 CarbonylContact C-O 3.56Å; Y827-C838 VanDerWaalsContact CA-O 3.26Å; Y827-C838 WeakPolarHBondContact CA-O 3.45Å; F828-C838 PolarHBondContact N-O 3.21Å; C838-E843 HydrophobicContact CB-CB 4.42Å; C838-L844 HydrophobicContact CB-CB 4.12Å; C838-L844 HydrophobicContact CB-CD1 4.38Å
839	R	83.3	Confident	79	Confident	143 Å²	143	52.2 Å²	52.2	54%	0.54	26%	0.256	S	S	.	.	S	Bend	trans	-98.8	-12.1	-179.9	-67.4	-174.4	177.5	-177	-0	113.6	D826 Y827 F828 E843	D826-R839 WeakPolarHBondContact O-CA 3.47Å; Y827-R839 HydrophobicContact CD1-CG 3.95Å; Y827-R839 HydrophobicContact CE1-CG 3.87Å; F828-R839 VanDerWaalsContact CD2-O 3.28Å; F828-R839 WeakPolarHBondContact CD2-O 3.47Å; F828-R839 WeakPolarHBondContact CE2-O 3.41Å; R839-E843 PolarHBondContact N-OE2 2.87Å
840	L	86	Confident	78	Confident	33 Å²	33	56.4 Å²	56.4	17%	0.173	28%	0.28	C	S	.	.	S	Bend	trans	-129.8	153.1	175.9	-59.9	171.7	0	0	0	110.7	A761 N762 D765 S842 E843 L844	A761-L840 HydrophobicContact CB-CD2 4.17Å; N762-L840 HydrophobicContact CB-CD2 4.12Å; D765-L840 HydrophobicContact CB-CD1 4.46Å; L840-S842 VanDerWaalsContact C-N 3.28Å; L840-S842 PolarHBondContact O-N 3.48Å; L840-E843 HydrophobicContact CB-CB 4.34Å; L840-E843 HydrophobicContact CB-CG 4.04Å; L840-E843 HydrophobicContact CD1-CG 4.44Å; L840-E843 PolarHBondContact N-OE2 3.12Å; L840-E843 PolarHBondContact O-N 3.01Å; L840-L844 PolarHBondContact O-N 3.17Å; L840-L844 VanDerWaalsContact O-N 3.15Å
841	V	86.1	Confident	77	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.3	-33.5	174.2	173.3	0	0	0	0	111.4	N762 L766 W771 V795 F806 I821 F828 L844 V845	N762-V841 WeakPolarHBondContact ND2-CG2 3.48Å; N762-V841 WeakPolarHBondContact OD1-CB 3.39Å; N762-V841 WeakPolarHBondContact OD1-CG2 3.38Å; N762-V841 PolarHBondContact OD1-N 3.18Å; L766-V841 HydrophobicContact CD1-CB 4.49Å; L766-V841 HydrophobicContact CD1-CG2 4.48Å; L766-V841 HydrophobicContact CD2-CB 3.99Å; L766-V841 HydrophobicContact CD2-CG1 3.97Å; L766-V841 HydrophobicContact CG-CB 4.47Å; W771-V841 HydrophobicContact CH2-CG1 4.14Å; W771-V841 HydrophobicContact CZ3-CG1 4.29Å; V795-V841 HydrophobicContact CG1-CG1 4.27Å; F806-V841 HydrophobicContact CD2-CG2 3.74Å; F806-V841 HydrophobicContact CE2-CG2 4.08Å; F806-V841 HydrophobicContact CG-CG2 4.24Å; I821-V841 HydrophobicContact CD1-CG1 3.92Å; I821-V841 HydrophobicContact CG2-CG2 4.47Å; F828-V841 HydrophobicContact CD1-CG2 3.57Å; F828-V841 HydrophobicContact CE1-CG2 3.79Å; F828-V841 HydrophobicContact CG-CG2 4.03Å; F828-V841 HydrophobicContact CZ-CG2 4.42Å; V841-L844 WeakPolarHBondContact O-CB 3.18Å; V841-L844 PolarHBondContact O-N 3.25Å; V841-V845 HydrophobicContact CG1-CG2 4.45Å; V841-V845 WeakPolarHBondContact O-CG2 3.48Å; V841-V845 PolarHBondContact O-N 3.26Å
842	S	85.2	Confident	76.1	Confident	17 Å²	17	59.3 Å²	59.3	12%	0.119	29%	0.294	C	S	.	.	H	α-helix	trans	-65.4	-41.2	174.6	51	0	0	0	0	113.2	D765 L840 L844 V845 E846	D765-S842 VanDerWaalsContact CG-OG 3.31Å; D765-S842 WeakPolarHBondContact OD2-CB 3.3Å; D765-S842 PolarHBondContact OD2-OG 3.47Å; L840-S842 VanDerWaalsContact C-N 3.28Å; L840-S842 PolarHBondContact O-N 3.48Å; S842-L844 VanDerWaalsContact C-N 3.28Å; S842-L844 PolarHBondContact O-N 2.81Å; S842-V845 PolarHBondContact O-N 2.86Å; S842-E846 WeakPolarHBondContact O-CB 3.15Å; S842-E846 PolarHBondContact O-N 2.95Å
843	E	83.6	Confident	74.9	Confident	87 Å²	87	57.4 Å²	57.4	41%	0.407	28%	0.284	S	S	.	.	H	α-helix	trans	-59.8	-41.1	172.3	-70.6	173.2	-177.5	0	0	110.9	C838 R839 L840 E846 F847	C838-E843 HydrophobicContact CB-CB 4.42Å; R839-E843 PolarHBondContact N-OE2 2.87Å; L840-E843 HydrophobicContact CB-CB 4.34Å; L840-E843 HydrophobicContact CB-CG 4.04Å; L840-E843 HydrophobicContact CD1-CG 4.44Å; L840-E843 PolarHBondContact N-OE2 3.12Å; L840-E843 PolarHBondContact O-N 3.01Å; E843-E846 PolarHBondContact O-N 2.78Å; E843-F847 WeakPolarHBondContact O-CB 3.36Å; E843-F847 PolarHBondContact O-N 2.77Å
844	L	85.4	Confident	73.8	Confident	8 Å²	8	60.8 Å²	60.8	4%	0.042	30%	0.304	C	S	.	.	H	α-helix	trans	-64.6	-43.6	175.9	-177.5	66.6	0	0	0	112	I821 F828 F830 C838 L840 V841 S842 F847 C848	I821-L844 HydrophobicContact CD1-CD2 4.22Å; I821-L844 HydrophobicContact CG1-CD2 4.15Å; I821-L844 HydrophobicContact CG2-CD2 3.66Å; F828-L844 HydrophobicContact CB-CD2 4.43Å; F830-L844 HydrophobicContact CD2-CD1 4.13Å; F830-L844 HydrophobicContact CD2-CD2 4.4Å; F830-L844 HydrophobicContact CE1-CD2 4.31Å; F830-L844 HydrophobicContact CE2-CD1 3.59Å; F830-L844 HydrophobicContact CE2-CD2 3.84Å; F830-L844 HydrophobicContact CE2-CG 3.69Å; F830-L844 HydrophobicContact CZ-CD1 4.32Å; F830-L844 HydrophobicContact CZ-CD2 3.81Å; F830-L844 HydrophobicContact CZ-CG 3.89Å; C838-L844 HydrophobicContact CB-CB 4.12Å; C838-L844 HydrophobicContact CB-CD1 4.38Å; L840-L844 PolarHBondContact O-N 3.17Å; L840-L844 VanDerWaalsContact O-N 3.15Å; V841-L844 WeakPolarHBondContact O-CB 3.18Å; V841-L844 PolarHBondContact O-N 3.25Å; S842-L844 VanDerWaalsContact C-N 3.28Å; S842-L844 PolarHBondContact O-N 2.81Å; L844-F847 PolarHBondContact O-N 3.42Å; L844-C848 PolarHBondContact O-N 3.27Å; L844-C848 PolarHBondContact O-SG 2.78Å
845	V	83.9	Confident	72.3	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.006	32%	0.324	C	S	.	.	H	α-helix	trans	-62.9	-47.9	176.4	168.4	0	0	0	0	110.5	W771 F793 V795 V841 S842 F847 C848 R849 L863	W771-V845 HydrophobicContact CH2-CB 4.22Å; W771-V845 HydrophobicContact CH2-CG2 3.75Å; W771-V845 HydrophobicContact CZ2-CB 4.04Å; W771-V845 HydrophobicContact CZ2-CG1 4.1Å; W771-V845 HydrophobicContact CZ2-CG2 4.06Å; W771-V845 HydrophobicContact CZ3-CG2 4.01Å; F793-V845 HydrophobicContact CD2-CG1 4.49Å; F793-V845 HydrophobicContact CE2-CG1 3.61Å; F793-V845 HydrophobicContact CZ-CG1 4.06Å; V795-V845 HydrophobicContact CG2-CG2 3.96Å; V841-V845 HydrophobicContact CG1-CG2 4.45Å; V841-V845 WeakPolarHBondContact O-CG2 3.48Å; V841-V845 PolarHBondContact O-N 3.26Å; S842-V845 PolarHBondContact O-N 2.86Å; V845-F847 VanDerWaalsContact C-N 3.33Å; V845-F847 PolarHBondContact O-N 3.37Å; V845-C848 CarbonylContact O-C 3.54Å; V845-C848 WeakPolarHBondContact O-CB 3.44Å; V845-C848 PolarHBondContact O-N 3.17Å; V845-C848 VanDerWaalsContact O-N 3.1Å; V845-R849 WeakPolarHBondContact O-CG 3.37Å; V845-R849 PolarHBondContact O-N 3.08Å; V845-L863 HydrophobicContact CG1-CD1 4.06Å
846	E	75.4	Confident	70.9	Confident	94 Å²	94	58.8 Å²	58.8	44%	0.439	31%	0.306	S	S	.	.	H	α-helix	trans	-64.7	-38.3	178.8	-164	60	-141	0	0	111.5	S842 E843 C848 R849 V850	S842-E846 WeakPolarHBondContact O-CB 3.15Å; S842-E846 PolarHBondContact O-N 2.95Å; E843-E846 PolarHBondContact O-N 2.78Å; E846-C848 VanDerWaalsContact C-N 3.29Å; E846-C848 PolarHBondContact O-N 3.14Å; E846-R849 WeakPolarHBondContact O-CB 2.99Å; E846-R849 PolarHBondContact O-N 3.28Å; E846-R849 VanDerWaalsContact O-N 3.11Å; E846-R849 IonicContact OE1-NH1 3.25Å; E846-R849 WeakPolarHBondContact OE2-CD 3.44Å; E846-R849 IonicContact OE2-CZ 3.65Å; E846-R849 IonicContact OE2-NH1 3.79Å; E846-R849 PolarHBondContact OE2-NH1 3.2Å; E846-V850 PolarHBondContact O-N 3.15Å
847	F	75.6	Confident	69.4	Low	97 Å²	97	61.7 Å²	61.7	43%	0.425	33%	0.328	S	S	.	.	H	α-helix	trans	-57.1	-42.5	171.1	180	-95.5	0	0	0	111.7	E843 L844 V845 R849 V850 H851	E843-F847 WeakPolarHBondContact O-CB 3.36Å; E843-F847 PolarHBondContact O-N 2.77Å; L844-F847 PolarHBondContact O-N 3.42Å; V845-F847 VanDerWaalsContact C-N 3.33Å; V845-F847 PolarHBondContact O-N 3.37Å; F847-R849 VanDerWaalsContact C-N 3.32Å; F847-R849 PolarHBondContact O-N 2.89Å; F847-V850 PolarHBondContact O-N 3.38Å; F847-H851 HydrophobicContact CD1-CB 4.39Å; F847-H851 AromaticContact CD2-CE1 3.85Å; F847-H851 AromaticContact CD2-ND1 3.45Å; F847-H851 WeakPolarHBondContact CD2-ND1 3.29Å; F847-H851 HydrophobicContact CE1-CB 3.98Å; F847-H851 HydrophobicContact CE2-CB 4.43Å; F847-H851 AromaticContact CE2-CE1 3.58Å; F847-H851 AromaticContact CE2-CG 3.76Å; F847-H851 AromaticContact CE2-ND1 3.35Å; F847-H851 VanDerWaalsContact CE2-ND1 3.35Å; F847-H851 WeakPolarHBondContact CE2-ND1 3.46Å; F847-H851 AromaticContact CG-ND1 4Å; F847-H851 HydrophobicContact CZ-CB 4Å; F847-H851 AromaticContact CZ-CG 3.75Å; F847-H851 AromaticContact CZ-ND1 3.81Å; F847-H851 WeakPolarHBondContact O-CB 3.33Å; F847-H851 PolarHBondContact O-N 3.42Å; F847-H851 PolarHBondContact O-ND1 2.79Å
848	C	75	Confident	67.9	Low	4 Å²	4	58.7 Å²	58.7	3%	0.027	31%	0.307	C	S	.	.	H	α-helix	trans	-74.8	-14.3	177.5	-64.6	0	0	0	0	115	F830 L844 V845 E846 H851 L853 L863	F830-C848 WeakPolarHBondContact CE2-SG 3.47Å; L844-C848 PolarHBondContact O-N 3.27Å; L844-C848 PolarHBondContact O-SG 2.78Å; V845-C848 CarbonylContact O-C 3.54Å; V845-C848 WeakPolarHBondContact O-CB 3.44Å; V845-C848 PolarHBondContact O-N 3.17Å; V845-C848 VanDerWaalsContact O-N 3.1Å; E846-C848 VanDerWaalsContact C-N 3.29Å; E846-C848 PolarHBondContact O-N 3.14Å; C848-H851 CarbonylContact C-O 3.53Å; C848-H851 WeakPolarHBondContact CA-O 3.29Å; C848-L853 HydrophobicContact CB-CD2 4.37Å; C848-L853 HydrophobicContact CB-CG 4.29Å; C848-L863 HydrophobicContact CB-CD1 3.56Å; C848-L863 HydrophobicContact CB-CG 4.1Å
849	R	71.8	Confident	65.9	Low	104 Å²	104	62.9 Å²	62.9	39%	0.392	34%	0.336	S	S	.	.	H	α-helix	trans	-74.9	-34.5	170.5	-67.9	178.3	77.9	-160.6	0.9	111	V845 E846 F847 L863	V845-R849 WeakPolarHBondContact O-CG 3.37Å; V845-R849 PolarHBondContact O-N 3.08Å; E846-R849 WeakPolarHBondContact O-CB 2.99Å; E846-R849 PolarHBondContact O-N 3.28Å; E846-R849 VanDerWaalsContact O-N 3.11Å; E846-R849 IonicContact OE1-NH1 3.25Å; E846-R849 WeakPolarHBondContact OE2-CD 3.44Å; E846-R849 IonicContact OE2-CZ 3.65Å; E846-R849 IonicContact OE2-NH1 3.79Å; E846-R849 PolarHBondContact OE2-NH1 3.2Å; F847-R849 VanDerWaalsContact C-N 3.32Å; F847-R849 PolarHBondContact O-N 2.89Å; R849-L863 HydrophobicContact CG-CB 3.74Å; R849-L863 HydrophobicContact CG-CD1 4.49Å
850	V	62	Low	64.4	Low	95 Å²	95	61.7 Å²	61.7	58%	0.576	34%	0.34	S	S	*	.	H	α-helix	trans	-92.8	-37	-177.8	-174	0	0	0	0	112.1	E846 F847	E846-V850 PolarHBondContact O-N 3.15Å; F847-V850 PolarHBondContact O-N 3.38Å
851	H	59.8	Low	63.1	Low	90 Å²	90	60.2 Å²	60.2	42%	0.417	33%	0.333	S	S	.	.	S	Bend	trans	-108.2	130.4	-178.4	-58.2	84.7	0	0	0	110.9	F847 C848	F847-H851 HydrophobicContact CD1-CB 4.39Å; F847-H851 AromaticContact CD2-CE1 3.85Å; F847-H851 AromaticContact CD2-ND1 3.45Å; F847-H851 WeakPolarHBondContact CD2-ND1 3.29Å; F847-H851 HydrophobicContact CE1-CB 3.98Å; F847-H851 HydrophobicContact CE2-CB 4.43Å; F847-H851 AromaticContact CE2-CE1 3.58Å; F847-H851 AromaticContact CE2-CG 3.76Å; F847-H851 AromaticContact CE2-ND1 3.35Å; F847-H851 VanDerWaalsContact CE2-ND1 3.35Å; F847-H851 WeakPolarHBondContact CE2-ND1 3.46Å; F847-H851 AromaticContact CG-ND1 4Å; F847-H851 HydrophobicContact CZ-CB 4Å; F847-H851 AromaticContact CZ-CG 3.75Å; F847-H851 AromaticContact CZ-ND1 3.81Å; F847-H851 WeakPolarHBondContact O-CB 3.33Å; F847-H851 PolarHBondContact O-N 3.42Å; F847-H851 PolarHBondContact O-ND1 2.79Å; C848-H851 CarbonylContact C-O 3.53Å; C848-H851 WeakPolarHBondContact CA-O 3.29Å
852	P	55.2	Low	62	Low	52 Å²	52	67 Å²	67	34%	0.338	36%	0.358	S	S	.	.			trans	-59.5	138.1	177.4	-18.9	29.7	0	0	0	112.2	T854	P852-T854 PolarHBondContact O-N 3.3Å
853	L	53.5	Low	61.4	Low	9 Å²	9	66.4 Å²	66.4	5%	0.047	35%	0.354	C	S	.	.			trans	-69.1	99.7	172.1	-78.3	160.8	0	0	0	109.9	L808 F830 C848 L855 L861 L863	L808-L853 HydrophobicContact CD2-CD1 4.35Å; F830-L853 HydrophobicContact CD2-CD2 3.85Å; F830-L853 HydrophobicContact CE1-CD2 4.5Å; F830-L853 HydrophobicContact CE2-CD2 3.58Å; F830-L853 HydrophobicContact CG-CD2 4.46Å; F830-L853 HydrophobicContact CZ-CD2 3.92Å; C848-L853 HydrophobicContact CB-CD2 4.37Å; C848-L853 HydrophobicContact CB-CG 4.29Å; L853-L855 VanDerWaalsContact C-N 3.32Å; L853-L855 PolarHBondContact O-N 3.08Å; L853-L861 HydrophobicContact CB-CD2 4.39Å; L853-L861 HydrophobicContact CD1-CD2 3.41Å; L853-L861 VanDerWaalsContact CD1-CD2 3.41Å; L853-L861 HydrophobicContact CG-CD2 4.46Å; L853-L861 PolarHBondContact N-O 3.05Å; L853-L863 HydrophobicContact CD1-CD2 4.39Å
854	T	44.9	Very low	60.7	Low	121 Å²	121	66 Å²	66	74%	0.742	35%	0.354	S	S	*	.			trans	-87.1	10.6	177.7	49.8	0	0	0	0	114.3	P852	P852-T854 PolarHBondContact O-N 3.3Å
855	L	47.5	Very low	60.2	Low	84 Å²	84	70.1 Å²	70.1	44%	0.44	37%	0.369	S	S	.	.	S	Bend	trans	-88.5	-21.9	-173.9	-98.2	107.2	0	0	0	116.2	F830 L853	F830-L855 HydrophobicContact CB-CD1 4Å; F830-L855 HydrophobicContact CB-CD2 3.78Å; F830-L855 HydrophobicContact CB-CG 4.39Å; L853-L855 VanDerWaalsContact C-N 3.32Å; L853-L855 PolarHBondContact O-N 3.08Å
856	T	42	Very low	60	Low	47 Å²	47	72.9 Å²	72.9	29%	0.288	39%	0.387	S	S	.	.	S	Bend	trans	-120.2	149.7	168.9	41.4	0	0	0	0	106.6	C858	T856-C858 WeakPolarHBondContact O-CA 3.33Å; T856-C858 WeakPolarHBondContact O-CB 3.44Å; T856-C858 PolarHBondContact O-N 3.31Å
857	S	43.9	Very low	60.2	Low	125 Å²	125	68.8 Å²	68.8	87%	0.874	37%	0.368	S	S	*	.	S	Bend	trans	-58.3	48.2	-170.5	-43.3	0	0	0	0	116.1
858	C	42.5	Very low	60.1	Low	16 Å²	16	64.9 Å²	64.9	11%	0.108	35%	0.353	C	S	.	.			trans	-139.1	60.2	-159.5	-56.1	0	0	0	0	106.7	K817 T856 N860 L861	K817-C858 PolarHBondContact NZ-SG 3.41Å; T856-C858 WeakPolarHBondContact O-CA 3.33Å; T856-C858 WeakPolarHBondContact O-CB 3.44Å; T856-C858 PolarHBondContact O-N 3.31Å; C858-N860 PolarHBondContact O-N 2.84Å; C858-L861 HydrophobicContact CB-CB 4.19Å; C858-L861 HydrophobicContact CB-CD1 4.36Å; C858-L861 PolarHBondContact O-N 2.87Å; C858-L861 VanDerWaalsContact O-N 3.1Å
859	S	42	Very low	59.5	Low	94 Å²	94	69 Å²	69	66%	0.657	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	11.2	-167.8	37.6	0	0	0	0	116.3
860	N	50.1	Low	58.7	Low	118 Å²	118	70.5 Å²	70.5	63%	0.631	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.3	19.7	176.6	-76.4	-43	0	0	0	113.9	W812 C858 R862	W812-N860 HydrophobicContact CH2-CB 4.35Å; C858-N860 PolarHBondContact O-N 2.84Å; N860-R862 PolarHBondContact O-N 3.09Å
861	L	58.9	Low	58	Low	2 Å²	2	68.4 Å²	68.4	1%	0.01	36%	0.357	C	S	.	.			trans	-75	108.9	-179.5	-167	148	0	0	0	110.4	V810 W812 K817 L853 C858	V810-L861 HydrophobicContact CB-CD2 4.17Å; V810-L861 HydrophobicContact CG1-CD1 4.49Å; V810-L861 HydrophobicContact CG1-CD2 3.81Å; V810-L861 HydrophobicContact CG1-CG 4.31Å; V810-L861 HydrophobicContact CG2-CD2 4.17Å; W812-L861 HydrophobicContact CB-CD1 3.71Å; W812-L861 HydrophobicContact CD2-CB 4.38Å; W812-L861 HydrophobicContact CD2-CD1 3.63Å; W812-L861 HydrophobicContact CD2-CG 4.08Å; W812-L861 HydrophobicContact CE3-CB 3.99Å; W812-L861 HydrophobicContact CE3-CD1 3.73Å; W812-L861 HydrophobicContact CE3-CG 3.66Å; W812-L861 HydrophobicContact CG-CD1 3.65Å; W812-L861 HydrophobicContact CH2-CB 4.36Å; W812-L861 HydrophobicContact CZ3-CB 3.99Å; W812-L861 HydrophobicContact CZ3-CG 4.13Å; K817-L861 HydrophobicContact CD-CD1 3.96Å; L853-L861 HydrophobicContact CB-CD2 4.39Å; L853-L861 HydrophobicContact CD1-CD2 3.41Å; L853-L861 VanDerWaalsContact CD1-CD2 3.41Å; L853-L861 HydrophobicContact CG-CD2 4.46Å; L853-L861 PolarHBondContact N-O 3.05Å; C858-L861 HydrophobicContact CB-CB 4.19Å; C858-L861 HydrophobicContact CB-CD1 4.36Å; C858-L861 PolarHBondContact O-N 2.87Å; C858-L861 VanDerWaalsContact O-N 3.1Å
862	R	63.2	Low	57.4	Low	141 Å²	141	69.1 Å²	69.1	53%	0.532	36%	0.359	S	S	.	.			trans	-108.9	144.6	174.5	-70.3	-174	179.7	175.6	-0.6	110.7	N860 I864	N860-R862 PolarHBondContact O-N 3.09Å; R862-I864 HydrophobicContact CB-CG1 4.21Å; R862-I864 PolarHBondContact O-N 3.32Å
863	L	72.9	Confident	56.9	Low	5 Å²	5	70 Å²	70	3%	0.026	36%	0.355	C	S	.	.			trans	-81.6	100.5	171.8	-59.2	-174.9	0	0	0	109	F793 L808 V810 V845 C848 R849 L853	F793-L863 HydrophobicContact CB-CD2 3.74Å; F793-L863 HydrophobicContact CD1-CB 3.66Å; F793-L863 HydrophobicContact CD1-CD2 4.18Å; F793-L863 HydrophobicContact CD1-CG 4.39Å; F793-L863 HydrophobicContact CD2-CD1 4.3Å; F793-L863 HydrophobicContact CD2-CD2 4.42Å; F793-L863 HydrophobicContact CE1-CB 3.76Å; F793-L863 HydrophobicContact CE2-CD1 4.46Å; F793-L863 HydrophobicContact CG-CB 4.12Å; F793-L863 HydrophobicContact CG-CD1 4.44Å; F793-L863 HydrophobicContact CG-CD2 3.86Å; F793-L863 HydrophobicContact CG-CG 4.36Å; F793-L863 HydrophobicContact CZ-CB 4.3Å; L808-L863 HydrophobicContact CD1-CD1 4.24Å; L808-L863 HydrophobicContact CD1-CD2 4.28Å; L808-L863 HydrophobicContact CD2-CD1 4.04Å; L808-L863 HydrophobicContact CD2-CD2 4.18Å; V810-L863 HydrophobicContact CB-CD2 4.35Å; V810-L863 HydrophobicContact CG1-CD2 4.01Å; V810-L863 HydrophobicContact CG2-CD2 3.38Å; V845-L863 HydrophobicContact CG1-CD1 4.06Å; C848-L863 HydrophobicContact CB-CD1 3.56Å; C848-L863 HydrophobicContact CB-CG 4.1Å; R849-L863 HydrophobicContact CG-CB 3.74Å; R849-L863 HydrophobicContact CG-CD1 4.49Å; L853-L863 HydrophobicContact CD1-CD2 4.39Å
864	I	70	Confident	56.5	Low	79 Å²	79	70.1 Å²	70.1	41%	0.405	36%	0.356	S	S	.	.			trans	-97.8	-51.9	-170.8	-50.8	177.2	0	0	0	111.1	G791 R862	G791-I864 PolarHBondContact O-N 2.83Å; R862-I864 HydrophobicContact CB-CG1 4.21Å; R862-I864 PolarHBondContact O-N 3.32Å
865	W	73.8	Confident	56.2	Low	95 Å²	95	70.6 Å²	70.6	36%	0.36	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	118.6	-174	-62.5	-77.2	0	0	0	112.7	D790 G791 Y792 F793 V867	D790-W865 WeakPolarHBondContact O-CZ3 3.3Å; G791-W865 PolarHBondContact O-N 3.5Å; Y792-W865 CarbonylContact C-O 3.42Å; Y792-W865 VanDerWaalsContact CA-O 3.26Å; Y792-W865 WeakPolarHBondContact CA-O 3.4Å; Y792-W865 HydrophobicContact CD1-CB 3.55Å; Y792-W865 HydrophobicContact CD1-CG 4.5Å; Y792-W865 HydrophobicContact CD2-CB 4.3Å; Y792-W865 HydrophobicContact CD2-CD2 4.44Å; Y792-W865 AromaticContact CD2-CE3 3.85Å; Y792-W865 HydrophobicContact CD2-CE3 3.85Å; Y792-W865 HydrophobicContact CE1-CB 3.5Å; Y792-W865 VanDerWaalsContact CE1-CB 3.5Å; Y792-W865 HydrophobicContact CE1-CG 4.11Å; Y792-W865 HydrophobicContact CE2-CB 4.29Å; Y792-W865 HydrophobicContact CE2-CD2 4.08Å; Y792-W865 AromaticContact CE2-CE3 3.77Å; Y792-W865 HydrophobicContact CE2-CE3 3.77Å; Y792-W865 HydrophobicContact CE2-CG 4.32Å; Y792-W865 HydrophobicContact CE2-CZ3 4.47Å; Y792-W865 HydrophobicContact CG-CB 3.98Å; F793-W865 VanDerWaalsContact CD1-O 3.31Å; F793-W865 WeakPolarHBondContact CD1-O 3.19Å; F793-W865 PolarHBondContact N-O 2.86Å; W865-V867 PolarHBondContact O-N 3.46Å
866	P	79.8	Confident	55.4	Low	59 Å²	59	68.5 Å²	68.5	38%	0.383	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	129.4	173.5	27.8	-31.6	0	0	0	110.6	W771 F793 S868	W771-P866 HydrophobicContact CB-CB 3.83Å; W771-P866 HydrophobicContact CG-CB 4.37Å; F793-P866 HydrophobicContact CE1-CB 4.11Å; F793-P866 HydrophobicContact CE2-CB 4.4Å; F793-P866 HydrophobicContact CZ-CB 3.86Å; P866-S868 PolarHBondContact O-N 3.27Å
867	V	79.1	Confident	54.7	Low	7 Å²	7	75.2 Å²	75.2	4%	0.042	37%	0.374	C	S	.	.			trans	-79.9	102.2	168.9	-178.7	0	0	0	0	107.6	W773 M785 L788 Y792 F793 L794 W865	W773-V867 HydrophobicContact CZ2-CG1 3.84Å; W773-V867 PolarHBondContact NE1-O 3.23Å; M785-V867 HydrophobicContact SD-CG2 3.88Å; L788-V867 HydrophobicContact CD1-CG2 3.96Å; Y792-V867 HydrophobicContact CD1-CG2 3.81Å; Y792-V867 HydrophobicContact CG-CG2 4.4Å; F793-V867 PolarHBondContact O-N 3.05Å; L794-V867 HydrophobicContact CB-CB 4.27Å; L794-V867 HydrophobicContact CD2-CB 4.28Å; L794-V867 HydrophobicContact CD2-CG1 4.3Å; W865-V867 PolarHBondContact O-N 3.46Å
868	S	73.7	Confident	53.8	Low	16 Å²	16	75.2 Å²	75.2	11%	0.112	37%	0.368	C	S	.	.			trans	-71.6	128.8	-176.5	-176.1	0	0	0	0	111.4	E770 W773 P866 R870	E770-S868 PolarHBondContact OE2-OG 2.98Å; E770-S868 VanDerWaalsContact OE2-OG 3.08Å; W773-S868 WeakPolarHBondContact CZ2-O 3.31Å; P866-S868 PolarHBondContact O-N 3.27Å; S868-R870 PolarHBondContact O-N 2.86Å; S868-R870 VanDerWaalsContact O-N 3.16Å; S868-R870 PolarHBondContact OG-N 3.02Å
869	R	64	Low	53	Low	90 Å²	90	80.1 Å²	80.1	34%	0.34	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-14.1	171.5	79.3	-166.5	-161.9	-153.9	-5.7	113.9	Q767 Q769 E770 Y772 W773	Q767-R869 PolarHBondContact O-NH2 3.17Å; Q769-R869 PolarHBondContact O-NH1 3.41Å; Q769-R869 VanDerWaalsContact O-NH1 3.14Å; E770-R869 PolarHBondContact O-N 2.83Å; Y772-R869 WeakPolarHBondContact O-CD 3.06Å; Y772-R869 PolarHBondContact O-NH1 3.29Å; W773-R869 HydrophobicContact CD2-CB 3.83Å; W773-R869 HydrophobicContact CE3-CB 4.17Å; W773-R869 HydrophobicContact CG-CB 4.17Å; W773-R869 VanDerWaalsContact CZ2-CA 3.46Å; W773-R869 HydrophobicContact CZ2-CB 4.2Å
870	R	54.1	Low	52.3	Low	135 Å²	135	82.1 Å²	82.1	51%	0.509	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-20.9	-173.6	-63	177.7	178.3	166.3	-4.7	113.6	E770 S868	E770-R870 IonicContact OE1-CZ 3.41Å; E770-R870 IonicContact OE1-NH1 3.35Å; E770-R870 PolarHBondContact OE1-NH1 2.78Å; S868-R870 PolarHBondContact O-N 2.86Å; S868-R870 VanDerWaalsContact O-N 3.16Å; S868-R870 PolarHBondContact OG-N 3.02Å
871	H	48.1	Very low	51.1	Low	51 Å²	51	84.2 Å²	84.2	24%	0.236	41%	0.406	C	S	.	.			trans	-137.7	138.9	-169.7	-56.7	101.9	0	0	0	113.8
872	K	46.3	Very low	49.4	Very low	105 Å²	105	93.7 Å²	93.7	46%	0.457	45%	0.447	S	S	.	.			trans	-109.5	164.4	174.3	-83.2	-161.6	178	-171.7	0	113.7	F874 E1030	K872-F874 WeakPolarHBondContact O-CE2 3.35Å; K872-E1030 VanDerWaalsContact CB-OE2 3.29Å; K872-E1030 WeakPolarHBondContact CB-OE2 2.86Å
873	R	45.7	Very low	47.5	Very low	70 Å²	70	94 Å²	94	26%	0.264	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	140.3	-166.1	-135.1	177.1	170.5	-164.3	-1.1	113.4	D787 L788 F898	D787-R873 PolarHBondContact O-NH1 2.85Å; D787-R873 PolarHBondContact O-NH2 3.33Å; L788-R873 VanDerWaalsContact CD2-CZ 3.5Å; R873-F898 HydrophobicContact CB-CD1 4.26Å; R873-F898 HydrophobicContact CB-CE1 4.17Å; R873-F898 HydrophobicContact CG-CD1 4.14Å; R873-F898 HydrophobicContact CG-CD2 4.41Å; R873-F898 HydrophobicContact CG-CE1 3.94Å; R873-F898 HydrophobicContact CG-CE2 4.2Å; R873-F898 HydrophobicContact CG-CG 4.38Å; R873-F898 HydrophobicContact CG-CZ 3.97Å
874	F	43.9	Very low	45.2	Very low	12 Å²	12	100.7 Å²	100.7	5%	0.053	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	137.2	169.6	-65.2	-83.9	0	0	0	109.8	K872 G896 V897 A899 L902 E1030 I1031	K872-F874 WeakPolarHBondContact O-CE2 3.35Å; F874-G896 CarbonylContact O-C 3.59Å; F874-G896 VanDerWaalsContact O-C 3.23Å; F874-G896 WeakPolarHBondContact O-CA 3.31Å; F874-V897 WeakPolarHBondContact CA-O 3.47Å; F874-V897 WeakPolarHBondContact CB-O 3.22Å; F874-V897 PolarHBondContact N-O 2.84Å; F874-V897 PolarHBondContact O-N 3.43Å; F874-A899 HydrophobicContact CD2-CB 3.65Å; F874-A899 HydrophobicContact CE2-CB 3.15Å; F874-A899 HydrophobicContact CZ-CB 4.17Å; F874-L902 HydrophobicContact CB-CD1 3.74Å; F874-L902 HydrophobicContact CD2-CD1 4.12Å; F874-L902 HydrophobicContact CG-CD1 3.91Å; F874-E1030 HydrophobicContact CZ-CB 4.27Å; F874-I1031 HydrophobicContact CD1-CD1 4.25Å; F874-I1031 HydrophobicContact CD1-CG1 3.99Å; F874-I1031 HydrophobicContact CE1-CB 4.4Å; F874-I1031 HydrophobicContact CE1-CD1 3.67Å; F874-I1031 HydrophobicContact CE1-CG1 3.07Å; F874-I1031 HydrophobicContact CZ-CB 4.43Å; F874-I1031 HydrophobicContact CZ-CG1 3.47Å; F874-I1031 VanDerWaalsContact CZ-CG1 3.47Å
875	H	38.7	Very low	43	Very low	131 Å²	131	103.9 Å²	103.9	61%	0.606	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	116.2	171.5	-71	-82.1	0	0	0	108.3	K877	H875-K877 PolarHBondContact O-N 3.08Å
876	G	30.4	Very low	40.6	Very low	41 Å²	41	106 Å²	106	42%	0.423	54%	0.542	S	S	.	.			trans	-71.5	115.3	170.8	0	0	0	0	0	109.7
877	K	28.3	Very low	38	Very low	188 Å²	188	108.6 Å²	108.6	82%	0.817	56%	0.562	S	S	*	*			trans	-116.4	98.6	159.7	-81.1	-167.6	176.3	-169.1	0	108	H875	H875-K877 PolarHBondContact O-N 3.08Å
878	T	24.5	Very low	35.2	Very low	124 Å²	124	115.9 Å²	115.9	76%	0.761	60%	0.6	S	S	*	*			trans	-108.7	100.3	150.5	44.4	0	0	0	0	106.3
879	D	26.7	Very low	32.9	Very low	120 Å²	120	124 Å²	124	64%	0.642	64%	0.636	S	S	*	*			trans	-175.8	136.2	130.4	-82	-11	0	0	0	107
880	I	25.8	Very low	31.1	Very low	135 Å²	135	127.7 Å²	127.7	69%	0.692	66%	0.663	S	S	*	*			cis	-178.8	136.1	-21.2	-108.5	162	0	0	0	100.7	F882	I880-F882 PolarHBondContact O-N 2.94Å
881	L	24.9	Very low	29.8	Very low	163 Å²	163	130.1 Å²	130.1	85%	0.853	68%	0.677	S	S	*	*	S	Bend	trans	-58.2	130.6	164	-116.2	104.8	0	0	0	108.4	D883	L881-D883 PolarHBondContact O-N 3.05Å
882	F	23.6	Very low	28.8	Very low	201 Å²	201	133.1 Å²	133.1	88%	0.882	70%	0.704	S	S	*	*	S	Bend	trans	-4.7	103.7	159.7	-76.8	-96.9	0	0	0	115.2	I880	I880-F882 PolarHBondContact O-N 2.94Å
883	D	23	Very low	28.1	Very low	147 Å²	147	134.6 Å²	134.6	79%	0.786	72%	0.717	S	S	*	*				-155.3	143.9	125.1	-136.6	-19.2	0	0	0	112.1	L881 T885	L881-D883 PolarHBondContact O-N 3.05Å; D883-T885 PolarHBondContact O-N 3.37Å
884	N	24	Very low	27.3	Very low	145 Å²	145	135.4 Å²	135.4	78%	0.775	74%	0.739	S	S	*	*			trans	-70.2	123.3	-174.8	-66.8	-53.1	0	0	0	110.6
885	T	25.8	Very low	26.9	Very low	147 Å²	147	141.1 Å²	141.1	90%	0.902	77%	0.769	S	S	*	*			trans	-169.2	136	139.8	16.4	0	0	0	0	111.9	D883	D883-T885 PolarHBondContact O-N 3.37Å
886	V	23.2	Very low	26.9	Very low	138 Å²	138	135.4 Å²	135.4	84%	0.836	75%	0.746	S	S	*	*			trans	-60.5	135.7	-177.9	172.9	0	0	0	0	112.4
887	S	23.6	Very low	27.4	Very low	115 Å²	115	136 Å²	136	80%	0.804	74%	0.741	S	S	*	*			trans	175.7	130.4	130.4	-71.7	0	0	0	0	112.1
888	N	22.2	Very low	28.4	Very low	159 Å²	159	128.3 Å²	128.3	85%	0.85	71%	0.708	S	S	*	*			trans	-57.1	142.8	174.3	-73.3	-34.4	0	0	0	113.8
889	E	25	Very low	29.6	Very low	186 Å²	186	122.5 Å²	122.5	87%	0.869	67%	0.673	S	S	*	*				176	136	115.9	-94.2	-178.2	-172.5	0	0	112	K891	E889-K891 PolarHBondContact O-N 3.37Å
890	N	25	Very low	30.7	Very low	169 Å²	169	119.4 Å²	119.4	90%	0.904	66%	0.66	S	S	*	*			trans	-32.4	109.2	179.1	-64	-38.1	0	0	0	116.9
891	K	27.8	Very low	32	Very low	185 Å²	185	119.8 Å²	119.8	80%	0.804	66%	0.657	S	S	*	*			trans	-136.2	126.2	152.7	-79.9	-176.3	-179.9	170.2	0	110.8	E889 N893	E889-K891 PolarHBondContact O-N 3.37Å; K891-N893 PolarHBondContact O-N 2.79Å; K891-N893 PolarHBondContact O-OD1 3.45Å
892	S	27	Very low	33.8	Very low	114 Å²	114	112.9 Å²	112.9	80%	0.797	62%	0.621	S	S	*	*			trans	-63.9	96	177.5	47.9	0	0	0	0	111.2	A894	S892-A894 PolarHBondContact O-N 2.82Å
893	N	30.4	Very low	35.8	Very low	137 Å²	137	106.7 Å²	106.7	73%	0.733	60%	0.6	S	S	*	*			trans	-81.4	80.9	-177.4	-78.7	-11.6	0	0	0	112.9	K891	K891-N893 PolarHBondContact O-N 2.79Å; K891-N893 PolarHBondContact O-OD1 3.45Å
894	A	30.2	Very low	37.9	Very low	87 Å²	87	103.6 Å²	103.6	72%	0.719	58%	0.58	S	S	*	*			trans	-155.2	19.9	164.5	0	0	0	0	0	115.3	S892 G896	S892-A894 PolarHBondContact O-N 2.82Å; A894-G896 PolarHBondContact O-N 2.9Å; A894-G896 VanDerWaalsContact O-N 3.16Å
895	D	34.2	Very low	40.2	Very low	131 Å²	131	101 Å²	101	70%	0.701	57%	0.573	S	S	*	*			trans	-73.1	107.2	-177.5	-86.6	-20.9	0	0	0	112.3
896	G	39.6	Very low	42.5	Very low	12 Å²	12	98.3 Å²	98.3	12%	0.124	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.7	122.2	166.6	0	0	0	0	0	111.3	F874 A894	F874-G896 CarbonylContact O-C 3.59Å; F874-G896 VanDerWaalsContact O-C 3.23Å; F874-G896 WeakPolarHBondContact O-CA 3.31Å; A894-G896 PolarHBondContact O-N 2.9Å; A894-G896 VanDerWaalsContact O-N 3.16Å
897	V	41.8	Very low	45	Very low	52 Å²	52	91.8 Å²	91.8	32%	0.315	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.7	-176.8	179.4	0	0	0	0	109.6	F874 F901 L902	F874-V897 WeakPolarHBondContact CA-O 3.47Å; F874-V897 WeakPolarHBondContact CB-O 3.22Å; F874-V897 PolarHBondContact N-O 2.84Å; F874-V897 PolarHBondContact O-N 3.43Å; V897-F901 HydrophobicContact CG1-CB 3.39Å; V897-F901 HydrophobicContact CG1-CD2 4.41Å; V897-F901 HydrophobicContact CG1-CG 4.36Å; V897-L902 HydrophobicContact CB-CD2 3.99Å; V897-L902 HydrophobicContact CB-CG 4.41Å; V897-L902 HydrophobicContact CG1-CD2 3.89Å; V897-L902 HydrophobicContact CG1-CG 4.09Å
898	F	49.2	Very low	47.6	Very low	27 Å²	27	88.9 Å²	88.9	12%	0.118	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	150.6	174.7	-67.3	-95.6	0	0	0	111.1	L788 Y792 R873 C900 F901	L788-F898 HydrophobicContact CD2-CZ 4.48Å; Y792-F898 AromaticContact CE1-CE2 3.65Å; Y792-F898 HydrophobicContact CE1-CE2 3.65Å; Y792-F898 AromaticContact CE1-CZ 3.95Å; Y792-F898 HydrophobicContact CE1-CZ 3.95Å; R873-F898 HydrophobicContact CB-CD1 4.26Å; R873-F898 HydrophobicContact CB-CE1 4.17Å; R873-F898 HydrophobicContact CG-CD1 4.14Å; R873-F898 HydrophobicContact CG-CD2 4.41Å; R873-F898 HydrophobicContact CG-CE1 3.94Å; R873-F898 HydrophobicContact CG-CE2 4.2Å; R873-F898 HydrophobicContact CG-CG 4.38Å; R873-F898 HydrophobicContact CG-CZ 3.97Å; F898-C900 VanDerWaalsContact CB-SG 3.56Å; F898-C900 PolarHBondContact O-N 3.03Å; F898-F901 HydrophobicContact CB-CD2 3.75Å; F898-F901 HydrophobicContact CB-CE2 3.98Å; F898-F901 HydrophobicContact CD2-CD2 4.36Å; F898-F901 HydrophobicContact CD2-CE2 4.08Å; F898-F901 HydrophobicContact CG-CE2 4.41Å; F898-F901 PolarHBondContact O-N 3.26Å
899	A	49.6	Very low	50.4	Low	3 Å²	3	83.2 Å²	83.2	3%	0.025	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-49.8	-37.1	-178	0	0	0	0	0	113.1	F874 F901 L902 L907 A1034 R1038	F874-A899 HydrophobicContact CD2-CB 3.65Å; F874-A899 HydrophobicContact CE2-CB 3.15Å; F874-A899 HydrophobicContact CZ-CB 4.17Å; A899-F901 PolarHBondContact O-N 3.34Å; A899-L902 PolarHBondContact O-N 3.3Å; A899-L907 HydrophobicContact CB-CD2 4.3Å; A899-A1034 HydrophobicContact CB-CB 3.65Å; A899-R1038 PolarHBondContact O-NH2 3.2Å
900	C	49.7	Very low	53.1	Low	54 Å²	54	76.4 Å²	76.4	37%	0.365	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-60.7	-23.7	-179.2	52.4	0	0	0	0	113.1	F898 R1038	F898-C900 VanDerWaalsContact CB-SG 3.56Å; F898-C900 PolarHBondContact O-N 3.03Å; C900-R1038 PolarHBondContact O-NH2 3.46Å
901	F	52.3	Low	56	Low	143 Å²	143	69.5 Å²	69.5	63%	0.627	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-101.5	-8.3	-179.2	-56	-66.9	0	0	0	114.1	V897 F898 A899	V897-F901 HydrophobicContact CG1-CB 3.39Å; V897-F901 HydrophobicContact CG1-CD2 4.41Å; V897-F901 HydrophobicContact CG1-CG 4.36Å; F898-F901 HydrophobicContact CB-CD2 3.75Å; F898-F901 HydrophobicContact CB-CE2 3.98Å; F898-F901 HydrophobicContact CD2-CD2 4.36Å; F898-F901 HydrophobicContact CD2-CE2 4.08Å; F898-F901 HydrophobicContact CG-CE2 4.41Å; F898-F901 PolarHBondContact O-N 3.26Å; A899-F901 PolarHBondContact O-N 3.34Å
902	L	62	Low	58.7	Low	19 Å²	19	67.4 Å²	67.4	10%	0.099	39%	0.387	C	S	.	.	S	Bend	trans	-80.4	145.4	175.3	-68.4	176.4	0	0	0	111.1	F874 V897 A899 Q906 L907 R1038	F874-L902 HydrophobicContact CB-CD1 3.74Å; F874-L902 HydrophobicContact CD2-CD1 4.12Å; F874-L902 HydrophobicContact CG-CD1 3.91Å; V897-L902 HydrophobicContact CB-CD2 3.99Å; V897-L902 HydrophobicContact CB-CG 4.41Å; V897-L902 HydrophobicContact CG1-CD2 3.89Å; V897-L902 HydrophobicContact CG1-CG 4.09Å; A899-L902 PolarHBondContact O-N 3.3Å; L902-Q906 HydrophobicContact CB-CB 4.35Å; L902-Q906 HydrophobicContact CD2-CB 4.46Å; L902-L907 HydrophobicContact CB-CD2 4.19Å; L902-L907 HydrophobicContact CB-CG 4.03Å; L902-L907 HydrophobicContact CD1-CD2 4.07Å; L902-R1038 PolarHBondContact O-NH1 3.49Å; L902-R1038 PolarHBondContact O-NH2 3.18Å
903	T	65.6	Low	61.5	Low	71 Å²	71	65.1 Å²	65.1	44%	0.436	37%	0.371	S	S	.	.			trans	-72.7	161.3	172.8	68.4	0	0	0	0	110.7	S905 Q906 L907	T903-S905 PolarHBondContact O-N 3.26Å; T903-S905 PolarHBondContact OG1-OG 3.45Å; T903-Q906 WeakPolarHBondContact O-CB 3.38Å; T903-Q906 PolarHBondContact O-N 3.15Å; T903-Q906 VanDerWaalsContact OG1-CG 3.27Å; T903-Q906 WeakPolarHBondContact OG1-CG 3.38Å; T903-Q906 PolarHBondContact OG1-OE1 3.34Å; T903-L907 PolarHBondContact O-N 3.3Å
904	E	68.1	Low	64.3	Low	82 Å²	82	60 Å²	60	38%	0.383	34%	0.343	S	S	.	.	H	α-helix	trans	-61.4	-40.4	-178.2	-169.6	-169.4	145.4	0	0	113.1	Q906 L907 N908 L1035 F1040	E904-Q906 VanDerWaalsContact C-N 3.3Å; E904-Q906 PolarHBondContact O-N 3.3Å; E904-L907 PolarHBondContact O-N 2.63Å; E904-N908 PolarHBondContact O-N 3.01Å; E904-L1035 HydrophobicContact CG-CD2 4.45Å; E904-F1040 HydrophobicContact CG-CE2 4.27Å; E904-F1040 HydrophobicContact CG-CZ 4.35Å; E904-F1040 WeakPolarHBondContact OE1-CE1 3.41Å; E904-F1040 WeakPolarHBondContact OE1-CZ 3.34Å; E904-F1040 VanDerWaalsContact OE2-CZ 3.26Å; E904-F1040 WeakPolarHBondContact OE2-CZ 3.32Å
905	S	71.1	Confident	67	Low	90 Å²	90	57.7 Å²	57.7	63%	0.629	32%	0.323	S	S	*	.	H	α-helix	trans	-62.9	-37.2	176.1	58.5	0	0	0	0	112	T903 G909	T903-S905 PolarHBondContact O-N 3.26Å; T903-S905 PolarHBondContact OG1-OG 3.45Å; S905-G909 PolarHBondContact O-N 2.9Å
906	Q	74.9	Confident	69.6	Low	91 Å²	91	54.2 Å²	54.2	43%	0.425	31%	0.313	S	S	.	.	H	α-helix	trans	-67.3	-45	175.5	-70	171.8	-26.9	0	0	111.7	L902 T903 E904 N908 G909 E910	L902-Q906 HydrophobicContact CB-CB 4.35Å; L902-Q906 HydrophobicContact CD2-CB 4.46Å; T903-Q906 WeakPolarHBondContact O-CB 3.38Å; T903-Q906 PolarHBondContact O-N 3.15Å; T903-Q906 VanDerWaalsContact OG1-CG 3.27Å; T903-Q906 WeakPolarHBondContact OG1-CG 3.38Å; T903-Q906 PolarHBondContact OG1-OE1 3.34Å; E904-Q906 VanDerWaalsContact C-N 3.3Å; E904-Q906 PolarHBondContact O-N 3.3Å; Q906-N908 PolarHBondContact O-N 3.35Å; Q906-G909 PolarHBondContact O-N 3.44Å; Q906-E910 WeakPolarHBondContact O-CB 3.33Å; Q906-E910 WeakPolarHBondContact O-CG 3.5Å; Q906-E910 PolarHBondContact O-N 3.27Å
907	L	76.5	Confident	72.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-44	176.9	-74.2	169.6	0	0	0	112	A899 L902 T903 E904 E910 L911 I1031 L1035	A899-L907 HydrophobicContact CB-CD2 4.3Å; L902-L907 HydrophobicContact CB-CD2 4.19Å; L902-L907 HydrophobicContact CB-CG 4.03Å; L902-L907 HydrophobicContact CD1-CD2 4.07Å; T903-L907 PolarHBondContact O-N 3.3Å; E904-L907 PolarHBondContact O-N 2.63Å; L907-E910 PolarHBondContact O-N 2.87Å; L907-L911 WeakPolarHBondContact O-CB 3.44Å; L907-L911 PolarHBondContact O-N 2.53Å; L907-I1031 HydrophobicContact CB-CG2 4.27Å; L907-I1031 HydrophobicContact CD2-CG2 4.18Å; L907-I1031 WeakPolarHBondContact O-CG2 2.96Å; L907-L1035 HydrophobicContact CB-CD2 3.88Å; L907-L1035 HydrophobicContact CB-CG 4.26Å; L907-L1035 HydrophobicContact CD1-CD2 4.08Å; L907-L1035 HydrophobicContact CD1-CG 4.49Å
908	N	78.3	Confident	74.4	Confident	55 Å²	55	53.9 Å²	53.9	29%	0.294	31%	0.305	S	S	.	.	H	α-helix	trans	-66.3	-38.5	176.3	-81	-30.4	0	0	0	112.4	E904 Q906 L911 K912 L1035	E904-N908 PolarHBondContact O-N 3.01Å; Q906-N908 PolarHBondContact O-N 3.35Å; N908-L911 PolarHBondContact O-N 3.3Å; N908-K912 PolarHBondContact O-N 3.43Å; N908-L1035 WeakPolarHBondContact OD1-CD1 3.45Å
909	G	80.8	Confident	76.4	Confident	39 Å²	39	57.6 Å²	57.6	40%	0.402	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-46.5	173.6	0	0	0	0	0	112.6	S905 Q906 L911 K912 S913	S905-G909 PolarHBondContact O-N 2.9Å; Q906-G909 PolarHBondContact O-N 3.44Å; G909-L911 VanDerWaalsContact C-N 3.34Å; G909-L911 PolarHBondContact O-N 3.41Å; G909-K912 PolarHBondContact O-N 3.36Å; G909-S913 PolarHBondContact O-N 3.08Å
910	E	81.6	Confident	78.3	Confident	43 Å²	43	63.9 Å²	63.9	20%	0.201	36%	0.355	C	S	.	.	H	α-helix	trans	-61.1	-40.6	174.1	-77.4	-68.9	164.5	0	0	111.7	Q906 L907 K912 S913 K914 I1031	Q906-E910 WeakPolarHBondContact O-CB 3.33Å; Q906-E910 WeakPolarHBondContact O-CG 3.5Å; Q906-E910 PolarHBondContact O-N 3.27Å; L907-E910 PolarHBondContact O-N 2.87Å; E910-K912 PolarHBondContact O-N 2.65Å; E910-S913 PolarHBondContact O-N 3.32Å; E910-K914 WeakPolarHBondContact O-CB 3.37Å; E910-K914 WeakPolarHBondContact O-CG 3.3Å; E910-K914 PolarHBondContact O-N 2.97Å; E910-I1031 HydrophobicContact CB-CD1 3.83Å
911	L	84.7	Confident	80.4	Confident	25 Å²	25	62.4 Å²	62.4	13%	0.131	34%	0.344	C	S	.	.	H	α-helix	trans	-62.2	-44.6	177.4	-172.7	62	0	0	0	111.9	L907 N908 G909 K914 A915 A1028 I1031 R1032 L1035 L1045	L907-L911 WeakPolarHBondContact O-CB 3.44Å; L907-L911 PolarHBondContact O-N 2.53Å; N908-L911 PolarHBondContact O-N 3.3Å; G909-L911 VanDerWaalsContact C-N 3.34Å; G909-L911 PolarHBondContact O-N 3.41Å; L911-K914 PolarHBondContact O-N 3.39Å; L911-A915 WeakPolarHBondContact O-CB 3.32Å; L911-A915 PolarHBondContact O-N 3.19Å; L911-A1028 HydrophobicContact CD1-CB 4.2Å; L911-I1031 HydrophobicContact CB-CG2 3.95Å; L911-I1031 HydrophobicContact CD1-CB 4.33Å; L911-I1031 HydrophobicContact CD1-CG2 4.31Å; L911-R1032 HydrophobicContact CD1-CG 3.94Å; L911-R1032 HydrophobicContact CD2-CG 4.18Å; L911-L1035 HydrophobicContact CD2-CD1 4.23Å; L911-L1045 HydrophobicContact CD2-CD2 4.41Å
912	K	85.1	Confident	82.2	Confident	141 Å²	141	58.2 Å²	58.2	61%	0.613	33%	0.328	S	S	*	.	H	α-helix	trans	-62.5	-43.8	175.7	-73.5	-178.9	179.5	-177.6	0	111.6	N908 G909 E910 A915 A916	N908-K912 PolarHBondContact O-N 3.43Å; G909-K912 PolarHBondContact O-N 3.36Å; E910-K912 PolarHBondContact O-N 2.65Å; K912-A915 PolarHBondContact O-N 2.91Å; K912-A916 PolarHBondContact O-N 3.47Å
913	S	86.4	Confident	83.6	Confident	65 Å²	65	64.9 Å²	64.9	46%	0.455	36%	0.356	S	S	.	.	H	α-helix	trans	-59.7	-47.7	176	-178.6	0	0	0	0	111.8	G909 E910 A915 A916 E917	G909-S913 PolarHBondContact O-N 3.08Å; E910-S913 PolarHBondContact O-N 3.32Å; S913-A915 PolarHBondContact O-N 2.99Å; S913-A916 PolarHBondContact O-N 3.48Å; S913-E917 PolarHBondContact O-N 3.17Å
914	K	88.2	Confident	84.9	Confident	30 Å²	30	64.5 Å²	64.5	13%	0.13	35%	0.353	C	S	.	.	H	α-helix	trans	-66.4	-35.7	178.3	-65	-73.7	161.2	-108	0	112.5	E910 L911 E917 I918 V1024 Q1027 A1028 I1031	E910-K914 WeakPolarHBondContact O-CB 3.37Å; E910-K914 WeakPolarHBondContact O-CG 3.3Å; E910-K914 PolarHBondContact O-N 2.97Å; L911-K914 PolarHBondContact O-N 3.39Å; K914-E917 IonicContact NZ-OE2 3.91Å; K914-E917 PolarHBondContact NZ-OE2 3.49Å; K914-E917 PolarHBondContact O-N 2.86Å; K914-I918 WeakPolarHBondContact O-CD1 3.35Å; K914-I918 VanDerWaalsContact O-CG1 3.26Å; K914-I918 WeakPolarHBondContact O-CG1 3.35Å; K914-I918 PolarHBondContact O-N 2.83Å; K914-V1024 HydrophobicContact CB-CG1 4.19Å; K914-V1024 HydrophobicContact CD-CG1 3.76Å; K914-Q1027 HydrophobicContact CD-CB 4.49Å; K914-A1028 HydrophobicContact CB-CB 4.24Å; K914-I1031 HydrophobicContact CG-CD1 4.17Å
915	A	86.9	Confident	86	Confident	38 Å²	38	61.1 Å²	61.1	31%	0.314	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-42.4	173.4	0	0	0	0	0	112	L911 K912 S913 I918 N919	L911-A915 WeakPolarHBondContact O-CB 3.32Å; L911-A915 PolarHBondContact O-N 3.19Å; K912-A915 PolarHBondContact O-N 2.91Å; S913-A915 PolarHBondContact O-N 2.99Å; A915-I918 PolarHBondContact O-N 2.75Å; A915-N919 PolarHBondContact O-N 2.94Å; A915-N919 VanDerWaalsContact O-N 3.07Å
916	A	89	Confident	86.9	Confident	59 Å²	59	60.9 Å²	60.9	49%	0.488	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-42.8	173.9	0	0	0	0	0	112.1	K912 S913 I918 N919 Q920	K912-A916 PolarHBondContact O-N 3.47Å; S913-A916 PolarHBondContact O-N 3.48Å; A916-I918 VanDerWaalsContact C-N 3.34Å; A916-I918 PolarHBondContact O-N 2.85Å; A916-N919 PolarHBondContact O-N 2.87Å; A916-Q920 PolarHBondContact O-N 3.41Å
917	E	92	Very high	87.7	Confident	39 Å²	39	60.3 Å²	60.3	18%	0.182	33%	0.333	C	S	.	.	H	α-helix	trans	-60.9	-40.6	175.3	-172.5	178.1	176.3	0	0	111.7	S913 K914 Q920 L921 R1020 V1024	S913-E917 PolarHBondContact O-N 3.17Å; K914-E917 IonicContact NZ-OE2 3.91Å; K914-E917 PolarHBondContact NZ-OE2 3.49Å; K914-E917 PolarHBondContact O-N 2.86Å; E917-Q920 PolarHBondContact O-N 3.29Å; E917-L921 HydrophobicContact CG-CD1 4.19Å; E917-L921 WeakPolarHBondContact O-CB 3.32Å; E917-L921 WeakPolarHBondContact O-CG 3.35Å; E917-L921 PolarHBondContact O-N 2.96Å; E917-R1020 IonicContact OE1-CZ 3.14Å; E917-R1020 VanDerWaalsContact OE1-CZ 3.31Å; E917-R1020 IonicContact OE1-NE 2.88Å; E917-R1020 PolarHBondContact OE1-NE 3.36Å; E917-R1020 IonicContact OE1-NH2 2.72Å; E917-R1020 PolarHBondContact OE1-NH2 3.06Å; E917-R1020 IonicContact OE2-NH2 2.71Å; E917-V1024 HydrophobicContact CB-CG1 4.19Å; E917-V1024 VanDerWaalsContact CD-CG2 3.49Å; E917-V1024 HydrophobicContact CG-CG1 4.15Å; E917-V1024 HydrophobicContact CG-CG2 4.15Å; E917-V1024 VanDerWaalsContact OE1-CG2 3.25Å; E917-V1024 WeakPolarHBondContact OE1-CG2 3.39Å
918	I	90.4	Very high	88.5	Confident	17 Å²	17	61.1 Å²	61.1	9%	0.087	34%	0.337	C	S	.	.	H	α-helix	trans	-62.4	-48	175.5	-70.5	160.7	0	0	0	111	K914 A915 A916 Q920 L921 D922 V1024 R1025 A1028	K914-I918 WeakPolarHBondContact O-CD1 3.35Å; K914-I918 VanDerWaalsContact O-CG1 3.26Å; K914-I918 WeakPolarHBondContact O-CG1 3.35Å; K914-I918 PolarHBondContact O-N 2.83Å; A915-I918 PolarHBondContact O-N 2.75Å; A916-I918 VanDerWaalsContact C-N 3.34Å; A916-I918 PolarHBondContact O-N 2.85Å; I918-Q920 VanDerWaalsContact C-N 3.3Å; I918-Q920 PolarHBondContact O-N 3.22Å; I918-L921 PolarHBondContact O-N 2.7Å; I918-D922 WeakPolarHBondContact CG2-OD2 3.23Å; I918-D922 PolarHBondContact O-N 3.33Å; I918-V1024 HydrophobicContact CD1-CG1 4.17Å; I918-V1024 HydrophobicContact CG1-CB 4.33Å; I918-V1024 HydrophobicContact CG1-CG1 3.68Å; I918-R1025 HydrophobicContact CD1-CB 4.5Å; I918-R1025 HydrophobicContact CD1-CG 3.73Å; I918-R1025 HydrophobicContact CG1-CG 3.98Å; I918-R1025 HydrophobicContact CG2-CG 4.44Å; I918-A1028 HydrophobicContact CD1-CB 4.2Å
919	N	90.5	Very high	89	Confident	105 Å²	105	62.9 Å²	62.9	56%	0.561	34%	0.343	S	S	*	.	H	α-helix	trans	-61.8	-37.6	179	-73.5	-22	0	0	0	112.2	A915 A916 K923	A915-N919 PolarHBondContact O-N 2.94Å; A915-N919 VanDerWaalsContact O-N 3.07Å; A916-N919 PolarHBondContact O-N 2.87Å; N919-K923 PolarHBondContact O-N 3.32Å
920	Q	91.1	Very high	89.5	Confident	135 Å²	135	65.7 Å²	65.7	63%	0.631	35%	0.349	S	S	*	.	H	α-helix	trans	-66	-44.1	174.6	-173.4	177.4	4.4	0	0	111.4	A916 E917 I918 K923 V924	A916-Q920 PolarHBondContact O-N 3.41Å; E917-Q920 PolarHBondContact O-N 3.29Å; I918-Q920 VanDerWaalsContact C-N 3.3Å; I918-Q920 PolarHBondContact O-N 3.22Å; Q920-K923 PolarHBondContact O-N 2.72Å; Q920-V924 WeakPolarHBondContact O-CG2 3.23Å; Q920-V924 PolarHBondContact O-N 3.13Å; Q920-V924 VanDerWaalsContact O-N 3.11Å
921	L	92.4	Very high	90	Very high	24 Å²	24	67.2 Å²	67.2	13%	0.126	36%	0.356	C	S	.	.	H	α-helix	trans	-64	-39.2	176.3	-75	164.8	0	0	0	112.2	E917 I918 K923 V924 I925 R1020 Q1021 V1024	E917-L921 HydrophobicContact CG-CD1 4.19Å; E917-L921 WeakPolarHBondContact O-CB 3.32Å; E917-L921 WeakPolarHBondContact O-CG 3.35Å; E917-L921 PolarHBondContact O-N 2.96Å; I918-L921 PolarHBondContact O-N 2.7Å; L921-K923 VanDerWaalsContact C-N 3.33Å; L921-K923 PolarHBondContact O-N 2.93Å; L921-V924 PolarHBondContact O-N 3.49Å; L921-I925 WeakPolarHBondContact O-CB 3.47Å; L921-I925 WeakPolarHBondContact O-CD1 3.34Å; L921-I925 WeakPolarHBondContact O-CG1 3.38Å; L921-I925 PolarHBondContact O-N 3.47Å; L921-R1020 HydrophobicContact CD1-CB 4.39Å; L921-R1020 HydrophobicContact CD1-CG 3.8Å; L921-R1020 HydrophobicContact CD2-CB 4.33Å; L921-R1020 HydrophobicContact CD2-CG 4.1Å; L921-Q1021 HydrophobicContact CB-CB 4.32Å; L921-Q1021 HydrophobicContact CD1-CB 4.16Å; L921-V1024 HydrophobicContact CD1-CG2 4.26Å
922	D	90.7	Very high	90.2	Very high	55 Å²	55	67.1 Å²	67.1	29%	0.294	36%	0.357	S	S	.	.	H	α-helix	trans	-58.6	-43.3	175.3	-83.7	-50.5	0	0	0	111.2	I918 I925 T926 Q1021 R1025	I918-D922 WeakPolarHBondContact CG2-OD2 3.23Å; I918-D922 PolarHBondContact O-N 3.33Å; D922-I925 PolarHBondContact O-N 2.61Å; D922-T926 WeakPolarHBondContact O-CG2 3.42Å; D922-T926 PolarHBondContact O-N 2.95Å; D922-T926 PolarHBondContact O-OG1 2.64Å; D922-Q1021 PolarHBondContact OD1-NE2 2.78Å; D922-Q1021 PolarHBondContact OD2-NE2 2.97Å; D922-R1025 IonicContact OD1-NH2 3.31Å; D922-R1025 PolarHBondContact OD1-NH2 3.28Å; D922-R1025 IonicContact OD2-NH2 3.8Å; D922-R1025 PolarHBondContact OD2-NH2 3.38Å
923	K	91.3	Very high	90.2	Very high	159 Å²	159	66.5 Å²	66.5	69%	0.691	35%	0.354	S	S	*	.	H	α-helix	trans	-61.3	-47.7	174.2	-69.2	179.7	-177.7	-177.4	0	112.4	N919 Q920 L921 I925 T926 D927	N919-K923 PolarHBondContact O-N 3.32Å; Q920-K923 PolarHBondContact O-N 2.72Å; L921-K923 VanDerWaalsContact C-N 3.33Å; L921-K923 PolarHBondContact O-N 2.93Å; K923-I925 VanDerWaalsContact C-N 3.33Å; K923-I925 PolarHBondContact O-N 3.24Å; K923-T926 PolarHBondContact O-N 3.02Å; K923-T926 PolarHBondContact O-OG1 3.19Å; K923-D927 PolarHBondContact O-N 2.92Å
924	V	92.3	Very high	90.5	Very high	63 Å²	63	67.3 Å²	67.3	38%	0.382	35%	0.353	S	S	.	.	H	α-helix	trans	-61.3	-41.9	178.8	172.2	0	0	0	0	111.4	Q920 L921 D927 L928	Q920-V924 WeakPolarHBondContact O-CG2 3.23Å; Q920-V924 PolarHBondContact O-N 3.13Å; Q920-V924 VanDerWaalsContact O-N 3.11Å; L921-V924 PolarHBondContact O-N 3.49Å; V924-D927 PolarHBondContact O-N 3.36Å; V924-L928 HydrophobicContact CG1-CD1 3.79Å; V924-L928 HydrophobicContact CG1-CG 4.32Å; V924-L928 WeakPolarHBondContact O-CB 3.44Å; V924-L928 VanDerWaalsContact O-CG 3.3Å; V924-L928 WeakPolarHBondContact O-CG 3.26Å; V924-L928 PolarHBondContact O-N 2.88Å
925	I	91.6	Very high	90.5	Very high	10 Å²	10	66.1 Å²	66.1	5%	0.051	35%	0.349	C	S	.	.	H	α-helix	trans	-61.4	-45.3	177.5	-73.9	164.6	0	0	0	110.5	L921 D922 K923 L928 Q929 Y1014 A1017 I1018 Q1021	L921-I925 WeakPolarHBondContact O-CB 3.47Å; L921-I925 WeakPolarHBondContact O-CD1 3.34Å; L921-I925 WeakPolarHBondContact O-CG1 3.38Å; L921-I925 PolarHBondContact O-N 3.47Å; D922-I925 PolarHBondContact O-N 2.61Å; K923-I925 VanDerWaalsContact C-N 3.33Å; K923-I925 PolarHBondContact O-N 3.24Å; I925-L928 PolarHBondContact O-N 3.13Å; I925-Q929 WeakPolarHBondContact O-CG 3.42Å; I925-Q929 PolarHBondContact O-N 2.95Å; I925-Y1014 HydrophobicContact CG2-CD2 4.31Å; I925-Y1014 HydrophobicContact CG2-CE2 3.67Å; I925-A1017 HydrophobicContact CG1-CB 3.84Å; I925-I1018 HydrophobicContact CD1-CD1 3.73Å; I925-I1018 HydrophobicContact CD1-CG1 4.26Å; I925-I1018 HydrophobicContact CG1-CD1 4.19Å; I925-I1018 HydrophobicContact CG1-CG1 4.41Å; I925-I1018 HydrophobicContact CG2-CD1 3.94Å; I925-Q1021 HydrophobicContact CD1-CB 4.11Å; I925-Q1021 HydrophobicContact CD1-CG 4.43Å
926	T	90.9	Very high	90.5	Very high	85 Å²	85	67.9 Å²	67.9	52%	0.521	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-39	178.1	52.4	0	0	0	0	113.1	D922 K923 Q929 L930	D922-T926 WeakPolarHBondContact O-CG2 3.42Å; D922-T926 PolarHBondContact O-N 2.95Å; D922-T926 PolarHBondContact O-OG1 2.64Å; K923-T926 PolarHBondContact O-N 3.02Å; K923-T926 PolarHBondContact O-OG1 3.19Å; T926-Q929 PolarHBondContact O-N 2.93Å; T926-L930 PolarHBondContact O-N 3.38Å; T926-L930 VanDerWaalsContact O-N 3.15Å
927	D	91.4	Very high	90.5	Very high	80 Å²	80	68.4 Å²	68.4	43%	0.428	35%	0.347	S	S	.	.	H	α-helix	trans	-66.3	-46.1	176.8	179	43.4	0	0	0	111.4	K923 V924 Q929 L930 Q931	K923-D927 PolarHBondContact O-N 2.92Å; V924-D927 PolarHBondContact O-N 3.36Å; D927-Q929 VanDerWaalsContact C-N 3.31Å; D927-Q929 PolarHBondContact O-N 3.24Å; D927-L930 PolarHBondContact O-N 3.49Å; D927-L930 VanDerWaalsContact O-N 3.15Å; D927-Q931 WeakPolarHBondContact O-CG 3.44Å; D927-Q931 PolarHBondContact O-N 3.46Å; D927-Q931 PolarHBondContact OD1-NE2 3.46Å; D927-Q931 VanDerWaalsContact OD1-NE2 3.11Å; D927-Q931 PolarHBondContact OD2-NE2 3.26Å
928	L	94	Very high	90.5	Very high	16 Å²	16	70.7 Å²	70.7	8%	0.084	36%	0.36	C	S	.	.	H	α-helix	trans	-61.7	-36.5	176.2	-71.1	170.7	0	0	0	112.7	V924 I925 S932 I1010 N1013 Y1014 A1017	V924-L928 HydrophobicContact CG1-CD1 3.79Å; V924-L928 HydrophobicContact CG1-CG 4.32Å; V924-L928 WeakPolarHBondContact O-CB 3.44Å; V924-L928 VanDerWaalsContact O-CG 3.3Å; V924-L928 WeakPolarHBondContact O-CG 3.26Å; V924-L928 PolarHBondContact O-N 2.88Å; I925-L928 PolarHBondContact O-N 3.13Å; L928-S932 WeakPolarHBondContact O-CB 3.3Å; L928-S932 PolarHBondContact O-N 3.32Å; L928-I1010 HydrophobicContact CB-CG2 4.41Å; L928-I1010 HydrophobicContact CD2-CG2 4.12Å; L928-I1010 VanDerWaalsContact O-CG2 3.26Å; L928-I1010 WeakPolarHBondContact O-CG2 3.38Å; L928-N1013 HydrophobicContact CD1-CB 4.08Å; L928-N1013 HydrophobicContact CD2-CB 4.07Å; L928-Y1014 HydrophobicContact CB-CD2 4.25Å; L928-A1017 HydrophobicContact CD1-CB 4.3Å
929	Q	88.1	Confident	90.4	Very high	92 Å²	92	73.3 Å²	73.3	43%	0.43	37%	0.371	S	S	.	.	H	α-helix	trans	-63	-44.7	173.7	-75.6	175	-21.3	0	0	112	I925 T926 D927 S932 K933 Y1014	I925-Q929 WeakPolarHBondContact O-CG 3.42Å; I925-Q929 PolarHBondContact O-N 2.95Å; T926-Q929 PolarHBondContact O-N 2.93Å; D927-Q929 VanDerWaalsContact C-N 3.31Å; D927-Q929 PolarHBondContact O-N 3.24Å; Q929-S932 PolarHBondContact O-N 3.14Å; Q929-K933 PolarHBondContact O-N 3.32Å; Q929-Y1014 HydrophobicContact CG-CD2 3.91Å; Q929-Y1014 HydrophobicContact CG-CE2 3.33Å; Q929-Y1014 PolarHBondContact NE2-OH 2.97Å
930	L	90.9	Very high	90.2	Very high	99 Å²	99	73.1 Å²	73.1	52%	0.518	37%	0.367	S	S	.	.	H	α-helix	trans	-64.3	-44.8	177.9	-177.9	61.9	0	0	0	111.3	T926 D927 S932 K933 N934	T926-L930 PolarHBondContact O-N 3.38Å; T926-L930 VanDerWaalsContact O-N 3.15Å; D927-L930 PolarHBondContact O-N 3.49Å; D927-L930 VanDerWaalsContact O-N 3.15Å; L930-S932 VanDerWaalsContact C-N 3.35Å; L930-S932 PolarHBondContact O-N 3.47Å; L930-K933 PolarHBondContact O-N 2.83Å; L930-N934 VanDerWaalsContact O-CG 3.3Å; L930-N934 PolarHBondContact O-N 3.28Å
931	Q	91.3	Very high	90.2	Very high	75 Å²	75	71.4 Å²	71.4	35%	0.35	36%	0.359	S	S	.	.	H	α-helix	trans	-61.9	-41.6	176.2	-68.8	179.6	29.2	0	0	112.2	D927 K933 N934 A935 I1010	D927-Q931 WeakPolarHBondContact O-CG 3.44Å; D927-Q931 PolarHBondContact O-N 3.46Å; D927-Q931 PolarHBondContact OD1-NE2 3.46Å; D927-Q931 VanDerWaalsContact OD1-NE2 3.11Å; D927-Q931 PolarHBondContact OD2-NE2 3.26Å; Q931-K933 VanDerWaalsContact C-N 3.33Å; Q931-K933 PolarHBondContact O-N 2.94Å; Q931-N934 PolarHBondContact O-N 3.38Å; Q931-A935 WeakPolarHBondContact O-CB 3.41Å; Q931-A935 PolarHBondContact O-N 3.37Å; Q931-I1010 HydrophobicContact CB-CD1 3.99Å; Q931-I1010 HydrophobicContact CB-CG2 4.25Å
932	S	89.2	Confident	90.2	Very high	22 Å²	22	70.6 Å²	70.6	15%	0.154	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-43.5	176.6	-179	0	0	0	0	111.3	L928 Q929 L930 I936	L928-S932 WeakPolarHBondContact O-CB 3.3Å; L928-S932 PolarHBondContact O-N 3.32Å; Q929-S932 PolarHBondContact O-N 3.14Å; L930-S932 VanDerWaalsContact C-N 3.35Å; L930-S932 PolarHBondContact O-N 3.47Å; S932-I936 WeakPolarHBondContact O-CD1 3.32Å; S932-I936 VanDerWaalsContact O-CG1 3.26Å; S932-I936 WeakPolarHBondContact O-CG1 3.39Å; S932-I936 PolarHBondContact O-N 3.17Å; S932-I936 VanDerWaalsContact O-N 3.15Å
933	K	86.5	Confident	90.2	Very high	129 Å²	129	70.5 Å²	70.5	56%	0.561	36%	0.357	S	S	*	.	H	α-helix	trans	-62.7	-50.2	177.7	-174.8	-177.8	174.7	-174.2	0	111.1	Q929 L930 Q931 A935 I936 D937	Q929-K933 PolarHBondContact O-N 3.32Å; L930-K933 PolarHBondContact O-N 2.83Å; Q931-K933 VanDerWaalsContact C-N 3.33Å; Q931-K933 PolarHBondContact O-N 2.94Å; K933-A935 VanDerWaalsContact C-N 3.31Å; K933-A935 PolarHBondContact O-N 3.01Å; K933-I936 PolarHBondContact O-N 3.41Å; K933-I936 VanDerWaalsContact O-N 3.13Å; K933-D937 PolarHBondContact O-N 3.39Å
934	N	91.1	Very high	90.2	Very high	81 Å²	81	69.8 Å²	69.8	43%	0.433	35%	0.35	S	S	.	.	H	α-helix	trans	-59.3	-40.4	179.5	-67.8	-12.7	0	0	0	112.5	L930 Q931 D937 L938	L930-N934 VanDerWaalsContact O-CG 3.3Å; L930-N934 PolarHBondContact O-N 3.28Å; Q931-N934 PolarHBondContact O-N 3.38Å; N934-D937 PolarHBondContact O-N 3.21Å; N934-L938 WeakPolarHBondContact O-CG 3.46Å; N934-L938 PolarHBondContact O-N 3.42Å
935	A	89.2	Confident	90.3	Very high	6 Å²	6	70.2 Å²	70.2	5%	0.05	35%	0.35	C	S	.	.	H	α-helix	trans	-66.3	-36.8	177.6	0	0	0	0	0	112.6	Q931 K933 K939 A1007 I1010	Q931-A935 WeakPolarHBondContact O-CB 3.41Å; Q931-A935 PolarHBondContact O-N 3.37Å; K933-A935 VanDerWaalsContact C-N 3.31Å; K933-A935 PolarHBondContact O-N 3.01Å; A935-K939 WeakPolarHBondContact O-CB 3.48Å; A935-K939 PolarHBondContact O-N 3.46Å; A935-K939 VanDerWaalsContact O-N 3.1Å; A935-A1007 HydrophobicContact CB-CB 4.06Å; A935-I1010 HydrophobicContact CB-CD1 4.33Å
936	I	87	Confident	90.4	Very high	74 Å²	74	70.6 Å²	70.6	38%	0.379	35%	0.352	S	S	.	.	H	α-helix	trans	-68	-46.7	175.2	-68.5	165.3	0	0	0	110.3	S932 K933 L938 K939 E940	S932-I936 WeakPolarHBondContact O-CD1 3.32Å; S932-I936 VanDerWaalsContact O-CG1 3.26Å; S932-I936 WeakPolarHBondContact O-CG1 3.39Å; S932-I936 PolarHBondContact O-N 3.17Å; S932-I936 VanDerWaalsContact O-N 3.15Å; K933-I936 PolarHBondContact O-N 3.41Å; K933-I936 VanDerWaalsContact O-N 3.13Å; I936-L938 PolarHBondContact O-N 3.01Å; I936-K939 WeakPolarHBondContact O-CB 3.39Å; I936-K939 PolarHBondContact O-N 3.41Å; I936-K939 VanDerWaalsContact O-N 3.13Å; I936-E940 HydrophobicContact CG2-CG 4.43Å; I936-E940 WeakPolarHBondContact O-CG 3.22Å; I936-E940 PolarHBondContact O-N 2.99Å
937	D	89.3	Confident	90.4	Very high	70 Å²	70	72.8 Å²	72.8	37%	0.374	35%	0.354	S	S	.	.	H	α-helix	trans	-59.9	-44.1	-179.3	-67.7	-18.3	0	0	0	111.5	K933 N934 E940 E941	K933-D937 PolarHBondContact O-N 3.39Å; N934-D937 PolarHBondContact O-N 3.21Å; D937-E940 PolarHBondContact O-N 3.01Å; D937-E941 PolarHBondContact O-N 2.67Å
938	L	91.2	Very high	90.4	Very high	87 Å²	87	70.4 Å²	70.4	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-65	-38.4	174.9	-72.6	173	0	0	0	112.7	N934 I936 E941 G942 Q1003	N934-L938 WeakPolarHBondContact O-CG 3.46Å; N934-L938 PolarHBondContact O-N 3.42Å; I936-L938 PolarHBondContact O-N 3.01Å; L938-E941 PolarHBondContact O-N 2.9Å; L938-G942 PolarHBondContact O-N 3.44Å; L938-Q1003 HydrophobicContact CB-CG 4.34Å
939	K	88.5	Confident	90.5	Very high	73 Å²	73	72.5 Å²	72.5	32%	0.317	36%	0.356	S	S	.	.	H	α-helix	trans	-63.3	-45.5	175.4	-178	-175.5	171.6	175.6	0	110.8	A935 I936 E941 G942 V943 V1000 Q1003 S1004	A935-K939 WeakPolarHBondContact O-CB 3.48Å; A935-K939 PolarHBondContact O-N 3.46Å; A935-K939 VanDerWaalsContact O-N 3.1Å; I936-K939 WeakPolarHBondContact O-CB 3.39Å; I936-K939 PolarHBondContact O-N 3.41Å; I936-K939 VanDerWaalsContact O-N 3.13Å; K939-E941 VanDerWaalsContact C-N 3.32Å; K939-E941 PolarHBondContact O-N 3.47Å; K939-G942 PolarHBondContact O-N 3.13Å; K939-V943 WeakPolarHBondContact O-CG2 3.31Å; K939-V943 PolarHBondContact O-N 3.35Å; K939-V1000 HydrophobicContact CG-CG1 4.07Å; K939-Q1003 HydrophobicContact CB-CB 4.16Å; K939-S1004 PolarHBondContact NZ-OG 2.67Å
940	E	87.4	Confident	90.7	Very high	100 Å²	100	72.1 Å²	72.1	47%	0.467	35%	0.354	S	S	.	.	H	α-helix	trans	-63.3	-38.6	177.3	-71.3	-173.7	176.9	0	0	112	I936 D937 V943 R944	I936-E940 HydrophobicContact CG2-CG 4.43Å; I936-E940 WeakPolarHBondContact O-CG 3.22Å; I936-E940 PolarHBondContact O-N 2.99Å; D937-E940 PolarHBondContact O-N 3.01Å; E940-V943 PolarHBondContact O-N 2.95Å; E940-R944 WeakPolarHBondContact O-CG 3.17Å; E940-R944 PolarHBondContact O-N 2.99Å; E940-R944 IonicContact OE2-NH1 3.78Å
941	E	90.5	Very high	90.9	Very high	99 Å²	99	75 Å²	75	46%	0.463	36%	0.363	S	S	.	.	H	α-helix	trans	-60.8	-48	173.1	-171.1	175.8	-179.6	0	0	112.2	D937 L938 K939 V943 R944 L945	D937-E941 PolarHBondContact O-N 2.67Å; L938-E941 PolarHBondContact O-N 2.9Å; K939-E941 VanDerWaalsContact C-N 3.32Å; K939-E941 PolarHBondContact O-N 3.47Å; E941-V943 VanDerWaalsContact C-N 3.3Å; E941-V943 PolarHBondContact O-N 3.04Å; E941-R944 VanDerWaalsContact CA-NH2 3.35Å; E941-R944 WeakPolarHBondContact O-CB 3.2Å; E941-R944 PolarHBondContact O-N 3.27Å; E941-R944 VanDerWaalsContact O-N 3.11Å; E941-L945 HydrophobicContact CG-CD1 4.5Å; E941-L945 PolarHBondContact O-N 3.47Å
942	G	91.3	Very high	90.9	Very high	7 Å²	7	75 Å²	75	7%	0.072	37%	0.365	C	S	.	.	H	α-helix	trans	-59	-39.5	175.1	0	0	0	0	0	112.8	L938 K939 L945 I946	L938-G942 PolarHBondContact O-N 3.44Å; K939-G942 PolarHBondContact O-N 3.13Å; G942-L945 PolarHBondContact O-N 2.97Å; G942-I946 VanDerWaalsContact O-CG1 3.27Å; G942-I946 WeakPolarHBondContact O-CG1 3.25Å; G942-I946 PolarHBondContact O-N 2.8Å
943	V	90.7	Very high	91.2	Very high	53 Å²	53	77.7 Å²	77.7	32%	0.321	37%	0.371	S	S	.	.	H	α-helix	trans	-65.1	-40.1	174.9	172	0	0	0	0	111.7	K939 E940 E941 I946 K947 V1000	K939-V943 WeakPolarHBondContact O-CG2 3.31Å; K939-V943 PolarHBondContact O-N 3.35Å; E940-V943 PolarHBondContact O-N 2.95Å; E941-V943 VanDerWaalsContact C-N 3.3Å; E941-V943 PolarHBondContact O-N 3.04Å; V943-I946 PolarHBondContact O-N 3.05Å; V943-K947 WeakPolarHBondContact O-CG 3.49Å; V943-K947 PolarHBondContact O-N 3.45Å; V943-K947 VanDerWaalsContact O-N 3.12Å; V943-V1000 HydrophobicContact CG2-CG1 4.03Å; V943-V1000 HydrophobicContact CG2-CG2 4.19Å
944	R	92.6	Very high	91.5	Very high	144 Å²	144	78.2 Å²	78.2	54%	0.543	37%	0.374	S	S	.	.	H	α-helix	trans	-62.1	-44.5	174.6	-73.7	-174.4	-65.6	-95.7	2.3	111.3	E940 E941 K947 G948	E940-R944 WeakPolarHBondContact O-CG 3.17Å; E940-R944 PolarHBondContact O-N 2.99Å; E940-R944 IonicContact OE2-NH1 3.78Å; E941-R944 VanDerWaalsContact CA-NH2 3.35Å; E941-R944 WeakPolarHBondContact O-CB 3.2Å; E941-R944 PolarHBondContact O-N 3.27Å; E941-R944 VanDerWaalsContact O-N 3.11Å; R944-K947 PolarHBondContact O-N 2.94Å; R944-G948 PolarHBondContact O-N 3.03Å
945	L	93.4	Very high	91.5	Very high	73 Å²	73	82.1 Å²	82.1	38%	0.382	38%	0.382	S	S	.	.	H	α-helix	trans	-60.9	-46.8	176.8	-74.2	168.4	0	0	0	112	E941 G942 K947 G948 Y949	E941-L945 HydrophobicContact CG-CD1 4.5Å; E941-L945 PolarHBondContact O-N 3.47Å; G942-L945 PolarHBondContact O-N 2.97Å; L945-K947 VanDerWaalsContact C-N 3.32Å; L945-K947 PolarHBondContact O-N 3.2Å; L945-G948 WeakPolarHBondContact O-CA 3.38Å; L945-G948 PolarHBondContact O-N 3.23Å; L945-G948 VanDerWaalsContact O-N 3.07Å; L945-Y949 HydrophobicContact CB-CD2 4.43Å; L945-Y949 HydrophobicContact CB-CE2 4.31Å; L945-Y949 HydrophobicContact CD2-CE2 4.47Å; L945-Y949 WeakPolarHBondContact O-CD2 3.27Å; L945-Y949 PolarHBondContact O-N 3.37Å
946	I	94.2	Very high	91.6	Very high	18 Å²	18	82 Å²	82	9%	0.092	38%	0.381	C	S	.	.	H	α-helix	trans	-56.7	-46.6	176.8	-68.2	162.9	0	0	0	110.9	G942 V943 G948 Y949 Q950 I993 N996 K997 V1000	G942-I946 VanDerWaalsContact O-CG1 3.27Å; G942-I946 WeakPolarHBondContact O-CG1 3.25Å; G942-I946 PolarHBondContact O-N 2.8Å; V943-I946 PolarHBondContact O-N 3.05Å; I946-G948 VanDerWaalsContact C-N 3.31Å; I946-G948 PolarHBondContact O-N 3.47Å; I946-Y949 PolarHBondContact O-N 3.12Å; I946-Q950 HydrophobicContact CG2-CG 4.4Å; I946-Q950 WeakPolarHBondContact O-CB 3.46Å; I946-Q950 VanDerWaalsContact O-CG 3.28Å; I946-Q950 WeakPolarHBondContact O-CG 3.47Å; I946-Q950 PolarHBondContact O-N 2.88Å; I946-I993 HydrophobicContact CG2-CG2 4.45Å; I946-N996 HydrophobicContact CD1-CB 4.18Å; I946-N996 HydrophobicContact CG1-CB 3.62Å; I946-K997 HydrophobicContact CD1-CB 4.49Å; I946-K997 HydrophobicContact CD1-CG 3.84Å; I946-K997 HydrophobicContact CG1-CG 4.44Å; I946-V1000 HydrophobicContact CD1-CG2 3.93Å
947	K	91	Very high	91.8	Very high	130 Å²	130	81.5 Å²	81.5	57%	0.565	38%	0.377	S	S	*	.	H	α-helix	trans	-61.8	-39.9	176.9	-72.8	179.3	180	-179.9	0	111.6	V943 R944 L945 K951	V943-K947 WeakPolarHBondContact O-CG 3.49Å; V943-K947 PolarHBondContact O-N 3.45Å; V943-K947 VanDerWaalsContact O-N 3.12Å; R944-K947 PolarHBondContact O-N 2.94Å; L945-K947 VanDerWaalsContact C-N 3.32Å; L945-K947 PolarHBondContact O-N 3.2Å; K947-K951 WeakPolarHBondContact O-CG 3.45Å; K947-K951 PolarHBondContact O-N 3.06Å; K947-K951 VanDerWaalsContact O-N 3.16Å
948	G	91.4	Very high	91.9	Very high	31 Å²	31	81.9 Å²	81.9	32%	0.32	38%	0.382	S	S	.	.	H	α-helix	trans	-60	-52.6	174.7	0	0	0	0	0	112.2	R944 L945 I946 Q950 K951 I952	R944-G948 PolarHBondContact O-N 3.03Å; L945-G948 WeakPolarHBondContact O-CA 3.38Å; L945-G948 PolarHBondContact O-N 3.23Å; L945-G948 VanDerWaalsContact O-N 3.07Å; I946-G948 VanDerWaalsContact C-N 3.31Å; I946-G948 PolarHBondContact O-N 3.47Å; G948-Q950 VanDerWaalsContact C-N 3.33Å; G948-Q950 PolarHBondContact O-N 2.96Å; G948-K951 WeakPolarHBondContact O-CB 3.45Å; G948-K951 PolarHBondContact O-N 3.03Å; G948-K951 VanDerWaalsContact O-N 3.14Å; G948-I952 PolarHBondContact O-N 3.15Å; G948-I952 VanDerWaalsContact O-N 3.13Å
949	Y	95.5	Very high	91.7	Very high	60 Å²	60	78.9 Å²	78.9	24%	0.235	37%	0.368	C	S	.	.	H	α-helix	trans	-62.2	-37.8	177.9	-74.7	-58.9	0	0	0	113	L945 I946 K951 I952 R953 I989 Q992 I993 N996	L945-Y949 HydrophobicContact CB-CD2 4.43Å; L945-Y949 HydrophobicContact CB-CE2 4.31Å; L945-Y949 HydrophobicContact CD2-CE2 4.47Å; L945-Y949 WeakPolarHBondContact O-CD2 3.27Å; L945-Y949 PolarHBondContact O-N 3.37Å; I946-Y949 PolarHBondContact O-N 3.12Å; Y949-K951 VanDerWaalsContact C-N 3.31Å; Y949-K951 PolarHBondContact O-N 3.28Å; Y949-I952 PolarHBondContact O-N 3.47Å; Y949-R953 WeakPolarHBondContact O-CB 3.4Å; Y949-R953 PolarHBondContact O-N 3.5Å; Y949-I989 HydrophobicContact CD1-CD1 3.56Å; Y949-I989 HydrophobicContact CD1-CG2 4.13Å; Y949-I989 HydrophobicContact CE1-CD1 3.88Å; Y949-I989 HydrophobicContact CG-CG2 4.49Å; Y949-I989 WeakPolarHBondContact O-CG2 3.42Å; Y949-Q992 HydrophobicContact CD1-CB 4.33Å; Y949-Q992 HydrophobicContact CD2-CB 4.31Å; Y949-Q992 HydrophobicContact CE1-CB 4.07Å; Y949-Q992 HydrophobicContact CE1-CG 4.35Å; Y949-Q992 HydrophobicContact CE2-CB 4.07Å; Y949-Q992 HydrophobicContact CG-CB 4.45Å; Y949-I993 VanDerWaalsContact CB-CG1 3.47Å; Y949-I993 HydrophobicContact CG-CG1 4.36Å; Y949-N996 VanDerWaalsContact CE2-ND2 3.3Å; Y949-N996 WeakPolarHBondContact CE2-ND2 3.48Å
950	Q	93.6	Very high	91.7	Very high	83 Å²	83	76.5 Å²	76.5	39%	0.388	36%	0.359	S	S	.	.	H	α-helix	trans	-62.9	-36.4	174.8	-77	177.4	-18.8	0	0	112.8	I946 G948 K954 I993	I946-Q950 HydrophobicContact CG2-CG 4.4Å; I946-Q950 WeakPolarHBondContact O-CB 3.46Å; I946-Q950 VanDerWaalsContact O-CG 3.28Å; I946-Q950 WeakPolarHBondContact O-CG 3.47Å; I946-Q950 PolarHBondContact O-N 2.88Å; G948-Q950 VanDerWaalsContact C-N 3.33Å; G948-Q950 PolarHBondContact O-N 2.96Å; Q950-K954 WeakPolarHBondContact O-CG 3.14Å; Q950-K954 PolarHBondContact O-N 3.04Å; Q950-I993 HydrophobicContact CG-CD1 3.98Å
951	K	93.9	Very high	91.6	Very high	160 Å²	160	75 Å²	75	70%	0.696	36%	0.359	S	S	*	.	H	α-helix	trans	-65.5	-44.9	174	-72.5	178.9	179.9	-175.2	0	111.2	K947 G948 Y949 K954 W955	K947-K951 WeakPolarHBondContact O-CG 3.45Å; K947-K951 PolarHBondContact O-N 3.06Å; K947-K951 VanDerWaalsContact O-N 3.16Å; G948-K951 WeakPolarHBondContact O-CB 3.45Å; G948-K951 PolarHBondContact O-N 3.03Å; G948-K951 VanDerWaalsContact O-N 3.14Å; Y949-K951 VanDerWaalsContact C-N 3.31Å; Y949-K951 PolarHBondContact O-N 3.28Å; K951-K954 PolarHBondContact O-N 3.44Å; K951-W955 PolarHBondContact O-N 3.07Å
952	I	92.5	Very high	91.3	Very high	76 Å²	76	75.9 Å²	75.9	39%	0.39	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-46	176.9	-63.4	168.2	0	0	0	110.4	G948 Y949 K954 W955 L956 I989	G948-I952 PolarHBondContact O-N 3.15Å; G948-I952 VanDerWaalsContact O-N 3.13Å; Y949-I952 PolarHBondContact O-N 3.47Å; I952-K954 VanDerWaalsContact C-N 3.34Å; I952-K954 PolarHBondContact O-N 3.38Å; I952-W955 WeakPolarHBondContact O-CB 3.49Å; I952-W955 PolarHBondContact O-N 3.21Å; I952-W955 VanDerWaalsContact O-N 3.14Å; I952-L956 HydrophobicContact CG2-CD1 3.99Å; I952-L956 HydrophobicContact CG2-CG 4.3Å; I952-L956 WeakPolarHBondContact O-CG 3.35Å; I952-L956 PolarHBondContact O-N 2.87Å; I952-I989 HydrophobicContact CG2-CD1 3.95Å; I952-I989 HydrophobicContact CG2-CG1 4.23Å
953	R	93.8	Very high	90.7	Very high	77 Å²	77	77.8 Å²	77.8	29%	0.291	37%	0.371	S	S	.	.	H	α-helix	trans	-56.4	-46.7	176.4	-178.2	-179.9	175.8	-96.8	8.8	112	Y949 W955 L956 Q957 I989 E990	Y949-R953 WeakPolarHBondContact O-CB 3.4Å; Y949-R953 PolarHBondContact O-N 3.5Å; R953-W955 VanDerWaalsContact C-N 3.34Å; R953-W955 PolarHBondContact O-N 2.9Å; R953-L956 PolarHBondContact O-N 2.93Å; R953-Q957 VanDerWaalsContact CZ-NE2 3.25Å; R953-Q957 WeakPolarHBondContact O-CB 3.41Å; R953-Q957 VanDerWaalsContact O-CG 3.27Å; R953-Q957 WeakPolarHBondContact O-CG 3.5Å; R953-Q957 PolarHBondContact O-N 3.09Å; R953-I989 HydrophobicContact CB-CG2 3.95Å; R953-E990 IonicContact CZ-OE1 3.32Å; R953-E990 IonicContact NE-OE1 3.94Å; R953-E990 PolarHBondContact NE-OE1 2.81Å; R953-E990 IonicContact NH2-OE1 2.87Å; R953-E990 PolarHBondContact NH2-OE1 3.16Å
954	K	93.3	Very high	89.9	Confident	141 Å²	141	78.8 Å²	78.8	61%	0.613	38%	0.375	S	S	*	.	H	α-helix	trans	-60.6	-44.4	176.4	-76	-179.6	179.8	-173.4	0	111.5	Q950 K951 I952 Q957 T958	Q950-K954 WeakPolarHBondContact O-CG 3.14Å; Q950-K954 PolarHBondContact O-N 3.04Å; K951-K954 PolarHBondContact O-N 3.44Å; I952-K954 VanDerWaalsContact C-N 3.34Å; I952-K954 PolarHBondContact O-N 3.38Å; K954-Q957 PolarHBondContact O-N 3.46Å; K954-T958 PolarHBondContact O-N 2.98Å; K954-T958 PolarHBondContact O-OG1 3.31Å
955	W	91.6	Very high	89.1	Confident	163 Å²	163	78.5 Å²	78.5	62%	0.617	38%	0.384	S	S	*	.	H	α-helix	trans	-60.7	-48.2	177.4	177.4	81.1	0	0	0	111.9	K951 I952 R953 Q957 T958 S959	K951-W955 PolarHBondContact O-N 3.07Å; I952-W955 WeakPolarHBondContact O-CB 3.49Å; I952-W955 PolarHBondContact O-N 3.21Å; I952-W955 VanDerWaalsContact O-N 3.14Å; R953-W955 VanDerWaalsContact C-N 3.34Å; R953-W955 PolarHBondContact O-N 2.9Å; W955-Q957 VanDerWaalsContact C-N 3.34Å; W955-Q957 PolarHBondContact O-N 2.93Å; W955-T958 PolarHBondContact O-N 2.97Å; W955-S959 PolarHBondContact O-N 3.46Å; W955-S959 PolarHBondContact O-OG 3.32Å
956	L	91.4	Very high	87.6	Confident	2 Å²	2	84.2 Å²	84.2	1%	0.01	40%	0.402	C	S	.	.	H	α-helix	trans	-60.3	-41.5	176.2	-70.5	171.8	0	0	0	112.3	I952 R953 S959 L960 L982 E985 I986 I989	I952-L956 HydrophobicContact CG2-CD1 3.99Å; I952-L956 HydrophobicContact CG2-CG 4.3Å; I952-L956 WeakPolarHBondContact O-CG 3.35Å; I952-L956 PolarHBondContact O-N 2.87Å; R953-L956 PolarHBondContact O-N 2.93Å; L956-S959 PolarHBondContact O-N 3.13Å; L956-L960 WeakPolarHBondContact O-CB 3.49Å; L956-L960 PolarHBondContact O-N 2.78Å; L956-L982 HydrophobicContact CD2-CD2 3.59Å; L956-E985 HydrophobicContact CD1-CB 3.94Å; L956-E985 HydrophobicContact CD2-CB 4.47Å; L956-E985 WeakPolarHBondContact CD2-OE2 3.31Å; L956-I986 HydrophobicContact CB-CD1 4.01Å; L956-I986 HydrophobicContact CB-CG1 3.56Å; L956-I986 HydrophobicContact CD1-CG1 3.99Å; L956-I986 HydrophobicContact CG-CG1 4.4Å; L956-I989 HydrophobicContact CD1-CG1 4.2Å
957	Q	91.2	Very high	85.9	Confident	65 Å²	65	85 Å²	85	30%	0.304	41%	0.409	S	S	.	.	H	α-helix	trans	-62.8	-44.1	176	-76.8	177.9	-31.9	0	0	111.8	R953 K954 W955 L960 S961 I986	R953-Q957 VanDerWaalsContact CZ-NE2 3.25Å; R953-Q957 WeakPolarHBondContact O-CB 3.41Å; R953-Q957 VanDerWaalsContact O-CG 3.27Å; R953-Q957 WeakPolarHBondContact O-CG 3.5Å; R953-Q957 PolarHBondContact O-N 3.09Å; K954-Q957 PolarHBondContact O-N 3.46Å; W955-Q957 VanDerWaalsContact C-N 3.34Å; W955-Q957 PolarHBondContact O-N 2.93Å; Q957-L960 WeakPolarHBondContact O-CB 3.45Å; Q957-L960 PolarHBondContact O-N 3.12Å; Q957-S961 PolarHBondContact O-N 2.86Å; Q957-S961 PolarHBondContact O-OG 3.16Å; Q957-I986 HydrophobicContact CG-CD1 3.94Å
958	T	90.7	Very high	84.8	Confident	78 Å²	78	87.3 Å²	87.3	48%	0.479	42%	0.416	S	S	.	.	H	α-helix	trans	-62.3	-43.6	175.4	-57	0	0	0	0	111.5	K954 W955 L960 S961 Q962	K954-T958 PolarHBondContact O-N 2.98Å; K954-T958 PolarHBondContact O-OG1 3.31Å; W955-T958 PolarHBondContact O-N 2.97Å; T958-L960 VanDerWaalsContact C-N 3.32Å; T958-L960 PolarHBondContact O-N 3.02Å; T958-S961 PolarHBondContact O-N 3.39Å; T958-Q962 WeakPolarHBondContact O-CG 3.38Å; T958-Q962 PolarHBondContact O-N 3.14Å
959	S	87.6	Confident	83.6	Confident	23 Å²	23	90.9 Å²	90.9	16%	0.161	43%	0.433	C	S	.	.	H	α-helix	trans	-63.2	-37.4	176	-64.4	0	0	0	0	112.5	W955 L956 Q962 L963	W955-S959 PolarHBondContact O-N 3.46Å; W955-S959 PolarHBondContact O-OG 3.32Å; L956-S959 PolarHBondContact O-N 3.13Å; S959-Q962 PolarHBondContact O-N 3.46Å; S959-L963 WeakPolarHBondContact O-CG 3.46Å; S959-L963 PolarHBondContact O-N 3.17Å; S959-L963 VanDerWaalsContact O-N 3.16Å
960	L	87.4	Confident	82.3	Confident	24 Å²	24	92.1 Å²	92.1	13%	0.126	45%	0.451	C	S	.	.	H	α-helix	trans	-64.4	-46.6	174.8	-174.7	65	0	0	0	111.3	L956 Q957 T958 Q962 L963 D964 I979 L982 K983 I986	L956-L960 WeakPolarHBondContact O-CB 3.49Å; L956-L960 PolarHBondContact O-N 2.78Å; Q957-L960 WeakPolarHBondContact O-CB 3.45Å; Q957-L960 PolarHBondContact O-N 3.12Å; T958-L960 VanDerWaalsContact C-N 3.32Å; T958-L960 PolarHBondContact O-N 3.02Å; L960-Q962 VanDerWaalsContact C-N 3.35Å; L960-Q962 PolarHBondContact O-N 2.63Å; L960-L963 PolarHBondContact O-N 3.48Å; L960-D964 PolarHBondContact O-N 2.75Å; L960-I979 HydrophobicContact CD1-CB 4.37Å; L960-I979 HydrophobicContact CD1-CG1 4.43Å; L960-I979 HydrophobicContact CD1-CG2 3.84Å; L960-L982 HydrophobicContact CD1-CB 4.32Å; L960-L982 HydrophobicContact CD1-CD1 4.45Å; L960-K983 HydrophobicContact CD1-CG 4.35Å; L960-K983 HydrophobicContact CD2-CG 4.06Å; L960-I986 HydrophobicContact CD2-CD1 4.05Å
961	S	85.8	Confident	81.1	Confident	68 Å²	68	93 Å²	93	48%	0.476	46%	0.455	S	S	.	.	H	α-helix	trans	-61.1	-41.7	176.5	-64.1	0	0	0	0	112.3	Q957 T958 L963 D964 D965	Q957-S961 PolarHBondContact O-N 2.86Å; Q957-S961 PolarHBondContact O-OG 3.16Å; T958-S961 PolarHBondContact O-N 3.39Å; S961-L963 VanDerWaalsContact C-N 3.28Å; S961-L963 PolarHBondContact O-N 3.36Å; S961-D964 PolarHBondContact O-N 2.84Å; S961-D965 PolarHBondContact O-N 3.17Å
962	Q	83.8	Confident	79.8	Confident	118 Å²	118	90.5 Å²	90.5	55%	0.551	44%	0.444	S	S	*	.	H	α-helix	trans	-60.9	-35.8	175.8	-74	175.5	-2.8	0	0	112.7	T958 S959 L960 Y966	T958-Q962 WeakPolarHBondContact O-CG 3.38Å; T958-Q962 PolarHBondContact O-N 3.14Å; S959-Q962 PolarHBondContact O-N 3.46Å; L960-Q962 VanDerWaalsContact C-N 3.35Å; L960-Q962 PolarHBondContact O-N 2.63Å; Q962-Y966 WeakPolarHBondContact O-CD2 3.49Å; Q962-Y966 PolarHBondContact O-N 2.82Å
963	L	78.9	Confident	78.8	Confident	46 Å²	46	93.7 Å²	93.7	24%	0.241	46%	0.461	C	S	.	.	H	α-helix	trans	-75.6	-32.1	176.8	-71.6	164.8	0	0	0	112.7	S959 L960 S961 I975 I979 L982	S959-L963 WeakPolarHBondContact O-CG 3.46Å; S959-L963 PolarHBondContact O-N 3.17Å; S959-L963 VanDerWaalsContact O-N 3.16Å; L960-L963 PolarHBondContact O-N 3.48Å; S961-L963 VanDerWaalsContact C-N 3.28Å; S961-L963 PolarHBondContact O-N 3.36Å; L963-I975 HydrophobicContact CD2-CG2 3.98Å; L963-I979 HydrophobicContact CB-CG1 4.38Å; L963-L982 HydrophobicContact CD1-CD1 3.41Å; L963-L982 VanDerWaalsContact CD1-CD1 3.41Å
964	D	74.6	Confident	77.9	Confident	74 Å²	74	98.3 Å²	98.3	40%	0.396	48%	0.483	S	S	.	.	H	α-helix	trans	-69.9	-32.1	175.1	-84.7	-31.2	0	0	0	112.2	L960 S961	L960-D964 PolarHBondContact O-N 2.75Å; S961-D964 PolarHBondContact O-N 2.84Å
965	D	75.2	Confident	77.1	Confident	138 Å²	138	93.1 Å²	93.1	74%	0.738	46%	0.462	S	S	*	.	H	α-helix	trans	-74	-31.6	179.1	-71.7	-19.1	0	0	0	113.3	S961	S961-D965 PolarHBondContact O-N 3.17Å
966	Y	62.5	Low	76.6	Confident	193 Å²	193	88.3 Å²	88.3	76%	0.757	45%	0.453	S	S	*	.	S	Bend	trans	-99.2	80.6	177.5	-79.5	-91.2	0	0	0	111.2	Q962	Q962-Y966 WeakPolarHBondContact O-CD2 3.49Å; Q962-Y966 PolarHBondContact O-N 2.82Å
967	S	58.8	Low	76.3	Confident	34 Å²	34	91.8 Å²	91.8	24%	0.238	48%	0.476	C	S	.	.			trans	-158.8	104.3	168.9	-125.9	0	0	0	0	115.5	K972	S967-K972 WeakPolarHBondContact OG-CA 3.26Å; S967-K972 VanDerWaalsContact OG-CB 3.3Å; S967-K972 WeakPolarHBondContact OG-CB 3.34Å; S967-K972 PolarHBondContact OG-N 2.88Å; S967-K972 VanDerWaalsContact OG-N 3.11Å
968	Y	67	Low	75.9	Confident	180 Å²	180	94.2 Å²	94.2	71%	0.706	49%	0.487	S	S	*	.			trans	-61.7	148.2	154.1	-81.7	-89.6	0	0	0	109.4	S970 E971 K972	Y968-S970 PolarHBondContact O-N 2.78Å; Y968-E971 PolarHBondContact O-N 3.18Å; Y968-K972 PolarHBondContact O-N 2.95Å; Y968-K972 VanDerWaalsContact O-N 3.13Å
969	P	66.7	Low	75.6	Confident	105 Å²	105	91.2 Å²	91.2	68%	0.682	47%	0.468	S	S	*	.	H	α-helix	trans	-52.3	-31	-173.6	-27.7	33.6	0	0	0	115.2
970	S	68.6	Low	75.6	Confident	87 Å²	87	95.7 Å²	95.7	61%	0.608	49%	0.486	S	S	*	.	H	α-helix	trans	-75.3	-31	178.8	51.4	0	0	0	0	114.2	Y968	Y968-S970 PolarHBondContact O-N 2.78Å
971	E	67.5	Low	75.8	Confident	101 Å²	101	97.3 Å²	97.3	47%	0.472	50%	0.497	S	S	.	.	H	α-helix	trans	-83.3	-30.4	176.4	-69.6	-176.7	157.8	0	0	111.7	Y968 L973 K974 I975	Y968-E971 PolarHBondContact O-N 3.18Å; E971-L973 PolarHBondContact O-N 2.84Å; E971-K974 WeakPolarHBondContact O-CA 3.25Å; E971-K974 WeakPolarHBondContact O-CB 3.29Å; E971-K974 PolarHBondContact O-N 2.95Å; E971-I975 HydrophobicContact CB-CD1 4.3Å; E971-I975 WeakPolarHBondContact O-CG1 3.41Å; E971-I975 PolarHBondContact O-N 3.04Å
972	K	66.6	Low	75.9	Confident	107 Å²	107	95.1 Å²	95.1	47%	0.465	48%	0.48	S	S	.	.	H	α-helix	trans	-57.2	-36.6	178	-159.5	168.1	-174.3	164.1	0	112.9	S967 Y968 K974 I975 S976	S967-K972 WeakPolarHBondContact OG-CA 3.26Å; S967-K972 VanDerWaalsContact OG-CB 3.3Å; S967-K972 WeakPolarHBondContact OG-CB 3.34Å; S967-K972 PolarHBondContact OG-N 2.88Å; S967-K972 VanDerWaalsContact OG-N 3.11Å; Y968-K972 PolarHBondContact O-N 2.95Å; Y968-K972 VanDerWaalsContact O-N 3.13Å; K972-K974 VanDerWaalsContact C-N 3.33Å; K972-K974 PolarHBondContact O-N 3Å; K972-I975 PolarHBondContact O-N 3.35Å; K972-S976 PolarHBondContact O-N 2.93Å
973	L	71.3	Confident	76.2	Confident	144 Å²	144	94.6 Å²	94.6	75%	0.754	48%	0.476	S	S	*	.	H	α-helix	trans	-64.4	-34.3	174	-74.2	165.9	0	0	0	112.8	E971	E971-L973 PolarHBondContact O-N 2.84Å
974	K	75.1	Confident	76.9	Confident	174 Å²	174	99.7 Å²	99.7	76%	0.757	49%	0.492	S	S	*	.	H	α-helix	trans	-77.2	-32.5	177.4	-65.5	-177.4	-179.2	176.4	0	112.5	E971 K972 P977	E971-K974 WeakPolarHBondContact O-CA 3.25Å; E971-K974 WeakPolarHBondContact O-CB 3.29Å; E971-K974 PolarHBondContact O-N 2.95Å; K972-K974 VanDerWaalsContact C-N 3.33Å; K972-K974 PolarHBondContact O-N 3Å; K974-P977 WeakPolarHBondContact O-CD 3.28Å
975	I	76.6	Confident	77.8	Confident	32 Å²	32	100.6 Å²	100.6	16%	0.164	49%	0.494	C	S	.	.	H	α-helix	trans	-87.5	-17.9	-176.8	-58.4	164.4	0	0	0	111.8	L963 E971 K972 P977 Q978 I979	L963-I975 HydrophobicContact CD2-CG2 3.98Å; E971-I975 HydrophobicContact CB-CD1 4.3Å; E971-I975 WeakPolarHBondContact O-CG1 3.41Å; E971-I975 PolarHBondContact O-N 3.04Å; K972-I975 PolarHBondContact O-N 3.35Å; I975-P977 VanDerWaalsContact C-N 3.34Å; I975-P977 VanDerWaalsContact O-N 3.12Å; I975-Q978 WeakPolarHBondContact O-CB 3.32Å; I975-Q978 PolarHBondContact O-N 3.47Å; I975-I979 HydrophobicContact CG2-CD1 4.08Å; I975-I979 HydrophobicContact CG2-CG1 4.09Å; I975-I979 PolarHBondContact O-N 3.42Å
976	S	81	Confident	78.7	Confident	61 Å²	61	94.6 Å²	94.6	43%	0.427	46%	0.462	S	S	.	.	H	α-helix	trans	-45	-44.5	-179.8	-171.8	0	0	0	0	115.1	K972 Q978 I979 E980	K972-S976 PolarHBondContact O-N 2.93Å; S976-Q978 VanDerWaalsContact C-N 3.32Å; S976-Q978 PolarHBondContact O-N 2.87Å; S976-I979 PolarHBondContact O-N 3.07Å; S976-E980 PolarHBondContact O-N 3.45Å; S976-E980 VanDerWaalsContact O-N 3.08Å
977	P	84.6	Confident	80.1	Confident	76 Å²	76	90.2 Å²	90.2	49%	0.494	45%	0.451	S	S	.	.	H	α-helix	trans	-66	-30.8	179.2	-20.9	34.2	0	0	0	114	K974 I975 T981	K974-P977 WeakPolarHBondContact O-CD 3.28Å; I975-P977 VanDerWaalsContact C-N 3.34Å; I975-P977 VanDerWaalsContact O-N 3.12Å; P977-T981 WeakPolarHBondContact O-CB 3.36Å; P977-T981 PolarHBondContact O-N 3.35Å; P977-T981 VanDerWaalsContact O-N 3.09Å; P977-T981 PolarHBondContact O-OG1 3.26Å
978	Q	83.6	Confident	81.9	Confident	115 Å²	115	92.7 Å²	92.7	54%	0.537	46%	0.459	S	S	.	.	H	α-helix	trans	-73.3	-42.3	178	-65.4	178.1	-15.1	0	0	111	I975 S976 E980 T981 L982	I975-Q978 WeakPolarHBondContact O-CB 3.32Å; I975-Q978 PolarHBondContact O-N 3.47Å; S976-Q978 VanDerWaalsContact C-N 3.32Å; S976-Q978 PolarHBondContact O-N 2.87Å; Q978-E980 VanDerWaalsContact C-N 3.33Å; Q978-E980 PolarHBondContact O-N 3.12Å; Q978-T981 WeakPolarHBondContact O-CB 3.21Å; Q978-T981 PolarHBondContact O-N 3.29Å; Q978-L982 PolarHBondContact O-N 2.91Å
979	I	85.5	Confident	83.2	Confident	15 Å²	15	85.2 Å²	85.2	8%	0.077	43%	0.431	C	S	.	.	H	α-helix	trans	-58.2	-46.5	173.9	-70.7	172.1	0	0	0	110.4	L960 L963 I975 S976 T981 L982 K983	L960-I979 HydrophobicContact CD1-CB 4.37Å; L960-I979 HydrophobicContact CD1-CG1 4.43Å; L960-I979 HydrophobicContact CD1-CG2 3.84Å; L963-I979 HydrophobicContact CB-CG1 4.38Å; I975-I979 HydrophobicContact CG2-CD1 4.08Å; I975-I979 HydrophobicContact CG2-CG1 4.09Å; I975-I979 PolarHBondContact O-N 3.42Å; S976-I979 PolarHBondContact O-N 3.07Å; I979-T981 VanDerWaalsContact C-N 3.3Å; I979-T981 PolarHBondContact O-N 3.13Å; I979-L982 PolarHBondContact O-N 3.32Å; I979-K983 HydrophobicContact CG2-CD 4.28Å; I979-K983 WeakPolarHBondContact O-CG 3.34Å; I979-K983 PolarHBondContact O-N 3.47Å
980	E	87.5	Confident	84.5	Confident	118 Å²	118	83.8 Å²	83.8	55%	0.551	42%	0.415	S	S	*	.	H	α-helix	trans	-65.9	-34.1	179.1	-166.9	174	-173.7	0	0	112.3	S976 Q978 R984	S976-E980 PolarHBondContact O-N 3.45Å; S976-E980 VanDerWaalsContact O-N 3.08Å; Q978-E980 VanDerWaalsContact C-N 3.33Å; Q978-E980 PolarHBondContact O-N 3.12Å; E980-R984 WeakPolarHBondContact O-CB 3.26Å; E980-R984 PolarHBondContact O-N 3.48Å; E980-R984 VanDerWaalsContact O-N 3.09Å
981	T	90.1	Very high	85.7	Confident	57 Å²	57	85.4 Å²	85.4	35%	0.35	41%	0.411	S	S	.	.	H	α-helix	trans	-66	-46.5	174.2	-57.7	0	0	0	0	111.4	P977 Q978 I979 K983 R984 E985	P977-T981 WeakPolarHBondContact O-CB 3.36Å; P977-T981 PolarHBondContact O-N 3.35Å; P977-T981 VanDerWaalsContact O-N 3.09Å; P977-T981 PolarHBondContact O-OG1 3.26Å; Q978-T981 WeakPolarHBondContact O-CB 3.21Å; Q978-T981 PolarHBondContact O-N 3.29Å; I979-T981 VanDerWaalsContact C-N 3.3Å; I979-T981 PolarHBondContact O-N 3.13Å; T981-K983 PolarHBondContact O-N 3.48Å; T981-R984 WeakPolarHBondContact O-CB 3.5Å; T981-R984 PolarHBondContact O-N 2.87Å; T981-E985 PolarHBondContact O-N 3.03Å
982	L	88.9	Confident	87	Confident	23 Å²	23	83 Å²	83	12%	0.12	40%	0.4	C	S	.	.	H	α-helix	trans	-62.4	-41.7	176.7	-73.3	174	0	0	0	112.4	L956 L960 L963 Q978 I979 R984 E985 I986	L956-L982 HydrophobicContact CD2-CD2 3.59Å; L960-L982 HydrophobicContact CD1-CB 4.32Å; L960-L982 HydrophobicContact CD1-CD1 4.45Å; L963-L982 HydrophobicContact CD1-CD1 3.41Å; L963-L982 VanDerWaalsContact CD1-CD1 3.41Å; Q978-L982 PolarHBondContact O-N 2.91Å; I979-L982 PolarHBondContact O-N 3.32Å; L982-R984 VanDerWaalsContact C-N 3.33Å; L982-R984 PolarHBondContact O-N 3.24Å; L982-E985 PolarHBondContact O-N 3.07Å; L982-I986 WeakPolarHBondContact O-CG1 3.22Å; L982-I986 PolarHBondContact O-N 2.85Å
983	K	90.7	Very high	88.4	Confident	106 Å²	106	78.6 Å²	78.6	46%	0.461	38%	0.382	S	S	.	.	H	α-helix	trans	-58.8	-45.8	175.2	-74.9	177.6	179.1	178.3	0	111.3	L960 I979 T981 E985 I986 D987	L960-K983 HydrophobicContact CD1-CG 4.35Å; L960-K983 HydrophobicContact CD2-CG 4.06Å; I979-K983 HydrophobicContact CG2-CD 4.28Å; I979-K983 WeakPolarHBondContact O-CG 3.34Å; I979-K983 PolarHBondContact O-N 3.47Å; T981-K983 PolarHBondContact O-N 3.48Å; K983-E985 VanDerWaalsContact C-N 3.32Å; K983-E985 PolarHBondContact O-N 3.36Å; K983-I986 PolarHBondContact O-N 3.39Å; K983-D987 PolarHBondContact O-N 3.47Å
984	R	92.8	Very high	89.5	Confident	153 Å²	153	78 Å²	78	58%	0.577	37%	0.373	S	S	*	.	H	α-helix	trans	-61.7	-38.4	176.6	-162.8	-170.6	-52.3	140.2	6.9	112.6	E980 T981 L982 E988	E980-R984 WeakPolarHBondContact O-CB 3.26Å; E980-R984 PolarHBondContact O-N 3.48Å; E980-R984 VanDerWaalsContact O-N 3.09Å; T981-R984 WeakPolarHBondContact O-CB 3.5Å; T981-R984 PolarHBondContact O-N 2.87Å; L982-R984 VanDerWaalsContact C-N 3.33Å; L982-R984 PolarHBondContact O-N 3.24Å; R984-E988 PolarHBondContact O-N 2.89Å; R984-E988 VanDerWaalsContact O-N 3.09Å
985	E	93.4	Very high	90.5	Very high	93 Å²	93	73.5 Å²	73.5	44%	0.435	36%	0.356	S	S	.	.	H	α-helix	trans	-68	-40.2	175.1	-72.7	-175.3	-179.8	0	0	112.2	L956 T981 L982 K983 D987 E988 I989	L956-E985 HydrophobicContact CD1-CB 3.94Å; L956-E985 HydrophobicContact CD2-CB 4.47Å; L956-E985 WeakPolarHBondContact CD2-OE2 3.31Å; T981-E985 PolarHBondContact O-N 3.03Å; L982-E985 PolarHBondContact O-N 3.07Å; K983-E985 VanDerWaalsContact C-N 3.32Å; K983-E985 PolarHBondContact O-N 3.36Å; E985-D987 VanDerWaalsContact C-N 3.35Å; E985-E988 PolarHBondContact O-N 3.48Å; E985-I989 WeakPolarHBondContact O-CB 3.24Å; E985-I989 WeakPolarHBondContact O-CG1 3.3Å; E985-I989 PolarHBondContact O-N 3.17Å
986	I	93.2	Very high	91.3	Very high	12 Å²	12	73 Å²	73	6%	0.062	35%	0.354	C	S	.	.	H	α-helix	trans	-59.6	-47.3	174	-70.1	168	0	0	0	110.2	L956 Q957 L960 L982 K983 E988 I989 E990	L956-I986 HydrophobicContact CB-CD1 4.01Å; L956-I986 HydrophobicContact CB-CG1 3.56Å; L956-I986 HydrophobicContact CD1-CG1 3.99Å; L956-I986 HydrophobicContact CG-CG1 4.4Å; Q957-I986 HydrophobicContact CG-CD1 3.94Å; L960-I986 HydrophobicContact CD2-CD1 4.05Å; L982-I986 WeakPolarHBondContact O-CG1 3.22Å; L982-I986 PolarHBondContact O-N 2.85Å; K983-I986 PolarHBondContact O-N 3.39Å; I986-E988 VanDerWaalsContact C-N 3.34Å; I986-E988 PolarHBondContact O-N 2.98Å; I986-I989 PolarHBondContact O-N 3.37Å; I986-E990 HydrophobicContact CG2-CG 4.44Å; I986-E990 WeakPolarHBondContact O-CG 3.5Å; I986-E990 PolarHBondContact O-N 3.47Å
987	D	93.7	Very high	91.9	Very high	101 Å²	101	75.6 Å²	75.6	54%	0.54	36%	0.358	S	S	.	.	H	α-helix	trans	-61.3	-41.2	179.8	-67.4	-20.7	0	0	0	111.9	K983 E985 E990 K991	K983-D987 PolarHBondContact O-N 3.47Å; E985-D987 VanDerWaalsContact C-N 3.35Å; D987-E990 PolarHBondContact O-N 3.23Å; D987-K991 WeakPolarHBondContact O-CB 3.28Å; D987-K991 PolarHBondContact O-N 3.23Å
988	E	94.8	Very high	92.3	Very high	86 Å²	86	76.9 Å²	76.9	40%	0.402	36%	0.357	S	S	.	.	H	α-helix	trans	-67	-41.6	176.2	-178.4	56.3	-146.3	0	0	111.7	R984 E985 I986 E990 K991 Q992	R984-E988 PolarHBondContact O-N 2.89Å; R984-E988 VanDerWaalsContact O-N 3.09Å; E985-E988 PolarHBondContact O-N 3.48Å; I986-E988 VanDerWaalsContact C-N 3.34Å; I986-E988 PolarHBondContact O-N 2.98Å; E988-E990 VanDerWaalsContact C-N 3.33Å; E988-E990 PolarHBondContact O-N 3.16Å; E988-K991 WeakPolarHBondContact O-CB 3.24Å; E988-K991 PolarHBondContact O-N 2.74Å; E988-Q992 WeakPolarHBondContact O-CG 3.39Å; E988-Q992 PolarHBondContact O-N 3.22Å; E988-Q992 PolarHBondContact OE1-NE2 3.27Å
989	I	95.4	Very high	92.7	Very high	23 Å²	23	75.3 Å²	75.3	12%	0.118	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-39.8	176.1	-65.9	-73.6	0	0	0	110.8	Y949 I952 R953 L956 E985 I986 K991 Q992 I993	Y949-I989 HydrophobicContact CD1-CD1 3.56Å; Y949-I989 HydrophobicContact CD1-CG2 4.13Å; Y949-I989 HydrophobicContact CE1-CD1 3.88Å; Y949-I989 HydrophobicContact CG-CG2 4.49Å; Y949-I989 WeakPolarHBondContact O-CG2 3.42Å; I952-I989 HydrophobicContact CG2-CD1 3.95Å; I952-I989 HydrophobicContact CG2-CG1 4.23Å; R953-I989 HydrophobicContact CB-CG2 3.95Å; L956-I989 HydrophobicContact CD1-CG1 4.2Å; E985-I989 WeakPolarHBondContact O-CB 3.24Å; E985-I989 WeakPolarHBondContact O-CG1 3.3Å; E985-I989 PolarHBondContact O-N 3.17Å; I986-I989 PolarHBondContact O-N 3.37Å; I989-K991 VanDerWaalsContact C-N 3.33Å; I989-K991 PolarHBondContact O-N 2.95Å; I989-Q992 PolarHBondContact O-N 3.37Å; I989-I993 HydrophobicContact CG2-CD1 4.09Å; I989-I993 WeakPolarHBondContact O-CG1 3.32Å; I989-I993 PolarHBondContact O-N 3.33Å
990	E	93.3	Very high	93.1	Very high	76 Å²	76	75.7 Å²	75.7	36%	0.355	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-40.7	174	-75.9	-170.4	171.4	0	0	112	R953 I986 D987 E988 I993 K994	R953-E990 IonicContact CZ-OE1 3.32Å; R953-E990 IonicContact NE-OE1 3.94Å; R953-E990 PolarHBondContact NE-OE1 2.81Å; R953-E990 IonicContact NH2-OE1 2.87Å; R953-E990 PolarHBondContact NH2-OE1 3.16Å; I986-E990 HydrophobicContact CG2-CG 4.44Å; I986-E990 WeakPolarHBondContact O-CG 3.5Å; I986-E990 PolarHBondContact O-N 3.47Å; D987-E990 PolarHBondContact O-N 3.23Å; E988-E990 VanDerWaalsContact C-N 3.33Å; E988-E990 PolarHBondContact O-N 3.16Å; E990-I993 PolarHBondContact O-N 3.33Å; E990-K994 PolarHBondContact O-N 3.1Å
991	K	95	Very high	93.2	Very high	120 Å²	120	74 Å²	74	52%	0.522	35%	0.348	S	S	.	.	H	α-helix	trans	-60.6	-44.2	172.6	-172	-175.4	177.7	-173.5	0	111.8	D987 E988 I989 I993 K994 I995	D987-K991 WeakPolarHBondContact O-CB 3.28Å; D987-K991 PolarHBondContact O-N 3.23Å; E988-K991 WeakPolarHBondContact O-CB 3.24Å; E988-K991 PolarHBondContact O-N 2.74Å; I989-K991 VanDerWaalsContact C-N 3.33Å; I989-K991 PolarHBondContact O-N 2.95Å; K991-I993 PolarHBondContact O-N 2.96Å; K991-K994 WeakPolarHBondContact O-CB 3.37Å; K991-K994 PolarHBondContact O-N 3.41Å; K991-I995 HydrophobicContact CG-CD1 4.22Å; K991-I995 WeakPolarHBondContact O-CG1 3.31Å; K991-I995 PolarHBondContact O-N 2.88Å
992	Q	94.9	Very high	93.3	Very high	51 Å²	51	74.8 Å²	74.8	24%	0.238	35%	0.349	C	S	.	.	H	α-helix	trans	-64.4	-38.3	175.5	-67.2	-57.5	-28.3	0	0	112.7	Y949 E988 I989 K994 I995 N996	Y949-Q992 HydrophobicContact CD1-CB 4.33Å; Y949-Q992 HydrophobicContact CD2-CB 4.31Å; Y949-Q992 HydrophobicContact CE1-CB 4.07Å; Y949-Q992 HydrophobicContact CE1-CG 4.35Å; Y949-Q992 HydrophobicContact CE2-CB 4.07Å; Y949-Q992 HydrophobicContact CG-CB 4.45Å; E988-Q992 WeakPolarHBondContact O-CG 3.39Å; E988-Q992 PolarHBondContact O-N 3.22Å; E988-Q992 PolarHBondContact OE1-NE2 3.27Å; I989-Q992 PolarHBondContact O-N 3.37Å; Q992-K994 VanDerWaalsContact C-N 3.32Å; Q992-K994 PolarHBondContact O-N 3.47Å; Q992-I995 PolarHBondContact O-N 2.88Å; Q992-N996 WeakPolarHBondContact O-CB 3.36Å; Q992-N996 PolarHBondContact O-N 3.39Å; Q992-N996 PolarHBondContact O-ND2 3.01Å
993	I	95.4	Very high	93.3	Very high	14 Å²	14	74.4 Å²	74.4	7%	0.072	35%	0.347	C	S	.	.	H	α-helix	trans	-61.7	-42.7	173.6	-70.6	166.7	0	0	0	110.3	I946 Y949 Q950 I989 E990 K991 K997	I946-I993 HydrophobicContact CG2-CG2 4.45Å; Y949-I993 VanDerWaalsContact CB-CG1 3.47Å; Y949-I993 HydrophobicContact CG-CG1 4.36Å; Q950-I993 HydrophobicContact CG-CD1 3.98Å; I989-I993 HydrophobicContact CG2-CD1 4.09Å; I989-I993 WeakPolarHBondContact O-CG1 3.32Å; I989-I993 PolarHBondContact O-N 3.33Å; E990-I993 PolarHBondContact O-N 3.33Å; K991-I993 PolarHBondContact O-N 2.96Å; I993-K997 HydrophobicContact CG2-CD 4.09Å; I993-K997 HydrophobicContact CG2-CG 4.42Å; I993-K997 WeakPolarHBondContact O-CB 3.43Å; I993-K997 VanDerWaalsContact O-CG 3.28Å; I993-K997 WeakPolarHBondContact O-CG 3.37Å; I993-K997 PolarHBondContact O-N 2.9Å
994	K	95.2	Very high	93.2	Very high	133 Å²	133	71.4 Å²	71.4	58%	0.578	34%	0.339	S	S	*	.	H	α-helix	trans	-62	-49.3	178.3	-172.5	-178.1	176.2	-175.4	0	111.5	E990 K991 Q992 N996 K997 E998	E990-K994 PolarHBondContact O-N 3.1Å; K991-K994 WeakPolarHBondContact O-CB 3.37Å; K991-K994 PolarHBondContact O-N 3.41Å; Q992-K994 VanDerWaalsContact C-N 3.32Å; Q992-K994 PolarHBondContact O-N 3.47Å; K994-N996 PolarHBondContact O-N 3.24Å; K994-K997 WeakPolarHBondContact O-CB 3.31Å; K994-K997 PolarHBondContact O-N 2.88Å; K994-E998 WeakPolarHBondContact CE-OE1 3.33Å; K994-E998 PolarHBondContact O-N 3.44Å
995	I	94.6	Very high	93.1	Very high	78 Å²	78	69.6 Å²	69.6	40%	0.4	34%	0.336	S	S	.	.	H	α-helix	trans	-59.5	-47.1	178.5	-67	166.8	0	0	0	111	K991 Q992 K997 E998 E999	K991-I995 HydrophobicContact CG-CD1 4.22Å; K991-I995 WeakPolarHBondContact O-CG1 3.31Å; K991-I995 PolarHBondContact O-N 2.88Å; Q992-I995 PolarHBondContact O-N 2.88Å; I995-K997 VanDerWaalsContact C-N 3.33Å; I995-K997 PolarHBondContact O-N 3.26Å; I995-E998 PolarHBondContact O-N 2.84Å; I995-E999 PolarHBondContact O-N 3.03Å
996	N	93.7	Very high	92.9	Very high	22 Å²	22	70.4 Å²	70.4	12%	0.118	34%	0.338	C	S	.	.	H	α-helix	trans	-66.8	-33.3	179.5	-73.9	-56.4	0	0	0	112.8	I946 Y949 Q992 K994 E999 V1000	I946-N996 HydrophobicContact CD1-CB 4.18Å; I946-N996 HydrophobicContact CG1-CB 3.62Å; Y949-N996 VanDerWaalsContact CE2-ND2 3.3Å; Y949-N996 WeakPolarHBondContact CE2-ND2 3.48Å; Q992-N996 WeakPolarHBondContact O-CB 3.36Å; Q992-N996 PolarHBondContact O-N 3.39Å; Q992-N996 PolarHBondContact O-ND2 3.01Å; K994-N996 PolarHBondContact O-N 3.24Å; N996-E999 PolarHBondContact O-N 3.02Å; N996-V1000 WeakPolarHBondContact O-CB 3.08Å; N996-V1000 VanDerWaalsContact O-CG2 3.28Å; N996-V1000 WeakPolarHBondContact O-CG2 3.4Å; N996-V1000 PolarHBondContact O-N 3.48Å
997	K	94.2	Very high	92.6	Very high	116 Å²	116	70.5 Å²	70.5	50%	0.504	34%	0.34	S	S	.	.	H	α-helix	trans	-63.6	-42.1	172.8	-80.3	177.3	176.4	-176.5	0	111.7	I946 I993 K994 I995 N1001	I946-K997 HydrophobicContact CD1-CB 4.49Å; I946-K997 HydrophobicContact CD1-CG 3.84Å; I946-K997 HydrophobicContact CG1-CG 4.44Å; I993-K997 HydrophobicContact CG2-CD 4.09Å; I993-K997 HydrophobicContact CG2-CG 4.42Å; I993-K997 WeakPolarHBondContact O-CB 3.43Å; I993-K997 VanDerWaalsContact O-CG 3.28Å; I993-K997 WeakPolarHBondContact O-CG 3.37Å; I993-K997 PolarHBondContact O-N 2.9Å; K994-K997 WeakPolarHBondContact O-CB 3.31Å; K994-K997 PolarHBondContact O-N 2.88Å; I995-K997 VanDerWaalsContact C-N 3.33Å; I995-K997 PolarHBondContact O-N 3.26Å; K997-N1001 WeakPolarHBondContact O-CB 3.29Å; K997-N1001 PolarHBondContact O-N 3.41Å; K997-N1001 VanDerWaalsContact O-N 3.07Å
998	E	92.9	Very high	92.1	Very high	103 Å²	103	72.9 Å²	72.9	48%	0.481	34%	0.342	S	S	.	.	H	α-helix	trans	-63.1	-44.1	175.9	-71.6	171.5	-167.4	0	0	111	K994 I995 N1001 N1002	K994-E998 WeakPolarHBondContact CE-OE1 3.33Å; K994-E998 PolarHBondContact O-N 3.44Å; I995-E998 PolarHBondContact O-N 2.84Å; E998-N1001 WeakPolarHBondContact O-CB 3.28Å; E998-N1001 PolarHBondContact O-N 3.24Å; E998-N1002 VanDerWaalsContact O-CG 3.31Å; E998-N1002 PolarHBondContact O-N 2.88Å; E998-N1002 PolarHBondContact O-ND2 3.41Å
999	E	91.8	Very high	91.8	Very high	82 Å²	82	73.4 Å²	73.4	38%	0.383	35%	0.346	S	S	.	.	H	α-helix	trans	-64.2	-44.8	177.2	-176.2	55.5	-155.4	0	0	112.7	I995 N996 N1001 N1002 Q1003	I995-E999 PolarHBondContact O-N 3.03Å; N996-E999 PolarHBondContact O-N 3.02Å; E999-N1001 VanDerWaalsContact C-N 3.26Å; E999-N1001 PolarHBondContact O-N 3.31Å; E999-N1002 PolarHBondContact O-N 2.93Å; E999-N1002 VanDerWaalsContact O-N 3.14Å; E999-Q1003 HydrophobicContact CG-CG 4.49Å; E999-Q1003 WeakPolarHBondContact O-CG 3.36Å; E999-Q1003 PolarHBondContact O-N 2.81Å; E999-Q1003 WeakPolarHBondContact OE1-CG 3.26Å; E999-Q1003 PolarHBondContact OE1-NE2 2.86Å
1000	V	93.3	Very high	91.5	Very high	22 Å²	22	73.2 Å²	73.2	13%	0.133	35%	0.345	C	S	.	.	H	α-helix	trans	-58.3	-40	174.8	165.6	0	0	0	0	111.4	K939 V943 I946 N996 S1004	K939-V1000 HydrophobicContact CG-CG1 4.07Å; V943-V1000 HydrophobicContact CG2-CG1 4.03Å; V943-V1000 HydrophobicContact CG2-CG2 4.19Å; I946-V1000 HydrophobicContact CD1-CG2 3.93Å; N996-V1000 WeakPolarHBondContact O-CB 3.08Å; N996-V1000 VanDerWaalsContact O-CG2 3.28Å; N996-V1000 WeakPolarHBondContact O-CG2 3.4Å; N996-V1000 PolarHBondContact O-N 3.48Å; V1000-S1004 WeakPolarHBondContact O-CB 3.22Å; V1000-S1004 PolarHBondContact O-N 2.91Å
1001	N	90.2	Very high	91.1	Very high	84 Å²	84	72.7 Å²	72.7	45%	0.449	35%	0.349	S	S	.	.	H	α-helix	trans	-66.4	-43.6	176.2	-170.9	39.5	0	0	0	111.6	K997 E998 E999 S1004 K1005	K997-N1001 WeakPolarHBondContact O-CB 3.29Å; K997-N1001 PolarHBondContact O-N 3.41Å; K997-N1001 VanDerWaalsContact O-N 3.07Å; E998-N1001 WeakPolarHBondContact O-CB 3.28Å; E998-N1001 PolarHBondContact O-N 3.24Å; E999-N1001 VanDerWaalsContact C-N 3.26Å; E999-N1001 PolarHBondContact O-N 3.31Å; N1001-S1004 PolarHBondContact O-N 2.89Å; N1001-K1005 WeakPolarHBondContact O-CG 3.23Å; N1001-K1005 PolarHBondContact O-N 2.76Å
1002	N	91.6	Very high	90.5	Very high	73 Å²	73	72.3 Å²	72.3	39%	0.39	35%	0.349	S	S	.	.	H	α-helix	trans	-61.4	-45	176.5	-71.7	-21.9	0	0	0	112	E998 E999 S1004 K1005 K1006	E998-N1002 VanDerWaalsContact O-CG 3.31Å; E998-N1002 PolarHBondContact O-N 2.88Å; E998-N1002 PolarHBondContact O-ND2 3.41Å; E999-N1002 PolarHBondContact O-N 2.93Å; E999-N1002 VanDerWaalsContact O-N 3.14Å; N1002-S1004 VanDerWaalsContact C-N 3.33Å; N1002-S1004 PolarHBondContact O-N 3.29Å; N1002-K1005 PolarHBondContact O-N 3.3Å; N1002-K1006 WeakPolarHBondContact O-CG 3.46Å; N1002-K1006 PolarHBondContact O-N 3.37Å
1003	Q	90.2	Very high	90.2	Very high	14 Å²	14	73.6 Å²	73.6	7%	0.065	36%	0.358	C	S	.	.	H	α-helix	trans	-64.8	-36.9	175.4	-65.9	-59	-24.8	0	0	112	L938 K939 E999 K1005 K1006 A1007	L938-Q1003 HydrophobicContact CB-CG 4.34Å; K939-Q1003 HydrophobicContact CB-CB 4.16Å; E999-Q1003 HydrophobicContact CG-CG 4.49Å; E999-Q1003 WeakPolarHBondContact O-CG 3.36Å; E999-Q1003 PolarHBondContact O-N 2.81Å; E999-Q1003 WeakPolarHBondContact OE1-CG 3.26Å; E999-Q1003 PolarHBondContact OE1-NE2 2.86Å; Q1003-K1005 VanDerWaalsContact C-N 3.34Å; Q1003-K1005 PolarHBondContact O-N 2.93Å; Q1003-K1006 PolarHBondContact O-N 3.05Å; Q1003-A1007 WeakPolarHBondContact O-CB 3.48Å; Q1003-A1007 PolarHBondContact O-N 2.89Å
1004	S	88.4	Confident	89.9	Confident	43 Å²	43	76.6 Å²	76.6	30%	0.301	37%	0.369	S	S	.	.	H	α-helix	trans	-64.9	-36.8	174.8	-159.6	0	0	0	0	112.7	K939 V1000 N1001 N1002 R1008	K939-S1004 PolarHBondContact NZ-OG 2.67Å; V1000-S1004 WeakPolarHBondContact O-CB 3.22Å; V1000-S1004 PolarHBondContact O-N 2.91Å; N1001-S1004 PolarHBondContact O-N 2.89Å; N1002-S1004 VanDerWaalsContact C-N 3.33Å; N1002-S1004 PolarHBondContact O-N 3.29Å; S1004-R1008 PolarHBondContact O-N 3.48Å
1005	K	89.5	Confident	89.1	Confident	116 Å²	116	72.8 Å²	72.8	50%	0.504	36%	0.362	S	S	.	.	H	α-helix	trans	-66.9	-45.5	173.3	-69.5	176.6	-176.4	178.7	0	111.5	N1001 N1002 Q1003 R1008 I1009	N1001-K1005 WeakPolarHBondContact O-CG 3.23Å; N1001-K1005 PolarHBondContact O-N 2.76Å; N1002-K1005 PolarHBondContact O-N 3.3Å; Q1003-K1005 VanDerWaalsContact C-N 3.34Å; Q1003-K1005 PolarHBondContact O-N 2.93Å; K1005-R1008 WeakPolarHBondContact O-CB 3.48Å; K1005-R1008 PolarHBondContact O-N 3.19Å; K1005-I1009 WeakPolarHBondContact O-CG1 3.35Å; K1005-I1009 PolarHBondContact O-N 3.4Å
1006	K	89.6	Confident	88.6	Confident	110 Å²	110	73.5 Å²	73.5	48%	0.478	37%	0.367	S	S	.	.	H	α-helix	trans	-58.3	-49.5	175.7	-72.3	175.9	-177.6	173	0	111.7	N1002 Q1003 R1008 I1009 I1010	N1002-K1006 WeakPolarHBondContact O-CG 3.46Å; N1002-K1006 PolarHBondContact O-N 3.37Å; Q1003-K1006 PolarHBondContact O-N 3.05Å; K1006-R1008 VanDerWaalsContact C-N 3.27Å; K1006-R1008 PolarHBondContact O-N 3.47Å; K1006-I1009 PolarHBondContact O-N 2.97Å; K1006-I1010 WeakPolarHBondContact O-CD1 3.36Å; K1006-I1010 VanDerWaalsContact O-CG1 3.29Å; K1006-I1010 WeakPolarHBondContact O-CG1 3.48Å; K1006-I1010 PolarHBondContact O-N 2.9Å
1007	A	87.5	Confident	88.3	Confident	14 Å²	14	73 Å²	73	12%	0.116	37%	0.365	C	S	.	.	H	α-helix	trans	-58	-39	178.7	0	0	0	0	0	112.2	A935 Q1003 I1010 C1011	A935-A1007 HydrophobicContact CB-CB 4.06Å; Q1003-A1007 WeakPolarHBondContact O-CB 3.48Å; Q1003-A1007 PolarHBondContact O-N 2.89Å; A1007-I1010 PolarHBondContact O-N 3.33Å; A1007-C1011 PolarHBondContact O-N 3.47Å; A1007-C1011 PolarHBondContact O-SG 3.04Å
1008	R	83.5	Confident	87.9	Confident	150 Å²	150	69 Å²	69	57%	0.566	35%	0.349	S	S	*	.	H	α-helix	trans	-62	-49.7	176.2	-178.1	178.2	174.7	151.8	-0	112.2	S1004 K1005 K1006 I1010 C1011 E1012	S1004-R1008 PolarHBondContact O-N 3.48Å; K1005-R1008 WeakPolarHBondContact O-CB 3.48Å; K1005-R1008 PolarHBondContact O-N 3.19Å; K1006-R1008 VanDerWaalsContact C-N 3.27Å; K1006-R1008 PolarHBondContact O-N 3.47Å; R1008-I1010 VanDerWaalsContact C-N 3.3Å; R1008-I1010 PolarHBondContact O-N 3.1Å; R1008-C1011 PolarHBondContact O-N 3.36Å; R1008-E1012 PolarHBondContact O-N 2.83Å; R1008-E1012 VanDerWaalsContact O-N 3.09Å
1009	I	88.5	Confident	87.3	Confident	97 Å²	97	70.5 Å²	70.5	50%	0.497	36%	0.355	S	S	.	.	H	α-helix	trans	-61.9	-40.4	179.8	-64.1	167.8	0	0	0	110.6	K1005 K1006 E1012 N1013	K1005-I1009 WeakPolarHBondContact O-CG1 3.35Å; K1005-I1009 PolarHBondContact O-N 3.4Å; K1006-I1009 PolarHBondContact O-N 2.97Å; I1009-E1012 PolarHBondContact O-N 3.31Å; I1009-N1013 PolarHBondContact O-N 3.23Å; I1009-N1013 PolarHBondContact O-ND2 3.13Å
1010	I	89.5	Confident	87.2	Confident	20 Å²	20	71.8 Å²	71.8	10%	0.103	36%	0.356	C	S	.	.	H	α-helix	trans	-63.2	-45.2	177.4	-65.4	160.8	0	0	0	111.1	L928 Q931 A935 K1006 A1007 R1008 E1012 N1013 Y1014	L928-I1010 HydrophobicContact CB-CG2 4.41Å; L928-I1010 HydrophobicContact CD2-CG2 4.12Å; L928-I1010 VanDerWaalsContact O-CG2 3.26Å; L928-I1010 WeakPolarHBondContact O-CG2 3.38Å; Q931-I1010 HydrophobicContact CB-CD1 3.99Å; Q931-I1010 HydrophobicContact CB-CG2 4.25Å; A935-I1010 HydrophobicContact CB-CD1 4.33Å; K1006-I1010 WeakPolarHBondContact O-CD1 3.36Å; K1006-I1010 VanDerWaalsContact O-CG1 3.29Å; K1006-I1010 WeakPolarHBondContact O-CG1 3.48Å; K1006-I1010 PolarHBondContact O-N 2.9Å; A1007-I1010 PolarHBondContact O-N 3.33Å; R1008-I1010 VanDerWaalsContact C-N 3.3Å; R1008-I1010 PolarHBondContact O-N 3.1Å; I1010-E1012 VanDerWaalsContact C-N 3.32Å; I1010-E1012 PolarHBondContact O-N 3.34Å; I1010-N1013 PolarHBondContact O-N 3.45Å; I1010-Y1014 WeakPolarHBondContact O-CB 3.48Å; I1010-Y1014 PolarHBondContact O-N 3.32Å
1011	C	84	Confident	87	Confident	64 Å²	64	71.3 Å²	71.3	43%	0.432	35%	0.352	S	S	.	.	H	α-helix	trans	-61.8	-38.3	177.7	-74.5	0	0	0	0	112.9	A1007 R1008 Y1014 A1015	A1007-C1011 PolarHBondContact O-N 3.47Å; A1007-C1011 PolarHBondContact O-SG 3.04Å; R1008-C1011 PolarHBondContact O-N 3.36Å; C1011-Y1014 PolarHBondContact O-N 3.34Å; C1011-A1015 PolarHBondContact O-N 3.35Å
1012	E	83	Confident	86.6	Confident	113 Å²	113	74 Å²	74	53%	0.528	36%	0.356	S	S	.	.	H	α-helix	trans	-65.3	-48.4	175.7	-174.3	176.8	171.1	0	0	111.5	R1008 I1009 I1010 Y1014 A1015 N1016	R1008-E1012 PolarHBondContact O-N 2.83Å; R1008-E1012 VanDerWaalsContact O-N 3.09Å; I1009-E1012 PolarHBondContact O-N 3.31Å; I1010-E1012 VanDerWaalsContact C-N 3.32Å; I1010-E1012 PolarHBondContact O-N 3.34Å; E1012-Y1014 VanDerWaalsContact C-N 3.27Å; E1012-Y1014 PolarHBondContact O-N 3.23Å; E1012-A1015 PolarHBondContact O-N 2.8Å; E1012-N1016 PolarHBondContact O-N 3.42Å; E1012-N1016 PolarHBondContact O-ND2 2.81Å
1013	N	88.1	Confident	86.1	Confident	77 Å²	77	75.6 Å²	75.6	41%	0.412	36%	0.359	S	S	.	.	H	α-helix	trans	-59.2	-39.2	174.8	-72.6	-19.8	0	0	0	111.9	L928 I1009 I1010 N1016 A1017	L928-N1013 HydrophobicContact CD1-CB 4.08Å; L928-N1013 HydrophobicContact CD2-CB 4.07Å; I1009-N1013 PolarHBondContact O-N 3.23Å; I1009-N1013 PolarHBondContact O-ND2 3.13Å; I1010-N1013 PolarHBondContact O-N 3.45Å; N1013-N1016 PolarHBondContact O-N 3.33Å; N1013-A1017 WeakPolarHBondContact O-CB 3.36Å; N1013-A1017 PolarHBondContact O-N 3.07Å
1014	Y	88.6	Confident	85.9	Confident	77 Å²	77	74.9 Å²	74.9	30%	0.302	36%	0.356	S	S	.	.	H	α-helix	trans	-63.6	-46.2	176.6	174	-100.3	0	0	0	111.9	I925 L928 Q929 I1010 C1011 E1012 N1016 A1017 I1018	I925-Y1014 HydrophobicContact CG2-CD2 4.31Å; I925-Y1014 HydrophobicContact CG2-CE2 3.67Å; L928-Y1014 HydrophobicContact CB-CD2 4.25Å; Q929-Y1014 HydrophobicContact CG-CD2 3.91Å; Q929-Y1014 HydrophobicContact CG-CE2 3.33Å; Q929-Y1014 PolarHBondContact NE2-OH 2.97Å; I1010-Y1014 WeakPolarHBondContact O-CB 3.48Å; I1010-Y1014 PolarHBondContact O-N 3.32Å; C1011-Y1014 PolarHBondContact O-N 3.34Å; E1012-Y1014 VanDerWaalsContact C-N 3.27Å; E1012-Y1014 PolarHBondContact O-N 3.23Å; Y1014-N1016 VanDerWaalsContact C-N 3.35Å; Y1014-N1016 PolarHBondContact O-N 3.47Å; Y1014-A1017 PolarHBondContact O-N 2.8Å; Y1014-I1018 HydrophobicContact CE1-CG1 4.16Å; Y1014-I1018 HydrophobicContact CE2-CD1 4.35Å; Y1014-I1018 HydrophobicContact CE2-CG1 4.13Å; Y1014-I1018 WeakPolarHBondContact O-CG1 3.3Å; Y1014-I1018 PolarHBondContact O-N 3.45Å
1015	A	78.9	Confident	85.8	Confident	54 Å²	54	76.1 Å²	76.1	45%	0.446	35%	0.354	S	S	.	.	H	α-helix	trans	-61.4	-43.3	176.6	0	0	0	0	0	111.8	C1011 E1012 I1018 F1019	C1011-A1015 PolarHBondContact O-N 3.35Å; E1012-A1015 PolarHBondContact O-N 2.8Å; A1015-I1018 PolarHBondContact O-N 3.04Å; A1015-F1019 PolarHBondContact O-N 2.74Å
1016	N	83.8	Confident	85.1	Confident	93 Å²	93	78.3 Å²	78.3	50%	0.497	36%	0.359	S	S	.	.	H	α-helix	trans	-63.8	-42.1	177	-73	-26.6	0	0	0	112.3	E1012 N1013 Y1014 F1019 R1020	E1012-N1016 PolarHBondContact O-N 3.42Å; E1012-N1016 PolarHBondContact O-ND2 2.81Å; N1013-N1016 PolarHBondContact O-N 3.33Å; Y1014-N1016 VanDerWaalsContact C-N 3.35Å; Y1014-N1016 PolarHBondContact O-N 3.47Å; N1016-F1019 PolarHBondContact O-N 2.73Å; N1016-R1020 WeakPolarHBondContact O-CB 3.25Å; N1016-R1020 PolarHBondContact O-N 3.37Å
1017	A	87.5	Confident	84.7	Confident	10 Å²	10	75.1 Å²	75.1	8%	0.083	35%	0.346	C	S	.	.	H	α-helix	trans	-63	-43.6	176	0	0	0	0	0	111.9	I925 L928 N1013 Y1014 R1020 Q1021	I925-A1017 HydrophobicContact CG1-CB 3.84Å; L928-A1017 HydrophobicContact CD1-CB 4.3Å; N1013-A1017 WeakPolarHBondContact O-CB 3.36Å; N1013-A1017 PolarHBondContact O-N 3.07Å; Y1014-A1017 PolarHBondContact O-N 2.8Å; A1017-R1020 PolarHBondContact O-N 2.77Å; A1017-Q1021 WeakPolarHBondContact O-CB 3.34Å; A1017-Q1021 PolarHBondContact O-N 2.79Å
1018	I	85.5	Confident	84.4	Confident	33 Å²	33	74.5 Å²	74.5	17%	0.169	34%	0.341	C	S	.	.	H	α-helix	trans	-62.6	-42.7	175.2	-69.9	-76.6	0	0	0	111.3	I925 Y1014 A1015 Q1021 R1022	I925-I1018 HydrophobicContact CD1-CD1 3.73Å; I925-I1018 HydrophobicContact CD1-CG1 4.26Å; I925-I1018 HydrophobicContact CG1-CD1 4.19Å; I925-I1018 HydrophobicContact CG1-CG1 4.41Å; I925-I1018 HydrophobicContact CG2-CD1 3.94Å; Y1014-I1018 HydrophobicContact CE1-CG1 4.16Å; Y1014-I1018 HydrophobicContact CE2-CD1 4.35Å; Y1014-I1018 HydrophobicContact CE2-CG1 4.13Å; Y1014-I1018 WeakPolarHBondContact O-CG1 3.3Å; Y1014-I1018 PolarHBondContact O-N 3.45Å; A1015-I1018 PolarHBondContact O-N 3.04Å; I1018-Q1021 PolarHBondContact O-N 2.78Å; I1018-R1022 WeakPolarHBondContact O-CG 3.21Å; I1018-R1022 PolarHBondContact O-N 2.83Å
1019	F	81.6	Confident	84.3	Confident	135 Å²	135	71.6 Å²	71.6	59%	0.592	33%	0.334	S	S	*	.	H	α-helix	trans	-63	-45.4	176.8	-179.2	-95.5	0	0	0	111.6	A1015 N1016 Q1021 R1022 K1023	A1015-F1019 PolarHBondContact O-N 2.74Å; N1016-F1019 PolarHBondContact O-N 2.73Å; F1019-Q1021 VanDerWaalsContact C-N 3.34Å; F1019-Q1021 PolarHBondContact O-N 2.9Å; F1019-R1022 PolarHBondContact O-N 3.19Å; F1019-K1023 PolarHBondContact O-N 2.86Å
1020	R	88.1	Confident	83.5	Confident	108 Å²	108	68.7 Å²	68.7	41%	0.408	32%	0.318	S	S	.	.	H	α-helix	trans	-59.1	-46.2	175.3	-177.9	64.4	-174.1	-171.7	2.7	110.9	E917 L921 N1016 A1017 R1022 K1023 V1024	E917-R1020 IonicContact OE1-CZ 3.14Å; E917-R1020 VanDerWaalsContact OE1-CZ 3.31Å; E917-R1020 IonicContact OE1-NE 2.88Å; E917-R1020 PolarHBondContact OE1-NE 3.36Å; E917-R1020 IonicContact OE1-NH2 2.72Å; E917-R1020 PolarHBondContact OE1-NH2 3.06Å; E917-R1020 IonicContact OE2-NH2 2.71Å; L921-R1020 HydrophobicContact CD1-CB 4.39Å; L921-R1020 HydrophobicContact CD1-CG 3.8Å; L921-R1020 HydrophobicContact CD2-CB 4.33Å; L921-R1020 HydrophobicContact CD2-CG 4.1Å; N1016-R1020 WeakPolarHBondContact O-CB 3.25Å; N1016-R1020 PolarHBondContact O-N 3.37Å; A1017-R1020 PolarHBondContact O-N 2.77Å; R1020-R1022 VanDerWaalsContact C-N 3.35Å; R1020-R1022 PolarHBondContact O-N 2.89Å; R1020-K1023 WeakPolarHBondContact O-CB 3.21Å; R1020-K1023 PolarHBondContact O-N 2.86Å; R1020-K1023 VanDerWaalsContact O-N 3.13Å; R1020-V1024 HydrophobicContact CG-CG2 4.35Å; R1020-V1024 VanDerWaalsContact O-CG2 3.29Å; R1020-V1024 WeakPolarHBondContact O-CG2 3.32Å; R1020-V1024 PolarHBondContact O-N 2.86Å
1021	Q	89	Confident	83	Confident	12 Å²	12	67.8 Å²	67.8	6%	0.056	31%	0.313	C	S	.	.	H	α-helix	trans	-59.3	-44.3	177.6	-175.6	-174.9	69	0	0	112	L921 D922 I925 A1017 I1018 F1019 K1023 V1024 R1025	L921-Q1021 HydrophobicContact CB-CB 4.32Å; L921-Q1021 HydrophobicContact CD1-CB 4.16Å; D922-Q1021 PolarHBondContact OD1-NE2 2.78Å; D922-Q1021 PolarHBondContact OD2-NE2 2.97Å; I925-Q1021 HydrophobicContact CD1-CB 4.11Å; I925-Q1021 HydrophobicContact CD1-CG 4.43Å; A1017-Q1021 WeakPolarHBondContact O-CB 3.34Å; A1017-Q1021 PolarHBondContact O-N 2.79Å; I1018-Q1021 PolarHBondContact O-N 2.78Å; F1019-Q1021 VanDerWaalsContact C-N 3.34Å; F1019-Q1021 PolarHBondContact O-N 2.9Å; Q1021-K1023 VanDerWaalsContact C-N 3.32Å; Q1021-K1023 PolarHBondContact O-N 2.76Å; Q1021-V1024 PolarHBondContact O-N 3.21Å; Q1021-R1025 HydrophobicContact CG-CG 4.3Å; Q1021-R1025 VanDerWaalsContact NE2-NH2 3.17Å; Q1021-R1025 WeakPolarHBondContact O-CB 3.4Å; Q1021-R1025 WeakPolarHBondContact O-CG 3.38Å; Q1021-R1025 PolarHBondContact O-N 3.26Å
1022	R	82.4	Confident	82.7	Confident	142 Å²	142	70 Å²	70	54%	0.536	31%	0.313	S	S	.	.	H	α-helix	trans	-60.1	-42	175.5	-74	174.4	179.6	175.9	1	111.7	I1018 F1019 R1020 R1026	I1018-R1022 WeakPolarHBondContact O-CG 3.21Å; I1018-R1022 PolarHBondContact O-N 2.83Å; F1019-R1022 PolarHBondContact O-N 3.19Å; R1020-R1022 VanDerWaalsContact C-N 3.35Å; R1020-R1022 PolarHBondContact O-N 2.89Å; R1022-R1026 VanDerWaalsContact O-CG 3.27Å; R1022-R1026 WeakPolarHBondContact O-CG 3.25Å; R1022-R1026 PolarHBondContact O-N 2.91Å
1023	K	82	Confident	82.2	Confident	105 Å²	105	70.3 Å²	70.3	46%	0.457	31%	0.309	S	S	.	.	H	α-helix	trans	-62.5	-48	177.3	-172	173.3	-179.2	173.3	0	111.3	F1019 R1020 Q1021 R1026 Q1027	F1019-K1023 PolarHBondContact O-N 2.86Å; R1020-K1023 WeakPolarHBondContact O-CB 3.21Å; R1020-K1023 PolarHBondContact O-N 2.86Å; R1020-K1023 VanDerWaalsContact O-N 3.13Å; Q1021-K1023 VanDerWaalsContact C-N 3.32Å; Q1021-K1023 PolarHBondContact O-N 2.76Å; K1023-R1026 PolarHBondContact O-N 3.05Å; K1023-Q1027 WeakPolarHBondContact O-CG 3.19Å; K1023-Q1027 PolarHBondContact O-N 3.02Å
1024	V	85.3	Confident	81.4	Confident	0 Å²	0	67 Å²	67	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.4	-41.4	179.7	-179.7	0	0	0	0	111.6	K914 E917 I918 L921 R1020 Q1021 R1026 Q1027 A1028	K914-V1024 HydrophobicContact CB-CG1 4.19Å; K914-V1024 HydrophobicContact CD-CG1 3.76Å; E917-V1024 HydrophobicContact CB-CG1 4.19Å; E917-V1024 VanDerWaalsContact CD-CG2 3.49Å; E917-V1024 HydrophobicContact CG-CG1 4.15Å; E917-V1024 HydrophobicContact CG-CG2 4.15Å; E917-V1024 VanDerWaalsContact OE1-CG2 3.25Å; E917-V1024 WeakPolarHBondContact OE1-CG2 3.39Å; I918-V1024 HydrophobicContact CD1-CG1 4.17Å; I918-V1024 HydrophobicContact CG1-CB 4.33Å; I918-V1024 HydrophobicContact CG1-CG1 3.68Å; L921-V1024 HydrophobicContact CD1-CG2 4.26Å; R1020-V1024 HydrophobicContact CG-CG2 4.35Å; R1020-V1024 VanDerWaalsContact O-CG2 3.29Å; R1020-V1024 WeakPolarHBondContact O-CG2 3.32Å; R1020-V1024 PolarHBondContact O-N 2.86Å; Q1021-V1024 PolarHBondContact O-N 3.21Å; V1024-R1026 VanDerWaalsContact C-N 3.34Å; V1024-R1026 PolarHBondContact O-N 3.33Å; V1024-Q1027 WeakPolarHBondContact O-CB 3.36Å; V1024-Q1027 PolarHBondContact O-N 2.93Å; V1024-A1028 PolarHBondContact O-N 3.39Å
1025	R	86.4	Confident	80.7	Confident	69 Å²	69	63.5 Å²	63.5	26%	0.26	28%	0.279	S	S	.	.	H	α-helix	trans	-61.9	-38.8	175	-76.3	-176.1	-179.4	173.3	4	112.3	I918 D922 Q1021 A1028 H1029	I918-R1025 HydrophobicContact CD1-CB 4.5Å; I918-R1025 HydrophobicContact CD1-CG 3.73Å; I918-R1025 HydrophobicContact CG1-CG 3.98Å; I918-R1025 HydrophobicContact CG2-CG 4.44Å; D922-R1025 IonicContact OD1-NH2 3.31Å; D922-R1025 PolarHBondContact OD1-NH2 3.28Å; D922-R1025 IonicContact OD2-NH2 3.8Å; D922-R1025 PolarHBondContact OD2-NH2 3.38Å; Q1021-R1025 HydrophobicContact CG-CG 4.3Å; Q1021-R1025 VanDerWaalsContact NE2-NH2 3.17Å; Q1021-R1025 WeakPolarHBondContact O-CB 3.4Å; Q1021-R1025 WeakPolarHBondContact O-CG 3.38Å; Q1021-R1025 PolarHBondContact O-N 3.26Å; R1025-A1028 PolarHBondContact O-N 2.94Å; R1025-H1029 WeakPolarHBondContact O-CB 3.4Å; R1025-H1029 PolarHBondContact O-N 3.21Å
1026	R	75.5	Confident	80.3	Confident	161 Å²	161	67.2 Å²	67.2	61%	0.608	29%	0.285	S	S	*	.	H	α-helix	trans	-63.4	-45.9	173.4	-72.9	174.5	-164.2	173.8	3.2	111.4	R1022 K1023 V1024 A1028 H1029 E1030	R1022-R1026 VanDerWaalsContact O-CG 3.27Å; R1022-R1026 WeakPolarHBondContact O-CG 3.25Å; R1022-R1026 PolarHBondContact O-N 2.91Å; K1023-R1026 PolarHBondContact O-N 3.05Å; V1024-R1026 VanDerWaalsContact C-N 3.34Å; V1024-R1026 PolarHBondContact O-N 3.33Å; R1026-A1028 PolarHBondContact O-N 3.44Å; R1026-H1029 PolarHBondContact O-N 3.4Å; R1026-E1030 WeakPolarHBondContact O-CG 3.35Å; R1026-E1030 PolarHBondContact O-N 2.93Å
1027	Q	80.8	Confident	79.5	Confident	43 Å²	43	68.2 Å²	68.2	20%	0.201	29%	0.291	C	S	.	.	H	α-helix	trans	-59.3	-46.5	175.9	-70.8	176.3	-34.3	0	0	111.5	K914 K1023 V1024 H1029 E1030 I1031	K914-Q1027 HydrophobicContact CD-CB 4.49Å; K1023-Q1027 WeakPolarHBondContact O-CG 3.19Å; K1023-Q1027 PolarHBondContact O-N 3.02Å; V1024-Q1027 WeakPolarHBondContact O-CB 3.36Å; V1024-Q1027 PolarHBondContact O-N 2.93Å; Q1027-H1029 VanDerWaalsContact C-N 3.31Å; Q1027-H1029 PolarHBondContact O-N 3.5Å; Q1027-E1030 WeakPolarHBondContact O-CB 3.17Å; Q1027-E1030 PolarHBondContact O-N 2.92Å; Q1027-E1030 VanDerWaalsContact O-N 3.14Å; Q1027-I1031 WeakPolarHBondContact O-CG1 3.35Å; Q1027-I1031 PolarHBondContact O-N 2.88Å
1028	A	81.3	Confident	78.7	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-60.1	-40.1	176	0	0	0	0	0	112.3	L911 K914 I918 V1024 R1025 R1026 E1030 I1031 R1032	L911-A1028 HydrophobicContact CD1-CB 4.2Å; K914-A1028 HydrophobicContact CB-CB 4.24Å; I918-A1028 HydrophobicContact CD1-CB 4.2Å; V1024-A1028 PolarHBondContact O-N 3.39Å; R1025-A1028 PolarHBondContact O-N 2.94Å; R1026-A1028 PolarHBondContact O-N 3.44Å; A1028-E1030 VanDerWaalsContact C-N 3.35Å; A1028-I1031 PolarHBondContact O-N 3.2Å; A1028-R1032 WeakPolarHBondContact O-CG 3.28Å; A1028-R1032 PolarHBondContact O-N 3.34Å
1029	H	79.6	Confident	77.4	Confident	89 Å²	89	74.2 Å²	74.2	41%	0.412	33%	0.329	S	S	.	.	H	α-helix	trans	-67.4	-34	176.1	-172.8	64	0	0	0	112.7	R1025 R1026 Q1027 R1032 R1033	R1025-H1029 WeakPolarHBondContact O-CB 3.4Å; R1025-H1029 PolarHBondContact O-N 3.21Å; R1026-H1029 PolarHBondContact O-N 3.4Å; Q1027-H1029 VanDerWaalsContact C-N 3.31Å; Q1027-H1029 PolarHBondContact O-N 3.5Å; H1029-R1032 PolarHBondContact O-N 2.92Å; H1029-R1033 WeakPolarHBondContact O-CG 3.38Å; H1029-R1033 PolarHBondContact O-N 3.18Å
1030	E	73.7	Confident	76	Confident	37 Å²	37	72 Å²	72	17%	0.173	32%	0.319	C	S	.	.	H	α-helix	trans	-67.1	-41.9	172.9	-72.5	168.2	-168.4	0	0	112.2	K872 F874 R1026 Q1027 A1028 R1032 R1033 A1034	K872-E1030 VanDerWaalsContact CB-OE2 3.29Å; K872-E1030 WeakPolarHBondContact CB-OE2 2.86Å; F874-E1030 HydrophobicContact CZ-CB 4.27Å; R1026-E1030 WeakPolarHBondContact O-CG 3.35Å; R1026-E1030 PolarHBondContact O-N 2.93Å; Q1027-E1030 WeakPolarHBondContact O-CB 3.17Å; Q1027-E1030 PolarHBondContact O-N 2.92Å; Q1027-E1030 VanDerWaalsContact O-N 3.14Å; A1028-E1030 VanDerWaalsContact C-N 3.35Å; E1030-R1032 VanDerWaalsContact C-N 3.33Å; E1030-R1032 PolarHBondContact O-N 3.46Å; E1030-R1033 PolarHBondContact O-N 3.36Å; E1030-A1034 PolarHBondContact O-N 3.36Å
1031	I	77.7	Confident	74.2	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.1	-46.6	173.2	-62.1	167.3	0	0	0	110.4	F874 L907 E910 L911 K914 Q1027 A1028 R1033 A1034 L1035	F874-I1031 HydrophobicContact CD1-CD1 4.25Å; F874-I1031 HydrophobicContact CD1-CG1 3.99Å; F874-I1031 HydrophobicContact CE1-CB 4.4Å; F874-I1031 HydrophobicContact CE1-CD1 3.67Å; F874-I1031 HydrophobicContact CE1-CG1 3.07Å; F874-I1031 HydrophobicContact CZ-CB 4.43Å; F874-I1031 HydrophobicContact CZ-CG1 3.47Å; F874-I1031 VanDerWaalsContact CZ-CG1 3.47Å; L907-I1031 HydrophobicContact CB-CG2 4.27Å; L907-I1031 HydrophobicContact CD2-CG2 4.18Å; L907-I1031 WeakPolarHBondContact O-CG2 2.96Å; E910-I1031 HydrophobicContact CB-CD1 3.83Å; L911-I1031 HydrophobicContact CB-CG2 3.95Å; L911-I1031 HydrophobicContact CD1-CB 4.33Å; L911-I1031 HydrophobicContact CD1-CG2 4.31Å; K914-I1031 HydrophobicContact CG-CD1 4.17Å; Q1027-I1031 WeakPolarHBondContact O-CG1 3.35Å; Q1027-I1031 PolarHBondContact O-N 2.88Å; A1028-I1031 PolarHBondContact O-N 3.2Å; I1031-R1033 VanDerWaalsContact C-N 3.31Å; I1031-R1033 PolarHBondContact O-N 3.22Å; I1031-A1034 PolarHBondContact O-N 2.88Å; I1031-L1035 HydrophobicContact CG2-CD1 3.93Å; I1031-L1035 HydrophobicContact CG2-CG 4.45Å; I1031-L1035 WeakPolarHBondContact O-CG 3.23Å; I1031-L1035 PolarHBondContact O-N 2.9Å
1032	R	77.2	Confident	72.3	Confident	110 Å²	110	80.6 Å²	80.6	42%	0.415	36%	0.361	S	S	.	.	H	α-helix	trans	-60.8	-39.1	177.5	-70.8	179.7	-152.6	147.3	4.2	112.3	L911 A1028 H1029 E1030 L1035 K1036	L911-R1032 HydrophobicContact CD1-CG 3.94Å; L911-R1032 HydrophobicContact CD2-CG 4.18Å; A1028-R1032 WeakPolarHBondContact O-CG 3.28Å; A1028-R1032 PolarHBondContact O-N 3.34Å; H1029-R1032 PolarHBondContact O-N 2.92Å; E1030-R1032 VanDerWaalsContact C-N 3.33Å; E1030-R1032 PolarHBondContact O-N 3.46Å; R1032-L1035 PolarHBondContact O-N 3.18Å; R1032-K1036 WeakPolarHBondContact O-CB 3.47Å; R1032-K1036 PolarHBondContact O-N 2.97Å
1033	R	72.2	Confident	70.4	Confident	120 Å²	120	81.1 Å²	81.1	45%	0.453	37%	0.37	S	S	.	.	H	α-helix	trans	-63.8	-46.6	175.2	-78.6	-173.7	-73.8	-156.8	3.2	111.7	H1029 E1030 I1031 L1035 K1036 D1037	H1029-R1033 WeakPolarHBondContact O-CG 3.38Å; H1029-R1033 PolarHBondContact O-N 3.18Å; E1030-R1033 PolarHBondContact O-N 3.36Å; I1031-R1033 VanDerWaalsContact C-N 3.31Å; I1031-R1033 PolarHBondContact O-N 3.22Å; R1033-L1035 VanDerWaalsContact C-N 3.31Å; R1033-L1035 PolarHBondContact O-N 3.12Å; R1033-K1036 WeakPolarHBondContact O-CB 3.25Å; R1033-K1036 PolarHBondContact O-N 3.39Å; R1033-K1036 VanDerWaalsContact O-N 3.09Å; R1033-D1037 PolarHBondContact O-N 3.28Å
1034	A	71.4	Confident	68.4	Low	9 Å²	9	80.1 Å²	80.1	7%	0.074	38%	0.376	C	S	.	.	H	α-helix	trans	-61	-37.7	176.5	0	0	0	0	0	113	A899 E1030 I1031 R1038	A899-A1034 HydrophobicContact CB-CB 3.65Å; E1030-A1034 PolarHBondContact O-N 3.36Å; I1031-A1034 PolarHBondContact O-N 2.88Å; A1034-R1038 PolarHBondContact O-N 3.17Å
1035	L	75.2	Confident	66.4	Low	2 Å²	2	82 Å²	82	1%	0.01	39%	0.386	C	S	.	.	H	α-helix	trans	-67.2	-38	173.4	-71.9	167.9	0	0	0	112.1	E904 L907 N908 L911 I1031 R1032 R1033 R1038 L1045	E904-L1035 HydrophobicContact CG-CD2 4.45Å; L907-L1035 HydrophobicContact CB-CD2 3.88Å; L907-L1035 HydrophobicContact CB-CG 4.26Å; L907-L1035 HydrophobicContact CD1-CD2 4.08Å; L907-L1035 HydrophobicContact CD1-CG 4.49Å; N908-L1035 WeakPolarHBondContact OD1-CD1 3.45Å; L911-L1035 HydrophobicContact CD2-CD1 4.23Å; I1031-L1035 HydrophobicContact CG2-CD1 3.93Å; I1031-L1035 HydrophobicContact CG2-CG 4.45Å; I1031-L1035 WeakPolarHBondContact O-CG 3.23Å; I1031-L1035 PolarHBondContact O-N 2.9Å; R1032-L1035 PolarHBondContact O-N 3.18Å; R1033-L1035 VanDerWaalsContact C-N 3.31Å; R1033-L1035 PolarHBondContact O-N 3.12Å; L1035-R1038 PolarHBondContact O-N 3.45Å; L1035-L1045 HydrophobicContact CB-CD1 4.44Å; L1035-L1045 HydrophobicContact CD1-CD2 3.85Å
1036	K	70.8	Confident	64.1	Low	133 Å²	133	82 Å²	82	58%	0.578	40%	0.396	S	S	*	.	H	α-helix	trans	-66.7	-42.2	176.7	-173.7	174.3	-177.9	167	0	112.4	R1032 R1033 R1038 G1039	R1032-K1036 WeakPolarHBondContact O-CB 3.47Å; R1032-K1036 PolarHBondContact O-N 2.97Å; R1033-K1036 WeakPolarHBondContact O-CB 3.25Å; R1033-K1036 PolarHBondContact O-N 3.39Å; R1033-K1036 VanDerWaalsContact O-N 3.09Å; K1036-R1038 PolarHBondContact O-N 3.13Å; K1036-G1039 PolarHBondContact O-N 2.98Å
1037	D	65.9	Low	62	Low	114 Å²	114	77.8 Å²	77.8	61%	0.61	39%	0.392	S	S	*	.	H	α-helix	trans	-64.9	-25.4	178.3	-68.7	-20.7	0	0	0	112.2	R1033 G1039	R1033-D1037 PolarHBondContact O-N 3.28Å; D1037-G1039 PolarHBondContact O-N 2.93Å
1038	R	70.8	Confident	59.7	Low	105 Å²	105	79.5 Å²	79.5	40%	0.396	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	6.4	171.5	-69.7	-175.3	177.5	176.2	3.2	114.3	A899 C900 L902 A1034 L1035 K1036	A899-R1038 PolarHBondContact O-NH2 3.2Å; C900-R1038 PolarHBondContact O-NH2 3.46Å; L902-R1038 PolarHBondContact O-NH1 3.49Å; L902-R1038 PolarHBondContact O-NH2 3.18Å; A1034-R1038 PolarHBondContact O-N 3.17Å; L1035-R1038 PolarHBondContact O-N 3.45Å; K1036-R1038 PolarHBondContact O-N 3.13Å
1039	G	58.4	Low	57.3	Low	64 Å²	64	84.3 Å²	84.3	66%	0.66	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	11.9	170.2	0	0	0	0	0	116.1	K1036 D1037	K1036-G1039 PolarHBondContact O-N 2.98Å; D1037-G1039 PolarHBondContact O-N 2.93Å
1040	F	52.8	Low	54.8	Low	87 Å²	87	84.1 Å²	84.1	38%	0.382	45%	0.451	S	S	.	.			trans	-77.8	130.9	175.2	-79	-92	0	0	0	112.1	E904	E904-F1040 HydrophobicContact CG-CE2 4.27Å; E904-F1040 HydrophobicContact CG-CZ 4.35Å; E904-F1040 WeakPolarHBondContact OE1-CE1 3.41Å; E904-F1040 WeakPolarHBondContact OE1-CZ 3.34Å; E904-F1040 VanDerWaalsContact OE2-CZ 3.26Å; E904-F1040 WeakPolarHBondContact OE2-CZ 3.32Å
1041	K	49	Very low	52.5	Low	162 Å²	162	86.4 Å²	86.4	70%	0.704	47%	0.471	S	S	*	.			trans	-73.9	139.5	178.1	-69.4	-178.6	177.3	-180	0	111.2	E1043 S1044	K1041-E1043 PolarHBondContact O-N 3.1Å; K1041-E1043 VanDerWaalsContact O-N 3.1Å; K1041-S1044 PolarHBondContact O-N 3.46Å
1042	E	48.8	Very low	49.9	Very low	139 Å²	139	94.9 Å²	94.9	65%	0.65	52%	0.515	S	S	*	.	H	α-helix	trans	-60.1	-21.8	-172.4	-156.3	163.8	-167	0	0	114.1	L1045 S1046	E1042-L1045 PolarHBondContact O-N 2.83Å; E1042-S1046 PolarHBondContact O-N 3.07Å; E1042-S1046 PolarHBondContact O-OG 2.97Å
1043	E	44.1	Very low	47.4	Very low	153 Å²	153	94.6 Å²	94.6	72%	0.715	53%	0.529	S	S	*	.	H	α-helix	trans	-64.2	-41.2	179.2	-72.9	170.8	162.5	0	0	112.6	K1041 L1045 S1046 S1047	K1041-E1043 PolarHBondContact O-N 3.1Å; K1041-E1043 VanDerWaalsContact O-N 3.1Å; E1043-L1045 VanDerWaalsContact C-N 3.31Å; E1043-L1045 PolarHBondContact O-N 3.19Å; E1043-S1046 PolarHBondContact O-N 3.41Å; E1043-S1047 PolarHBondContact O-N 3.26Å; E1043-S1047 PolarHBondContact O-OG 2.98Å
1044	S	38.8	Very low	45	Very low	84 Å²	84	96.7 Å²	96.7	59%	0.587	55%	0.549	S	S	*	.	H	α-helix	trans	-74	-21.7	178.3	-51.2	0	0	0	0	113.5	K1041	K1041-S1044 PolarHBondContact O-N 3.46Å
1045	L	44	Very low	42.6	Very low	41 Å²	41	103.5 Å²	103.5	22%	0.215	58%	0.584	C	S	.	*	H	α-helix	trans	-84.7	-24.9	179.2	-68.7	165.3	0	0	0	112.4	L911 L1035 E1042 E1043	L911-L1045 HydrophobicContact CD2-CD2 4.41Å; L1035-L1045 HydrophobicContact CB-CD1 4.44Å; L1035-L1045 HydrophobicContact CD1-CD2 3.85Å; E1042-L1045 PolarHBondContact O-N 2.83Å; E1043-L1045 VanDerWaalsContact C-N 3.31Å; E1043-L1045 PolarHBondContact O-N 3.19Å
1046	S	39.1	Very low	40.1	Very low	67 Å²	67	108 Å²	108	47%	0.469	62%	0.615	S	S	.	*	H	α-helix	trans	-82.8	-33	177.9	-51.8	0	0	0	0	112	E1042 E1043 S1048 S1049	E1042-S1046 PolarHBondContact O-N 3.07Å; E1042-S1046 PolarHBondContact O-OG 2.97Å; E1043-S1046 PolarHBondContact O-N 3.41Å; S1046-S1048 VanDerWaalsContact C-N 3.28Å; S1046-S1048 PolarHBondContact O-N 3.34Å; S1046-S1049 PolarHBondContact O-N 2.77Å; S1046-S1049 PolarHBondContact O-OG 2.94Å; S1046-S1049 VanDerWaalsContact O-OG 3.1Å
1047	S	30.2	Very low	37.8	Very low	73 Å²	73	108.7 Å²	108.7	51%	0.51	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.6	-7.6	-178.8	-54.1	0	0	0	0	115.3	E1043 S1051	E1043-S1047 PolarHBondContact O-N 3.26Å; E1043-S1047 PolarHBondContact O-OG 2.98Å; S1047-S1051 PolarHBondContact O-OG 3.49Å
1048	S	32	Very low	35.6	Very low	79 Å²	79	108.1 Å²	108.1	55%	0.552	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	0.8	178.3	-65.3	0	0	0	0	114	S1046	S1046-S1048 VanDerWaalsContact C-N 3.28Å; S1046-S1048 PolarHBondContact O-N 3.34Å
1049	S	32.3	Very low	33.3	Very low	102 Å²	102	108.2 Å²	108.2	71%	0.713	65%	0.653	S	S	*	*	S	Bend	trans	-107.1	-3.3	175.3	34	0	0	0	0	114.2	S1046	S1046-S1049 PolarHBondContact O-N 2.77Å; S1046-S1049 PolarHBondContact O-OG 2.94Å; S1046-S1049 VanDerWaalsContact O-OG 3.1Å
1050	S	27.5	Very low	31.7	Very low	86 Å²	86	111.8 Å²	111.8	60%	0.601	66%	0.662	S	S	*	*	S	Bend	trans	-127	14	-177.8	65.1	0	0	0	0	114.7
1051	S	24.5	Very low	30.2	Very low	84 Å²	84	116.7 Å²	116.7	59%	0.587	68%	0.683	S	S	*	*	S	Bend	trans	-112.3	22.7	-173.7	60.3	0	0	0	0	115.8	S1047	S1047-S1051 PolarHBondContact O-OG 3.49Å
1052	L	23.7	Very low	28.9	Very low	179 Å²	179	117.2 Å²	117.2	94%	0.937	69%	0.689	S	S	*	*	S	Bend	trans	-126.6	25.7	172.8	-76.4	171.8	0	0	0	113.9
1053	C	24.4	Very low	27.6	Very low	103 Å²	103	115.7 Å²	115.7	70%	0.696	69%	0.693	S	S	*	*	S	Bend	trans	-148.5	61.3	165.8	58.5	0	0	0	0	110.4
1054	D	21	Very low	26.7	Very low	165 Å²	165	115.9 Å²	115.9	88%	0.882	70%	0.697	S	S	*	*			trans	-149.5	88.3	152.4	-93	-27.8	0	0	0	106.6
1055	D	21.8	Very low	25.8	Very low	151 Å²	151	119.2 Å²	119.2	81%	0.807	71%	0.708	S	S	*	*			trans	-133.3	102	153.6	-143.7	-6.4	0	0	0	108.3
1056	S	22.4	Very low	25	Very low	96 Å²	96	123.9 Å²	123.9	67%	0.671	73%	0.734	S	S	*	*			trans	62.4	84.4	136.9	-57.5	0	0	0	0	118.8
1057	T	23.4	Very low	24.2	Very low	148 Å²	148	128.5 Å²	128.5	91%	0.908	75%	0.748	S	S	*	*				-139.3	92.1	127	44.9	0	0	0	0	109.8
1058	S	19.3	Very low	23.9	Very low	103 Å²	103	129.8 Å²	129.8	72%	0.72	76%	0.757	S	S	*	*			trans	-73.9	146.1	155.5	55.8	0	0	0	0	109.6
1059	S	21.9	Very low	23.6	Very low	107 Å²	107	133.2 Å²	133.2	75%	0.748	77%	0.769	S	S	*	*			trans	79.9	102.1	156	-37.7	0	0	0	0	118
1060	T	24.6	Very low	23.1	Very low	139 Å²	139	135.3 Å²	135.3	85%	0.853	77%	0.771	S	S	*	*			trans	-179.2	82.8	136.1	-64.6	0	0	0	0	106.3
1061	K	21.3	Very low	23	Very low	189 Å²	189	137.2 Å²	137.2	82%	0.822	78%	0.779	S	S	*	*				29.5	128.2	95.6	-85.6	-171.6	178.8	178.2	0	115.6
1062	Q	21.2	Very low	23.2	Very low	174 Å²	174	138.2 Å²	138.2	81%	0.813	78%	0.783	S	S	*	*			trans	87.6	101.8	163.5	-64.8	173.9	-4.9	0	0	115.1
1063	S	21.5	Very low	23	Very low	107 Å²	107	140.8 Å²	140.8	75%	0.748	78%	0.78	S	S	*	*				71.9	99.7	88.5	-58.9	0	0	0	0	110.8
1064	I	25	Very low	23	Very low	156 Å²	156	143.2 Å²	143.2	80%	0.8	79%	0.786	S	S	*	*			trans	-154.8	104.8	131.2	-86.4	139.5	0	0	0	104.9	N1066	I1064-N1066 PolarHBondContact O-N 2.97Å
1065	D	20.6	Very low	23.3	Very low	154 Å²	154	140.2 Å²	140.2	82%	0.824	78%	0.778	S	S	*	*			trans	-47.2	129.2	153	-72.1	-56	0	0	0	109.1
1066	N	26.5	Very low	23.5	Very low	139 Å²	139	139.9 Å²	139.9	74%	0.743	78%	0.775	S	S	*	*			trans	-144.4	84.8	146.9	-94.3	-27	0	0	0	108.6	I1064	I1064-N1066 PolarHBondContact O-N 2.97Å
1067	Q	24.1	Very low	23.7	Very low	164 Å²	164	143 Å²	143	77%	0.766	78%	0.784	S	S	*	*			trans	58.5	88.2	143.4	-66.3	178.3	-3.3	0	0	116.3	N1069	Q1067-N1069 PolarHBondContact O-N 3.27Å; Q1067-N1069 VanDerWaalsContact O-N 3.13Å
1068	S	22.9	Very low	23.8	Very low	101 Å²	101	140.6 Å²	140.6	71%	0.706	77%	0.774	S	S	*	*			trans	-31	107	132.9	53.8	0	0	0	0	112.8
1069	N	25.5	Very low	24.4	Very low	150 Å²	150	144.3 Å²	144.3	80%	0.802	78%	0.779	S	S	*	*			trans	-105.4	78.2	145.1	-85	-24.8	0	0	0	107.5	Q1067 V1071	Q1067-N1069 PolarHBondContact O-N 3.27Å; Q1067-N1069 VanDerWaalsContact O-N 3.13Å; N1069-V1071 PolarHBondContact O-N 3.44Å
1070	I	23	Very low	24.7	Very low	147 Å²	147	145 Å²	145	75%	0.754	78%	0.778	S	S	*	*			trans	-66.1	113	153.1	-67	168.9	0	0	0	105.5
1071	V	24.7	Very low	24.9	Very low	126 Å²	126	145.9 Å²	145.9	76%	0.764	78%	0.778	S	S	*	*			trans	-118.4	129.4	152.4	-179.2	0	0	0	0	107.3	N1069	N1069-V1071 PolarHBondContact O-N 3.44Å
1072	P	27.8	Very low	25.8	Very low	104 Å²	104	142.5 Å²	142.5	68%	0.675	77%	0.768	S	S	*	*			trans	-77.3	148.8	-164.6	-12.4	29.4	0	0	0	113.5	N1074	P1072-N1074 PolarHBondContact O-N 3.39Å; P1072-N1074 VanDerWaalsContact O-N 3.1Å
1073	R	20.4	Very low	26.9	Very low	234 Å²	234	144.1 Å²	144.1	88%	0.883	77%	0.768	S	S	*	*			trans	-18.9	104.1	149.8	-167.2	178.6	-155	139.2	0.9	113.2
1074	N	23.6	Very low	28.8	Very low	153 Å²	153	142.8 Å²	142.8	82%	0.818	75%	0.752	S	S	*	*			trans	-104.7	116.3	149	-103.8	-12.2	0	0	0	108.4	P1072 I1076	P1072-N1074 PolarHBondContact O-N 3.39Å; P1072-N1074 VanDerWaalsContact O-N 3.1Å; N1074-I1076 PolarHBondContact O-N 2.83Å; N1074-I1076 VanDerWaalsContact O-N 3.13Å
1075	S	27.3	Very low	31.2	Very low	102 Å²	102	137.3 Å²	137.3	71%	0.713	73%	0.726	S	S	*	*			trans	-49.7	110.5	163.7	-58.7	0	0	0	0	109.6
1076	I	25.5	Very low	33.9	Very low	145 Å²	145	136.1 Å²	136.1	74%	0.744	72%	0.716	S	S	*	*			trans	-111.4	89.8	156.8	-60.3	177.1	0	0	0	105.7	N1074 S1078	N1074-I1076 PolarHBondContact O-N 2.83Å; N1074-I1076 VanDerWaalsContact O-N 3.13Å; I1076-S1078 PolarHBondContact O-N 3.24Å
1077	N	26.7	Very low	36.5	Very low	160 Å²	160	132.9 Å²	132.9	86%	0.856	70%	0.696	S	S	*	*			trans	-55.2	117	147.5	-84.2	-14.9	0	0	0	107.3
1078	S	25.7	Very low	39.5	Very low	99 Å²	99	125.2 Å²	125.2	69%	0.692	66%	0.66	S	S	*	*			trans	-142.4	50.1	154.9	62.8	0	0	0	0	109.6	I1076 V1080	I1076-S1078 PolarHBondContact O-N 3.24Å; S1078-V1080 PolarHBondContact O-N 3.43Å
1079	H	31.7	Very low	42.4	Very low	181 Å²	181	127.9 Å²	127.9	84%	0.838	66%	0.655	S	S	*	*	S	Bend	trans	-76.2	104.7	154.2	-148.5	-80.3	0	0	0	105.5	D1081	H1079-D1081 PolarHBondContact O-N 2.94Å; H1079-D1081 VanDerWaalsContact O-N 3.09Å
1080	V	28.9	Very low	45.2	Very low	120 Å²	120	123 Å²	123	73%	0.727	63%	0.629	S	S	*	*			trans	-25.1	108.9	176.3	-178.7	0	0	0	0	111.4	S1078 I1082	S1078-V1080 PolarHBondContact O-N 3.43Å; V1080-I1082 VanDerWaalsContact C-N 3.31Å; V1080-I1082 PolarHBondContact O-N 3.35Å
1081	D	29.6	Very low	48.4	Very low	159 Å²	159	120.3 Å²	120.3	85%	0.85	61%	0.609	S	S	*	*			trans	-58.6	94.3	170.1	-80.6	-41.2	0	0	0	108.2	H1079 Y1083	H1079-D1081 PolarHBondContact O-N 2.94Å; H1079-D1081 VanDerWaalsContact O-N 3.09Å; D1081-Y1083 PolarHBondContact O-N 3.48Å; D1081-Y1083 VanDerWaalsContact O-N 3.11Å
1082	I	38.7	Very low	51.3	Low	118 Å²	118	123.1 Å²	123.1	61%	0.605	61%	0.606	S	S	*	*			trans	-68.4	104.8	158.7	-62	173.7	0	0	0	104	V1080 L1084	V1080-I1082 VanDerWaalsContact C-N 3.31Å; V1080-I1082 PolarHBondContact O-N 3.35Å; I1082-L1084 PolarHBondContact O-N 3.37Å
1083	Y	45.4	Very low	54.2	Low	208 Å²	208	122 Å²	122	82%	0.816	59%	0.589	S	S	*	*			trans	-55.4	98.8	176	-169.8	-93.4	0	0	0	108.9	D1081 P1085	D1081-Y1083 PolarHBondContact O-N 3.48Å; D1081-Y1083 VanDerWaalsContact O-N 3.11Å; Y1083-P1085 WeakPolarHBondContact O-CD 3.36Å
1084	L	61.2	Low	57.6	Low	78 Å²	78	110.9 Å²	110.9	41%	0.408	55%	0.547	S	S	.	.			trans	-78.5	120.2	171.5	-87.5	153.3	0	0	0	107.3	I1082 H1169 V1170	I1082-L1084 PolarHBondContact O-N 3.37Å; L1084-H1169 HydrophobicContact CD2-CB 4.45Å; L1084-V1170 HydrophobicContact CD2-CG2 4.47Å
1085	P	75.4	Confident	60.9	Low	41 Å²	41	105 Å²	105	27%	0.266	52%	0.515	S	S	.	.			trans	-56.9	140.1	178.9	-21.8	31.9	0	0	0	111.5	Y1083 E1087 I1088	Y1083-P1085 WeakPolarHBondContact O-CD 3.36Å; P1085-E1087 WeakPolarHBondContact CB-OE2 3.21Å; P1085-E1087 PolarHBondContact O-N 2.89Å; P1085-E1087 VanDerWaalsContact O-N 3.16Å; P1085-I1088 HydrophobicContact CB-CG1 4.33Å; P1085-I1088 HydrophobicContact CG-CG1 4.43Å; P1085-I1088 PolarHBondContact O-N 3.16Å; P1085-I1088 VanDerWaalsContact O-N 3.08Å
1086	E	77.5	Confident	63.9	Low	129 Å²	129	101.5 Å²	101.5	60%	0.603	49%	0.488	S	S	*	.	H	α-helix	trans	-60.5	-28.9	-175.8	-172.3	163.9	-153.6	0	0	111.9	I1088 R1089 D1090	E1086-I1088 VanDerWaalsContact C-N 3.29Å; E1086-I1088 PolarHBondContact O-N 3.04Å; E1086-R1089 PolarHBondContact O-N 2.64Å; E1086-R1089 IonicContact OE1-NH2 2.73Å; E1086-D1090 PolarHBondContact O-N 3.05Å
1087	E	81.4	Confident	66.6	Low	71 Å²	71	98.7 Å²	98.7	33%	0.332	48%	0.477	S	S	.	.	H	α-helix	trans	-71.9	-20.5	-179.1	-47.6	83.5	176	0	0	113.3	P1085 Y1093 L1190	P1085-E1087 WeakPolarHBondContact CB-OE2 3.21Å; P1085-E1087 PolarHBondContact O-N 2.89Å; P1085-E1087 VanDerWaalsContact O-N 3.16Å; E1087-Y1093 HydrophobicContact CB-CD1 4.35Å; E1087-Y1093 HydrophobicContact CB-CD2 3.9Å; E1087-Y1093 HydrophobicContact CB-CE2 4.19Å; E1087-Y1093 HydrophobicContact CB-CG 3.98Å; E1087-Y1093 HydrophobicContact CG-CD2 4.43Å; E1087-Y1093 HydrophobicContact CG-CE1 4.32Å; E1087-Y1093 HydrophobicContact CG-CE2 4.24Å; E1087-Y1093 WeakPolarHBondContact O-CB 3.34Å; E1087-L1190 HydrophobicContact CB-CD1 3.69Å; E1087-L1190 HydrophobicContact CG-CD1 3.91Å; E1087-L1190 HydrophobicContact CG-CD2 4.28Å
1088	I	87.3	Confident	69.1	Low	3 Å²	3	98.2 Å²	98.2	2%	0.015	47%	0.474	C	S	.	.	H	α-helix	trans	-78.3	-38.7	171.7	-63.7	-68.1	0	0	0	110.2	P1085 E1086 W1094 F1116 I1165 H1169 P1187	P1085-I1088 HydrophobicContact CB-CG1 4.33Å; P1085-I1088 HydrophobicContact CG-CG1 4.43Å; P1085-I1088 PolarHBondContact O-N 3.16Å; P1085-I1088 VanDerWaalsContact O-N 3.08Å; E1086-I1088 VanDerWaalsContact C-N 3.29Å; E1086-I1088 PolarHBondContact O-N 3.04Å; I1088-W1094 PolarHBondContact O-NE1 2.84Å; I1088-F1116 HydrophobicContact CD1-CE1 4.13Å; I1088-F1116 HydrophobicContact CD1-CZ 4.27Å; I1088-I1165 HydrophobicContact CG2-CG2 4.19Å; I1088-H1169 WeakPolarHBondContact CD1-ND1 3.39Å; I1088-H1169 HydrophobicContact CG2-CB 4Å; I1088-P1187 HydrophobicContact CD1-CG 3.77Å
1089	R	83	Confident	72	Confident	157 Å²	157	94 Å²	94	59%	0.592	45%	0.446	S	S	*	.	H	α-helix	trans	-74.6	-33	-178.3	-169.6	176.3	64.5	-179.3	-1.8	112.3	E1086 R1091	E1086-R1089 PolarHBondContact O-N 2.64Å; E1086-R1089 IonicContact OE1-NH2 2.73Å; R1089-R1091 PolarHBondContact O-N 3.45Å
1090	D	85	Confident	74.6	Confident	48 Å²	48	89.1 Å²	89.1	26%	0.257	43%	0.429	S	S	.	.			trans	-85.5	112.7	178.8	-174.5	-4.5	0	0	0	111.8	E1086 R1092 Y1093 W1094	E1086-D1090 PolarHBondContact O-N 3.05Å; D1090-R1092 PolarHBondContact O-N 3.28Å; D1090-R1092 VanDerWaalsContact OD1-CB 3.3Å; D1090-R1092 WeakPolarHBondContact OD1-CB 3.41Å; D1090-R1092 VanDerWaalsContact OD1-CG 3.24Å; D1090-R1092 WeakPolarHBondContact OD1-CG 3.29Å; D1090-R1092 PolarHBondContact OD1-N 3.45Å; D1090-R1092 WeakPolarHBondContact OD2-CD 3.21Å; D1090-Y1093 HydrophobicContact CB-CD2 3.82Å; D1090-Y1093 HydrophobicContact CB-CE2 3.92Å; D1090-Y1093 PolarHBondContact O-N 3.46Å; D1090-Y1093 VanDerWaalsContact O-N 3.16Å; D1090-W1094 PolarHBondContact O-NE1 3.19Å
1091	R	89.8	Confident	77.5	Confident	90 Å²	90	89.5 Å²	89.5	34%	0.34	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-55	-21.7	176.6	74.9	-175.3	-54.7	149.7	-6	114.4	R1089 Y1093 W1094 F1095 E1162	R1089-R1091 PolarHBondContact O-N 3.45Å; R1091-Y1093 PolarHBondContact O-N 3.32Å; R1091-W1094 VanDerWaalsContact CA-CE2 3.47Å; R1091-W1094 VanDerWaalsContact CA-CZ2 3.45Å; R1091-W1094 HydrophobicContact CB-CH2 3.6Å; R1091-W1094 HydrophobicContact CB-CZ2 3.59Å; R1091-W1094 HydrophobicContact CB-CZ3 4.16Å; R1091-W1094 PolarHBondContact O-N 2.82Å; R1091-F1095 HydrophobicContact CB-CB 4.34Å; R1091-F1095 WeakPolarHBondContact O-CB 3.18Å; R1091-F1095 PolarHBondContact O-N 3.36Å; R1091-E1162 HydrophobicContact CB-CG 4.49Å; R1091-E1162 VanDerWaalsContact CD-OE1 3.31Å; R1091-E1162 WeakPolarHBondContact CD-OE1 3.43Å; R1091-E1162 IonicContact CZ-OE1 3.67Å; R1091-E1162 IonicContact NE-OE1 3.37Å; R1091-E1162 IonicContact NH1-OE1 3.48Å; R1091-E1162 PolarHBondContact NH1-OE1 2.86Å
1092	R	85.3	Confident	80.4	Confident	185 Å²	185	88 Å²	88	70%	0.698	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-57.7	-28.6	178.4	-69.9	174.5	-177.6	177.1	1.2	112.1	D1090 K1189	D1090-R1092 PolarHBondContact O-N 3.28Å; D1090-R1092 VanDerWaalsContact OD1-CB 3.3Å; D1090-R1092 WeakPolarHBondContact OD1-CB 3.41Å; D1090-R1092 VanDerWaalsContact OD1-CG 3.24Å; D1090-R1092 WeakPolarHBondContact OD1-CG 3.29Å; D1090-R1092 PolarHBondContact OD1-N 3.45Å; D1090-R1092 WeakPolarHBondContact OD2-CD 3.21Å; R1092-K1189 WeakPolarHBondContact O-CD 3.24Å; R1092-K1189 WeakPolarHBondContact O-CE 3.32Å; R1092-K1189 PolarHBondContact O-NZ 3.44Å
1093	Y	88.6	Confident	82.8	Confident	81 Å²	81	86.3 Å²	86.3	32%	0.318	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-86.1	-21.1	-175.5	-65.8	-81.3	0	0	0	115.1	E1087 D1090 R1091 P1187 I1188 K1189 L1190	E1087-Y1093 HydrophobicContact CB-CD1 4.35Å; E1087-Y1093 HydrophobicContact CB-CD2 3.9Å; E1087-Y1093 HydrophobicContact CB-CE2 4.19Å; E1087-Y1093 HydrophobicContact CB-CG 3.98Å; E1087-Y1093 HydrophobicContact CG-CD2 4.43Å; E1087-Y1093 HydrophobicContact CG-CE1 4.32Å; E1087-Y1093 HydrophobicContact CG-CE2 4.24Å; E1087-Y1093 WeakPolarHBondContact O-CB 3.34Å; D1090-Y1093 HydrophobicContact CB-CD2 3.82Å; D1090-Y1093 HydrophobicContact CB-CE2 3.92Å; D1090-Y1093 PolarHBondContact O-N 3.46Å; D1090-Y1093 VanDerWaalsContact O-N 3.16Å; R1091-Y1093 PolarHBondContact O-N 3.32Å; Y1093-P1187 WeakPolarHBondContact O-CB 3.46Å; Y1093-I1188 PolarHBondContact O-N 3.1Å; Y1093-K1189 VanDerWaalsContact O-CB 3.28Å; Y1093-K1189 WeakPolarHBondContact O-CB 3.23Å; Y1093-K1189 WeakPolarHBondContact O-CG 3.33Å; Y1093-K1189 PolarHBondContact O-N 3.23Å; Y1093-L1190 HydrophobicContact CD1-CD2 3.62Å; Y1093-L1190 HydrophobicContact CD1-CG 3.76Å; Y1093-L1190 HydrophobicContact CE1-CD2 3.7Å; Y1093-L1190 HydrophobicContact CE1-CG 4.35Å; Y1093-L1190 HydrophobicContact CG-CG 4.49Å
1094	W	92.9	Very high	85	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	-9.9	-176	47.2	-100.7	0	0	0	114.1	I1088 D1090 R1091 F1116 V1117 V1118 L1161 E1162 I1165 P1187	I1088-W1094 PolarHBondContact O-NE1 2.84Å; D1090-W1094 PolarHBondContact O-NE1 3.19Å; R1091-W1094 VanDerWaalsContact CA-CE2 3.47Å; R1091-W1094 VanDerWaalsContact CA-CZ2 3.45Å; R1091-W1094 HydrophobicContact CB-CH2 3.6Å; R1091-W1094 HydrophobicContact CB-CZ2 3.59Å; R1091-W1094 HydrophobicContact CB-CZ3 4.16Å; R1091-W1094 PolarHBondContact O-N 2.82Å; W1094-F1116 HydrophobicContact CB-CD2 4.17Å; W1094-F1116 HydrophobicContact CB-CE2 3.5Å; W1094-F1116 HydrophobicContact CB-CZ 3.87Å; W1094-F1116 AromaticContact CD1-CZ 3.98Å; W1094-F1116 HydrophobicContact CD2-CE2 4.16Å; W1094-F1116 AromaticContact CG-CE2 3.65Å; W1094-F1116 HydrophobicContact CG-CE2 3.65Å; W1094-F1116 AromaticContact CG-CZ 3.93Å; W1094-F1116 HydrophobicContact CG-CZ 3.93Å; W1094-V1117 CarbonylContact O-C 3.14Å; W1094-V1117 WeakPolarHBondContact O-CA 3.09Å; W1094-V1117 WeakPolarHBondContact O-CG2 3.17Å; W1094-V1118 HydrophobicContact CE3-CB 3.72Å; W1094-V1118 HydrophobicContact CE3-CG2 3.58Å; W1094-V1118 HydrophobicContact CZ3-CB 3.83Å; W1094-V1118 HydrophobicContact CZ3-CG1 4.39Å; W1094-V1118 HydrophobicContact CZ3-CG2 3.76Å; W1094-V1118 PolarHBondContact O-N 2.84Å; W1094-L1161 HydrophobicContact CH2-CD2 3.8Å; W1094-L1161 HydrophobicContact CH2-CG 3.8Å; W1094-L1161 HydrophobicContact CZ3-CD2 3.73Å; W1094-L1161 HydrophobicContact CZ3-CG 4.05Å; W1094-E1162 HydrophobicContact CH2-CG 4.46Å; W1094-E1162 HydrophobicContact CZ2-CG 4.13Å; W1094-I1165 HydrophobicContact CD2-CG1 4.46Å; W1094-I1165 HydrophobicContact CE3-CG1 4.42Å; W1094-I1165 HydrophobicContact CH2-CG1 3.91Å; W1094-I1165 HydrophobicContact CZ2-CB 4.26Å; W1094-I1165 HydrophobicContact CZ2-CG1 3.9Å; W1094-I1165 HydrophobicContact CZ2-CG2 4.45Å; W1094-I1165 HydrophobicContact CZ3-CG1 4.16Å; W1094-P1187 HydrophobicContact CB-CB 3.98Å
1095	F	92.6	Very high	86.5	Confident	31 Å²	31	75.5 Å²	75.5	14%	0.136	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-94.6	121.9	178.2	-164.4	-95.3	0	0	0	111.9	R1091 T1097 V1118 P1120 L1127 L1161 K1189	R1091-F1095 HydrophobicContact CB-CB 4.34Å; R1091-F1095 WeakPolarHBondContact O-CB 3.18Å; R1091-F1095 PolarHBondContact O-N 3.36Å; F1095-T1097 HydrophobicContact CD1-CG2 4.22Å; F1095-T1097 HydrophobicContact CE1-CG2 3.88Å; F1095-V1118 WeakPolarHBondContact CA-O 3.36Å; F1095-V1118 HydrophobicContact CD2-CB 3.97Å; F1095-V1118 HydrophobicContact CD2-CG1 3.85Å; F1095-V1118 HydrophobicContact CE2-CG1 3.96Å; F1095-P1120 HydrophobicContact CZ-CG 4.46Å; F1095-L1127 HydrophobicContact CE2-CD1 4.39Å; F1095-L1127 HydrophobicContact CE2-CD2 3.83Å; F1095-L1127 HydrophobicContact CZ-CD2 4.03Å; F1095-L1161 HydrophobicContact CD2-CD2 4.22Å; F1095-L1161 HydrophobicContact CE2-CD2 4.25Å; F1095-K1189 VanDerWaalsContact O-CE 3.32Å; F1095-K1189 WeakPolarHBondContact O-CE 3.35Å; F1095-K1189 PolarHBondContact O-NZ 3.15Å
1096	L	89	Confident	87.1	Confident	28 Å²	28	78.5 Å²	78.5	15%	0.147	36%	0.359	C	S	.	.			trans	-111.7	120	171.4	-65.3	-177.8	0	0	0	109.8	A1099 L1107 V1117 V1118 R1119 P1120 I1188 K1189	L1096-A1099 HydrophobicContact CB-CB 3.7Å; L1096-A1099 HydrophobicContact CD1-CB 3.81Å; L1096-A1099 HydrophobicContact CG-CB 4.41Å; L1096-L1107 HydrophobicContact CD1-CD1 3.9Å; L1096-V1117 HydrophobicContact CB-CG2 4.11Å; L1096-V1117 HydrophobicContact CD1-CG2 3.72Å; L1096-V1117 HydrophobicContact CG-CG2 3.7Å; L1096-V1118 PolarHBondContact N-O 3.39Å; L1096-R1119 WeakPolarHBondContact O-CA 3.5Å; L1096-P1120 WeakPolarHBondContact O-CD 3.39Å; L1096-I1188 HydrophobicContact CD1-CG2 4.32Å; L1096-I1188 HydrophobicContact CG-CG2 4.34Å; L1096-K1189 HydrophobicContact CD2-CD 4.34Å; L1096-K1189 HydrophobicContact CD2-CG 4.28Å
1097	T	82.6	Confident	87.7	Confident	85 Å²	85	74.1 Å²	74.1	52%	0.521	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-38.8	179.6	43.8	0	0	0	0	112.3	F1095 P1120	F1095-T1097 HydrophobicContact CD1-CG2 4.22Å; F1095-T1097 HydrophobicContact CE1-CG2 3.88Å; T1097-P1120 WeakPolarHBondContact O-CD 3.3Å; T1097-P1120 WeakPolarHBondContact O-CG 3.48Å
1098	D	79.9	Confident	88.2	Confident	150 Å²	150	70.8 Å²	70.8	80%	0.802	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	35.3	-165.9	-47.8	-53.4	0	0	0	112.9
1099	A	85.2	Confident	88.2	Confident	11 Å²	11	77.3 Å²	77.3	9%	0.091	35%	0.348	C	S	.	.			trans	-100.2	121.7	179.1	0	0	0	0	0	111.6	L1096 V1104 R1119	L1096-A1099 HydrophobicContact CB-CB 3.7Å; L1096-A1099 HydrophobicContact CD1-CB 3.81Å; L1096-A1099 HydrophobicContact CG-CB 4.41Å; A1099-V1104 HydrophobicContact CB-CG2 3.88Å; A1099-R1119 HydrophobicContact CB-CB 4.38Å; A1099-R1119 WeakPolarHBondContact O-CD 3.2Å
1100	T	88	Confident	88.2	Confident	78 Å²	78	76.4 Å²	76.4	48%	0.479	36%	0.355	S	S	.	.			trans	-74.6	168.5	170.7	69.5	0	0	0	0	111.3	E1102 K1103 V1104	T1100-E1102 VanDerWaalsContact C-N 3.3Å; T1100-E1102 WeakPolarHBondContact CB-OE2 3.41Å; T1100-E1102 PolarHBondContact O-N 2.83Å; T1100-E1102 PolarHBondContact OG1-OE2 2.88Å; T1100-K1103 PolarHBondContact O-N 3.31Å; T1100-K1103 PolarHBondContact OG1-N 2.99Å; T1100-K1103 VanDerWaalsContact OG1-N 3.17Å; T1100-V1104 WeakPolarHBondContact O-CG2 3.46Å; T1100-V1104 PolarHBondContact O-N 3.47Å
1101	R	90	Very high	88.4	Confident	129 Å²	129	78 Å²	78	49%	0.487	36%	0.357	S	S	.	.	H	α-helix	trans	-58.4	-46.7	175.6	-178.8	178.4	177.9	153.1	-1.3	110.8	K1103 V1104 E1105 R1119	R1101-K1103 VanDerWaalsContact C-N 3.32Å; R1101-K1103 PolarHBondContact O-N 2.97Å; R1101-V1104 PolarHBondContact O-N 3.48Å; R1101-E1105 IonicContact CZ-OE1 2.75Å; R1101-E1105 IonicContact NE-OE1 3.92Å; R1101-E1105 PolarHBondContact NE-OE1 3.3Å; R1101-E1105 IonicContact NH2-OE1 3.74Å; R1101-E1105 WeakPolarHBondContact O-CG 3.38Å; R1101-E1105 PolarHBondContact O-N 3.39Å; R1101-R1119 VanDerWaalsContact CB-NH2 3.33Å
1102	E	89.7	Confident	88.2	Confident	126 Å²	126	76.6 Å²	76.6	59%	0.589	36%	0.36	S	S	*	.	H	α-helix	trans	-63.5	-41.6	-177.9	-56.8	69.1	-144.8	0	0	110.1	T1100 V1104 E1105 E1106	T1100-E1102 VanDerWaalsContact C-N 3.3Å; T1100-E1102 WeakPolarHBondContact CB-OE2 3.41Å; T1100-E1102 PolarHBondContact O-N 2.83Å; T1100-E1102 PolarHBondContact OG1-OE2 2.88Å; E1102-V1104 PolarHBondContact O-N 2.89Å; E1102-E1105 PolarHBondContact O-N 2.98Å; E1102-E1106 PolarHBondContact O-N 3.32Å
1103	K	89	Confident	88.4	Confident	83 Å²	83	69.8 Å²	69.8	36%	0.361	34%	0.343	S	S	.	.	H	α-helix	trans	-65.7	-38.4	176.5	-170.1	58.3	-179.8	177.5	0	112.2	T1100 R1101 E1106 L1107	T1100-K1103 PolarHBondContact O-N 3.31Å; T1100-K1103 PolarHBondContact OG1-N 2.99Å; T1100-K1103 VanDerWaalsContact OG1-N 3.17Å; R1101-K1103 VanDerWaalsContact C-N 3.32Å; R1101-K1103 PolarHBondContact O-N 2.97Å; K1103-E1106 VanDerWaalsContact CD-OE2 3.23Å; K1103-E1106 WeakPolarHBondContact CD-OE2 3.37Å; K1103-E1106 IonicContact NZ-OE1 2.9Å; K1103-E1106 PolarHBondContact NZ-OE1 2.94Å; K1103-E1106 IonicContact NZ-OE2 2.9Å; K1103-E1106 PolarHBondContact NZ-OE2 3.48Å; K1103-E1106 WeakPolarHBondContact O-CB 3.41Å; K1103-E1106 PolarHBondContact O-N 3.46Å; K1103-L1107 HydrophobicContact CG-CD1 4.32Å; K1103-L1107 HydrophobicContact CG-CG 4.45Å; K1103-L1107 WeakPolarHBondContact O-CB 3.48Å; K1103-L1107 VanDerWaalsContact O-CG 3.25Å; K1103-L1107 WeakPolarHBondContact O-CG 3.48Å; K1103-L1107 PolarHBondContact O-N 3.26Å
1104	V	91.7	Very high	88.4	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-65	-42.2	174.5	167.7	0	0	0	0	111.8	A1099 T1100 R1101 E1102 E1106 L1107 L1108 V1117 R1119	A1099-V1104 HydrophobicContact CB-CG2 3.88Å; T1100-V1104 WeakPolarHBondContact O-CG2 3.46Å; T1100-V1104 PolarHBondContact O-N 3.47Å; R1101-V1104 PolarHBondContact O-N 3.48Å; E1102-V1104 PolarHBondContact O-N 2.89Å; V1104-E1106 VanDerWaalsContact C-N 3.3Å; V1104-E1106 PolarHBondContact O-N 3.2Å; V1104-L1107 PolarHBondContact O-N 2.97Å; V1104-L1108 HydrophobicContact CG1-CD1 3.64Å; V1104-L1108 HydrophobicContact CG1-CG 4.25Å; V1104-L1108 WeakPolarHBondContact O-CB 3.35Å; V1104-L1108 WeakPolarHBondContact O-CG 3.32Å; V1104-L1108 PolarHBondContact O-N 2.9Å; V1104-V1117 HydrophobicContact CB-CG1 4.13Å; V1104-V1117 HydrophobicContact CG1-CG1 3.29Å; V1104-V1117 HydrophobicContact CG2-CG1 3.7Å; V1104-R1119 HydrophobicContact CG2-CG 4.28Å
1105	E	92.8	Very high	88.5	Confident	59 Å²	59	65.9 Å²	65.9	28%	0.276	33%	0.328	S	S	.	.	H	α-helix	trans	-64	-36.6	177	-69.3	177.9	-172.9	0	0	111.6	R1101 E1102 R1109 V1137 H1139	R1101-E1105 IonicContact CZ-OE1 2.75Å; R1101-E1105 IonicContact NE-OE1 3.92Å; R1101-E1105 PolarHBondContact NE-OE1 3.3Å; R1101-E1105 IonicContact NH2-OE1 3.74Å; R1101-E1105 WeakPolarHBondContact O-CG 3.38Å; R1101-E1105 PolarHBondContact O-N 3.39Å; E1102-E1105 PolarHBondContact O-N 2.98Å; E1105-R1109 WeakPolarHBondContact O-CB 3.13Å; E1105-R1109 PolarHBondContact O-N 3.25Å; E1105-V1137 HydrophobicContact CG-CB 4.3Å; E1105-V1137 HydrophobicContact CG-CG1 4.13Å; E1105-H1139 VanDerWaalsContact CG-NE2 3.33Å; E1105-H1139 WeakPolarHBondContact CG-NE2 3.36Å; E1105-H1139 IonicContact OE1-CD2 3.65Å; E1105-H1139 IonicContact OE1-NE2 3.41Å; E1105-H1139 PolarHBondContact OE1-NE2 3.47Å
1106	E	88.7	Confident	88.6	Confident	105 Å²	105	64.4 Å²	64.4	49%	0.491	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-52.3	170.3	-169.8	-163.6	149.1	0	0	111.8	E1102 K1103 V1104 L1108 R1109	E1102-E1106 PolarHBondContact O-N 3.32Å; K1103-E1106 VanDerWaalsContact CD-OE2 3.23Å; K1103-E1106 WeakPolarHBondContact CD-OE2 3.37Å; K1103-E1106 IonicContact NZ-OE1 2.9Å; K1103-E1106 PolarHBondContact NZ-OE1 2.94Å; K1103-E1106 IonicContact NZ-OE2 2.9Å; K1103-E1106 PolarHBondContact NZ-OE2 3.48Å; K1103-E1106 WeakPolarHBondContact O-CB 3.41Å; K1103-E1106 PolarHBondContact O-N 3.46Å; V1104-E1106 VanDerWaalsContact C-N 3.3Å; V1104-E1106 PolarHBondContact O-N 3.2Å; E1106-L1108 VanDerWaalsContact C-N 3.3Å; E1106-L1108 PolarHBondContact O-N 2.92Å; E1106-R1109 PolarHBondContact O-N 3.48Å
1107	L	89.4	Confident	88.8	Confident	37 Å²	37	63.1 Å²	63.1	19%	0.194	31%	0.314	C	S	.	.	H	α-helix	trans	-63.8	-31.2	-177.3	-72.1	179	0	0	0	113.8	L1096 K1103 V1104 R1111 I1188 L1192	L1096-L1107 HydrophobicContact CD1-CD1 3.9Å; K1103-L1107 HydrophobicContact CG-CD1 4.32Å; K1103-L1107 HydrophobicContact CG-CG 4.45Å; K1103-L1107 WeakPolarHBondContact O-CB 3.48Å; K1103-L1107 VanDerWaalsContact O-CG 3.25Å; K1103-L1107 WeakPolarHBondContact O-CG 3.48Å; K1103-L1107 PolarHBondContact O-N 3.26Å; V1104-L1107 PolarHBondContact O-N 2.97Å; L1107-R1111 WeakPolarHBondContact O-CG 3.08Å; L1107-I1188 HydrophobicContact CB-CD1 4.43Å; L1107-L1192 HydrophobicContact CD2-CD2 3.9Å
1108	L	92.6	Very high	89.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-92.5	-11.9	-178	-72.2	178.3	0	0	0	114	V1104 E1106 D1110 R1111 T1115 V1117 R1132 V1137 I1188	V1104-L1108 HydrophobicContact CG1-CD1 3.64Å; V1104-L1108 HydrophobicContact CG1-CG 4.25Å; V1104-L1108 WeakPolarHBondContact O-CB 3.35Å; V1104-L1108 WeakPolarHBondContact O-CG 3.32Å; V1104-L1108 PolarHBondContact O-N 2.9Å; E1106-L1108 VanDerWaalsContact C-N 3.3Å; E1106-L1108 PolarHBondContact O-N 2.92Å; L1108-D1110 VanDerWaalsContact C-N 3.35Å; L1108-D1110 PolarHBondContact O-N 2.98Å; L1108-R1111 PolarHBondContact O-N 2.64Å; L1108-T1115 HydrophobicContact CD2-CG2 3.61Å; L1108-V1117 HydrophobicContact CD1-CG1 4.11Å; L1108-R1132 HydrophobicContact CB-CB 4.31Å; L1108-R1132 HydrophobicContact CD2-CB 4.38Å; L1108-R1132 VanDerWaalsContact O-CD 3.23Å; L1108-R1132 WeakPolarHBondContact O-CD 3.48Å; L1108-R1132 WeakPolarHBondContact O-CG 3.1Å; L1108-V1137 HydrophobicContact CB-CG1 4.14Å; L1108-V1137 HydrophobicContact CB-CG2 3.67Å; L1108-V1137 HydrophobicContact CD1-CG1 3.68Å; L1108-I1188 HydrophobicContact CD2-CD1 3.77Å
1109	R	86.3	Confident	90	Very high	141 Å²	141	52.5 Å²	52.5	53%	0.532	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-47.2	-170.5	-168	-179	-56.6	-104.2	-5.2	112.9	E1105 E1106 R1132	E1105-R1109 WeakPolarHBondContact O-CB 3.13Å; E1105-R1109 PolarHBondContact O-N 3.25Å; E1106-R1109 PolarHBondContact O-N 3.48Å; R1109-R1132 VanDerWaalsContact O-CZ 3.25Å; R1109-R1132 PolarHBondContact O-NE 3.44Å; R1109-R1132 PolarHBondContact O-NH2 3.11Å
1110	D	84	Confident	90.1	Very high	137 Å²	137	54.4 Å²	54.4	73%	0.733	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	23.9	-172.6	-55.8	-42	0	0	0	112.4	L1108	L1108-D1110 VanDerWaalsContact C-N 3.35Å; L1108-D1110 PolarHBondContact O-N 2.98Å
1111	R	87.7	Confident	90	Very high	83 Å²	83	51.6 Å²	51.6	31%	0.313	25%	0.248	S	C	.	.	S	Bend	trans	-105.8	157	-179.6	-61.2	-56	-174.4	-146.1	11.2	111.5	L1107 L1108 T1115 R1132 Q1191	L1107-R1111 WeakPolarHBondContact O-CG 3.08Å; L1108-R1111 PolarHBondContact O-N 2.64Å; R1111-T1115 HydrophobicContact CB-CG2 4.05Å; R1111-T1115 HydrophobicContact CG-CG2 4.49Å; R1111-R1132 WeakPolarHBondContact O-CG 2.97Å; R1111-Q1191 PolarHBondContact NE-O 2.68Å; R1111-Q1191 PolarHBondContact NH2-O 2.93Å
1112	P	87.3	Confident	89.3	Confident	60 Å²	60	50.3 Å²	50.3	39%	0.39	27%	0.265	S	S	.	.			trans	-62.1	153.4	-179.9	21.7	-30.9	0	0	0	112.6	G1114 T1115 Y1186	P1112-G1114 PolarHBondContact O-N 3.01Å; P1112-T1115 WeakPolarHBondContact CG-OG1 3.41Å; P1112-T1115 WeakPolarHBondContact O-CB 3.44Å; P1112-T1115 PolarHBondContact O-N 2.88Å; P1112-T1115 VanDerWaalsContact O-N 3.13Å; P1112-T1115 PolarHBondContact O-OG1 3.18Å; P1112-Y1186 HydrophobicContact CB-CD2 4.39Å; P1112-Y1186 HydrophobicContact CB-CE2 4.18Å; P1112-Y1186 HydrophobicContact CG-CD2 4.02Å; P1112-Y1186 HydrophobicContact CG-CE2 4.18Å
1113	A	87.8	Confident	88.3	Confident	41 Å²	41	49.2 Å²	49.2	34%	0.339	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	128.2	176.5	0	0	0	0	0	110.3	R1132 I1182	A1113-R1132 CarbonylContact C-O 3.58Å; A1113-R1132 WeakPolarHBondContact CA-O 3.28Å; A1113-I1182 VanDerWaalsContact C-CD1 3.46Å; A1113-I1182 HydrophobicContact CB-CD1 3.76Å
1114	G	90.1	Very high	86.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	102.6	-5.1	-174.3	0	0	0	0	0	113.3	P1112 R1132 K1185 Y1186	P1112-G1114 PolarHBondContact O-N 3.01Å; G1114-R1132 PolarHBondContact N-O 3.46Å; G1114-K1185 PolarHBondContact O-N 3.44Å; G1114-Y1186 PolarHBondContact O-N 3.03Å; G1114-Y1186 VanDerWaalsContact O-N 3.17Å
1115	T	93.7	Very high	86	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	131.7	168.1	-53.5	0	0	0	0	110.1	L1108 R1111 P1112 R1132 Y1186 I1188 Q1191	L1108-T1115 HydrophobicContact CD2-CG2 3.61Å; R1111-T1115 HydrophobicContact CB-CG2 4.05Å; R1111-T1115 HydrophobicContact CG-CG2 4.49Å; P1112-T1115 WeakPolarHBondContact CG-OG1 3.41Å; P1112-T1115 WeakPolarHBondContact O-CB 3.44Å; P1112-T1115 PolarHBondContact O-N 2.88Å; P1112-T1115 VanDerWaalsContact O-N 3.13Å; P1112-T1115 PolarHBondContact O-OG1 3.18Å; T1115-R1132 PolarHBondContact O-N 3.46Å; T1115-Y1186 CarbonylContact C-O 3.56Å; T1115-Y1186 VanDerWaalsContact CA-O 3.26Å; T1115-Y1186 WeakPolarHBondContact CA-O 3.36Å; T1115-I1188 HydrophobicContact CG2-CD1 3.87Å; T1115-Q1191 HydrophobicContact CG2-CG 4.28Å
1116	F	94.8	Very high	85.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	157.2	-172.4	75.9	-81.3	0	0	0	113.1	I1088 W1094 L1129 G1130 I1131 I1165 L1184 Y1186 P1187 I1188	I1088-F1116 HydrophobicContact CD1-CE1 4.13Å; I1088-F1116 HydrophobicContact CD1-CZ 4.27Å; W1094-F1116 HydrophobicContact CB-CD2 4.17Å; W1094-F1116 HydrophobicContact CB-CE2 3.5Å; W1094-F1116 HydrophobicContact CB-CZ 3.87Å; W1094-F1116 AromaticContact CD1-CZ 3.98Å; W1094-F1116 HydrophobicContact CD2-CE2 4.16Å; W1094-F1116 AromaticContact CG-CE2 3.65Å; W1094-F1116 HydrophobicContact CG-CE2 3.65Å; W1094-F1116 AromaticContact CG-CZ 3.93Å; W1094-F1116 HydrophobicContact CG-CZ 3.93Å; F1116-L1129 HydrophobicContact CB-CD1 4.13Å; F1116-L1129 HydrophobicContact CD2-CD1 3.87Å; F1116-L1129 HydrophobicContact CG-CD1 4.42Å; F1116-G1130 CarbonylContact C-O 3.54Å; F1116-G1130 VanDerWaalsContact CA-O 3.25Å; F1116-G1130 WeakPolarHBondContact CA-O 3.47Å; F1116-I1131 HydrophobicContact CB-CB 4.32Å; F1116-I1131 HydrophobicContact CB-CD1 4.38Å; F1116-I1131 HydrophobicContact CB-CG1 4.32Å; F1116-I1165 HydrophobicContact CE2-CD1 4.15Å; F1116-I1165 HydrophobicContact CE2-CG2 3.68Å; F1116-I1165 HydrophobicContact CZ-CG2 3.67Å; F1116-L1184 HydrophobicContact CB-CD2 4.09Å; F1116-L1184 HydrophobicContact CD1-CB 3.73Å; F1116-L1184 HydrophobicContact CD1-CD2 4.46Å; F1116-L1184 HydrophobicContact CD2-CB 4.35Å; F1116-L1184 HydrophobicContact CD2-CD1 4.33Å; F1116-L1184 HydrophobicContact CD2-CD2 4.32Å; F1116-L1184 HydrophobicContact CE1-CB 3.72Å; F1116-L1184 HydrophobicContact CE2-CB 4.33Å; F1116-L1184 HydrophobicContact CE2-CD1 4.32Å; F1116-L1184 HydrophobicContact CG-CB 4.06Å; F1116-L1184 HydrophobicContact CG-CD2 4.04Å; F1116-L1184 HydrophobicContact CG-CG 4.49Å; F1116-L1184 HydrophobicContact CZ-CB 4.03Å; F1116-Y1186 VanDerWaalsContact CD1-O 3.29Å; F1116-Y1186 WeakPolarHBondContact CD1-O 3.28Å; F1116-Y1186 PolarHBondContact N-O 2.84Å; F1116-P1187 HydrophobicContact CE1-CG 4.21Å; F1116-P1187 HydrophobicContact CZ-CG 4.29Å; F1116-I1188 PolarHBondContact O-N 3.36Å; F1116-I1188 VanDerWaalsContact O-N 3.09Å
1117	V	94	Very high	85.7	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.006	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	140.4	176.1	62.4	0	0	0	0	110	W1094 L1096 V1104 L1108 L1129 G1130 I1188	W1094-V1117 CarbonylContact O-C 3.14Å; W1094-V1117 WeakPolarHBondContact O-CA 3.09Å; W1094-V1117 WeakPolarHBondContact O-CG2 3.17Å; L1096-V1117 HydrophobicContact CB-CG2 4.11Å; L1096-V1117 HydrophobicContact CD1-CG2 3.72Å; L1096-V1117 HydrophobicContact CG-CG2 3.7Å; V1104-V1117 HydrophobicContact CB-CG1 4.13Å; V1104-V1117 HydrophobicContact CG1-CG1 3.29Å; V1104-V1117 HydrophobicContact CG2-CG1 3.7Å; L1108-V1117 HydrophobicContact CD1-CG1 4.11Å; V1117-L1129 CarbonylContact O-C 3.59Å; V1117-L1129 WeakPolarHBondContact O-CA 3.43Å; V1117-G1130 PolarHBondContact N-O 3.07Å; V1117-G1130 PolarHBondContact O-N 2.77Å; V1117-I1188 HydrophobicContact CB-CB 4.06Å; V1117-I1188 HydrophobicContact CB-CG2 3.72Å; V1117-I1188 HydrophobicContact CG2-CB 4.48Å; V1117-I1188 HydrophobicContact CG2-CG2 3.63Å
1118	V	94.6	Very high	85.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	132.2	169.1	-176.5	0	0	0	0	108.6	W1094 F1095 L1096 L1127 A1128 L1129 I1142 L1161 I1165	W1094-V1118 HydrophobicContact CE3-CB 3.72Å; W1094-V1118 HydrophobicContact CE3-CG2 3.58Å; W1094-V1118 HydrophobicContact CZ3-CB 3.83Å; W1094-V1118 HydrophobicContact CZ3-CG1 4.39Å; W1094-V1118 HydrophobicContact CZ3-CG2 3.76Å; W1094-V1118 PolarHBondContact O-N 2.84Å; F1095-V1118 WeakPolarHBondContact CA-O 3.36Å; F1095-V1118 HydrophobicContact CD2-CB 3.97Å; F1095-V1118 HydrophobicContact CD2-CG1 3.85Å; F1095-V1118 HydrophobicContact CE2-CG1 3.96Å; L1096-V1118 PolarHBondContact N-O 3.39Å; V1118-L1127 HydrophobicContact CG1-CB 4.4Å; V1118-A1128 WeakPolarHBondContact CA-O 3.27Å; V1118-L1129 HydrophobicContact CG2-CD1 3.9Å; V1118-I1142 HydrophobicContact CG1-CD1 4.01Å; V1118-I1142 HydrophobicContact CG2-CD1 4.32Å; V1118-L1161 HydrophobicContact CG1-CD2 4.21Å; V1118-I1165 HydrophobicContact CG2-CD1 3.78Å
1119	R	92.2	Very high	85.8	Confident	12 Å²	12	51.7 Å²	51.7	5%	0.045	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	160.4	179.8	57.5	161.5	177.1	88.2	1.5	111.6	L1096 A1099 R1101 V1104 L1127 A1128 H1139	L1096-R1119 WeakPolarHBondContact O-CA 3.5Å; A1099-R1119 HydrophobicContact CB-CB 4.38Å; A1099-R1119 WeakPolarHBondContact O-CD 3.2Å; R1101-R1119 VanDerWaalsContact CB-NH2 3.33Å; V1104-R1119 HydrophobicContact CG2-CG 4.28Å; R1119-L1127 CarbonylContact O-C 3.36Å; R1119-A1128 HydrophobicContact CG-CB 4.38Å; R1119-A1128 PolarHBondContact N-O 3.23Å; R1119-A1128 PolarHBondContact O-N 3.18Å; R1119-H1139 PolarHBondContact NH2-ND1 3.29Å
1120	P	88.2	Confident	86.2	Confident	51 Å²	51	45 Å²	45	33%	0.331	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	141.9	161.7	-25.4	36.8	0	0	0	111.9	F1095 L1096 T1097	F1095-P1120 HydrophobicContact CZ-CG 4.46Å; L1096-P1120 WeakPolarHBondContact O-CD 3.39Å; T1097-P1120 WeakPolarHBondContact O-CD 3.3Å; T1097-P1120 WeakPolarHBondContact O-CG 3.48Å
1121	S	85.5	Confident	86.6	Confident	19 Å²	19	38.4 Å²	38.4	13%	0.133	24%	0.241	C	C	.	.			trans	-76.9	147.6	170.7	-175	0	0	0	0	109.6	T1123 G1124 K1126	S1121-T1123 PolarHBondContact O-N 2.89Å; S1121-T1123 VanDerWaalsContact O-N 3.15Å; S1121-T1123 PolarHBondContact OG-N 2.86Å; S1121-T1123 PolarHBondContact OG-OG1 2.88Å; S1121-G1124 PolarHBondContact O-N 2.76Å; S1121-K1126 WeakPolarHBondContact CA-O 3.36Å; S1121-K1126 WeakPolarHBondContact CB-O 3.19Å; S1121-K1126 PolarHBondContact N-O 2.95Å
1122	A	75.7	Confident	86.8	Confident	102 Å²	102	36.7 Å²	36.7	84%	0.843	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.9	172.9	0	0	0	0	0	112.6	G1124	A1122-G1124 PolarHBondContact O-N 3.19Å
1123	T	69.2	Low	86.9	Confident	102 Å²	102	34.5 Å²	34.5	63%	0.626	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	29.1	-179.7	58.6	0	0	0	0	113.8	S1121 D1125	S1121-T1123 PolarHBondContact O-N 2.89Å; S1121-T1123 VanDerWaalsContact O-N 3.15Å; S1121-T1123 PolarHBondContact OG-N 2.86Å; S1121-T1123 PolarHBondContact OG-OG1 2.88Å; T1123-D1125 PolarHBondContact O-N 2.48Å
1124	G	58.3	Low	86.4	Confident	63 Å²	63	36.6 Å²	36.6	65%	0.649	24%	0.237	S	C	*	.	S	Bend	trans	82.2	-57.9	167.2	0	0	0	0	0	116.6	S1121 A1122	S1121-G1124 PolarHBondContact O-N 2.76Å; A1122-G1124 PolarHBondContact O-N 3.19Å
1125	D	72.5	Confident	86	Confident	162 Å²	162	42.5 Å²	42.5	87%	0.866	27%	0.273	S	S	*	.	S	Bend	trans	-120	5.5	-163.7	-73	-18	0	0	0	115.3	T1123	T1123-D1125 PolarHBondContact O-N 2.48Å
1126	K	83.7	Confident	85.6	Confident	76 Å²	76	44.7 Å²	44.7	33%	0.33	29%	0.289	S	S	.	.			trans	-115.4	155	-176.7	-62	-173.7	-178.8	-174.1	0	110.8	S1121 L1141 E1153	S1121-K1126 WeakPolarHBondContact CA-O 3.36Å; S1121-K1126 WeakPolarHBondContact CB-O 3.19Å; S1121-K1126 PolarHBondContact N-O 2.95Å; K1126-L1141 HydrophobicContact CB-CD2 4.19Å; K1126-E1153 IonicContact NZ-OE2 2.99Å
1127	L	91.4	Very high	85.4	Confident	32 Å²	32	45.9 Å²	45.9	17%	0.168	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	156.6	168.4	-67.1	177.4	0	0	0	109.4	F1095 V1118 R1119 I1142 Y1149 L1161	F1095-L1127 HydrophobicContact CE2-CD1 4.39Å; F1095-L1127 HydrophobicContact CE2-CD2 3.83Å; F1095-L1127 HydrophobicContact CZ-CD2 4.03Å; V1118-L1127 HydrophobicContact CG1-CB 4.4Å; R1119-L1127 CarbonylContact O-C 3.36Å; L1127-I1142 HydrophobicContact CB-CB 3.98Å; L1127-I1142 PolarHBondContact N-O 2.99Å; L1127-I1142 PolarHBondContact O-N 3.5Å; L1127-Y1149 HydrophobicContact CD1-CE1 4.22Å; L1127-L1161 HydrophobicContact CD1-CD1 4.11Å; L1127-L1161 HydrophobicContact CD1-CD2 3.69Å
1128	A	92	Very high	85.2	Confident	3 Å²	3	47.6 Å²	47.6	3%	0.025	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	129.2	175.3	0	0	0	0	0	110.2	V1118 R1119 C1140	V1118-A1128 WeakPolarHBondContact CA-O 3.27Å; R1119-A1128 HydrophobicContact CG-CB 4.38Å; R1119-A1128 PolarHBondContact N-O 3.23Å; R1119-A1128 PolarHBondContact O-N 3.18Å; A1128-C1140 CarbonylContact C-O 3.57Å; A1128-C1140 WeakPolarHBondContact CA-O 3.25Å
1129	L	93.7	Very high	85	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	120.6	168.7	174.6	70.6	0	0	0	108.9	F1116 V1117 V1118 H1139 C1140 I1142 F1151 L1173 L1184	F1116-L1129 HydrophobicContact CB-CD1 4.13Å; F1116-L1129 HydrophobicContact CD2-CD1 3.87Å; F1116-L1129 HydrophobicContact CG-CD1 4.42Å; V1117-L1129 CarbonylContact O-C 3.59Å; V1117-L1129 WeakPolarHBondContact O-CA 3.43Å; V1118-L1129 HydrophobicContact CG2-CD1 3.9Å; L1129-H1139 CarbonylContact O-C 3.57Å; L1129-H1139 WeakPolarHBondContact O-CA 3.34Å; L1129-C1140 HydrophobicContact CB-CB 4.32Å; L1129-C1140 PolarHBondContact N-O 3.34Å; L1129-C1140 PolarHBondContact O-N 2.95Å; L1129-I1142 HydrophobicContact CB-CD1 4.09Å; L1129-I1142 HydrophobicContact CB-CG1 4.28Å; L1129-F1151 HydrophobicContact CB-CE1 4.12Å; L1129-F1151 HydrophobicContact CD2-CE1 3.68Å; L1129-F1151 HydrophobicContact CD2-CZ 3.68Å; L1129-L1173 HydrophobicContact CD2-CD1 3.92Å; L1129-L1184 HydrophobicContact CD1-CD2 4.11Å; L1129-L1184 HydrophobicContact CD2-CD2 3.9Å
1130	G	93	Very high	84.9	Confident	0 Å²	0	50 Å²	50	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	132.5	162.5	0	0	0	0	0	110.4	F1116 V1117 Q1138	F1116-G1130 CarbonylContact C-O 3.54Å; F1116-G1130 VanDerWaalsContact CA-O 3.25Å; F1116-G1130 WeakPolarHBondContact CA-O 3.47Å; V1117-G1130 PolarHBondContact N-O 3.07Å; V1117-G1130 PolarHBondContact O-N 2.77Å; G1130-Q1138 CarbonylContact C-O 3.49Å; G1130-Q1138 WeakPolarHBondContact CA-O 3.38Å
1131	I	94.1	Very high	85	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.8	178.5	-176.7	155.2	0	0	0	111.6	F1116 V1137 Q1138 L1180 I1182 L1184	F1116-I1131 HydrophobicContact CB-CB 4.32Å; F1116-I1131 HydrophobicContact CB-CD1 4.38Å; F1116-I1131 HydrophobicContact CB-CG1 4.32Å; I1131-V1137 WeakPolarHBondContact O-CA 3.38Å; I1131-Q1138 HydrophobicContact CG2-CB 4.44Å; I1131-Q1138 PolarHBondContact N-O 3.16Å; I1131-Q1138 PolarHBondContact O-N 3.44Å; I1131-L1180 HydrophobicContact CG2-CD2 3.87Å; I1131-I1182 HydrophobicContact CD1-CG2 3.49Å; I1131-I1182 VanDerWaalsContact CD1-CG2 3.49Å; I1131-I1182 HydrophobicContact CG1-CG2 4.13Å; I1131-L1184 HydrophobicContact CD1-CD2 3.56Å
1132	R	91.8	Very high	85.3	Confident	46 Å²	46	50.4 Å²	50.4	17%	0.174	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	115.8	173.8	-177.7	55.3	-179.3	174.1	9.9	110.6	L1108 R1109 R1111 A1113 G1114 T1115	L1108-R1132 HydrophobicContact CB-CB 4.31Å; L1108-R1132 HydrophobicContact CD2-CB 4.38Å; L1108-R1132 VanDerWaalsContact O-CD 3.23Å; L1108-R1132 WeakPolarHBondContact O-CD 3.48Å; L1108-R1132 WeakPolarHBondContact O-CG 3.1Å; R1109-R1132 VanDerWaalsContact O-CZ 3.25Å; R1109-R1132 PolarHBondContact O-NE 3.44Å; R1109-R1132 PolarHBondContact O-NH2 3.11Å; R1111-R1132 WeakPolarHBondContact O-CG 2.97Å; A1113-R1132 CarbonylContact C-O 3.58Å; A1113-R1132 WeakPolarHBondContact CA-O 3.28Å; G1114-R1132 PolarHBondContact N-O 3.46Å; T1115-R1132 PolarHBondContact O-N 3.46Å
1133	L	87.7	Confident	85.9	Confident	14 Å²	14	46.7 Å²	46.7	7%	0.073	28%	0.28	C	S	.	.			trans	-88.9	172.1	164.9	-59.5	172.2	0	0	0	109.9	T1135 S1136 Q1138 L1179 L1180 I1182	L1133-T1135 PolarHBondContact O-N 3.21Å; L1133-S1136 WeakPolarHBondContact CA-O 3.43Å; L1133-S1136 VanDerWaalsContact CB-O 3.31Å; L1133-S1136 WeakPolarHBondContact CB-O 3.48Å; L1133-S1136 PolarHBondContact N-O 3.24Å; L1133-Q1138 HydrophobicContact CD1-CB 4.25Å; L1133-Q1138 VanDerWaalsContact CD1-CD 3.44Å; L1133-Q1138 HydrophobicContact CD1-CG 3.62Å; L1133-L1179 WeakPolarHBondContact CD1-O 3.37Å; L1133-L1179 WeakPolarHBondContact CD2-O 3.14Å; L1133-L1180 HydrophobicContact CD1-CD2 4.31Å; L1133-L1180 HydrophobicContact CD2-CD2 4.24Å; L1133-I1182 HydrophobicContact CD2-CB 4.23Å; L1133-I1182 HydrophobicContact CD2-CG2 3.56Å
1134	A	79.2	Confident	86.6	Confident	86 Å²	86	45 Å²	45	71%	0.711	27%	0.272	S	S	*	.	S	Bend	trans	-57	-33.2	176.9	0	0	0	0	0	113.1
1135	T	80.7	Confident	87.7	Confident	124 Å²	124	44.5 Å²	44.5	76%	0.761	26%	0.256	S	S	*	.	S	Bend	trans	-110.1	-25.4	-173.2	55.9	0	0	0	0	114.2	L1133	L1133-T1135 PolarHBondContact O-N 3.21Å
1136	S	85.9	Confident	88	Confident	46 Å²	46	43.4 Å²	43.4	32%	0.322	25%	0.25	S	C	.	.			trans	-156.9	168.8	-172.5	62.8	0	0	0	0	112.7	L1133	L1133-S1136 WeakPolarHBondContact CA-O 3.43Å; L1133-S1136 VanDerWaalsContact CB-O 3.31Å; L1133-S1136 WeakPolarHBondContact CB-O 3.48Å; L1133-S1136 PolarHBondContact N-O 3.24Å
1137	V	89.8	Confident	87.8	Confident	24 Å²	24	42 Å²	42	15%	0.145	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.6	169.3	-179.6	0	0	0	0	108.2	E1105 L1108 I1131	E1105-V1137 HydrophobicContact CG-CB 4.3Å; E1105-V1137 HydrophobicContact CG-CG1 4.13Å; L1108-V1137 HydrophobicContact CB-CG1 4.14Å; L1108-V1137 HydrophobicContact CB-CG2 3.67Å; L1108-V1137 HydrophobicContact CD1-CG1 3.68Å; I1131-V1137 WeakPolarHBondContact O-CA 3.38Å
1138	Q	89.8	Confident	87.5	Confident	38 Å²	38	44.7 Å²	44.7	18%	0.178	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	153.5	176.6	-75.9	-162.3	7	0	0	111.9	G1130 I1131 L1133 L1180	G1130-Q1138 CarbonylContact C-O 3.49Å; G1130-Q1138 WeakPolarHBondContact CA-O 3.38Å; I1131-Q1138 HydrophobicContact CG2-CB 4.44Å; I1131-Q1138 PolarHBondContact N-O 3.16Å; I1131-Q1138 PolarHBondContact O-N 3.44Å; L1133-Q1138 HydrophobicContact CD1-CB 4.25Å; L1133-Q1138 VanDerWaalsContact CD1-CD 3.44Å; L1133-Q1138 HydrophobicContact CD1-CG 3.62Å; Q1138-L1180 HydrophobicContact CB-CD2 3.99Å
1139	H	90.2	Very high	87.3	Confident	40 Å²	40	47 Å²	47	19%	0.185	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.4	179.2	-63.2	-84.5	0	0	0	111.2	E1105 R1119 L1129	E1105-H1139 VanDerWaalsContact CG-NE2 3.33Å; E1105-H1139 WeakPolarHBondContact CG-NE2 3.36Å; E1105-H1139 IonicContact OE1-CD2 3.65Å; E1105-H1139 IonicContact OE1-NE2 3.41Å; E1105-H1139 PolarHBondContact OE1-NE2 3.47Å; R1119-H1139 PolarHBondContact NH2-ND1 3.29Å; L1129-H1139 CarbonylContact O-C 3.57Å; L1129-H1139 WeakPolarHBondContact O-CA 3.34Å
1140	C	89.7	Confident	87.1	Confident	21 Å²	21	47 Å²	47	14%	0.142	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.2	175.4	-58.5	0	0	0	0	109.7	A1128 L1129 F1151 L1180	A1128-C1140 CarbonylContact C-O 3.57Å; A1128-C1140 WeakPolarHBondContact CA-O 3.25Å; L1129-C1140 HydrophobicContact CB-CB 4.32Å; L1129-C1140 PolarHBondContact N-O 3.34Å; L1129-C1140 PolarHBondContact O-N 2.95Å; C1140-F1151 HydrophobicContact CB-CD1 3.75Å; C1140-F1151 HydrophobicContact CB-CE1 3.88Å; C1140-L1180 WeakPolarHBondContact SG-CD1 3.26Å
1141	L	90.4	Very high	86.9	Confident	78 Å²	78	48 Å²	48	41%	0.408	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	131.8	172.9	-75.8	163.8	0	0	0	109.8	K1126	K1126-L1141 HydrophobicContact CB-CD2 4.19Å
1142	I	91.7	Very high	86.4	Confident	2 Å²	2	51 Å²	51	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.2	169.9	-56.4	175.5	0	0	0	106.9	V1118 L1127 L1129 Y1149 F1151 L1161 L1164	V1118-I1142 HydrophobicContact CG1-CD1 4.01Å; V1118-I1142 HydrophobicContact CG2-CD1 4.32Å; L1127-I1142 HydrophobicContact CB-CB 3.98Å; L1127-I1142 PolarHBondContact N-O 2.99Å; L1127-I1142 PolarHBondContact O-N 3.5Å; L1129-I1142 HydrophobicContact CB-CD1 4.09Å; L1129-I1142 HydrophobicContact CB-CG1 4.28Å; I1142-Y1149 HydrophobicContact CG2-CD1 4.11Å; I1142-F1151 HydrophobicContact CD1-CE1 4.36Å; I1142-F1151 HydrophobicContact CG1-CD1 4.07Å; I1142-F1151 HydrophobicContact CG1-CE1 3.71Å; I1142-L1161 HydrophobicContact CD1-CD1 3.81Å; I1142-L1161 HydrophobicContact CG2-CD1 4.1Å; I1142-L1164 HydrophobicContact CD1-CD2 4.49Å; I1142-L1164 HydrophobicContact CG2-CD1 4.32Å
1143	H	88.5	Confident	85.7	Confident	24 Å²	24	53.8 Å²	53.8	11%	0.111	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	133.3	175	-62.2	-107.9	0	0	0	109	V1145 Y1149 G1150 E1153 C1156	H1143-V1145 HydrophobicContact CB-CG2 4.4Å; H1143-Y1149 WeakPolarHBondContact O-CA 3.35Å; H1143-G1150 PolarHBondContact N-O 2.98Å; H1143-G1150 PolarHBondContact O-N 2.93Å; H1143-E1153 IonicContact CE1-OE2 3.31Å; H1143-E1153 PolarHBondContact CE1-OE2 3.31Å; H1143-E1153 IonicContact ND1-OE2 3.64Å; H1143-E1153 PolarHBondContact ND1-OE2 3.03Å; H1143-C1156 PolarHBondContact O-SG 3.27Å
1144	C	85	Confident	85.1	Confident	67 Å²	67	60.6 Å²	60.6	45%	0.453	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	108.1	166.5	-175.2	0	0	0	0	107.7	K1148 Y1149	C1144-K1148 CarbonylContact C-O 3.5Å; C1144-K1148 WeakPolarHBondContact CA-O 3.47Å; C1144-Y1149 HydrophobicContact CB-CD1 4.08Å; C1144-Y1149 HydrophobicContact CB-CE1 3.9Å
1145	V	81.7	Confident	85.1	Confident	52 Å²	52	58.9 Å²	58.9	32%	0.315	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	118.2	179	-176.5	0	0	0	0	107.4	H1143 G1147 K1148 E1153 C1156	H1143-V1145 HydrophobicContact CB-CG2 4.4Å; V1145-G1147 VanDerWaalsContact C-N 3.31Å; V1145-G1147 PolarHBondContact O-N 3.15Å; V1145-K1148 PolarHBondContact N-O 2.85Å; V1145-K1148 PolarHBondContact O-N 3.31Å; V1145-K1148 VanDerWaalsContact O-N 3.13Å; V1145-E1153 HydrophobicContact CG2-CG 3.93Å; V1145-C1156 HydrophobicContact CB-CB 4.48Å
1146	N	77.5	Confident	85.1	Confident	138 Å²	138	53.9 Å²	53.9	74%	0.738	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	38.5	-177.7	-57.2	-29.3	0	0	0	114.3	K1148	N1146-K1148 PolarHBondContact O-N 3.24Å
1147	G	79.9	Confident	85	Confident	46 Å²	46	56 Å²	56	47%	0.474	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	-0.5	-179.4	0	0	0	0	0	114.7	V1145	V1145-G1147 VanDerWaalsContact C-N 3.31Å; V1145-G1147 PolarHBondContact O-N 3.15Å
1148	K	85.6	Confident	84.9	Confident	90 Å²	90	56.3 Å²	56.3	39%	0.391	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	144.8	173.7	-64.3	-168.2	177.5	-165.4	0	111.4	C1144 V1145 N1146 C1156 Y1158	C1144-K1148 CarbonylContact C-O 3.5Å; C1144-K1148 WeakPolarHBondContact CA-O 3.47Å; V1145-K1148 PolarHBondContact N-O 2.85Å; V1145-K1148 PolarHBondContact O-N 3.31Å; V1145-K1148 VanDerWaalsContact O-N 3.13Å; N1146-K1148 PolarHBondContact O-N 3.24Å; K1148-C1156 HydrophobicContact CB-CB 3.9Å; K1148-C1156 WeakPolarHBondContact CB-O 3.47Å; K1148-C1156 WeakPolarHBondContact O-CB 3.48Å; K1148-Y1158 CarbonylContact C-O 3.6Å; K1148-Y1158 WeakPolarHBondContact CA-O 3.39Å; K1148-Y1158 WeakPolarHBondContact CB-O 3.33Å
1149	Y	88.4	Confident	84.6	Confident	52 Å²	52	61.7 Å²	61.7	20%	0.204	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	148.1	-176.2	-61.4	-95.5	0	0	0	111.3	L1127 I1142 H1143 C1144 T1157 Y1158 L1161	L1127-Y1149 HydrophobicContact CD1-CE1 4.22Å; I1142-Y1149 HydrophobicContact CG2-CD1 4.11Å; H1143-Y1149 WeakPolarHBondContact O-CA 3.35Å; C1144-Y1149 HydrophobicContact CB-CD1 4.08Å; C1144-Y1149 HydrophobicContact CB-CE1 3.9Å; Y1149-T1157 PolarHBondContact O-N 3.45Å; Y1149-Y1158 PolarHBondContact N-O 3.09Å; Y1149-Y1158 WeakPolarHBondContact O-CD2 3.45Å; Y1149-Y1158 PolarHBondContact O-N 3.27Å; Y1149-L1161 HydrophobicContact CD1-CB 4.08Å; Y1149-L1161 HydrophobicContact CD1-CD1 3.94Å; Y1149-L1161 HydrophobicContact CD2-CB 4.43Å; Y1149-L1161 HydrophobicContact CE1-CB 4.04Å; Y1149-L1161 HydrophobicContact CE1-CD1 4.4Å; Y1149-L1161 HydrophobicContact CE2-CB 4.41Å; Y1149-L1161 HydrophobicContact CG-CB 4.28Å; Y1149-L1161 HydrophobicContact CG-CD1 4.47Å
1150	G	89.6	Confident	84.4	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	163.9	176.1	0	0	0	0	0	112.9	H1143 V1152	H1143-G1150 PolarHBondContact N-O 2.98Å; H1143-G1150 PolarHBondContact O-N 2.93Å; G1150-V1152 VanDerWaalsContact C-N 3.33Å
1151	F	88.4	Confident	84.4	Confident	19 Å²	19	60.1 Å²	60.1	8%	0.083	33%	0.331	C	S	.	.	S	Bend	trans	-84.5	-5	177.7	-62.8	-72.7	0	0	0	114.2	L1129 C1140 I1142 L1164 Y1168 L1173 Y1176	L1129-F1151 HydrophobicContact CB-CE1 4.12Å; L1129-F1151 HydrophobicContact CD2-CE1 3.68Å; L1129-F1151 HydrophobicContact CD2-CZ 3.68Å; C1140-F1151 HydrophobicContact CB-CD1 3.75Å; C1140-F1151 HydrophobicContact CB-CE1 3.88Å; I1142-F1151 HydrophobicContact CD1-CE1 4.36Å; I1142-F1151 HydrophobicContact CG1-CD1 4.07Å; I1142-F1151 HydrophobicContact CG1-CE1 3.71Å; F1151-L1164 HydrophobicContact CE2-CD1 4.4Å; F1151-L1164 HydrophobicContact CE2-CD2 3.95Å; F1151-L1164 HydrophobicContact CE2-CG 4.38Å; F1151-L1164 HydrophobicContact CZ-CD2 3.76Å; F1151-Y1168 HydrophobicContact CD2-CE2 4.02Å; F1151-Y1168 AromaticContact CE2-CD2 3.61Å; F1151-Y1168 HydrophobicContact CE2-CD2 3.61Å; F1151-Y1168 AromaticContact CE2-CE2 3.53Å; F1151-Y1168 HydrophobicContact CE2-CE2 3.53Å; F1151-Y1168 HydrophobicContact CE2-CG 4.3Å; F1151-Y1168 HydrophobicContact CZ-CD2 4.41Å; F1151-L1173 HydrophobicContact CD2-CD2 3.88Å; F1151-L1173 HydrophobicContact CE2-CD2 3.24Å; F1151-L1173 HydrophobicContact CZ-CD2 3.66Å; F1151-Y1176 HydrophobicContact CB-CD1 4.08Å; F1151-Y1176 HydrophobicContact CB-CD2 4.23Å; F1151-Y1176 HydrophobicContact CB-CE1 4.03Å; F1151-Y1176 HydrophobicContact CB-CE2 4.18Å; F1151-Y1176 HydrophobicContact CB-CG 4.17Å; F1151-Y1176 AromaticContact CD2-CD2 3.88Å; F1151-Y1176 HydrophobicContact CD2-CD2 3.88Å; F1151-Y1176 AromaticContact CD2-CE2 3.47Å; F1151-Y1176 HydrophobicContact CD2-CE2 3.47Å; F1151-Y1176 VanDerWaalsContact CD2-CE2 3.47Å; F1151-Y1176 AromaticContact CD2-CZ 3.93Å; F1151-Y1176 HydrophobicContact CE2-CE2 4.31Å; F1151-Y1176 HydrophobicContact CG-CD2 4.33Å; F1151-Y1176 HydrophobicContact CG-CE2 4.22Å
1152	V	84.1	Confident	84.5	Confident	64 Å²	64	58.4 Å²	58.4	39%	0.388	32%	0.321	S	S	.	.	S	Bend	trans	-135.4	128	179.5	177.8	0	0	0	0	108.4	G1150 N1154 S1155 Y1176	G1150-V1152 VanDerWaalsContact C-N 3.33Å; V1152-N1154 VanDerWaalsContact C-N 3.25Å; V1152-N1154 PolarHBondContact O-N 3.48Å; V1152-S1155 WeakPolarHBondContact CB-OG 3.23Å; V1152-S1155 CarbonylContact O-C 3.53Å; V1152-S1155 PolarHBondContact O-N 3.23Å; V1152-Y1176 HydrophobicContact CG2-CD1 3.71Å; V1152-Y1176 HydrophobicContact CG2-CE1 3.73Å
1153	E	75.9	Confident	84.3	Confident	104 Å²	104	61.9 Å²	61.9	49%	0.486	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-37	-173.4	-159.8	162.4	147.5	0	0	113.8	K1126 H1143 V1145 S1155	K1126-E1153 IonicContact NZ-OE2 2.99Å; H1143-E1153 IonicContact CE1-OE2 3.31Å; H1143-E1153 PolarHBondContact CE1-OE2 3.31Å; H1143-E1153 IonicContact ND1-OE2 3.64Å; H1143-E1153 PolarHBondContact ND1-OE2 3.03Å; V1145-E1153 HydrophobicContact CG2-CG 3.93Å; E1153-S1155 VanDerWaalsContact C-N 3.31Å; E1153-S1155 PolarHBondContact O-N 2.94Å
1154	N	75.3	Confident	84.5	Confident	158 Å²	158	60.7 Å²	60.7	85%	0.845	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	0.7	-179.4	-63.2	-12.1	0	0	0	113.9	V1152	V1152-N1154 VanDerWaalsContact C-N 3.25Å; V1152-N1154 PolarHBondContact O-N 3.48Å
1155	S	78.6	Confident	84.9	Confident	49 Å²	49	57.5 Å²	57.5	34%	0.343	31%	0.313	S	S	.	.			trans	-145.3	54.9	-176.2	70.9	0	0	0	0	112.8	V1152 E1153 T1157	V1152-S1155 WeakPolarHBondContact CB-OG 3.23Å; V1152-S1155 CarbonylContact O-C 3.53Å; V1152-S1155 PolarHBondContact O-N 3.23Å; E1153-S1155 VanDerWaalsContact C-N 3.31Å; E1153-S1155 PolarHBondContact O-N 2.94Å; S1155-T1157 PolarHBondContact O-N 2.81Å
1156	C	82.4	Confident	85.1	Confident	20 Å²	20	56 Å²	56	14%	0.135	30%	0.304	C	S	.	.			trans	-83	103.6	169.9	-64.8	0	0	0	0	110.5	H1143 V1145 K1148	H1143-C1156 PolarHBondContact O-SG 3.27Å; V1145-C1156 HydrophobicContact CB-CB 4.48Å; K1148-C1156 HydrophobicContact CB-CB 3.9Å; K1148-C1156 WeakPolarHBondContact CB-O 3.47Å; K1148-C1156 WeakPolarHBondContact O-CB 3.48Å
1157	T	83	Confident	85.6	Confident	89 Å²	89	54.1 Å²	54.1	55%	0.546	29%	0.288	S	S	.	.			trans	-105.8	-17.7	-173.2	50.1	0	0	0	0	114.4	Y1149 S1155	Y1149-T1157 PolarHBondContact O-N 3.45Å; S1155-T1157 PolarHBondContact O-N 2.81Å
1158	Y	87.6	Confident	86.1	Confident	31 Å²	31	52.2 Å²	52.2	12%	0.122	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-93.1	135.4	-172	-56	-84.2	0	0	0	111.4	K1148 Y1149 L1164 Y1167 Y1168	K1148-Y1158 CarbonylContact C-O 3.6Å; K1148-Y1158 WeakPolarHBondContact CA-O 3.39Å; K1148-Y1158 WeakPolarHBondContact CB-O 3.33Å; Y1149-Y1158 PolarHBondContact N-O 3.09Å; Y1149-Y1158 WeakPolarHBondContact O-CD2 3.45Å; Y1149-Y1158 PolarHBondContact O-N 3.27Å; Y1158-L1164 HydrophobicContact CD1-CB 4.41Å; Y1158-L1164 HydrophobicContact CD2-CB 3.98Å; Y1158-L1164 HydrophobicContact CD2-CD1 3.85Å; Y1158-L1164 HydrophobicContact CD2-CG 3.98Å; Y1158-L1164 HydrophobicContact CE2-CD1 4.41Å; Y1158-L1164 HydrophobicContact CE2-CG 4.38Å; Y1158-L1164 HydrophobicContact CG-CB 3.82Å; Y1158-L1164 HydrophobicContact CG-CD1 4.5Å; Y1158-L1164 HydrophobicContact CG-CG 4.34Å; Y1158-Y1167 AromaticContact CE1-CD1 3.82Å; Y1158-Y1167 HydrophobicContact CE1-CD1 3.82Å; Y1158-Y1167 HydrophobicContact CE1-CD2 4.09Å; Y1158-Y1167 AromaticContact CE1-CG 3.55Å; Y1158-Y1167 HydrophobicContact CE1-CG 3.55Å; Y1158-Y1167 AromaticContact CZ-CD1 3.68Å; Y1158-Y1167 AromaticContact CZ-CG 3.94Å; Y1158-Y1167 WeakPolarHBondContact OH-CD1 3.45Å; Y1158-Y1167 WeakPolarHBondContact OH-CE1 3.48Å; Y1158-Y1168 AromaticContact CE2-CE2 3.79Å; Y1158-Y1168 HydrophobicContact CE2-CE2 3.79Å; Y1158-Y1168 AromaticContact CZ-CE2 3.77Å; Y1158-Y1168 WeakPolarHBondContact OH-CE2 3.26Å; Y1158-Y1168 PolarHBondContact OH-OH 3.38Å; Y1158-Y1168 VanDerWaalsContact OH-OH 3.05Å
1159	E	82.6	Confident	86.2	Confident	152 Å²	152	49.9 Å²	49.9	71%	0.71	26%	0.256	S	S	*	.	S	Bend	trans	-76.4	-24.9	-173.3	-61.1	-173.4	168.3	0	0	113.2
1160	S	87.4	Confident	85.8	Confident	28 Å²	28	51 Å²	51	20%	0.196	27%	0.269	C	S	.	.	S	Bend	trans	-135.7	166.3	173.1	69.8	0	0	0	0	111.5	E1162 D1163 L1164	S1160-E1162 VanDerWaalsContact C-N 3.28Å; S1160-D1163 PolarHBondContact N-OD2 3.3Å; S1160-D1163 WeakPolarHBondContact OG-CB 3.34Å; S1160-D1163 PolarHBondContact OG-N 3.29Å; S1160-D1163 PolarHBondContact OG-OD2 2.91Å; S1160-L1164 PolarHBondContact O-N 3.39Å
1161	L	89.7	Confident	85.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-67.8	-38	173.9	-178.5	64.6	0	0	0	109.6	W1094 F1095 V1118 L1127 I1142 Y1149 L1164 I1165	W1094-L1161 HydrophobicContact CH2-CD2 3.8Å; W1094-L1161 HydrophobicContact CH2-CG 3.8Å; W1094-L1161 HydrophobicContact CZ3-CD2 3.73Å; W1094-L1161 HydrophobicContact CZ3-CG 4.05Å; F1095-L1161 HydrophobicContact CD2-CD2 4.22Å; F1095-L1161 HydrophobicContact CE2-CD2 4.25Å; V1118-L1161 HydrophobicContact CG1-CD2 4.21Å; L1127-L1161 HydrophobicContact CD1-CD1 4.11Å; L1127-L1161 HydrophobicContact CD1-CD2 3.69Å; I1142-L1161 HydrophobicContact CD1-CD1 3.81Å; I1142-L1161 HydrophobicContact CG2-CD1 4.1Å; Y1149-L1161 HydrophobicContact CD1-CB 4.08Å; Y1149-L1161 HydrophobicContact CD1-CD1 3.94Å; Y1149-L1161 HydrophobicContact CD2-CB 4.43Å; Y1149-L1161 HydrophobicContact CE1-CB 4.04Å; Y1149-L1161 HydrophobicContact CE1-CD1 4.4Å; Y1149-L1161 HydrophobicContact CE2-CB 4.41Å; Y1149-L1161 HydrophobicContact CG-CB 4.28Å; Y1149-L1161 HydrophobicContact CG-CD1 4.47Å; L1161-L1164 WeakPolarHBondContact O-CB 3.33Å; L1161-L1164 PolarHBondContact O-N 3.17Å; L1161-I1165 WeakPolarHBondContact O-CG1 3.33Å; L1161-I1165 PolarHBondContact O-N 3.36Å
1162	E	91.5	Very high	85.2	Confident	42 Å²	42	56.2 Å²	56.2	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-60.9	-42.8	177.6	-63.8	74.1	-172.3	0	0	111.1	R1091 W1094 S1160 L1164 I1165 C1166	R1091-E1162 HydrophobicContact CB-CG 4.49Å; R1091-E1162 VanDerWaalsContact CD-OE1 3.31Å; R1091-E1162 WeakPolarHBondContact CD-OE1 3.43Å; R1091-E1162 IonicContact CZ-OE1 3.67Å; R1091-E1162 IonicContact NE-OE1 3.37Å; R1091-E1162 IonicContact NH1-OE1 3.48Å; R1091-E1162 PolarHBondContact NH1-OE1 2.86Å; W1094-E1162 HydrophobicContact CH2-CG 4.46Å; W1094-E1162 HydrophobicContact CZ2-CG 4.13Å; S1160-E1162 VanDerWaalsContact C-N 3.28Å; E1162-L1164 VanDerWaalsContact C-N 3.35Å; E1162-L1164 PolarHBondContact O-N 2.9Å; E1162-I1165 PolarHBondContact O-N 3.17Å; E1162-C1166 WeakPolarHBondContact O-CB 3.46Å; E1162-C1166 PolarHBondContact O-N 3.49Å; E1162-C1166 PolarHBondContact O-SG 3.27Å
1163	D	88.1	Confident	85.1	Confident	74 Å²	74	53.2 Å²	53.2	40%	0.396	28%	0.276	S	S	.	.	H	α-helix	trans	-65	-38.3	176	-64.6	-38.9	0	0	0	112.5	S1160 I1165 Y1167	S1160-D1163 PolarHBondContact N-OD2 3.3Å; S1160-D1163 WeakPolarHBondContact OG-CB 3.34Å; S1160-D1163 PolarHBondContact OG-N 3.29Å; S1160-D1163 PolarHBondContact OG-OD2 2.91Å; D1163-I1165 VanDerWaalsContact C-N 3.32Å; D1163-Y1167 WeakPolarHBondContact O-CB 3.25Å; D1163-Y1167 PolarHBondContact O-N 3.45Å
1164	L	92.3	Very high	85.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.7	-45.6	173.8	179.7	151.7	0	0	0	110	I1142 F1151 Y1158 S1160 L1161 E1162 Y1167 Y1168	I1142-L1164 HydrophobicContact CD1-CD2 4.49Å; I1142-L1164 HydrophobicContact CG2-CD1 4.32Å; F1151-L1164 HydrophobicContact CE2-CD1 4.4Å; F1151-L1164 HydrophobicContact CE2-CD2 3.95Å; F1151-L1164 HydrophobicContact CE2-CG 4.38Å; F1151-L1164 HydrophobicContact CZ-CD2 3.76Å; Y1158-L1164 HydrophobicContact CD1-CB 4.41Å; Y1158-L1164 HydrophobicContact CD2-CB 3.98Å; Y1158-L1164 HydrophobicContact CD2-CD1 3.85Å; Y1158-L1164 HydrophobicContact CD2-CG 3.98Å; Y1158-L1164 HydrophobicContact CE2-CD1 4.41Å; Y1158-L1164 HydrophobicContact CE2-CG 4.38Å; Y1158-L1164 HydrophobicContact CG-CB 3.82Å; Y1158-L1164 HydrophobicContact CG-CD1 4.5Å; Y1158-L1164 HydrophobicContact CG-CG 4.34Å; S1160-L1164 PolarHBondContact O-N 3.39Å; L1161-L1164 WeakPolarHBondContact O-CB 3.33Å; L1161-L1164 PolarHBondContact O-N 3.17Å; E1162-L1164 VanDerWaalsContact C-N 3.35Å; E1162-L1164 PolarHBondContact O-N 2.9Å; L1164-Y1167 PolarHBondContact O-N 2.9Å; L1164-Y1168 HydrophobicContact CD2-CD2 4.11Å; L1164-Y1168 HydrophobicContact CG-CD2 4.05Å; L1164-Y1168 HydrophobicContact CG-CE2 4.16Å; L1164-Y1168 WeakPolarHBondContact O-CD2 3.38Å; L1164-Y1168 PolarHBondContact O-N 2.9Å; L1164-Y1168 VanDerWaalsContact O-N 3.12Å
1165	I	92.6	Very high	85	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-46.1	179	-61.3	-60.4	0	0	0	111.4	I1088 W1094 F1116 V1118 L1161 E1162 D1163 Y1167 Y1168 H1169 L1184	I1088-I1165 HydrophobicContact CG2-CG2 4.19Å; W1094-I1165 HydrophobicContact CD2-CG1 4.46Å; W1094-I1165 HydrophobicContact CE3-CG1 4.42Å; W1094-I1165 HydrophobicContact CH2-CG1 3.91Å; W1094-I1165 HydrophobicContact CZ2-CB 4.26Å; W1094-I1165 HydrophobicContact CZ2-CG1 3.9Å; W1094-I1165 HydrophobicContact CZ2-CG2 4.45Å; W1094-I1165 HydrophobicContact CZ3-CG1 4.16Å; F1116-I1165 HydrophobicContact CE2-CD1 4.15Å; F1116-I1165 HydrophobicContact CE2-CG2 3.68Å; F1116-I1165 HydrophobicContact CZ-CG2 3.67Å; V1118-I1165 HydrophobicContact CG2-CD1 3.78Å; L1161-I1165 WeakPolarHBondContact O-CG1 3.33Å; L1161-I1165 PolarHBondContact O-N 3.36Å; E1162-I1165 PolarHBondContact O-N 3.17Å; D1163-I1165 VanDerWaalsContact C-N 3.32Å; I1165-Y1167 VanDerWaalsContact C-N 3.3Å; I1165-Y1167 PolarHBondContact O-N 3.37Å; I1165-Y1168 CarbonylContact O-C 3.46Å; I1165-Y1168 PolarHBondContact O-N 2.89Å; I1165-H1169 PolarHBondContact O-N 3.32Å; I1165-L1184 HydrophobicContact CB-CD1 4.32Å; I1165-L1184 HydrophobicContact CD1-CD1 3.43Å; I1165-L1184 VanDerWaalsContact CD1-CD1 3.43Å; I1165-L1184 HydrophobicContact CG1-CD1 4.43Å; I1165-L1184 HydrophobicContact CG2-CD1 4.02Å
1166	C	87.5	Confident	84.6	Confident	20 Å²	20	56.9 Å²	56.9	14%	0.135	27%	0.27	C	S	.	.	H	α-helix	trans	-59.1	-39.7	177	-73.1	0	0	0	0	112.4	E1162 H1169	E1162-C1166 WeakPolarHBondContact O-CB 3.46Å; E1162-C1166 PolarHBondContact O-N 3.49Å; E1162-C1166 PolarHBondContact O-SG 3.27Å; C1166-H1169 WeakPolarHBondContact O-CB 3.43Å; C1166-H1169 PolarHBondContact O-N 3.01Å
1167	Y	87.3	Confident	84	Confident	99 Å²	99	59 Å²	59	39%	0.388	28%	0.28	S	S	.	.	H	α-helix	trans	-64.7	-49.7	176.1	-177.6	-94	0	0	0	111.5	Y1158 D1163 L1164 I1165 H1169 V1170 E1171	Y1158-Y1167 AromaticContact CE1-CD1 3.82Å; Y1158-Y1167 HydrophobicContact CE1-CD1 3.82Å; Y1158-Y1167 HydrophobicContact CE1-CD2 4.09Å; Y1158-Y1167 AromaticContact CE1-CG 3.55Å; Y1158-Y1167 HydrophobicContact CE1-CG 3.55Å; Y1158-Y1167 AromaticContact CZ-CD1 3.68Å; Y1158-Y1167 AromaticContact CZ-CG 3.94Å; Y1158-Y1167 WeakPolarHBondContact OH-CD1 3.45Å; Y1158-Y1167 WeakPolarHBondContact OH-CE1 3.48Å; D1163-Y1167 WeakPolarHBondContact O-CB 3.25Å; D1163-Y1167 PolarHBondContact O-N 3.45Å; L1164-Y1167 PolarHBondContact O-N 2.9Å; I1165-Y1167 VanDerWaalsContact C-N 3.3Å; I1165-Y1167 PolarHBondContact O-N 3.37Å; Y1167-H1169 PolarHBondContact O-N 2.96Å; Y1167-V1170 PolarHBondContact O-N 3.39Å; Y1167-V1170 VanDerWaalsContact O-N 3.17Å; Y1167-E1171 HydrophobicContact CD1-CB 4.08Å; Y1167-E1171 HydrophobicContact CD1-CG 4.5Å; Y1167-E1171 HydrophobicContact CE1-CB 3.7Å; Y1167-E1171 HydrophobicContact CE1-CG 3.92Å; Y1167-E1171 HydrophobicContact CE2-CG 4.12Å; Y1167-E1171 PolarHBondContact O-N 3.37Å
1168	Y	90.2	Very high	83.4	Confident	5 Å²	5	59.8 Å²	59.8	2%	0.02	28%	0.281	C	S	.	.	H	α-helix	trans	-78.4	-0.4	-179.2	-69.6	-68.4	0	0	0	114.4	F1151 Y1158 L1164 I1165 E1171 L1173 Y1176 T1183 L1184	F1151-Y1168 HydrophobicContact CD2-CE2 4.02Å; F1151-Y1168 AromaticContact CE2-CD2 3.61Å; F1151-Y1168 HydrophobicContact CE2-CD2 3.61Å; F1151-Y1168 AromaticContact CE2-CE2 3.53Å; F1151-Y1168 HydrophobicContact CE2-CE2 3.53Å; F1151-Y1168 HydrophobicContact CE2-CG 4.3Å; F1151-Y1168 HydrophobicContact CZ-CD2 4.41Å; Y1158-Y1168 AromaticContact CE2-CE2 3.79Å; Y1158-Y1168 HydrophobicContact CE2-CE2 3.79Å; Y1158-Y1168 AromaticContact CZ-CE2 3.77Å; Y1158-Y1168 WeakPolarHBondContact OH-CE2 3.26Å; Y1158-Y1168 PolarHBondContact OH-OH 3.38Å; Y1158-Y1168 VanDerWaalsContact OH-OH 3.05Å; L1164-Y1168 HydrophobicContact CD2-CD2 4.11Å; L1164-Y1168 HydrophobicContact CG-CD2 4.05Å; L1164-Y1168 HydrophobicContact CG-CE2 4.16Å; L1164-Y1168 WeakPolarHBondContact O-CD2 3.38Å; L1164-Y1168 PolarHBondContact O-N 2.9Å; L1164-Y1168 VanDerWaalsContact O-N 3.12Å; I1165-Y1168 CarbonylContact O-C 3.46Å; I1165-Y1168 PolarHBondContact O-N 2.89Å; Y1168-E1171 CarbonylContact C-O 3.51Å; Y1168-E1171 VanDerWaalsContact CA-O 3.26Å; Y1168-E1171 WeakPolarHBondContact CA-O 3.05Å; Y1168-L1173 HydrophobicContact CD1-CD2 3.41Å; Y1168-L1173 VanDerWaalsContact CD1-CD2 3.41Å; Y1168-L1173 HydrophobicContact CD1-CG 3.91Å; Y1168-L1173 HydrophobicContact CD2-CD2 4.09Å; Y1168-L1173 HydrophobicContact CE1-CD2 3.72Å; Y1168-L1173 HydrophobicContact CE2-CD2 4.38Å; Y1168-L1173 HydrophobicContact CG-CD2 3.63Å; Y1168-L1173 HydrophobicContact CG-CG 4.25Å; Y1168-Y1176 HydrophobicContact CE1-CE2 4.05Å; Y1168-Y1176 AromaticContact CZ-CE2 3.69Å; Y1168-Y1176 VanDerWaalsContact OH-CE2 3.22Å; Y1168-Y1176 WeakPolarHBondContact OH-CE2 3.19Å; Y1168-Y1176 PolarHBondContact OH-OH 3.25Å; Y1168-T1183 CarbonylContact O-C 3.5Å; Y1168-T1183 WeakPolarHBondContact O-CA 3.32Å; Y1168-T1183 WeakPolarHBondContact O-CB 3.48Å; Y1168-L1184 PolarHBondContact O-N 3.18Å
1169	H	87.2	Confident	82.5	Confident	41 Å²	41	63.9 Å²	63.9	19%	0.19	30%	0.304	C	S	.	.	H	α-helix	trans	-70.5	-36.9	163.9	-179.5	73.6	0	0	0	111.5	L1084 I1088 I1165 C1166 Y1167 T1183 L1184	L1084-H1169 HydrophobicContact CD2-CB 4.45Å; I1088-H1169 WeakPolarHBondContact CD1-ND1 3.39Å; I1088-H1169 HydrophobicContact CG2-CB 4Å; I1165-H1169 PolarHBondContact O-N 3.32Å; C1166-H1169 WeakPolarHBondContact O-CB 3.43Å; C1166-H1169 PolarHBondContact O-N 3.01Å; Y1167-H1169 PolarHBondContact O-N 2.96Å; H1169-T1183 VanDerWaalsContact O-CB 3.23Å; H1169-T1183 WeakPolarHBondContact O-CB 3.44Å; H1169-T1183 PolarHBondContact O-OG1 3.29Å; H1169-L1184 PolarHBondContact ND1-O 2.84Å
1170	V	80.8	Confident	82.3	Confident	77 Å²	77	56.8 Å²	56.8	47%	0.467	27%	0.271	S	S	.	.	H	α-helix	trans	-94.6	-40.4	179.3	-175.1	0	0	0	0	111.2	L1084 Y1167	L1084-V1170 HydrophobicContact CD2-CG2 4.47Å; Y1167-V1170 PolarHBondContact O-N 3.39Å; Y1167-V1170 VanDerWaalsContact O-N 3.17Å
1171	E	81.6	Confident	81.9	Confident	88 Å²	88	60.4 Å²	60.4	41%	0.411	29%	0.288	S	S	.	.	S	Bend	trans	-97.8	140.2	-178.4	-74.9	-69.2	168.8	0	0	112.4	Y1167 Y1168	Y1167-E1171 HydrophobicContact CD1-CB 4.08Å; Y1167-E1171 HydrophobicContact CD1-CG 4.5Å; Y1167-E1171 HydrophobicContact CE1-CB 3.7Å; Y1167-E1171 HydrophobicContact CE1-CG 3.92Å; Y1167-E1171 HydrophobicContact CE2-CG 4.12Å; Y1167-E1171 PolarHBondContact O-N 3.37Å; Y1168-E1171 CarbonylContact C-O 3.51Å; Y1168-E1171 VanDerWaalsContact CA-O 3.26Å; Y1168-E1171 WeakPolarHBondContact CA-O 3.05Å
1172	N	82.9	Confident	81.7	Confident	40 Å²	40	61.5 Å²	61.5	21%	0.214	29%	0.294	C	S	.	.			trans	-80.7	154.4	-179.5	54.7	55	0	0	0	112.3	K1174 T1183	N1172-K1174 PolarHBondContact O-N 3.16Å; N1172-K1174 WeakPolarHBondContact OD1-CD 3Å; N1172-K1174 WeakPolarHBondContact OD1-CE 3.47Å; N1172-K1174 WeakPolarHBondContact OD1-CG 3.45Å; N1172-T1183 HydrophobicContact CB-CG2 4.19Å
1173	L	82	Confident	81.5	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-82	7.9	-178.5	-72.8	164.4	0	0	0	114.1	L1129 F1151 Y1168 R1175 Y1176 L1180 I1182 L1184	L1129-L1173 HydrophobicContact CD2-CD1 3.92Å; F1151-L1173 HydrophobicContact CD2-CD2 3.88Å; F1151-L1173 HydrophobicContact CE2-CD2 3.24Å; F1151-L1173 HydrophobicContact CZ-CD2 3.66Å; Y1168-L1173 HydrophobicContact CD1-CD2 3.41Å; Y1168-L1173 VanDerWaalsContact CD1-CD2 3.41Å; Y1168-L1173 HydrophobicContact CD1-CG 3.91Å; Y1168-L1173 HydrophobicContact CD2-CD2 4.09Å; Y1168-L1173 HydrophobicContact CE1-CD2 3.72Å; Y1168-L1173 HydrophobicContact CE2-CD2 4.38Å; Y1168-L1173 HydrophobicContact CG-CD2 3.63Å; Y1168-L1173 HydrophobicContact CG-CG 4.25Å; L1173-R1175 PolarHBondContact O-N 3.15Å; L1173-Y1176 HydrophobicContact CD2-CD2 4.17Å; L1173-Y1176 HydrophobicContact CD2-CE2 4.38Å; L1173-Y1176 PolarHBondContact O-N 3.18Å; L1173-L1180 CarbonylContact C-O 3.16Å; L1173-L1180 WeakPolarHBondContact CA-O 3.34Å; L1173-L1180 HydrophobicContact CB-CB 3.71Å; L1173-L1180 HydrophobicContact CB-CD1 4.4Å; L1173-L1180 WeakPolarHBondContact CB-O 3.49Å; L1173-L1180 PolarHBondContact N-O 3.13Å; L1173-I1182 PolarHBondContact N-O 2.76Å; L1173-L1184 HydrophobicContact CD1-CD2 3.9Å
1174	K	77.3	Confident	81.7	Confident	107 Å²	107	57.1 Å²	57.1	47%	0.465	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-58.4	-24.8	-173.4	80.4	-168.4	165.2	-177.8	0	113.6	N1172 Y1176 N1177 L1180 N1181	N1172-K1174 PolarHBondContact O-N 3.16Å; N1172-K1174 WeakPolarHBondContact OD1-CD 3Å; N1172-K1174 WeakPolarHBondContact OD1-CE 3.47Å; N1172-K1174 WeakPolarHBondContact OD1-CG 3.45Å; K1174-Y1176 PolarHBondContact O-N 3.41Å; K1174-N1177 WeakPolarHBondContact CA-O 3.38Å; K1174-N1177 CarbonylContact O-C 3.44Å; K1174-N1177 PolarHBondContact O-N 3Å; K1174-L1180 PolarHBondContact N-O 2.96Å; K1174-L1180 VanDerWaalsContact N-O 3.08Å; K1174-N1181 HydrophobicContact CB-CB 4.39Å
1175	R	71.9	Confident	81.5	Confident	209 Å²	209	61.7 Å²	61.7	79%	0.789	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-59.8	-30.1	178.7	-172.6	175.9	-179.4	176.5	-0	112.6	L1173	L1173-R1175 PolarHBondContact O-N 3.15Å
1176	Y	71.8	Confident	81.4	Confident	71 Å²	71	66.7 Å²	66.7	28%	0.278	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-35.9	-179.7	-56.7	-72.7	0	0	0	112.5	F1151 V1152 Y1168 L1173 K1174	F1151-Y1176 HydrophobicContact CB-CD1 4.08Å; F1151-Y1176 HydrophobicContact CB-CD2 4.23Å; F1151-Y1176 HydrophobicContact CB-CE1 4.03Å; F1151-Y1176 HydrophobicContact CB-CE2 4.18Å; F1151-Y1176 HydrophobicContact CB-CG 4.17Å; F1151-Y1176 AromaticContact CD2-CD2 3.88Å; F1151-Y1176 HydrophobicContact CD2-CD2 3.88Å; F1151-Y1176 AromaticContact CD2-CE2 3.47Å; F1151-Y1176 HydrophobicContact CD2-CE2 3.47Å; F1151-Y1176 VanDerWaalsContact CD2-CE2 3.47Å; F1151-Y1176 AromaticContact CD2-CZ 3.93Å; F1151-Y1176 HydrophobicContact CE2-CE2 4.31Å; F1151-Y1176 HydrophobicContact CG-CD2 4.33Å; F1151-Y1176 HydrophobicContact CG-CE2 4.22Å; V1152-Y1176 HydrophobicContact CG2-CD1 3.71Å; V1152-Y1176 HydrophobicContact CG2-CE1 3.73Å; Y1168-Y1176 HydrophobicContact CE1-CE2 4.05Å; Y1168-Y1176 AromaticContact CZ-CE2 3.69Å; Y1168-Y1176 VanDerWaalsContact OH-CE2 3.22Å; Y1168-Y1176 WeakPolarHBondContact OH-CE2 3.19Å; Y1168-Y1176 PolarHBondContact OH-OH 3.25Å; L1173-Y1176 HydrophobicContact CD2-CD2 4.17Å; L1173-Y1176 HydrophobicContact CD2-CE2 4.38Å; L1173-Y1176 PolarHBondContact O-N 3.18Å; K1174-Y1176 PolarHBondContact O-N 3.41Å
1177	N	68.3	Low	81.6	Confident	66 Å²	66	66 Å²	66	35%	0.353	31%	0.307	S	S	.	.			trans	-153.3	126.1	173.9	-174.2	-18.4	0	0	0	109.3	K1174 L1179 L1180	K1174-N1177 WeakPolarHBondContact CA-O 3.38Å; K1174-N1177 CarbonylContact O-C 3.44Å; K1174-N1177 PolarHBondContact O-N 3Å; N1177-L1179 PolarHBondContact O-N 3.48Å; N1177-L1179 VanDerWaalsContact O-N 3.09Å; N1177-L1179 WeakPolarHBondContact OD1-CB 3.42Å; N1177-L1179 PolarHBondContact OD1-N 3.23Å; N1177-L1180 HydrophobicContact CB-CB 4.49Å; N1177-L1180 HydrophobicContact CB-CD1 3.83Å; N1177-L1180 HydrophobicContact CB-CG 4.05Å; N1177-L1180 WeakPolarHBondContact O-CA 3.4Å; N1177-L1180 WeakPolarHBondContact O-CB 3.48Å; N1177-L1180 PolarHBondContact O-N 2.99Å
1178	N	70.8	Confident	81.7	Confident	104 Å²	104	61.2 Å²	61.2	56%	0.556	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-58.6	-24.9	-179.8	-71.6	-4.5	0	0	0	113.3	L1180	N1178-L1180 PolarHBondContact O-N 3.46Å
1179	L	68.9	Low	81.4	Confident	117 Å²	117	64.3 Å²	64.3	61%	0.613	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-68.3	-22.1	174	-62.5	176.2	0	0	0	112.6	L1133 N1177 N1181	L1133-L1179 WeakPolarHBondContact CD1-O 3.37Å; L1133-L1179 WeakPolarHBondContact CD2-O 3.14Å; N1177-L1179 PolarHBondContact O-N 3.48Å; N1177-L1179 VanDerWaalsContact O-N 3.09Å; N1177-L1179 WeakPolarHBondContact OD1-CB 3.42Å; N1177-L1179 PolarHBondContact OD1-N 3.23Å; L1179-N1181 VanDerWaalsContact C-N 3.27Å; L1179-N1181 PolarHBondContact O-N 3.2Å
1180	L	78.1	Confident	81	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.021	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-91.2	43.4	176.8	-60	170.5	0	0	0	111.5	I1131 L1133 Q1138 C1140 L1173 K1174 N1177 N1178 I1182	I1131-L1180 HydrophobicContact CG2-CD2 3.87Å; L1133-L1180 HydrophobicContact CD1-CD2 4.31Å; L1133-L1180 HydrophobicContact CD2-CD2 4.24Å; Q1138-L1180 HydrophobicContact CB-CD2 3.99Å; C1140-L1180 WeakPolarHBondContact SG-CD1 3.26Å; L1173-L1180 CarbonylContact C-O 3.16Å; L1173-L1180 WeakPolarHBondContact CA-O 3.34Å; L1173-L1180 HydrophobicContact CB-CB 3.71Å; L1173-L1180 HydrophobicContact CB-CD1 4.4Å; L1173-L1180 WeakPolarHBondContact CB-O 3.49Å; L1173-L1180 PolarHBondContact N-O 3.13Å; K1174-L1180 PolarHBondContact N-O 2.96Å; K1174-L1180 VanDerWaalsContact N-O 3.08Å; N1177-L1180 HydrophobicContact CB-CB 4.49Å; N1177-L1180 HydrophobicContact CB-CD1 3.83Å; N1177-L1180 HydrophobicContact CB-CG 4.05Å; N1177-L1180 WeakPolarHBondContact O-CA 3.4Å; N1177-L1180 WeakPolarHBondContact O-CB 3.48Å; N1177-L1180 PolarHBondContact O-N 2.99Å; N1178-L1180 PolarHBondContact O-N 3.46Å; L1180-I1182 PolarHBondContact O-N 3.18Å
1181	N	79.1	Confident	80.7	Confident	103 Å²	103	63.5 Å²	63.5	55%	0.551	30%	0.295	S	S	*	.			trans	-77.5	53.7	173	-170.9	26.9	0	0	0	111.6	K1174 L1179	K1174-N1181 HydrophobicContact CB-CB 4.39Å; L1179-N1181 VanDerWaalsContact C-N 3.27Å; L1179-N1181 PolarHBondContact O-N 3.2Å
1182	I	84.9	Confident	80.1	Confident	24 Å²	24	62.9 Å²	62.9	12%	0.123	29%	0.294	C	S	.	.			trans	-142	154.3	-177.6	-161.2	154.5	0	0	0	109.6	A1113 I1131 L1133 L1173 L1180	A1113-I1182 VanDerWaalsContact C-CD1 3.46Å; A1113-I1182 HydrophobicContact CB-CD1 3.76Å; I1131-I1182 HydrophobicContact CD1-CG2 3.49Å; I1131-I1182 VanDerWaalsContact CD1-CG2 3.49Å; I1131-I1182 HydrophobicContact CG1-CG2 4.13Å; L1133-I1182 HydrophobicContact CD2-CB 4.23Å; L1133-I1182 HydrophobicContact CD2-CG2 3.56Å; L1173-I1182 PolarHBondContact N-O 2.76Å; L1180-I1182 PolarHBondContact O-N 3.18Å
1183	T	88.2	Confident	78.6	Confident	23 Å²	23	68.2 Å²	68.2	14%	0.141	32%	0.322	C	S	.	.			trans	-101.2	160.4	173.9	61.3	0	0	0	0	110.7	Y1168 H1169 N1172 K1185	Y1168-T1183 CarbonylContact O-C 3.5Å; Y1168-T1183 WeakPolarHBondContact O-CA 3.32Å; Y1168-T1183 WeakPolarHBondContact O-CB 3.48Å; H1169-T1183 VanDerWaalsContact O-CB 3.23Å; H1169-T1183 WeakPolarHBondContact O-CB 3.44Å; H1169-T1183 PolarHBondContact O-OG1 3.29Å; N1172-T1183 HydrophobicContact CB-CG2 4.19Å; T1183-K1185 VanDerWaalsContact C-N 3.32Å; T1183-K1185 PolarHBondContact O-N 2.91Å; T1183-K1185 WeakPolarHBondContact OG1-CE 3.46Å; T1183-K1185 WeakPolarHBondContact OG1-CG 3.42Å
1184	L	91.5	Very high	76.5	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	37%	0.365	C	S	.	.			trans	-76.1	79.3	177.2	-56.1	-172	0	0	0	110.2	F1116 L1129 I1131 I1165 Y1168 H1169 L1173	F1116-L1184 HydrophobicContact CB-CD2 4.09Å; F1116-L1184 HydrophobicContact CD1-CB 3.73Å; F1116-L1184 HydrophobicContact CD1-CD2 4.46Å; F1116-L1184 HydrophobicContact CD2-CB 4.35Å; F1116-L1184 HydrophobicContact CD2-CD1 4.33Å; F1116-L1184 HydrophobicContact CD2-CD2 4.32Å; F1116-L1184 HydrophobicContact CE1-CB 3.72Å; F1116-L1184 HydrophobicContact CE2-CB 4.33Å; F1116-L1184 HydrophobicContact CE2-CD1 4.32Å; F1116-L1184 HydrophobicContact CG-CB 4.06Å; F1116-L1184 HydrophobicContact CG-CD2 4.04Å; F1116-L1184 HydrophobicContact CG-CG 4.49Å; F1116-L1184 HydrophobicContact CZ-CB 4.03Å; L1129-L1184 HydrophobicContact CD1-CD2 4.11Å; L1129-L1184 HydrophobicContact CD2-CD2 3.9Å; I1131-L1184 HydrophobicContact CD1-CD2 3.56Å; I1165-L1184 HydrophobicContact CB-CD1 4.32Å; I1165-L1184 HydrophobicContact CD1-CD1 3.43Å; I1165-L1184 VanDerWaalsContact CD1-CD1 3.43Å; I1165-L1184 HydrophobicContact CG1-CD1 4.43Å; I1165-L1184 HydrophobicContact CG2-CD1 4.02Å; Y1168-L1184 PolarHBondContact O-N 3.18Å; H1169-L1184 PolarHBondContact ND1-O 2.84Å; L1173-L1184 HydrophobicContact CD1-CD2 3.9Å
1185	K	88.1	Confident	76.5	Confident	96 Å²	96	75.8 Å²	75.8	42%	0.417	36%	0.36	S	S	.	.			trans	-84.1	-46.8	-168.1	-68.2	-174.5	178.5	-178.5	0	114.3	G1114 T1183	G1114-K1185 PolarHBondContact O-N 3.44Å; T1183-K1185 VanDerWaalsContact C-N 3.32Å; T1183-K1185 PolarHBondContact O-N 2.91Å; T1183-K1185 WeakPolarHBondContact OG1-CE 3.46Å; T1183-K1185 WeakPolarHBondContact OG1-CG 3.42Å
1186	Y	90.2	Very high	76.7	Confident	105 Å²	105	68.8 Å²	68.8	41%	0.412	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	112.5	-169.8	-47.5	-72.1	0	0	0	111.5	P1112 G1114 T1115 F1116	P1112-Y1186 HydrophobicContact CB-CD2 4.39Å; P1112-Y1186 HydrophobicContact CB-CE2 4.18Å; P1112-Y1186 HydrophobicContact CG-CD2 4.02Å; P1112-Y1186 HydrophobicContact CG-CE2 4.18Å; G1114-Y1186 PolarHBondContact O-N 3.03Å; G1114-Y1186 VanDerWaalsContact O-N 3.17Å; T1115-Y1186 CarbonylContact C-O 3.56Å; T1115-Y1186 VanDerWaalsContact CA-O 3.26Å; T1115-Y1186 WeakPolarHBondContact CA-O 3.36Å; F1116-Y1186 VanDerWaalsContact CD1-O 3.29Å; F1116-Y1186 WeakPolarHBondContact CD1-O 3.28Å; F1116-Y1186 PolarHBondContact N-O 2.84Å
1187	P	92.2	Very high	77	Confident	5 Å²	5	68.7 Å²	68.7	3%	0.032	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	135.3	169.8	-26.9	36	0	0	0	112.6	I1088 Y1093 W1094 F1116 K1189 L1190	I1088-P1187 HydrophobicContact CD1-CG 3.77Å; Y1093-P1187 WeakPolarHBondContact O-CB 3.46Å; W1094-P1187 HydrophobicContact CB-CB 3.98Å; F1116-P1187 HydrophobicContact CE1-CG 4.21Å; F1116-P1187 HydrophobicContact CZ-CG 4.29Å; P1187-K1189 PolarHBondContact O-N 3.28Å; P1187-L1190 HydrophobicContact CB-CD1 4.25Å; P1187-L1190 HydrophobicContact CG-CD1 4.15Å; P1187-L1190 PolarHBondContact O-N 3.24Å
1188	I	89.2	Confident	77.5	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-61	-35.4	-174.8	-168.8	58.6	0	0	0	114.8	Y1093 L1096 L1107 L1108 T1115 F1116 V1117 L1190 Q1191 L1192	Y1093-I1188 PolarHBondContact O-N 3.1Å; L1096-I1188 HydrophobicContact CD1-CG2 4.32Å; L1096-I1188 HydrophobicContact CG-CG2 4.34Å; L1107-I1188 HydrophobicContact CB-CD1 4.43Å; L1108-I1188 HydrophobicContact CD2-CD1 3.77Å; T1115-I1188 HydrophobicContact CG2-CD1 3.87Å; F1116-I1188 PolarHBondContact O-N 3.36Å; F1116-I1188 VanDerWaalsContact O-N 3.09Å; V1117-I1188 HydrophobicContact CB-CB 4.06Å; V1117-I1188 HydrophobicContact CB-CG2 3.72Å; V1117-I1188 HydrophobicContact CG2-CB 4.48Å; V1117-I1188 HydrophobicContact CG2-CG2 3.63Å; I1188-L1190 PolarHBondContact O-N 3.29Å; I1188-Q1191 CarbonylContact O-C 3.57Å; I1188-Q1191 WeakPolarHBondContact O-CA 3.43Å; I1188-Q1191 WeakPolarHBondContact O-CB 3.39Å; I1188-Q1191 PolarHBondContact O-N 3.46Å; I1188-L1192 PolarHBondContact O-N 3.07Å
1189	K	85.4	Confident	77.9	Confident	69 Å²	69	66.6 Å²	66.6	30%	0.3	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-73.2	-27.8	-173.9	-62.6	-160.1	-165.5	155	0	113.4	R1092 Y1093 F1095 L1096 P1187 Q1191 L1192 D1193	R1092-K1189 WeakPolarHBondContact O-CD 3.24Å; R1092-K1189 WeakPolarHBondContact O-CE 3.32Å; R1092-K1189 PolarHBondContact O-NZ 3.44Å; Y1093-K1189 VanDerWaalsContact O-CB 3.28Å; Y1093-K1189 WeakPolarHBondContact O-CB 3.23Å; Y1093-K1189 WeakPolarHBondContact O-CG 3.33Å; Y1093-K1189 PolarHBondContact O-N 3.23Å; F1095-K1189 VanDerWaalsContact O-CE 3.32Å; F1095-K1189 WeakPolarHBondContact O-CE 3.35Å; F1095-K1189 PolarHBondContact O-NZ 3.15Å; L1096-K1189 HydrophobicContact CD2-CD 4.34Å; L1096-K1189 HydrophobicContact CD2-CG 4.28Å; P1187-K1189 PolarHBondContact O-N 3.28Å; K1189-Q1191 PolarHBondContact O-N 2.72Å; K1189-Q1191 VanDerWaalsContact O-N 3.14Å; K1189-L1192 HydrophobicContact CG-CD1 4.42Å; K1189-L1192 PolarHBondContact O-N 3.49Å; K1189-D1193 PolarHBondContact O-N 2.96Å
1190	L	78	Confident	78.5	Confident	65 Å²	65	63.3 Å²	63.3	34%	0.34	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-64.8	-12.2	168.4	-67.7	173.8	0	0	0	112.8	E1087 Y1093 P1187 I1188	E1087-L1190 HydrophobicContact CB-CD1 3.69Å; E1087-L1190 HydrophobicContact CG-CD1 3.91Å; E1087-L1190 HydrophobicContact CG-CD2 4.28Å; Y1093-L1190 HydrophobicContact CD1-CD2 3.62Å; Y1093-L1190 HydrophobicContact CD1-CG 3.76Å; Y1093-L1190 HydrophobicContact CE1-CD2 3.7Å; Y1093-L1190 HydrophobicContact CE1-CG 4.35Å; Y1093-L1190 HydrophobicContact CG-CG 4.49Å; P1187-L1190 HydrophobicContact CB-CD1 4.25Å; P1187-L1190 HydrophobicContact CG-CD1 4.15Å; P1187-L1190 PolarHBondContact O-N 3.24Å; I1188-L1190 PolarHBondContact O-N 3.29Å
1191	Q	74.2	Confident	78.6	Confident	36 Å²	36	67.5 Å²	67.5	17%	0.168	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-108.4	6.6	177	-57.6	-71.5	-76.7	0	0	111.7	R1111 T1115 I1188 K1189	R1111-Q1191 PolarHBondContact NE-O 2.68Å; R1111-Q1191 PolarHBondContact NH2-O 2.93Å; T1115-Q1191 HydrophobicContact CG2-CG 4.28Å; I1188-Q1191 CarbonylContact O-C 3.57Å; I1188-Q1191 WeakPolarHBondContact O-CA 3.43Å; I1188-Q1191 WeakPolarHBondContact O-CB 3.39Å; I1188-Q1191 PolarHBondContact O-N 3.46Å; K1189-Q1191 PolarHBondContact O-N 2.72Å; K1189-Q1191 VanDerWaalsContact O-N 3.14Å
1192	L	69.3	Low	78.5	Confident	75 Å²	75	64.8 Å²	64.8	39%	0.393	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-25.4	173.4	-68.6	173.9	0	0	0	112	L1107 I1188 K1189 E1194	L1107-L1192 HydrophobicContact CD2-CD2 3.9Å; I1188-L1192 PolarHBondContact O-N 3.07Å; K1189-L1192 HydrophobicContact CG-CD1 4.42Å; K1189-L1192 PolarHBondContact O-N 3.49Å; L1192-E1194 VanDerWaalsContact C-N 3.33Å
1193	D	50.9	Low	78	Confident	152 Å²	152	68.2 Å²	68.2	81%	0.813	33%	0.326	S	S	*	.			trans	-84.6	-6.1	175.4	-68.3	-26.1	0	0	0	113.2	K1189	K1189-D1193 PolarHBondContact O-N 2.96Å
1194	E	38.7	Very low	77.1	Confident	192 Å²	192	72.3 Å²	72.3	90%	0.897	34%	0.343	S	S	*	.			trans	-99.9	0	164.8	-71.6	-174.5	161.2	0	0	110.4	L1192	L1192-E1194 VanDerWaalsContact C-N 3.33Å

Retrieved 1,194 of 1,194 residues in 1446.6 ms (Link to these results)

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