A0A077ZEX1_TRITR Loading...

VWD and AMOP and Sushi domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZEX1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,333 aa.

						>A0A077ZEX1_TRITR|A0A077ZEX1
MGKKLLVDHLMPPYWLWTIIMVGWVTCQIPNPFSGTLTPIQSSHYGNLYQYGKGTTDEKLYDRELTTGRQIDLFTFFPYYGGRYNYTVLSVHGYAAFGNVLDLGTDFAFGEGTENWPDDPDPALIAVYACRQRPMSINPDYQGIHYRLVFRGNMISDDSESLPLNGPPMKRSNLPKYVDHNGDSFLDRIQEDLRDGIVGANSFQADVALVVTWENVTFMQASNDDEDKGRVCLLEHYFTGRLQTATYQLVLTTDRAGQLSYAIINYHKLGYAGSDIMGSARRGRCKAELNGGNATGSVLVDPVYSKMPMQLAMMSSVPHRVRGRYLFRVDDIVRKGGCSNLTVGTYRLNIYPDIVNSMGDTTVQVNGPCMSFTDTPILYVAENKPAYCKVKNAAIAECKMVRYYHWGVKYVYFSVRNIKSYVGSIYYVVVIWAVPSGLDPYALTMGQIDHWFEKEPPGNLKIMWYADNFTGADFRRSSQLQLTLWGYKERRDDRETKFIPTLELLGKIGSNIRNPMEKYRNIGEYIISNDVKLEDTPYSFNELQTFRLGFLKLADMNGLEEGNALWSPPIPIHRFFIRSKEVLEVYAADECIRWFEEDGQQWNFIRDTETNASCPCRYEQAVIDIGRFMPHPRCSQRFRSLHCDTYVGAKECFLNAHNIQGNYVTHYGQVCCYDRDGYLMHTSYQTVVQIENYPYNPGFPQRAFEFGTYPFAKQFELPTMSHYYHDVLPYYLCCKWTPEHCQFFYWRRPSSSCLEYRPPAFASVFGAGHFTTFDGRNYSINKPGTYMLVHKPKTEPQWRNDIYQVMLPEVQIQIRMENYPDRTVDFGHRDTYQHRLVQPLNVSVVTGVAVQEGTSMESDRVLVLLRKDTRRYKYRTHILVNDELRYFDTIKTQRFRGVTVYVNDWKEGQCEVFIVLEQSRIGLRIQESYSIEITRHLNYEESLGLLNVLVSVPPEYRMEQQAGRRVEYSDALSGLAGTFSSKQPADLVHSDRKTVAQYANELFVDSCRLSCRFGRVDNHQFHSLFSLLTTDHRDWPEAHLIGPVYPVAKRWLKENYRENFVPSQILPAEFQNEYHKCMNSYEYHATCPSYDTMKAIEKTCLEMYHCQYDSFYLKQPYLGYLLKQEEVLQLEIRTAGMRNYNSCGAINVEYPDFLFINPATGKLYLEGNEVLFECYPSHWLKGDSKFTCTRGRWNQGWQPWCRSKQLETTLRILSIIFGLLVCIAFIGAIFVCCWALNNSKKEPPPNAYRTGVPLLSKADETRGAIPFSQRPRSNPALEPPPFYDTPQGANTHPVNQVFRRPQDLYSNTANGSTSSSHNSPRRISPVVGMKTLV
					

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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	33.1	Very low	32.9	Very low	249 Å²	249	167.1 Å²	167.1	100%	1.227	87%	0.867	S	S	*	*				0	132.5	0	-77.8	176.5	164.4	0	0	108
2	G	34.6	Very low	32.8	Very low	78 Å²	78	163 Å²	163	80%	0.804	86%	0.858	S	S	*	*			trans	70	142.3	-179.3	0	0	0	0	0	114.7
3	K	35.7	Very low	32.7	Very low	214 Å²	214	159.1 Å²	159.1	93%	0.93	85%	0.848	S	S	*	*			cis	-146.8	144.1	-16	-117.9	-177.4	-179.8	-178.9	0	107.6
4	K	31.9	Very low	32.2	Very low	195 Å²	195	163.2 Å²	163.2	85%	0.848	85%	0.848	S	S	*	*			trans	-87.6	156.1	168.7	-77	-175.9	172.6	-175.7	0	110.3
5	L	37.3	Very low	31.9	Very low	168 Å²	168	167.7 Å²	167.7	88%	0.88	85%	0.85	S	S	*	*			trans	-167.9	146.7	131.2	-106	159.3	0	0	0	111.5
6	L	29.3	Very low	31.6	Very low	133 Å²	133	167.1 Å²	167.1	70%	0.696	85%	0.848	S	S	*	*			trans	-97.5	153.4	165.4	-78.8	69.7	0	0	0	108.5
7	V	37.5	Very low	31.2	Very low	138 Å²	138	170.9 Å²	170.9	84%	0.836	85%	0.85	S	S	*	*			trans	-145.2	135	141.7	-176.5	0	0	0	0	107.8
8	D	29	Very low	30.9	Very low	124 Å²	124	168 Å²	168	66%	0.663	84%	0.843	S	S	*	*			trans	-82.1	159	177.6	-54.1	-83.4	0	0	0	113.1
9	H	34.2	Very low	30.9	Very low	192 Å²	192	167.4 Å²	167.4	89%	0.889	84%	0.841	S	S	*	*			trans	-138.3	128.2	154	-103.8	-71.2	0	0	0	110.5
10	L	29.1	Very low	30.7	Very low	160 Å²	160	166.6 Å²	166.6	84%	0.838	84%	0.838	S	S	*	*			trans	-85.4	146.4	-176.6	-60.2	93.9	0	0	0	112.3
11	M	29.9	Very low	30.4	Very low	187 Å²	187	166.6 Å²	166.6	92%	0.921	84%	0.837	S	S	*	*			trans	-132.9	147.8	147.8	-78.8	-163	168.7	0	0	109.8
12	P	32.1	Very low	30.2	Very low	118 Å²	118	161.7 Å²	161.7	77%	0.766	82%	0.821	S	S	*	*			trans	-86.7	158.1	-162.7	33.8	-37	0	0	0	114.6
13	P	30.8	Very low	29.8	Very low	112 Å²	112	160.6 Å²	160.6	73%	0.727	81%	0.81	S	S	*	*			trans	-95.4	121.5	-172.7	35.1	-32.7	0	0	0	114.2
14	Y	26.2	Very low	29.3	Very low	217 Å²	217	161.4 Å²	161.4	85%	0.851	81%	0.807	S	S	*	*			trans	-142.6	163	153.9	-81.2	-78.8	0	0	0	108.6
15	W	28.1	Very low	29	Very low	230 Å²	230	158 Å²	158	87%	0.871	80%	0.803	S	S	*	*			trans	73	58.5	-171.5	-57.8	87	0	0	0	116.3
16	L	26.2	Very low	28.5	Very low	158 Å²	158	155.5 Å²	155.5	83%	0.827	79%	0.794	S	S	*	*			trans	-97.9	169.1	135.3	-103.2	78	0	0	0	109
17	W	25.1	Very low	28.2	Very low	233 Å²	233	155.3 Å²	155.3	88%	0.883	80%	0.803	S	S	*	*	S	Bend	trans	78.9	59	-178.3	-60.6	91.4	0	0	0	117
18	T	26.3	Very low	27.7	Very low	118 Å²	118	156.9 Å²	156.9	72%	0.724	80%	0.801	S	S	*	*			trans	-156.5	167.1	141.5	-3.8	0	0	0	0	109.9
19	I	30.2	Very low	27.6	Very low	156 Å²	156	158 Å²	158	80%	0.8	81%	0.806	S	S	*	*			trans	69.1	69.5	-174.3	-43.3	176.9	0	0	0	113.6
20	I	26.7	Very low	27.4	Very low	151 Å²	151	154.2 Å²	154.2	77%	0.774	80%	0.798	S	S	*	*			trans	-97.7	146.9	137.7	-59.5	172.2	0	0	0	105.4
21	M	25.4	Very low	27.9	Very low	167 Å²	167	149.6 Å²	149.6	82%	0.823	77%	0.774	S	S	*	*			trans	70.7	100.5	-173.8	-46.8	-63.6	-89.3	0	0	115.3
22	V	29.1	Very low	28.4	Very low	146 Å²	146	146 Å²	146	89%	0.885	77%	0.765	S	S	*	*				-172.4	136.5	128.5	147.1	0	0	0	0	109.2
23	G	26.5	Very low	28.8	Very low	56 Å²	56	142.7 Å²	142.7	58%	0.577	74%	0.738	S	S	*	*			trans	63.9	99.2	145.8	0	0	0	0	0	119.9	V25	G23-V25 PolarHBondContact O-N 3.26Å
24	W	24.3	Very low	29.3	Very low	231 Å²	231	140.2 Å²	140.2	88%	0.875	72%	0.724	S	S	*	*			trans	-67	95.8	147.3	-85.9	35.6	0	0	0	109.1
25	V	25.3	Very low	29.5	Very low	124 Å²	124	132.8 Å²	132.8	75%	0.752	71%	0.713	S	S	*	*			trans	-106.7	123.2	169.8	-179.4	0	0	0	0	108.6	G23 C27	G23-V25 PolarHBondContact O-N 3.26Å; V25-C27 PolarHBondContact O-N 3Å
26	T	27.8	Very low	29.5	Very low	114 Å²	114	129 Å²	129	70%	0.699	72%	0.716	S	S	*	*			trans	-62.4	127.8	172.7	47.9	0	0	0	0	110	Q28	T26-Q28 PolarHBondContact O-N 3.42Å
27	C	23.6	Very low	29.9	Very low	130 Å²	130	127.4 Å²	127.4	88%	0.878	71%	0.707	S	S	*	*			trans	-68	74.3	174.6	-63	0	0	0	0	112	V25 I29	V25-C27 PolarHBondContact O-N 3Å; C27-I29 PolarHBondContact O-N 3.06Å
28	Q	26.1	Very low	29.9	Very low	171 Å²	171	121.8 Å²	121.8	80%	0.799	70%	0.699	S	S	*	*			trans	-70.9	103.5	156	-73.3	-176.1	-27.4	0	0	107.3	T26	T26-Q28 PolarHBondContact O-N 3.42Å
29	I	27.6	Very low	30	Very low	148 Å²	148	122.4 Å²	122.4	76%	0.759	70%	0.704	S	S	*	*			trans	-59.1	125	161.3	-61.9	171.6	0	0	0	105.9	C27 N31	C27-I29 PolarHBondContact O-N 3.06Å; I29-N31 PolarHBondContact O-N 2.72Å; I29-N31 VanDerWaalsContact O-N 3.11Å
30	P	29.3	Very low	30.2	Very low	112 Å²	112	121.1 Å²	121.1	73%	0.727	70%	0.698	S	S	*	*			trans	-61.6	119.8	179.9	24.8	-33.2	0	0	0	108.9	P32	P30-P32 VanDerWaalsContact O-CD 3.29Å; P30-P32 WeakPolarHBondContact O-CD 3.06Å
31	N	39.4	Very low	30.4	Very low	63 Å²	63	122.2 Å²	122.2	34%	0.337	70%	0.7	S	S	.	*			trans	-72.2	111.5	-177.3	-177.4	4.6	0	0	0	109	I29 F33 S34 P318	I29-N31 PolarHBondContact O-N 2.72Å; I29-N31 VanDerWaalsContact O-N 3.11Å; N31-F33 PolarHBondContact O-N 3.21Å; N31-F33 WeakPolarHBondContact OD1-CD2 3.32Å; N31-F33 PolarHBondContact OD1-N 3.47Å; N31-S34 PolarHBondContact O-N 3.16Å; N31-S34 PolarHBondContact O-OG 3.39Å; N31-S34 VanDerWaalsContact O-OG 3.09Å; N31-P318 PolarHBondContact ND2-O 3.05Å
32	P	40.9	Very low	30.6	Very low	111 Å²	111	119.2 Å²	119.2	72%	0.721	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-7.3	-173.4	29.8	-35.7	0	0	0	113.2	P30	P30-P32 VanDerWaalsContact O-CD 3.29Å; P30-P32 WeakPolarHBondContact O-CD 3.06Å
33	F	41.1	Very low	31.3	Very low	48 Å²	48	113.8 Å²	113.8	21%	0.211	66%	0.664	C	S	.	*	T	Hydrogen-bonded Turn	trans	-100.6	-5.6	-179.1	-51.4	-69.8	0	0	0	114.1	N31 G35 M370 A393	N31-F33 PolarHBondContact O-N 3.21Å; N31-F33 WeakPolarHBondContact OD1-CD2 3.32Å; N31-F33 PolarHBondContact OD1-N 3.47Å; F33-G35 PolarHBondContact O-N 2.95Å; F33-M370 WeakPolarHBondContact CE1-O 3.15Å; F33-A393 HydrophobicContact CB-CB 4.13Å; F33-A393 HydrophobicContact CD1-CB 4.12Å; F33-A393 HydrophobicContact CG-CB 4.07Å
34	S	40.8	Very low	32.5	Very low	61 Å²	61	118.8 Å²	118.8	43%	0.427	67%	0.672	S	S	.	*			trans	-90	103.1	-176.8	60.9	0	0	0	0	112.6	N31	N31-S34 PolarHBondContact O-N 3.16Å; N31-S34 PolarHBondContact O-OG 3.39Å; N31-S34 VanDerWaalsContact O-OG 3.09Å
35	G	31	Very low	34.4	Very low	60 Å²	60	110.2 Å²	110.2	62%	0.619	64%	0.64	S	S	*	*			trans	-60.3	160.9	150.6	0	0	0	0	0	110.8	F33 L37	F33-G35 PolarHBondContact O-N 2.95Å; G35-L37 PolarHBondContact O-N 2.98Å
36	T	27.5	Very low	36.5	Very low	152 Å²	152	107.8 Å²	107.8	93%	0.933	64%	0.64	S	S	*	*			trans	-56.2	101.2	-173.7	46.4	0	0	0	0	113.2
37	L	33.2	Very low	39.3	Very low	123 Å²	123	102.8 Å²	102.8	64%	0.644	61%	0.609	S	S	*	*			trans	-77.7	138.7	173.3	-74.1	168.6	0	0	0	111.2	G35	G35-L37 PolarHBondContact O-N 2.98Å
38	T	27	Very low	42.6	Very low	116 Å²	116	97 Å²	97	71%	0.712	57%	0.569	S	S	*	*			trans	-79.4	145.5	173.1	44.1	0	0	0	0	111	I40	T38-I40 PolarHBondContact O-N 3.14Å; T38-I40 VanDerWaalsContact O-N 3.14Å
39	P	26.6	Very low	45.8	Very low	130 Å²	130	89.4 Å²	89.4	84%	0.844	53%	0.533	S	S	*	.			trans	-77.6	101.7	-176.4	30.1	-34.1	0	0	0	111.6
40	I	34.7	Very low	48.8	Very low	130 Å²	130	87.2 Å²	87.2	67%	0.667	52%	0.52	S	S	*	.			trans	-78.3	139.2	172.6	-61.4	178.9	0	0	0	110	T38	T38-I40 PolarHBondContact O-N 3.14Å; T38-I40 VanDerWaalsContact O-N 3.14Å
41	Q	30.6	Very low	51.7	Low	174 Å²	174	83.2 Å²	83.2	81%	0.813	49%	0.49	S	S	*	.			trans	-72.8	137.5	-165.9	-66.8	171.8	-65.8	0	0	114.8	S43	Q41-S43 PolarHBondContact O-N 2.6Å
42	S	31.4	Very low	53.8	Low	103 Å²	103	80.9 Å²	80.9	72%	0.72	48%	0.481	S	S	*	.			trans	36.5	63.7	148.6	64.5	0	0	0	0	118.7
43	S	43.6	Very low	55.6	Low	33 Å²	33	83.3 Å²	83.3	23%	0.231	48%	0.48	C	S	.	.				-85.9	144.2	127.7	172.8	0	0	0	0	107.6	Q41 Y45	Q41-S43 PolarHBondContact O-N 2.6Å; S43-Y45 PolarHBondContact O-N 2.88Å; S43-Y45 PolarHBondContact OG-N 3.36Å; S43-Y45 VanDerWaalsContact OG-N 3.16Å; S43-Y45 PolarHBondContact OG-O 3.38Å
44	H	51.4	Low	57.5	Low	160 Å²	160	84.5 Å²	84.5	74%	0.741	51%	0.506	S	S	*	.	S	Bend	trans	-64.3	-19.7	172.4	-128.5	-9.1	0	0	0	111.7
45	Y	62.7	Low	59.7	Low	51 Å²	51	83.2 Å²	83.2	20%	0.2	50%	0.496	C	S	.	.	S	Bend	trans	-127.6	93.1	-180	-59.6	-67.2	0	0	0	109.6	S43 N47 L48 Y51 H267	S43-Y45 PolarHBondContact O-N 2.88Å; S43-Y45 PolarHBondContact OG-N 3.36Å; S43-Y45 VanDerWaalsContact OG-N 3.16Å; S43-Y45 PolarHBondContact OG-O 3.38Å; Y45-N47 PolarHBondContact O-N 3.11Å; Y45-L48 HydrophobicContact CD2-CD1 4.33Å; Y45-L48 HydrophobicContact CG-CD1 4.4Å; Y45-L48 PolarHBondContact O-N 3.3Å; Y45-Y51 HydrophobicContact CD2-CE1 4.33Å; Y45-Y51 WeakPolarHBondContact CD2-OH 3.46Å; Y45-Y51 WeakPolarHBondContact CE2-OH 3.48Å; Y45-H267 AromaticContact CD1-CD2 3.58Å; Y45-H267 AromaticContact CD1-CE1 3.62Å; Y45-H267 AromaticContact CD1-CG 3.93Å; Y45-H267 AromaticContact CD1-ND1 3.96Å; Y45-H267 AromaticContact CD1-NE2 3.41Å; Y45-H267 WeakPolarHBondContact CD1-NE2 3.47Å; Y45-H267 AromaticContact CE1-NE2 3.99Å
46	G	71.1	Confident	62.5	Low	73 Å²	73	82.4 Å²	82.4	75%	0.753	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	11.6	-166.2	0	0	0	0	0	118.9
47	N	86	Confident	65.4	Low	9 Å²	9	76.1 Å²	76.1	5%	0.048	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	-4.9	168.2	71.6	-44.6	0	0	0	113.9	Y45 Y266 H267 V321 R322	Y45-N47 PolarHBondContact O-N 3.11Å; N47-Y266 PolarHBondContact ND2-O 3.42Å; N47-H267 PolarHBondContact OD1-ND1 3.25Å; N47-V321 HydrophobicContact CB-CB 4.05Å; N47-V321 HydrophobicContact CB-CG1 4.46Å; N47-V321 HydrophobicContact CB-CG2 4.47Å; N47-R322 WeakPolarHBondContact CB-O 3.38Å; N47-R322 PolarHBondContact ND2-O 3.45Å
48	L	91.8	Very high	68.2	Low	9 Å²	9	71.9 Å²	71.9	5%	0.047	42%	0.416	C	S	.	.	S	Bend	trans	-94.5	145.5	172.8	-53.7	-175.1	0	0	0	110.1	Y45 Y51 T212 T246 Q248 N265 H267	Y45-L48 HydrophobicContact CD2-CD1 4.33Å; Y45-L48 HydrophobicContact CG-CD1 4.4Å; Y45-L48 PolarHBondContact O-N 3.3Å; L48-Y51 HydrophobicContact CB-CE1 4.47Å; L48-Y51 HydrophobicContact CD1-CE1 3.9Å; L48-T212 HydrophobicContact CD1-CG2 4.39Å; L48-T246 HydrophobicContact CD1-CG2 3.97Å; L48-Q248 HydrophobicContact CD2-CB 4.04Å; L48-N265 HydrophobicContact CD2-CB 3.59Å; L48-H267 HydrophobicContact CD1-CB 4.14Å; L48-H267 HydrophobicContact CD2-CB 4.14Å; L48-H267 HydrophobicContact CG-CB 4.18Å
49	Y	93.2	Very high	71.1	Confident	11 Å²	11	70 Å²	70	4%	0.043	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-66.2	153	166.7	-64.1	-69.2	0	0	0	110.5	Y51 F185 I189 D192 Q248 V250 I263 N265 R324	Y49-Y51 WeakPolarHBondContact O-CD1 3.42Å; Y49-Y51 PolarHBondContact O-N 2.97Å; Y49-F185 HydrophobicContact CG-CE2 4.43Å; Y49-F185 HydrophobicContact CG-CZ 4.4Å; Y49-I189 HydrophobicContact CE1-CG1 4.32Å; Y49-I189 HydrophobicContact CE2-CG1 4.48Å; Y49-D192 PolarHBondContact OH-OD2 2.94Å; Y49-Q248 PolarHBondContact O-NE2 2.85Å; Y49-V250 HydrophobicContact CD2-CG2 3.58Å; Y49-V250 HydrophobicContact CE2-CG2 3.91Å; Y49-I263 HydrophobicContact CE2-CD1 4.18Å; Y49-I263 HydrophobicContact CE2-CG2 4.1Å; Y49-I263 WeakPolarHBondContact OH-CD1 3.38Å; Y49-N265 WeakPolarHBondContact CD2-ND2 3.46Å; Y49-R324 PolarHBondContact OH-NH1 3.09Å
50	Q	90.7	Very high	73.9	Confident	102 Å²	102	64 Å²	64	48%	0.477	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-59.1	133.6	-177.5	-171	-176.7	-1.9	0	0	112.3	T55 R147	Q50-T55 HydrophobicContact CG-CG2 3.9Å; Q50-R147 PolarHBondContact O-NH2 2.83Å
51	Y	90.5	Very high	75.7	Confident	29 Å²	29	65 Å²	65	11%	0.114	36%	0.356	C	S	.	.			trans	-148.3	168.2	-176.4	74.4	-85.6	0	0	0	110.2	Y45 L48 Y49 D57 H145 T212 E214	Y45-Y51 HydrophobicContact CD2-CE1 4.33Å; Y45-Y51 WeakPolarHBondContact CD2-OH 3.46Å; Y45-Y51 WeakPolarHBondContact CE2-OH 3.48Å; L48-Y51 HydrophobicContact CB-CE1 4.47Å; L48-Y51 HydrophobicContact CD1-CE1 3.9Å; Y49-Y51 WeakPolarHBondContact O-CD1 3.42Å; Y49-Y51 PolarHBondContact O-N 2.97Å; Y51-D57 VanDerWaalsContact CA-OD2 3.26Å; Y51-D57 WeakPolarHBondContact CA-OD2 3.28Å; Y51-D57 VanDerWaalsContact CB-OD2 3.24Å; Y51-D57 WeakPolarHBondContact CB-OD2 3.3Å; Y51-H145 HydrophobicContact CD2-CB 4.26Å; Y51-T212 HydrophobicContact CD1-CG2 3.88Å; Y51-T212 HydrophobicContact CD2-CG2 3.71Å; Y51-T212 HydrophobicContact CE1-CG2 3.77Å; Y51-T212 HydrophobicContact CE2-CG2 3.59Å; Y51-T212 HydrophobicContact CG-CG2 3.84Å; Y51-E214 HydrophobicContact CE2-CB 4.21Å; Y51-E214 HydrophobicContact CE2-CG 4.43Å; Y51-E214 PolarHBondContact OH-OE1 3.48Å
52	G	84.7	Confident	77.4	Confident	14 Å²	14	63.3 Å²	63.3	14%	0.144	35%	0.352	C	S	.	.	S	Bend	trans	73.8	-141.6	174.4	0	0	0	0	0	114.9	G54 T55 D57	G52-G54 PolarHBondContact O-N 3.13Å; G52-G54 VanDerWaalsContact O-N 3.14Å; G52-T55 PolarHBondContact N-OG1 2.69Å; G52-T55 PolarHBondContact O-N 3Å; G52-T55 PolarHBondContact O-OG1 3.33Å; G52-D57 PolarHBondContact N-OD2 3.2Å
53	K	79.2	Confident	78.8	Confident	162 Å²	162	69.6 Å²	69.6	70%	0.704	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	117.1	-173.2	-70.8	-179.9	-177.3	173.5	0	111.3	D140	K53-D140 IonicContact NZ-OD2 3.03Å; K53-D140 PolarHBondContact NZ-OD2 2.79Å
54	G	80.3	Confident	79.8	Confident	73 Å²	73	70.5 Å²	70.5	75%	0.753	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	106	-0.2	-176.3	0	0	0	0	0	114.7	G52	G52-G54 PolarHBondContact O-N 3.13Å; G52-G54 VanDerWaalsContact O-N 3.14Å
55	T	86.8	Confident	80.3	Confident	34 Å²	34	63.8 Å²	63.8	21%	0.209	33%	0.33	C	S	.	.	S	Bend	trans	-117.6	178.4	169.1	60.1	0	0	0	0	110.4	Q50 G52 D57	Q50-T55 HydrophobicContact CG-CG2 3.9Å; G52-T55 PolarHBondContact N-OG1 2.69Å; G52-T55 PolarHBondContact O-N 3Å; G52-T55 PolarHBondContact O-OG1 3.33Å; T55-D57 PolarHBondContact O-N 3.24Å; T55-D57 PolarHBondContact OG1-OD1 3.12Å
56	T	88.9	Confident	80.3	Confident	42 Å²	42	65 Å²	65	26%	0.258	34%	0.343	S	S	.	.			trans	-77.8	1.5	174.7	53.5	0	0	0	0	114.1	E58 R147 D179	T56-E58 PolarHBondContact O-N 2.88Å; T56-R147 VanDerWaalsContact OG1-CD 3.32Å; T56-R147 WeakPolarHBondContact OG1-CD 3.22Å; T56-D179 HydrophobicContact CG2-CB 4.11Å; T56-D179 WeakPolarHBondContact OG1-CB 3.46Å
57	D	90	Very high	80.1	Confident	20 Å²	20	66.9 Å²	66.9	11%	0.107	34%	0.34	C	S	.	.			trans	-48.9	123.6	-174.2	-73.7	24.4	0	0	0	113.8	Y51 G52 T55 H145 Y146 R147	Y51-D57 VanDerWaalsContact CA-OD2 3.26Å; Y51-D57 WeakPolarHBondContact CA-OD2 3.28Å; Y51-D57 VanDerWaalsContact CB-OD2 3.24Å; Y51-D57 WeakPolarHBondContact CB-OD2 3.3Å; G52-D57 PolarHBondContact N-OD2 3.2Å; T55-D57 PolarHBondContact O-N 3.24Å; T55-D57 PolarHBondContact OG1-OD1 3.12Å; D57-H145 HydrophobicContact CB-CB 4.29Å; D57-Y146 CarbonylContact C-O 3.57Å; D57-Y146 WeakPolarHBondContact CA-O 3.41Å; D57-R147 WeakPolarHBondContact OD1-CD 3.32Å; D57-R147 WeakPolarHBondContact OD1-CG 3.4Å; D57-R147 IonicContact OD1-NE 2.92Å; D57-R147 PolarHBondContact OD1-NE 2.82Å
58	E	90.8	Very high	79.6	Confident	34 Å²	34	67 Å²	67	16%	0.159	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	150.7	167.5	-162.3	178.4	140.6	0	0	109.9	T56 R69 H145 Y146	T56-E58 PolarHBondContact O-N 2.88Å; E58-R69 IonicContact OE1-CZ 2.75Å; E58-R69 IonicContact OE1-NH1 2.81Å; E58-R69 PolarHBondContact OE1-NH1 3.29Å; E58-R69 IonicContact OE1-NH2 2.6Å; E58-R69 PolarHBondContact OE1-NH2 3.26Å; E58-R69 IonicContact OE2-NH2 3.96Å; E58-H145 WeakPolarHBondContact O-CA 3.34Å; E58-Y146 HydrophobicContact CB-CE1 4.01Å; E58-Y146 HydrophobicContact CB-CE2 4.2Å; E58-Y146 VanDerWaalsContact CD-OH 3.25Å; E58-Y146 HydrophobicContact CG-CE1 4.43Å; E58-Y146 PolarHBondContact N-O 2.76Å; E58-Y146 WeakPolarHBondContact O-CD1 3.49Å; E58-Y146 PolarHBondContact O-N 2.89Å; E58-Y146 PolarHBondContact OE1-OH 3.17Å
59	K	88	Confident	79.3	Confident	76 Å²	76	68.8 Å²	68.8	33%	0.33	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.1	179.2	-168.1	179.9	-172.5	177.1	0	109.2	P139 Q142 I144	K59-P139 PolarHBondContact NZ-O 2.93Å; K59-Q142 WeakPolarHBondContact CE-O 3.42Å; K59-Q142 PolarHBondContact NZ-O 2.73Å; K59-I144 WeakPolarHBondContact CA-O 3.41Å
60	L	85.2	Confident	79.2	Confident	6 Å²	6	73.3 Å²	73.3	3%	0.031	37%	0.371	C	S	.	.			trans	-58	137.2	173	-97.9	147.7	0	0	0	111.6	E64 L65 R69 L89 I144 Y146	L60-E64 HydrophobicContact CD2-CB 3.96Å; L60-L65 HydrophobicContact CB-CD2 3.93Å; L60-R69 HydrophobicContact CD2-CB 3.54Å; L60-R69 HydrophobicContact CD2-CG 4.43Å; L60-L89 HydrophobicContact CD1-CB 4.15Å; L60-I144 HydrophobicContact CB-CB 4.27Å; L60-I144 HydrophobicContact CD1-CB 3.72Å; L60-I144 HydrophobicContact CD1-CG1 4.46Å; L60-I144 HydrophobicContact CD1-CG2 3.64Å; L60-I144 PolarHBondContact N-O 2.82Å; L60-I144 VanDerWaalsContact N-O 3.12Å; L60-Y146 HydrophobicContact CD1-CD1 4.46Å; L60-Y146 HydrophobicContact CG-CD1 4.4Å; L60-Y146 HydrophobicContact CG-CE1 4.24Å
61	Y	74	Confident	79.1	Confident	151 Å²	151	68.6 Å²	68.6	59%	0.592	35%	0.349	S	S	*	.			trans	-84.7	147.9	-178.5	-68.2	-69.6	0	0	0	112.7	R63 E64 L65	Y61-R63 PolarHBondContact O-N 3.02Å; Y61-E64 WeakPolarHBondContact CD2-OE2 3.49Å; Y61-E64 PolarHBondContact N-OE2 2.76Å; Y61-E64 VanDerWaalsContact N-OE2 3.11Å; Y61-E64 WeakPolarHBondContact O-CB 3.48Å; Y61-E64 PolarHBondContact O-N 2.9Å; Y61-L65 WeakPolarHBondContact O-CD2 3.37Å; Y61-L65 WeakPolarHBondContact O-CG 3.02Å
62	D	66	Low	79.2	Confident	137 Å²	137	70.8 Å²	70.8	73%	0.733	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-21.8	-172.6	-66.1	-36.2	0	0	0	115.8	L65	D62-L65 HydrophobicContact CB-CD1 4.4Å; D62-L65 WeakPolarHBondContact O-CG 3.47Å
63	R	59.9	Low	79.4	Confident	236 Å²	236	70.1 Å²	70.1	89%	0.891	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-22	175.2	-71.6	-177	173.2	177.5	-2.2	114.4	Y61 L65	Y61-R63 PolarHBondContact O-N 3.02Å; R63-L65 VanDerWaalsContact C-N 3.29Å
64	E	65.3	Low	79.8	Confident	51 Å²	51	65.3 Å²	65.3	24%	0.238	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-8	-179.5	-55.9	175.5	141.6	0	0	111.6	L60 Y61 T66 G68 R69	L60-E64 HydrophobicContact CD2-CB 3.96Å; Y61-E64 WeakPolarHBondContact CD2-OE2 3.49Å; Y61-E64 PolarHBondContact N-OE2 2.76Å; Y61-E64 VanDerWaalsContact N-OE2 3.11Å; Y61-E64 WeakPolarHBondContact O-CB 3.48Å; Y61-E64 PolarHBondContact O-N 2.9Å; E64-T66 PolarHBondContact O-N 3.46Å; E64-G68 CarbonylContact O-C 3.58Å; E64-G68 WeakPolarHBondContact O-CA 3.29Å; E64-G68 PolarHBondContact O-N 2.78Å; E64-R69 HydrophobicContact CB-CB 4.34Å; E64-R69 IonicContact OE1-CZ 3.42Å; E64-R69 IonicContact OE1-NE 2.72Å; E64-R69 IonicContact OE1-NH1 3.21Å; E64-R69 PolarHBondContact OE1-NH1 3.38Å; E64-R69 WeakPolarHBondContact OE2-CD 3.43Å; E64-R69 IonicContact OE2-CZ 3.06Å; E64-R69 IonicContact OE2-NE 3.73Å; E64-R69 IonicContact OE2-NH1 2.68Å; E64-R69 PolarHBondContact OE2-NH1 3.12Å
65	L	62.1	Low	80.2	Confident	19 Å²	19	62.9 Å²	62.9	10%	0.099	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-30.8	-164.6	-60.6	-169.3	0	0	0	115.1	L60 Y61 D62 R63 V91 P134 I144	L60-L65 HydrophobicContact CB-CD2 3.93Å; Y61-L65 WeakPolarHBondContact O-CD2 3.37Å; Y61-L65 WeakPolarHBondContact O-CG 3.02Å; D62-L65 HydrophobicContact CB-CD1 4.4Å; D62-L65 WeakPolarHBondContact O-CG 3.47Å; R63-L65 VanDerWaalsContact C-N 3.29Å; L65-V91 HydrophobicContact CB-CB 4.29Å; L65-V91 HydrophobicContact CB-CG2 3.36Å; L65-V91 HydrophobicContact CD1-CG2 4.06Å; L65-V91 HydrophobicContact CD2-CG2 3.39Å; L65-V91 HydrophobicContact CG-CG2 3.7Å; L65-V91 WeakPolarHBondContact O-CG2 3.39Å; L65-P134 HydrophobicContact CD1-CG 3.93Å; L65-I144 HydrophobicContact CD2-CD1 4.13Å
66	T	62.1	Low	80.4	Confident	76 Å²	76	65.1 Å²	65.1	47%	0.466	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-46.9	-175	48.4	0	0	0	0	112.3	E64 G68	E64-T66 PolarHBondContact O-N 3.46Å; T66-G68 VanDerWaalsContact C-N 3.31Å
67	T	66.6	Low	80.6	Confident	113 Å²	113	63.1 Å²	63.1	69%	0.693	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-20.7	175.9	55	0	0	0	0	113.1
68	G	76.6	Confident	80.7	Confident	12 Å²	12	62.2 Å²	62.2	12%	0.124	30%	0.295	C	S	.	.			trans	78.5	164.9	-167.4	0	0	0	0	0	112.9	E64 T66 L89	E64-G68 CarbonylContact O-C 3.58Å; E64-G68 WeakPolarHBondContact O-CA 3.29Å; E64-G68 PolarHBondContact O-N 2.78Å; T66-G68 VanDerWaalsContact C-N 3.31Å; G68-L89 CarbonylContact C-O 3.56Å; G68-L89 WeakPolarHBondContact CA-O 3.32Å
69	R	85.5	Confident	80.8	Confident	47 Å²	47	60.6 Å²	60.6	18%	0.177	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	128	178.1	-175	-175.4	179.9	149.5	-18.1	109.8	E58 L60 E64 V88 L89 Y146	E58-R69 IonicContact OE1-CZ 2.75Å; E58-R69 IonicContact OE1-NH1 2.81Å; E58-R69 PolarHBondContact OE1-NH1 3.29Å; E58-R69 IonicContact OE1-NH2 2.6Å; E58-R69 PolarHBondContact OE1-NH2 3.26Å; E58-R69 IonicContact OE2-NH2 3.96Å; L60-R69 HydrophobicContact CD2-CB 3.54Å; L60-R69 HydrophobicContact CD2-CG 4.43Å; E64-R69 HydrophobicContact CB-CB 4.34Å; E64-R69 IonicContact OE1-CZ 3.42Å; E64-R69 IonicContact OE1-NE 2.72Å; E64-R69 IonicContact OE1-NH1 3.21Å; E64-R69 PolarHBondContact OE1-NH1 3.38Å; E64-R69 WeakPolarHBondContact OE2-CD 3.43Å; E64-R69 IonicContact OE2-CZ 3.06Å; E64-R69 IonicContact OE2-NE 3.73Å; E64-R69 IonicContact OE2-NH1 2.68Å; E64-R69 PolarHBondContact OE2-NH1 3.12Å; R69-V88 WeakPolarHBondContact O-CA 3.39Å; R69-L89 PolarHBondContact N-O 3.23Å; R69-L89 PolarHBondContact O-N 3.38Å; R69-Y146 PolarHBondContact NE-OH 3.35Å; R69-Y146 PolarHBondContact NH2-OH 2.86Å
70	Q	89.3	Confident	80.9	Confident	105 Å²	105	57.1 Å²	57.1	49%	0.491	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	135.5	166.9	-177.2	-178.5	-36.5	0	0	109.9	D72 Y86 T87 V88	Q70-D72 PolarHBondContact NE2-OD1 2.94Å; Q70-Y86 HydrophobicContact CG-CD2 4.06Å; Q70-Y86 HydrophobicContact CG-CG 4.3Å; Q70-T87 CarbonylContact C-O 3.43Å; Q70-T87 WeakPolarHBondContact CA-O 3.26Å; Q70-V88 HydrophobicContact CB-CG2 4.34Å
71	I	89.9	Confident	81	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	127.7	174.5	-61.8	172.8	0	0	0	107.6	Y86 T87 L89 Y146 Y177	I71-Y86 CarbonylContact O-C 3.48Å; I71-Y86 VanDerWaalsContact O-CA 3.25Å; I71-Y86 WeakPolarHBondContact O-CA 3.45Å; I71-T87 HydrophobicContact CB-CG2 4.44Å; I71-T87 PolarHBondContact N-O 2.58Å; I71-T87 PolarHBondContact O-N 3.15Å; I71-L89 HydrophobicContact CD1-CD1 3.36Å; I71-L89 HydrophobicContact CD1-CG 3.73Å; I71-Y146 HydrophobicContact CD1-CD1 4.23Å; I71-Y146 HydrophobicContact CD1-CD2 3.43Å; I71-Y146 VanDerWaalsContact CD1-CD2 3.43Å; I71-Y146 HydrophobicContact CD1-CE1 4.24Å; I71-Y146 HydrophobicContact CD1-CE2 3.42Å; I71-Y146 VanDerWaalsContact CD1-CE2 3.42Å; I71-Y146 HydrophobicContact CD1-CG 3.84Å; I71-Y146 HydrophobicContact CG1-CE2 4.1Å; I71-Y146 HydrophobicContact CG2-CE2 4.5Å; I71-Y177 HydrophobicContact CG2-CD2 4.43Å; I71-Y177 HydrophobicContact CG2-CE1 4.39Å; I71-Y177 HydrophobicContact CG2-CE2 3.71Å
72	D	91	Very high	81.6	Confident	76 Å²	76	49.9 Å²	49.9	41%	0.406	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	131.6	175.2	-57.1	-34.5	0	0	0	109.5	Q70 F74 Y177	Q70-D72 PolarHBondContact NE2-OD1 2.94Å; D72-F74 HydrophobicContact CB-CD1 4.44Å; D72-F74 HydrophobicContact CB-CE1 3.92Å; D72-F74 HydrophobicContact CB-CZ 3.98Å; D72-F74 WeakPolarHBondContact O-CE2 3.24Å; D72-Y177 PolarHBondContact O-OH 3.43Å
73	L	90.7	Very high	82.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-10.7	-172.2	-62.1	172.9	0	0	0	113	T75 F77 N85 T87 L148 L209	L73-T75 PolarHBondContact O-N 2.83Å; L73-F77 HydrophobicContact CB-CD2 3.9Å; L73-F77 HydrophobicContact CB-CE2 3.94Å; L73-F77 HydrophobicContact CD1-CB 4.39Å; L73-F77 HydrophobicContact CD1-CD2 3.65Å; L73-F77 HydrophobicContact CD1-CE2 4.26Å; L73-F77 HydrophobicContact CD1-CG 4.25Å; L73-F77 HydrophobicContact CD2-CD2 4.47Å; L73-F77 HydrophobicContact CD2-CE2 4.27Å; L73-F77 HydrophobicContact CG-CD2 4.21Å; L73-F77 HydrophobicContact CG-CE2 4.39Å; L73-N85 WeakPolarHBondContact CB-O 3.41Å; L73-N85 PolarHBondContact N-O 3.03Å; L73-T87 HydrophobicContact CD2-CG2 4.03Å; L73-L148 HydrophobicContact CD2-CD1 4.2Å; L73-L148 WeakPolarHBondContact O-CD2 3.27Å; L73-L209 HydrophobicContact CD2-CB 4.48Å; L73-L209 HydrophobicContact CD2-CD1 4.26Å; L73-L209 HydrophobicContact CD2-CD2 4.21Å
74	F	87.5	Confident	83.9	Confident	61 Å²	61	37.9 Å²	37.9	27%	0.268	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	55	-10.7	179.6	-51.2	-66.6	0	0	0	117.6	D72 L148 F150 M169 P175 Y177 V178	D72-F74 HydrophobicContact CB-CD1 4.44Å; D72-F74 HydrophobicContact CB-CE1 3.92Å; D72-F74 HydrophobicContact CB-CZ 3.98Å; D72-F74 WeakPolarHBondContact O-CE2 3.24Å; F74-L148 HydrophobicContact CD2-CD2 3.89Å; F74-L148 HydrophobicContact CE2-CD2 4.49Å; F74-F150 HydrophobicContact CB-CZ 4.16Å; F74-M169 HydrophobicContact CB-CE 4.35Å; F74-M169 HydrophobicContact CB-SD 3.43Å; F74-M169 WeakPolarHBondContact CB-SD 3.48Å; F74-M169 HydrophobicContact CD1-CE 3.41Å; F74-M169 VanDerWaalsContact CD1-CE 3.41Å; F74-M169 HydrophobicContact CD1-SD 3.67Å; F74-M169 HydrophobicContact CD2-CE 3.91Å; F74-M169 HydrophobicContact CD2-SD 3.78Å; F74-M169 HydrophobicContact CE1-CE 3.55Å; F74-M169 HydrophobicContact CE1-SD 4.39Å; F74-M169 HydrophobicContact CE2-CE 4.03Å; F74-M169 HydrophobicContact CE2-SD 4.47Å; F74-M169 HydrophobicContact CG-CE 3.62Å; F74-M169 HydrophobicContact CG-SD 3.32Å; F74-M169 WeakPolarHBondContact CG-SD 3.25Å; F74-M169 HydrophobicContact CZ-CE 3.87Å; F74-P175 HydrophobicContact CE2-CG 3.96Å; F74-P175 HydrophobicContact CZ-CG 3.75Å; F74-Y177 HydrophobicContact CE2-CE2 4.18Å; F74-Y177 WeakPolarHBondContact CE2-OH 3.11Å; F74-V178 HydrophobicContact CD2-CG2 4.41Å; F74-V178 HydrophobicContact CE2-CG2 4.06Å
75	T	88.5	Confident	85	Confident	21 Å²	21	39.5 Å²	39.5	13%	0.129	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	171.3	164.5	-169.1	0	0	0	0	109.2	L73 F77 V207 T253	L73-T75 PolarHBondContact O-N 2.83Å; T75-F77 HydrophobicContact CG2-CD2 3.95Å; T75-F77 HydrophobicContact CG2-CE2 3.56Å; T75-F77 HydrophobicContact CG2-CZ 4.34Å; T75-V207 HydrophobicContact CG2-CB 4.06Å; T75-V207 HydrophobicContact CG2-CG1 4.04Å; T75-V207 HydrophobicContact CG2-CG2 3.9Å; T75-T253 HydrophobicContact CG2-CG2 3.91Å
76	F	90.4	Very high	86.5	Confident	82 Å²	82	41.8 Å²	41.8	36%	0.36	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	128.8	172.5	-67.7	-75.5	0	0	0	111.4	P78 R83 Y84 N85 G257	F76-P78 VanDerWaalsContact O-CD 3.32Å; F76-P78 WeakPolarHBondContact O-CD 3Å; F76-R83 HydrophobicContact CB-CG 4.02Å; F76-R83 HydrophobicContact CD1-CB 4.05Å; F76-R83 HydrophobicContact CD1-CG 4.29Å; F76-R83 HydrophobicContact CG-CG 4.29Å; F76-Y84 WeakPolarHBondContact CA-O 3.42Å; F76-N85 HydrophobicContact CD1-CB 4.11Å; F76-N85 HydrophobicContact CE1-CB 4Å; F76-G257 WeakPolarHBondContact O-CA 3.4Å
77	F	93	Very high	88	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	106.3	165.8	-76.2	-99.3	0	0	0	109.1	L73 T75 Y79 Y84 L148 V207 L251 T253	L73-F77 HydrophobicContact CB-CD2 3.9Å; L73-F77 HydrophobicContact CB-CE2 3.94Å; L73-F77 HydrophobicContact CD1-CB 4.39Å; L73-F77 HydrophobicContact CD1-CD2 3.65Å; L73-F77 HydrophobicContact CD1-CE2 4.26Å; L73-F77 HydrophobicContact CD1-CG 4.25Å; L73-F77 HydrophobicContact CD2-CD2 4.47Å; L73-F77 HydrophobicContact CD2-CE2 4.27Å; L73-F77 HydrophobicContact CG-CD2 4.21Å; L73-F77 HydrophobicContact CG-CE2 4.39Å; T75-F77 HydrophobicContact CG2-CD2 3.95Å; T75-F77 HydrophobicContact CG2-CE2 3.56Å; T75-F77 HydrophobicContact CG2-CZ 4.34Å; F77-Y79 PolarHBondContact O-N 2.82Å; F77-Y84 PolarHBondContact N-O 3.23Å; F77-Y84 PolarHBondContact O-N 3.19Å; F77-L148 HydrophobicContact CE2-CD1 4.31Å; F77-L148 HydrophobicContact CZ-CD1 4.27Å; F77-V207 HydrophobicContact CE2-CG1 4.25Å; F77-V207 HydrophobicContact CZ-CB 4.21Å; F77-V207 HydrophobicContact CZ-CG1 3.93Å; F77-L251 HydrophobicContact CB-CD2 4.21Å; F77-L251 HydrophobicContact CD1-CD2 3.7Å; F77-L251 HydrophobicContact CD1-CG 3.71Å; F77-L251 HydrophobicContact CE1-CD2 4.33Å; F77-L251 HydrophobicContact CE1-CG 4.1Å; F77-L251 WeakPolarHBondContact CE1-O 3.2Å; F77-L251 HydrophobicContact CG-CD2 4.13Å; F77-T253 HydrophobicContact CD1-CG2 3.76Å; F77-T253 HydrophobicContact CD2-CG2 4.2Å; F77-T253 HydrophobicContact CE1-CG2 3.63Å; F77-T253 HydrophobicContact CE2-CG2 4.08Å; F77-T253 HydrophobicContact CG-CG2 4.08Å; F77-T253 HydrophobicContact CZ-CG2 3.81Å
78	P	92.9	Very high	89.2	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	130.2	166.9	-32.5	37.3	0	0	0	112.9	F76 G82 R83 G257 S260 D330 Y872	F76-P78 VanDerWaalsContact O-CD 3.32Å; F76-P78 WeakPolarHBondContact O-CD 3Å; P78-G82 WeakPolarHBondContact CA-O 3.43Å; P78-R83 HydrophobicContact CG-CG 4.43Å; P78-G257 WeakPolarHBondContact CG-O 3.38Å; P78-S260 VanDerWaalsContact CD-OG 3.28Å; P78-S260 WeakPolarHBondContact CD-OG 3.35Å; P78-S260 WeakPolarHBondContact O-CB 3.29Å; P78-S260 PolarHBondContact O-OG 2.87Å; P78-S260 VanDerWaalsContact O-OG 3.08Å; P78-D330 HydrophobicContact CB-CB 4Å; P78-Y872 HydrophobicContact CB-CE1 4.38Å; P78-Y872 WeakPolarHBondContact CB-OH 3.28Å
79	Y	93.4	Very high	89.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	124	173.9	-177	-104.1	0	0	0	110.7	F77 G81 G82 Y84 F97 A123 L124 I125 L289 N290 V329	F77-Y79 PolarHBondContact O-N 2.82Å; Y79-G81 PolarHBondContact O-N 3.21Å; Y79-G81 VanDerWaalsContact O-N 3.08Å; Y79-G82 PolarHBondContact N-O 3.06Å; Y79-G82 PolarHBondContact O-N 3.35Å; Y79-Y84 HydrophobicContact CD1-CE2 4.26Å; Y79-Y84 WeakPolarHBondContact O-CE2 3.4Å; Y79-F97 AromaticContact CD1-CD2 3.51Å; Y79-F97 HydrophobicContact CD1-CD2 3.51Å; Y79-F97 AromaticContact CD1-CE2 3.49Å; Y79-F97 HydrophobicContact CD1-CE2 3.49Å; Y79-F97 VanDerWaalsContact CD1-CE2 3.49Å; Y79-F97 HydrophobicContact CD2-CE2 4.06Å; Y79-F97 AromaticContact CE1-CD2 3.92Å; Y79-F97 HydrophobicContact CE1-CD2 3.92Å; Y79-F97 AromaticContact CE1-CE2 3.89Å; Y79-F97 HydrophobicContact CE1-CE2 3.89Å; Y79-F97 HydrophobicContact CE2-CE2 4.42Å; Y79-F97 HydrophobicContact CG-CD2 4.04Å; Y79-F97 AromaticContact CG-CE2 3.59Å; Y79-F97 HydrophobicContact CG-CE2 3.59Å; Y79-F97 HydrophobicContact CG-CZ 4.28Å; Y79-A123 HydrophobicContact CD1-CB 4.43Å; Y79-A123 HydrophobicContact CE1-CB 4.37Å; Y79-L124 PolarHBondContact OH-O 2.92Å; Y79-I125 HydrophobicContact CD2-CD1 4.25Å; Y79-I125 HydrophobicContact CD2-CG1 4.35Å; Y79-I125 HydrophobicContact CE2-CD1 3.82Å; Y79-I125 HydrophobicContact CE2-CG1 3.53Å; Y79-L289 HydrophobicContact CE2-CD2 4.41Å; Y79-L289 WeakPolarHBondContact OH-CA 3.27Å; Y79-L289 WeakPolarHBondContact OH-CB 3.38Å; Y79-N290 WeakPolarHBondContact CE1-O 3.34Å; Y79-N290 PolarHBondContact OH-N 2.98Å; Y79-N290 PolarHBondContact OH-O 2.74Å; Y79-V329 CarbonylContact C-O 3.58Å; Y79-V329 WeakPolarHBondContact CA-O 3.45Å; Y79-V329 HydrophobicContact CD2-CB 3.86Å; Y79-V329 HydrophobicContact CD2-CG2 3.89Å; Y79-V329 HydrophobicContact CE2-CB 4.13Å; Y79-V329 HydrophobicContact CE2-CG2 4.49Å
80	Y	90	Very high	90.1	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.016	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	30.5	-177.1	-94.7	-94.2	0	0	0	114.5	G82 L289 G291 G296 V298 V329 D331 V333 R870	Y80-G82 VanDerWaalsContact C-N 3.29Å; Y80-G82 PolarHBondContact O-N 2.86Å; Y80-L289 HydrophobicContact CE2-CB 4.28Å; Y80-L289 PolarHBondContact OH-O 2.86Å; Y80-L289 VanDerWaalsContact OH-O 3.13Å; Y80-G291 VanDerWaalsContact CD1-CA 3.42Å; Y80-G296 WeakPolarHBondContact CE1-O 3.29Å; Y80-G296 VanDerWaalsContact CZ-O 3.23Å; Y80-G296 PolarHBondContact OH-O 2.98Å; Y80-G296 VanDerWaalsContact OH-O 3.13Å; Y80-V298 PolarHBondContact OH-N 3.17Å; Y80-V329 PolarHBondContact N-O 3.27Å; Y80-D331 CarbonylContact C-O 3.58Å; Y80-D331 VanDerWaalsContact C-O 3.23Å; Y80-D331 VanDerWaalsContact CA-O 3.31Å; Y80-D331 WeakPolarHBondContact CA-O 3.19Å; Y80-V333 HydrophobicContact CD2-CG2 3.76Å; Y80-V333 HydrophobicContact CE2-CB 4.2Å; Y80-V333 HydrophobicContact CE2-CG2 3.18Å; Y80-R870 WeakPolarHBondContact O-CG 3.27Å; Y80-R870 PolarHBondContact O-NE 2.9Å; Y80-R870 PolarHBondContact O-NH1 3.49Å
81	G	86.1	Confident	90	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.01	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	82	0.7	-179.6	0	0	0	0	0	114.6	Y79 D330 D331 R870 Y872	Y79-G81 PolarHBondContact O-N 3.21Å; Y79-G81 VanDerWaalsContact O-N 3.08Å; G81-D330 WeakPolarHBondContact CA-O 3.4Å; G81-D330 PolarHBondContact N-O 3.08Å; G81-D331 WeakPolarHBondContact CA-OD1 3.45Å; G81-R870 CarbonylContact O-C 3.55Å; G81-R870 VanDerWaalsContact O-CA 3.25Å; G81-R870 WeakPolarHBondContact O-CA 3.43Å; G81-Y872 WeakPolarHBondContact O-CD1 3.35Å; G81-Y872 WeakPolarHBondContact O-CE1 3.31Å
82	G	86.1	Confident	89.9	Confident	4 Å²	4	26.2 Å²	26.2	4%	0.041	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	163.1	164	0	0	0	0	0	111.6	P78 Y79 Y80 T869	P78-G82 WeakPolarHBondContact CA-O 3.43Å; Y79-G82 PolarHBondContact N-O 3.06Å; Y79-G82 PolarHBondContact O-N 3.35Å; Y80-G82 VanDerWaalsContact C-N 3.29Å; Y80-G82 PolarHBondContact O-N 2.86Å; G82-T869 VanDerWaalsContact CA-O 3.29Å; G82-T869 WeakPolarHBondContact CA-O 3.32Å
83	R	85.1	Confident	89.8	Confident	86 Å²	86	22.6 Å²	22.6	33%	0.325	10%	0.103	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	112	178.2	-112.5	-170.2	168.8	-169.8	-5.2	109.7	F76 P78 A256 G257 Y872	F76-R83 HydrophobicContact CB-CG 4.02Å; F76-R83 HydrophobicContact CD1-CB 4.05Å; F76-R83 HydrophobicContact CD1-CG 4.29Å; F76-R83 HydrophobicContact CG-CG 4.29Å; P78-R83 HydrophobicContact CG-CG 4.43Å; R83-A256 PolarHBondContact NH2-O 2.97Å; R83-G257 PolarHBondContact NE-O 2.83Å; R83-G257 PolarHBondContact NH2-O 2.83Å; R83-Y872 HydrophobicContact CB-CD1 3.95Å; R83-Y872 HydrophobicContact CB-CE1 4.48Å; R83-Y872 HydrophobicContact CB-CG 4.05Å; R83-Y872 HydrophobicContact CG-CD1 3.73Å; R83-Y872 HydrophobicContact CG-CD2 3.78Å; R83-Y872 HydrophobicContact CG-CE1 3.91Å; R83-Y872 HydrophobicContact CG-CE2 3.93Å; R83-Y872 HydrophobicContact CG-CG 3.71Å
84	Y	89.4	Confident	89.8	Confident	35 Å²	35	23 Å²	23	14%	0.137	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	134.2	-174.4	-55.4	-77.2	0	0	0	112	F76 F77 Y79 F97	F76-Y84 WeakPolarHBondContact CA-O 3.42Å; F77-Y84 PolarHBondContact N-O 3.23Å; F77-Y84 PolarHBondContact O-N 3.19Å; Y79-Y84 HydrophobicContact CD1-CE2 4.26Å; Y79-Y84 WeakPolarHBondContact O-CE2 3.4Å; Y84-F97 HydrophobicContact CD1-CB 3.62Å; Y84-F97 HydrophobicContact CD1-CD1 4.36Å; Y84-F97 HydrophobicContact CD1-CG 4.26Å; Y84-F97 HydrophobicContact CD2-CB 3.98Å; Y84-F97 AromaticContact CD2-CD1 3.89Å; Y84-F97 HydrophobicContact CD2-CD1 3.89Å; Y84-F97 HydrophobicContact CD2-CD2 4.38Å; Y84-F97 HydrophobicContact CD2-CE1 4.47Å; Y84-F97 AromaticContact CD2-CG 3.83Å; Y84-F97 HydrophobicContact CD2-CG 3.83Å; Y84-F97 HydrophobicContact CE1-CB 3.67Å; Y84-F97 HydrophobicContact CE2-CB 4.04Å; Y84-F97 HydrophobicContact CE2-CD2 4.47Å; Y84-F97 HydrophobicContact CE2-CG 4.16Å; Y84-F97 HydrophobicContact CG-CB 3.75Å; Y84-F97 AromaticContact CG-CD1 3.69Å; Y84-F97 HydrophobicContact CG-CD1 3.69Å; Y84-F97 AromaticContact CG-CG 3.87Å; Y84-F97 HydrophobicContact CG-CG 3.87Å
85	N	89.9	Confident	90.1	Very high	84 Å²	84	20.1 Å²	20.1	45%	0.449	9%	0.093	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	0.6	177.1	62.1	-16.7	0	0	0	113.2	L73 F76	L73-N85 WeakPolarHBondContact CB-O 3.41Å; L73-N85 PolarHBondContact N-O 3.03Å; F76-N85 HydrophobicContact CD1-CB 4.11Å; F76-N85 HydrophobicContact CE1-CB 4Å
86	Y	92.5	Very high	90.3	Very high	67 Å²	67	19.1 Å²	19.1	26%	0.263	9%	0.086	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	165.9	172.5	71.2	-91.8	0	0	0	110.5	Q70 I71 V88 F97	Q70-Y86 HydrophobicContact CG-CD2 4.06Å; Q70-Y86 HydrophobicContact CG-CG 4.3Å; I71-Y86 CarbonylContact O-C 3.48Å; I71-Y86 VanDerWaalsContact O-CA 3.25Å; I71-Y86 WeakPolarHBondContact O-CA 3.45Å; Y86-V88 HydrophobicContact CD2-CG2 4.49Å; Y86-V88 HydrophobicContact CE2-CG2 4.43Å; Y86-F97 WeakPolarHBondContact O-CD1 3.46Å; Y86-F97 PolarHBondContact OH-O 3.33Å; Y86-F97 VanDerWaalsContact OH-O 3.05Å
87	T	94	Very high	90.3	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.006	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	153.8	163.4	-172.3	0	0	0	0	110.6	Q70 I71 L73 L89 A96 L209	Q70-T87 CarbonylContact C-O 3.43Å; Q70-T87 WeakPolarHBondContact CA-O 3.26Å; I71-T87 HydrophobicContact CB-CG2 4.44Å; I71-T87 PolarHBondContact N-O 2.58Å; I71-T87 PolarHBondContact O-N 3.15Å; L73-T87 HydrophobicContact CD2-CG2 4.03Å; T87-L89 HydrophobicContact CG2-CD2 4.02Å; T87-L89 HydrophobicContact CG2-CG 4.42Å; T87-A96 CarbonylContact C-O 3.54Å; T87-A96 VanDerWaalsContact CA-O 3.28Å; T87-A96 WeakPolarHBondContact CA-O 3.2Å; T87-A96 PolarHBondContact OG1-O 3.23Å; T87-L209 HydrophobicContact CG2-CD2 3.82Å
88	V	91.9	Very high	89.8	Confident	23 Å²	23	16.3 Å²	16.3	14%	0.139	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	116	172.5	-177.7	0	0	0	0	109.1	R69 Q70 Y86 A96	R69-V88 WeakPolarHBondContact O-CA 3.39Å; Q70-V88 HydrophobicContact CB-CG2 4.34Å; Y86-V88 HydrophobicContact CD2-CG2 4.49Å; Y86-V88 HydrophobicContact CE2-CG2 4.43Å; V88-A96 HydrophobicContact CB-CB 4.46Å; V88-A96 PolarHBondContact N-O 3.15Å; V88-A96 PolarHBondContact O-N 2.8Å
89	L	91.7	Very high	89	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.8	176.4	-58.4	-171.2	0	0	0	110.9	L60 G68 R69 I71 T87 A95 Y146 V211	L60-L89 HydrophobicContact CD1-CB 4.15Å; G68-L89 CarbonylContact C-O 3.56Å; G68-L89 WeakPolarHBondContact CA-O 3.32Å; R69-L89 PolarHBondContact N-O 3.23Å; R69-L89 PolarHBondContact O-N 3.38Å; I71-L89 HydrophobicContact CD1-CD1 3.36Å; I71-L89 HydrophobicContact CD1-CG 3.73Å; T87-L89 HydrophobicContact CG2-CD2 4.02Å; T87-L89 HydrophobicContact CG2-CG 4.42Å; L89-A95 HydrophobicContact CD2-CB 3.55Å; L89-Y146 HydrophobicContact CD1-CD1 4.43Å; L89-Y146 HydrophobicContact CD1-CG 4.1Å; L89-V211 HydrophobicContact CD1-CB 4.35Å; L89-V211 HydrophobicContact CD1-CG1 3.81Å; L89-V211 HydrophobicContact CD1-CG2 3.55Å; L89-V211 HydrophobicContact CD2-CG1 4.5Å; L89-V211 HydrophobicContact CD2-CG2 3.89Å; L89-V211 HydrophobicContact CG-CG2 4.4Å
90	S	88.5	Confident	88.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	146.6	175.6	-179.5	0	0	0	0	112.1	H92 G93 Y94 W213	S90-H92 PolarHBondContact O-N 3.44Å; S90-H92 PolarHBondContact OG-N 3Å; S90-H92 VanDerWaalsContact OG-N 3.16Å; S90-G93 PolarHBondContact O-N 2.96Å; S90-G93 VanDerWaalsContact O-N 3.1Å; S90-Y94 VanDerWaalsContact CB-CE2 3.42Å; S90-Y94 PolarHBondContact N-O 2.99Å; S90-W213 PolarHBondContact O-NE1 3.39Å
91	V	87.5	Confident	87.3	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.012	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-27.1	170.3	-178	0	0	0	0	111.8	L65 G93 Q132 I144 V216	L65-V91 HydrophobicContact CB-CB 4.29Å; L65-V91 HydrophobicContact CB-CG2 3.36Å; L65-V91 HydrophobicContact CD1-CG2 4.06Å; L65-V91 HydrophobicContact CD2-CG2 3.39Å; L65-V91 HydrophobicContact CG-CG2 3.7Å; L65-V91 WeakPolarHBondContact O-CG2 3.39Å; V91-G93 PolarHBondContact O-N 2.78Å; V91-Q132 HydrophobicContact CG1-CG 4.35Å; V91-Q132 WeakPolarHBondContact CG1-O 3.12Å; V91-Q132 WeakPolarHBondContact O-CG 3.24Å; V91-Q132 PolarHBondContact O-NE2 2.93Å; V91-I144 HydrophobicContact CB-CD1 4.16Å; V91-I144 HydrophobicContact CG1-CD1 4.05Å; V91-I144 HydrophobicContact CG2-CD1 3.33Å; V91-I144 HydrophobicContact CG2-CG1 4.03Å; V91-V216 HydrophobicContact CG1-CG1 4.44Å
92	H	87.3	Confident	86.3	Confident	4 Å²	4	31.1 Å²	31.1	2%	0.019	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	7.4	176.3	-65.4	-10.6	0	0	0	114	S90 Y94 F107 A129 C130 R131 Q132	S90-H92 PolarHBondContact O-N 3.44Å; S90-H92 PolarHBondContact OG-N 3Å; S90-H92 VanDerWaalsContact OG-N 3.16Å; H92-Y94 HydrophobicContact CB-CD1 4.22Å; H92-Y94 HydrophobicContact CB-CE1 3.8Å; H92-F107 HydrophobicContact CB-CE1 4.45Å; H92-F107 HydrophobicContact CB-CE2 4.31Å; H92-F107 HydrophobicContact CB-CZ 3.66Å; H92-F107 AromaticContact CD2-CZ 3.66Å; H92-F107 AromaticContact CG-CZ 3.87Å; H92-A129 CarbonylContact O-C 3.5Å; H92-A129 WeakPolarHBondContact O-CA 3.2Å; H92-C130 VanDerWaalsContact CA-O 3.24Å; H92-C130 WeakPolarHBondContact CA-O 3.34Å; H92-C130 WeakPolarHBondContact CB-O 3.43Å; H92-C130 PolarHBondContact O-N 3.36Å; H92-R131 PolarHBondContact CD2-NH1 2.84Å; H92-R131 PolarHBondContact NE2-NH1 3.01Å; H92-Q132 PolarHBondContact CE1-O 2.97Å; H92-Q132 PolarHBondContact ND1-O 2.81Å; H92-Q132 VanDerWaalsContact ND1-O 3.11Å; H92-Q132 PolarHBondContact O-NE2 2.78Å
93	G	89.5	Confident	85.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.3	26.2	158.5	0	0	0	0	0	114.5	S90 V91 V127 Y128 Y247	S90-G93 PolarHBondContact O-N 2.96Å; S90-G93 VanDerWaalsContact O-N 3.1Å; V91-G93 PolarHBondContact O-N 2.78Å; G93-V127 WeakPolarHBondContact O-CB 3.35Å; G93-V127 PolarHBondContact O-N 3.07Å; G93-Y128 WeakPolarHBondContact CA-O 3.44Å; G93-Y128 PolarHBondContact O-N 3.16Å; G93-Y247 VanDerWaalsContact CA-OH 3.24Å; G93-Y247 WeakPolarHBondContact CA-OH 3.47Å
94	Y	91.5	Very high	84.2	Confident	8 Å²	8	35.8 Å²	35.8	3%	0.031	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	154.9	178.5	60.5	-104.1	0	0	0	112	S90 H92 A96 V100 F107 I125	S90-Y94 VanDerWaalsContact CB-CE2 3.42Å; S90-Y94 PolarHBondContact N-O 2.99Å; H92-Y94 HydrophobicContact CB-CD1 4.22Å; H92-Y94 HydrophobicContact CB-CE1 3.8Å; Y94-A96 HydrophobicContact CD2-CB 4.02Å; Y94-A96 HydrophobicContact CE2-CB 4.18Å; Y94-V100 HydrophobicContact CD2-CG2 4.43Å; Y94-V100 HydrophobicContact CE2-CB 4.39Å; Y94-V100 HydrophobicContact CE2-CG2 3.79Å; Y94-F107 HydrophobicContact CE1-CE1 4.31Å; Y94-I125 VanDerWaalsContact CA-O 3.22Å; Y94-I125 WeakPolarHBondContact CA-O 3.41Å; Y94-I125 WeakPolarHBondContact CB-O 3.16Å
95	A	93.9	Very high	82.9	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.008	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	116.5	163.7	0	0	0	0	0	107.7	L89 L124 I125 L249	L89-A95 HydrophobicContact CD2-CB 3.55Å; A95-L124 WeakPolarHBondContact O-CA 3.35Å; A95-I125 PolarHBondContact N-O 2.88Å; A95-I125 PolarHBondContact O-N 2.85Å; A95-L249 HydrophobicContact CB-CD2 3.78Å
96	A	92.3	Very high	81.8	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	158.5	-175.6	0	0	0	0	0	112.2	T87 V88 Y94 V100 L124	T87-A96 CarbonylContact C-O 3.54Å; T87-A96 VanDerWaalsContact CA-O 3.28Å; T87-A96 WeakPolarHBondContact CA-O 3.2Å; T87-A96 PolarHBondContact OG1-O 3.23Å; V88-A96 HydrophobicContact CB-CB 4.46Å; V88-A96 PolarHBondContact N-O 3.15Å; V88-A96 PolarHBondContact O-N 2.8Å; Y94-A96 HydrophobicContact CD2-CB 4.02Å; Y94-A96 HydrophobicContact CE2-CB 4.18Å; A96-V100 HydrophobicContact CB-CG2 3.75Å; A96-L124 HydrophobicContact CB-CB 3.84Å
97	F	90.3	Very high	81	Confident	5 Å²	5	33.5 Å²	33.5	2%	0.022	20%	0.196	C	C	.	.	S	Bend	trans	-119.3	13.6	176.2	-55.9	-75.2	0	0	0	112.1	Y79 Y84 Y86 A123 I125 L251	Y79-F97 AromaticContact CD1-CD2 3.51Å; Y79-F97 HydrophobicContact CD1-CD2 3.51Å; Y79-F97 AromaticContact CD1-CE2 3.49Å; Y79-F97 HydrophobicContact CD1-CE2 3.49Å; Y79-F97 VanDerWaalsContact CD1-CE2 3.49Å; Y79-F97 HydrophobicContact CD2-CE2 4.06Å; Y79-F97 AromaticContact CE1-CD2 3.92Å; Y79-F97 HydrophobicContact CE1-CD2 3.92Å; Y79-F97 AromaticContact CE1-CE2 3.89Å; Y79-F97 HydrophobicContact CE1-CE2 3.89Å; Y79-F97 HydrophobicContact CE2-CE2 4.42Å; Y79-F97 HydrophobicContact CG-CD2 4.04Å; Y79-F97 AromaticContact CG-CE2 3.59Å; Y79-F97 HydrophobicContact CG-CE2 3.59Å; Y79-F97 HydrophobicContact CG-CZ 4.28Å; Y84-F97 HydrophobicContact CD1-CB 3.62Å; Y84-F97 HydrophobicContact CD1-CD1 4.36Å; Y84-F97 HydrophobicContact CD1-CG 4.26Å; Y84-F97 HydrophobicContact CD2-CB 3.98Å; Y84-F97 AromaticContact CD2-CD1 3.89Å; Y84-F97 HydrophobicContact CD2-CD1 3.89Å; Y84-F97 HydrophobicContact CD2-CD2 4.38Å; Y84-F97 HydrophobicContact CD2-CE1 4.47Å; Y84-F97 AromaticContact CD2-CG 3.83Å; Y84-F97 HydrophobicContact CD2-CG 3.83Å; Y84-F97 HydrophobicContact CE1-CB 3.67Å; Y84-F97 HydrophobicContact CE2-CB 4.04Å; Y84-F97 HydrophobicContact CE2-CD2 4.47Å; Y84-F97 HydrophobicContact CE2-CG 4.16Å; Y84-F97 HydrophobicContact CG-CB 3.75Å; Y84-F97 AromaticContact CG-CD1 3.69Å; Y84-F97 HydrophobicContact CG-CD1 3.69Å; Y84-F97 AromaticContact CG-CG 3.87Å; Y84-F97 HydrophobicContact CG-CG 3.87Å; Y86-F97 WeakPolarHBondContact O-CD1 3.46Å; Y86-F97 PolarHBondContact OH-O 3.33Å; Y86-F97 VanDerWaalsContact OH-O 3.05Å; F97-A123 HydrophobicContact CB-CB 4.25Å; F97-A123 PolarHBondContact N-O 2.7Å; F97-I125 HydrophobicContact CE2-CD1 4.37Å; F97-I125 HydrophobicContact CE2-CG1 4.35Å; F97-L251 HydrophobicContact CE1-CD2 4.39Å; F97-L251 HydrophobicContact CZ-CD2 3.91Å
98	G	81.2	Confident	80.3	Confident	18 Å²	18	36.1 Å²	36.1	19%	0.186	22%	0.217	C	C	.	.	S	Bend	trans	-166.4	174.9	175.9	0	0	0	0	0	110.9	V100	G98-V100 PolarHBondContact O-N 2.75Å
99	N	76.5	Confident	79.9	Confident	137 Å²	137	35 Å²	35	73%	0.733	21%	0.211	S	C	*	.	P	Polyproline II helix	trans	-67.3	121.8	-176.4	-75.9	-16.9	0	0	0	112.2
100	V	77.7	Confident	79.4	Confident	28 Å²	28	35.7 Å²	35.7	17%	0.17	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-91.8	121.3	173.2	-173.4	0	0	0	0	109.3	Y94 A96 G98 D102 P122 L124	Y94-V100 HydrophobicContact CD2-CG2 4.43Å; Y94-V100 HydrophobicContact CE2-CB 4.39Å; Y94-V100 HydrophobicContact CE2-CG2 3.79Å; A96-V100 HydrophobicContact CB-CG2 3.75Å; G98-V100 PolarHBondContact O-N 2.75Å; V100-D102 PolarHBondContact O-N 3.01Å; V100-P122 HydrophobicContact CB-CG 4.4Å; V100-P122 HydrophobicContact CG1-CG 4.36Å; V100-P122 HydrophobicContact CG2-CB 4.13Å; V100-P122 HydrophobicContact CG2-CG 4.01Å; V100-L124 HydrophobicContact CG1-CD2 4.5Å; V100-L124 HydrophobicContact CG2-CD2 3.75Å
101	L	70.8	Confident	78.8	Confident	86 Å²	86	42.6 Å²	42.6	45%	0.45	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-77.3	116.7	173.8	-75	-172.1	0	0	0	110.8	L103 P120	L101-L103 HydrophobicContact CB-CD1 4.29Å; L101-L103 HydrophobicContact CB-CG 4.3Å; L101-L103 HydrophobicContact CD1-CD1 3.97Å; L101-L103 PolarHBondContact O-N 2.83Å; L101-L103 VanDerWaalsContact O-N 3.09Å; L101-P120 HydrophobicContact CD1-CG 3.41Å; L101-P120 VanDerWaalsContact CD1-CG 3.41Å; L101-P120 HydrophobicContact CG-CG 3.67Å
102	D	65.5	Low	78.1	Confident	65 Å²	65	44 Å²	44	35%	0.348	27%	0.265	S	S	.	.			trans	-87.6	37.8	-173.9	-160.8	54.6	0	0	0	113.4	V100 G104 F107 R131	V100-D102 PolarHBondContact O-N 3.01Å; D102-G104 PolarHBondContact O-N 3.08Å; D102-G104 VanDerWaalsContact O-N 3.1Å; D102-F107 WeakPolarHBondContact OD1-CE1 3.48Å; D102-R131 PolarHBondContact O-NH2 2.77Å; D102-R131 IonicContact OD1-CZ 3.85Å; D102-R131 IonicContact OD1-NH1 3.95Å; D102-R131 PolarHBondContact OD1-NH1 3.22Å; D102-R131 IonicContact OD1-NH2 3.66Å; D102-R131 PolarHBondContact OD1-NH2 3.29Å; D102-R131 IonicContact OD2-CZ 3.78Å; D102-R131 VanDerWaalsContact OD2-CZ 3.23Å; D102-R131 IonicContact OD2-NH1 3.3Å; D102-R131 PolarHBondContact OD2-NH1 3.02Å; D102-R131 IonicContact OD2-NH2 2.67Å; D102-R131 PolarHBondContact OD2-NH2 3.05Å
103	L	61.1	Low	77.6	Confident	142 Å²	142	44.9 Å²	44.9	74%	0.743	27%	0.271	S	S	*	.			trans	-86	79	-167.9	-67.5	175.9	0	0	0	113.4	L101	L101-L103 HydrophobicContact CB-CD1 4.29Å; L101-L103 HydrophobicContact CB-CG 4.3Å; L101-L103 HydrophobicContact CD1-CD1 3.97Å; L101-L103 PolarHBondContact O-N 2.83Å; L101-L103 VanDerWaalsContact O-N 3.09Å
104	G	65.2	Low	76.9	Confident	45 Å²	45	53.1 Å²	53.1	46%	0.464	31%	0.309	S	S	.	.	S	Bend	trans	122.4	-158.7	165.9	0	0	0	0	0	115.2	D102 R131	D102-G104 PolarHBondContact O-N 3.08Å; D102-G104 VanDerWaalsContact O-N 3.1Å; G104-R131 PolarHBondContact O-NH2 2.84Å
105	T	62.4	Low	76.3	Confident	65 Å²	65	55.7 Å²	55.7	40%	0.399	32%	0.323	S	S	.	.	S	Bend	trans	-81.3	-19	-174	51.6	0	0	0	0	114.4	R282	T105-R282 HydrophobicContact CG2-CG 4.44Å
106	D	66.4	Low	75.6	Confident	59 Å²	59	58 Å²	58	32%	0.316	33%	0.332	S	S	.	.	S	Bend	trans	-133.9	145.3	-169.4	-67.3	-103.1	0	0	0	109.1	A108 R282 G283 R284	D106-A108 PolarHBondContact O-N 2.81Å; D106-R282 WeakPolarHBondContact OD2-CA 3.36Å; D106-G283 WeakPolarHBondContact OD1-CA 3.45Å; D106-G283 PolarHBondContact OD1-N 2.82Å; D106-G283 PolarHBondContact OD2-N 2.91Å; D106-R284 PolarHBondContact OD1-N 2.83Å
107	F	76.2	Confident	75.2	Confident	14 Å²	14	58.3 Å²	58.3	6%	0.061	33%	0.334	C	S	.	.			trans	-86.4	114.4	-176.5	-62.6	-70.3	0	0	0	112.8	H92 Y94 D102 F109 A129 R131 K286	H92-F107 HydrophobicContact CB-CE1 4.45Å; H92-F107 HydrophobicContact CB-CE2 4.31Å; H92-F107 HydrophobicContact CB-CZ 3.66Å; H92-F107 AromaticContact CD2-CZ 3.66Å; H92-F107 AromaticContact CG-CZ 3.87Å; Y94-F107 HydrophobicContact CE1-CE1 4.31Å; D102-F107 WeakPolarHBondContact OD1-CE1 3.48Å; F107-F109 HydrophobicContact CB-CD1 3.72Å; F107-F109 HydrophobicContact CB-CE1 3.34Å; F107-F109 HydrophobicContact CB-CZ 4.11Å; F107-F109 AromaticContact CG-CE1 3.96Å; F107-F109 HydrophobicContact CG-CE1 3.96Å; F107-F109 PolarHBondContact O-N 2.94Å; F107-A129 HydrophobicContact CD2-CB 4.31Å; F107-R131 HydrophobicContact CE2-CG 4.48Å; F107-R131 HydrophobicContact CZ-CG 4.35Å; F107-K286 PolarHBondContact O-NZ 2.97Å
108	A	78.5	Confident	74.8	Confident	56 Å²	56	59.8 Å²	59.8	46%	0.463	34%	0.342	S	S	.	.			trans	-82.8	98.5	169.6	0	0	0	0	0	110.5	D106	D106-A108 PolarHBondContact O-N 2.81Å
109	F	84.3	Confident	74.8	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.352	C	S	.	.			trans	-153.7	158.9	166.6	53.5	-112.9	0	0	0	108.5	F107 G112 T113 P122 L124 A126 A129 K286 E288	F107-F109 HydrophobicContact CB-CD1 3.72Å; F107-F109 HydrophobicContact CB-CE1 3.34Å; F107-F109 HydrophobicContact CB-CZ 4.11Å; F107-F109 AromaticContact CG-CE1 3.96Å; F107-F109 HydrophobicContact CG-CE1 3.96Å; F107-F109 PolarHBondContact O-N 2.94Å; F109-G112 PolarHBondContact O-N 3.39Å; F109-G112 VanDerWaalsContact O-N 3.09Å; F109-T113 WeakPolarHBondContact CA-OG1 3.46Å; F109-T113 PolarHBondContact N-OG1 3.31Å; F109-P122 HydrophobicContact CB-CG 4.27Å; F109-L124 HydrophobicContact CB-CD2 4.42Å; F109-L124 HydrophobicContact CD1-CD1 4.22Å; F109-L124 HydrophobicContact CD1-CD2 3.77Å; F109-L124 HydrophobicContact CD2-CD1 4.05Å; F109-L124 HydrophobicContact CE1-CD1 4.07Å; F109-L124 HydrophobicContact CE1-CD2 4.14Å; F109-L124 HydrophobicContact CE2-CD1 3.92Å; F109-L124 HydrophobicContact CG-CD1 4.21Å; F109-L124 HydrophobicContact CG-CD2 4.11Å; F109-L124 HydrophobicContact CZ-CD1 3.94Å; F109-A126 HydrophobicContact CE2-CB 3.88Å; F109-A126 HydrophobicContact CZ-CB 3.7Å; F109-A129 HydrophobicContact CE1-CB 4.28Å; F109-A129 HydrophobicContact CZ-CB 3.73Å; F109-K286 HydrophobicContact CD2-CD 4.2Å; F109-K286 HydrophobicContact CE2-CB 4.27Å; F109-K286 HydrophobicContact CE2-CD 3.49Å; F109-K286 VanDerWaalsContact CE2-CD 3.49Å; F109-K286 HydrophobicContact CZ-CB 4.24Å; F109-K286 HydrophobicContact CZ-CD 3.77Å; F109-K286 PolarHBondContact O-NZ 2.92Å; F109-E288 HydrophobicContact CD2-CG 4.43Å; F109-E288 WeakPolarHBondContact CD2-OE1 3.47Å; F109-E288 HydrophobicContact CE2-CG 3.8Å; F109-E288 WeakPolarHBondContact CE2-OE1 3.36Å
110	G	81.4	Confident	75.1	Confident	14 Å²	14	57.3 Å²	57.3	14%	0.144	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	62.5	-136.9	-179.7	0	0	0	0	0	112.4	G112 T113 D121 N290	G110-G112 PolarHBondContact O-N 3.18Å; G110-T113 PolarHBondContact N-OG1 3.19Å; G110-T113 PolarHBondContact O-N 3.06Å; G110-T113 VanDerWaalsContact O-N 3.1Å; G110-T113 PolarHBondContact O-OG1 2.79Å; G110-D121 PolarHBondContact N-OD1 2.92Å; G110-N290 VanDerWaalsContact CA-OD1 3.31Å; G110-N290 WeakPolarHBondContact CA-OD1 3.48Å; G110-N290 PolarHBondContact N-ND2 3.33Å
111	E	74.9	Confident	75.6	Confident	145 Å²	145	56.4 Å²	56.4	68%	0.678	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-58.1	-11.8	173	-67.1	-162.2	133.3	0	0	114
112	G	72.7	Confident	76.4	Confident	33 Å²	33	52.8 Å²	52.8	34%	0.34	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-82.4	-2.5	175.2	0	0	0	0	0	115.8	F109 G110 E114	F109-G112 PolarHBondContact O-N 3.39Å; F109-G112 VanDerWaalsContact O-N 3.09Å; G110-G112 PolarHBondContact O-N 3.18Å; G112-E114 PolarHBondContact O-N 3.16Å
113	T	77.8	Confident	77.6	Confident	21 Å²	21	50.1 Å²	50.1	13%	0.129	29%	0.289	C	S	.	.			trans	-96.8	87.6	-172.8	-47.4	0	0	0	0	112	F109 G110 N115 W116 D119 D121	F109-T113 WeakPolarHBondContact CA-OG1 3.46Å; F109-T113 PolarHBondContact N-OG1 3.31Å; G110-T113 PolarHBondContact N-OG1 3.19Å; G110-T113 PolarHBondContact O-N 3.06Å; G110-T113 VanDerWaalsContact O-N 3.1Å; G110-T113 PolarHBondContact O-OG1 2.79Å; T113-N115 VanDerWaalsContact C-N 3.34Å; T113-N115 PolarHBondContact O-N 2.86Å; T113-W116 HydrophobicContact CG2-CB 4Å; T113-D119 HydrophobicContact CG2-CB 4.41Å; T113-D121 HydrophobicContact CG2-CB 4.35Å
114	E	73.8	Confident	79.1	Confident	174 Å²	174	43.3 Å²	43.3	81%	0.813	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-22.6	-172.5	-63	-170.3	167.4	0	0	115.8	G112 K1049	G112-E114 PolarHBondContact O-N 3.16Å; E114-K1049 PolarHBondContact O-NZ 3.4Å
115	N	79.3	Confident	80.6	Confident	61 Å²	61	41.2 Å²	41.2	33%	0.326	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.9	30.2	-175.7	-49.5	-71.8	0	0	0	114.9	T113 D118 D119 K1049	T113-N115 VanDerWaalsContact C-N 3.34Å; T113-N115 PolarHBondContact O-N 2.86Å; N115-D118 HydrophobicContact CB-CB 4.49Å; N115-D118 WeakPolarHBondContact O-CA 3.28Å; N115-D118 WeakPolarHBondContact O-CB 3.35Å; N115-D118 PolarHBondContact O-N 2.93Å; N115-D119 WeakPolarHBondContact CB-OD2 3.38Å; N115-D119 PolarHBondContact ND2-OD2 3.47Å; N115-D119 PolarHBondContact O-N 2.88Å; N115-K1049 PolarHBondContact OD1-NZ 3.4Å
116	W	79.9	Confident	82	Confident	50 Å²	50	38.1 Å²	38.1	19%	0.189	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	134.6	165.3	177.9	84.4	0	0	0	110.3	T113 D119 D121 N293 A294 P1046	T113-W116 HydrophobicContact CG2-CB 4Å; W116-D119 WeakPolarHBondContact CA-O 3.43Å; W116-D121 HydrophobicContact CG-CB 4.46Å; W116-N293 WeakPolarHBondContact CZ2-O 3.47Å; W116-A294 HydrophobicContact CD2-CB 3.55Å; W116-A294 HydrophobicContact CE3-CB 3.57Å; W116-A294 HydrophobicContact CG-CB 4.19Å; W116-A294 HydrophobicContact CH2-CB 3.81Å; W116-A294 HydrophobicContact CZ2-CB 3.82Å; W116-A294 HydrophobicContact CZ3-CB 3.71Å; W116-P1046 HydrophobicContact CE3-CB 4.4Å; W116-P1046 HydrophobicContact CH2-CB 3.57Å; W116-P1046 HydrophobicContact CH2-CG 3.39Å; W116-P1046 HydrophobicContact CZ2-CB 4.22Å; W116-P1046 HydrophobicContact CZ2-CG 3.6Å; W116-P1046 HydrophobicContact CZ3-CB 3.67Å; W116-P1046 HydrophobicContact CZ3-CG 4Å
117	P	83.5	Confident	83.3	Confident	6 Å²	6	35.3 Å²	35.3	4%	0.039	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	cis	-101	16.7	5.8	42.2	-39.8	0	0	0	115.4	V837 P1046 A1048	P117-V837 HydrophobicContact CB-CG1 4.25Å; P117-V837 HydrophobicContact CB-CG2 3.97Å; P117-V837 HydrophobicContact CG-CB 4.4Å; P117-V837 HydrophobicContact CG-CG1 4.48Å; P117-V837 HydrophobicContact CG-CG2 3.84Å; P117-P1046 HydrophobicContact CB-CG 4.25Å; P117-P1046 HydrophobicContact CG-CB 3.94Å; P117-P1046 HydrophobicContact CG-CG 4.06Å; P117-A1048 HydrophobicContact CG-CB 4.16Å
118	D	83	Confident	83.9	Confident	37 Å²	37	34.8 Å²	34.8	20%	0.198	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-45.1	168.2	-59.8	-92.1	0	0	0	110.1	N115 A1048 K1049 R1050	N115-D118 HydrophobicContact CB-CB 4.49Å; N115-D118 WeakPolarHBondContact O-CA 3.28Å; N115-D118 WeakPolarHBondContact O-CB 3.35Å; N115-D118 PolarHBondContact O-N 2.93Å; D118-A1048 WeakPolarHBondContact OD1-CB 3.36Å; D118-K1049 VanDerWaalsContact CG-N 3.27Å; D118-K1049 PolarHBondContact OD1-N 3.17Å; D118-K1049 WeakPolarHBondContact OD2-CB 3.32Å; D118-K1049 VanDerWaalsContact OD2-CG 3.26Å; D118-K1049 WeakPolarHBondContact OD2-CG 3.48Å; D118-K1049 PolarHBondContact OD2-N 3.41Å; D118-R1050 PolarHBondContact OD1-N 3.32Å; D118-R1050 VanDerWaalsContact OD1-N 3.11Å
119	D	80.7	Confident	84.3	Confident	71 Å²	71	32.1 Å²	32.1	38%	0.38	17%	0.173	S	C	.	.	S	Bend	trans	-92.6	140.3	169.3	-66.9	-40.3	0	0	0	110.8	T113 N115 W116	T113-D119 HydrophobicContact CG2-CB 4.41Å; N115-D119 WeakPolarHBondContact CB-OD2 3.38Å; N115-D119 PolarHBondContact ND2-OD2 3.47Å; N115-D119 PolarHBondContact O-N 2.88Å; W116-D119 WeakPolarHBondContact CA-O 3.43Å
120	P	82.2	Confident	84.2	Confident	32 Å²	32	32.3 Å²	32.3	21%	0.208	18%	0.175	C	C	.	.			trans	-73.9	143.8	177.7	30.2	-34.3	0	0	0	112.6	L101 Q833	L101-P120 HydrophobicContact CD1-CG 3.41Å; L101-P120 VanDerWaalsContact CD1-CG 3.41Å; L101-P120 HydrophobicContact CG-CG 3.67Å; P120-Q833 HydrophobicContact CB-CB 4.13Å; P120-Q833 HydrophobicContact CB-CG 4.38Å
121	D	87.3	Confident	84.2	Confident	8 Å²	8	34.2 Å²	34.2	4%	0.043	18%	0.178	C	C	.	.			trans	-114.6	100.7	172.7	177.4	47	0	0	0	109	G110 T113 W116 N290 G292 N293 A294	G110-D121 PolarHBondContact N-OD1 2.92Å; T113-D121 HydrophobicContact CG2-CB 4.35Å; W116-D121 HydrophobicContact CG-CB 4.46Å; D121-N290 PolarHBondContact OD1-ND2 2.81Å; D121-G292 CarbonylContact O-C 3.57Å; D121-G292 WeakPolarHBondContact O-CA 3.41Å; D121-G292 VanDerWaalsContact OD2-CA 3.23Å; D121-G292 WeakPolarHBondContact OD2-CA 3.15Å; D121-N293 PolarHBondContact O-N 2.84Å; D121-N293 PolarHBondContact OD2-N 3.08Å; D121-N293 VanDerWaalsContact OD2-N 3.13Å; D121-A294 WeakPolarHBondContact OD2-CA 3.25Å; D121-A294 PolarHBondContact OD2-N 2.86Å
122	P	87.9	Confident	84.5	Confident	10 Å²	10	27.4 Å²	27.4	7%	0.065	15%	0.146	C	C	.	.			trans	-80.4	139.8	-172.8	30.3	-35.4	0	0	0	113.2	V100 F109 L124 N290	V100-P122 HydrophobicContact CB-CG 4.4Å; V100-P122 HydrophobicContact CG1-CG 4.36Å; V100-P122 HydrophobicContact CG2-CB 4.13Å; V100-P122 HydrophobicContact CG2-CG 4.01Å; F109-P122 HydrophobicContact CB-CG 4.27Å; P122-L124 HydrophobicContact CB-CD2 4.33Å; P122-L124 HydrophobicContact CG-CD2 3.81Å; P122-L124 PolarHBondContact O-N 3.49Å; P122-N290 PolarHBondContact O-ND2 2.97Å
123	A	91.4	Very high	85	Confident	9 Å²	9	28.1 Å²	28.1	7%	0.074	14%	0.138	C	C	.	.			trans	-68.9	119.6	169.3	0	0	0	0	0	110	Y79 F97 N290 G291	Y79-A123 HydrophobicContact CD1-CB 4.43Å; Y79-A123 HydrophobicContact CE1-CB 4.37Å; F97-A123 HydrophobicContact CB-CB 4.25Å; F97-A123 PolarHBondContact N-O 2.7Å; A123-N290 CarbonylContact C-O 3.53Å; A123-N290 WeakPolarHBondContact CA-O 3.4Å; A123-G291 WeakPolarHBondContact CB-O 3.28Å
124	L	93.3	Very high	85.2	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	153.2	-178	60.9	84.1	0	0	0	114.1	Y79 A95 A96 V100 F109 P122 A126 N290	Y79-L124 PolarHBondContact OH-O 2.92Å; A95-L124 WeakPolarHBondContact O-CA 3.35Å; A96-L124 HydrophobicContact CB-CB 3.84Å; V100-L124 HydrophobicContact CG1-CD2 4.5Å; V100-L124 HydrophobicContact CG2-CD2 3.75Å; F109-L124 HydrophobicContact CB-CD2 4.42Å; F109-L124 HydrophobicContact CD1-CD1 4.22Å; F109-L124 HydrophobicContact CD1-CD2 3.77Å; F109-L124 HydrophobicContact CD2-CD1 4.05Å; F109-L124 HydrophobicContact CE1-CD1 4.07Å; F109-L124 HydrophobicContact CE1-CD2 4.14Å; F109-L124 HydrophobicContact CE2-CD1 3.92Å; F109-L124 HydrophobicContact CG-CD1 4.21Å; F109-L124 HydrophobicContact CG-CD2 4.11Å; F109-L124 HydrophobicContact CZ-CD1 3.94Å; P122-L124 HydrophobicContact CB-CD2 4.33Å; P122-L124 HydrophobicContact CG-CD2 3.81Å; P122-L124 PolarHBondContact O-N 3.49Å; L124-A126 HydrophobicContact CD1-CB 3.71Å; L124-N290 HydrophobicContact CD1-CB 4.48Å; L124-N290 PolarHBondContact N-O 3.42Å; L124-N290 PolarHBondContact O-N 3.36Å
125	I	95.2	Very high	85.5	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	102.6	167.3	-59.1	172.9	0	0	0	107.3	Y79 Y94 A95 F97 V127 L249 L251 A262 I264 L289	Y79-I125 HydrophobicContact CD2-CD1 4.25Å; Y79-I125 HydrophobicContact CD2-CG1 4.35Å; Y79-I125 HydrophobicContact CE2-CD1 3.82Å; Y79-I125 HydrophobicContact CE2-CG1 3.53Å; Y94-I125 VanDerWaalsContact CA-O 3.22Å; Y94-I125 WeakPolarHBondContact CA-O 3.41Å; Y94-I125 WeakPolarHBondContact CB-O 3.16Å; A95-I125 PolarHBondContact N-O 2.88Å; A95-I125 PolarHBondContact O-N 2.85Å; F97-I125 HydrophobicContact CE2-CD1 4.37Å; F97-I125 HydrophobicContact CE2-CG1 4.35Å; I125-V127 HydrophobicContact CG2-CG2 4.09Å; I125-V127 PolarHBondContact O-N 3.28Å; I125-L249 HydrophobicContact CB-CD2 4.41Å; I125-L249 HydrophobicContact CD1-CD2 4.44Å; I125-L249 HydrophobicContact CG2-CD1 4.05Å; I125-L249 HydrophobicContact CG2-CD2 4.17Å; I125-L251 HydrophobicContact CD1-CD1 4.04Å; I125-A262 HydrophobicContact CD1-CB 4.39Å; I125-I264 HydrophobicContact CG2-CD1 4.34Å; I125-L289 HydrophobicContact CG2-CG 4.45Å
126	A	92.2	Very high	85.2	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	91	172	0	0	0	0	0	109.3	F109 L124 A129 A287 E288	F109-A126 HydrophobicContact CE2-CB 3.88Å; F109-A126 HydrophobicContact CZ-CB 3.7Å; L124-A126 HydrophobicContact CD1-CB 3.71Å; A126-A129 HydrophobicContact CB-CB 3.67Å; A126-A287 CarbonylContact O-C 3.54Å; A126-A287 WeakPolarHBondContact O-CA 3.33Å; A126-E288 CarbonylContact C-O 3.59Å; A126-E288 WeakPolarHBondContact CA-O 3.41Å; A126-E288 HydrophobicContact CB-CG 4.05Å; A126-E288 WeakPolarHBondContact CB-O 3.42Å; A126-E288 PolarHBondContact N-O 3.33Å; A126-E288 PolarHBondContact O-N 2.98Å
127	V	93.1	Very high	84.5	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	-53.1	-178.6	-163.6	0	0	0	0	109.9	G93 I125 W213 Y247 L249 I264 Y266	G93-V127 WeakPolarHBondContact O-CB 3.35Å; G93-V127 PolarHBondContact O-N 3.07Å; I125-V127 HydrophobicContact CG2-CG2 4.09Å; I125-V127 PolarHBondContact O-N 3.28Å; V127-W213 HydrophobicContact CB-CH2 4.34Å; V127-W213 HydrophobicContact CB-CZ3 4.3Å; V127-W213 HydrophobicContact CG1-CZ3 4.41Å; V127-W213 HydrophobicContact CG2-CH2 3.72Å; V127-W213 HydrophobicContact CG2-CZ3 3.96Å; V127-Y247 HydrophobicContact CB-CD2 4.18Å; V127-Y247 HydrophobicContact CB-CE2 4.1Å; V127-Y247 HydrophobicContact CG1-CD2 3.64Å; V127-Y247 HydrophobicContact CG1-CE2 4.08Å; V127-L249 HydrophobicContact CG1-CB 4.4Å; V127-L249 HydrophobicContact CG2-CB 3.84Å; V127-L249 HydrophobicContact CG2-CD2 3.9Å; V127-L249 HydrophobicContact CG2-CG 4.3Å; V127-I264 HydrophobicContact CG1-CG1 4.35Å; V127-I264 HydrophobicContact CG1-CG2 3.71Å; V127-Y266 WeakPolarHBondContact O-CE1 3.22Å; V127-Y266 PolarHBondContact O-OH 2.99Å
128	Y	89.9	Confident	83.8	Confident	3 Å²	3	25.7 Å²	25.7	1%	0.012	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	78.9	164.6	-163.6	-121.5	0	0	0	108.8	G93 C130 Q132 Y247 L269 Y271 C285 K286 P308	G93-Y128 WeakPolarHBondContact CA-O 3.44Å; G93-Y128 PolarHBondContact O-N 3.16Å; Y128-C130 WeakPolarHBondContact CD1-SG 3.24Å; Y128-C130 WeakPolarHBondContact CE1-SG 3.36Å; Y128-C130 PolarHBondContact O-N 3.23Å; Y128-C130 VanDerWaalsContact O-N 3.08Å; Y128-Q132 PolarHBondContact O-NE2 2.93Å; Y128-Y247 HydrophobicContact CD1-CE1 4.31Å; Y128-L269 HydrophobicContact CD1-CD2 3.6Å; Y128-L269 HydrophobicContact CD2-CD1 3.82Å; Y128-L269 HydrophobicContact CD2-CD2 4.14Å; Y128-L269 HydrophobicContact CE1-CD2 3.9Å; Y128-L269 HydrophobicContact CE2-CD1 3.83Å; Y128-L269 HydrophobicContact CE2-CD2 4.45Å; Y128-L269 HydrophobicContact CG-CD1 4.28Å; Y128-L269 HydrophobicContact CG-CD2 3.74Å; Y128-Y271 HydrophobicContact CE1-CD2 4.39Å; Y128-Y271 HydrophobicContact CE1-CE2 4.06Å; Y128-Y271 PolarHBondContact OH-O 2.96Å; Y128-C285 HydrophobicContact CE1-CB 4.4Å; Y128-C285 HydrophobicContact CE2-CB 3.96Å; Y128-K286 CarbonylContact C-O 3.58Å; Y128-P308 HydrophobicContact CE2-CB 3.86Å; Y128-P308 HydrophobicContact CE2-CG 4.03Å; Y128-P308 WeakPolarHBondContact OH-CB 3.39Å; Y128-P308 WeakPolarHBondContact OH-CG 3.35Å
129	A	87.4	Confident	82.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	100.9	-170.9	0	0	0	0	0	111.2	H92 F107 F109 A126 C285 K286	H92-A129 CarbonylContact O-C 3.5Å; H92-A129 WeakPolarHBondContact O-CA 3.2Å; F107-A129 HydrophobicContact CD2-CB 4.31Å; F109-A129 HydrophobicContact CE1-CB 4.28Å; F109-A129 HydrophobicContact CZ-CB 3.73Å; A126-A129 HydrophobicContact CB-CB 3.67Å; A129-C285 VanDerWaalsContact O-CA 3.24Å; A129-C285 WeakPolarHBondContact O-CA 3.41Å; A129-K286 HydrophobicContact CB-CB 4.27Å; A129-K286 PolarHBondContact N-O 3.11Å; A129-K286 PolarHBondContact O-N 3.45Å
130	C	82.2	Confident	82.4	Confident	4 Å²	4	28.9 Å²	28.9	3%	0.027	16%	0.158	C	C	.	.			trans	-142.3	149.4	-175.8	-58.6	0	0	0	0	111	H92 Y128 Q132 Y271 C285	H92-C130 VanDerWaalsContact CA-O 3.24Å; H92-C130 WeakPolarHBondContact CA-O 3.34Å; H92-C130 WeakPolarHBondContact CB-O 3.43Å; H92-C130 PolarHBondContact O-N 3.36Å; Y128-C130 WeakPolarHBondContact CD1-SG 3.24Å; Y128-C130 WeakPolarHBondContact CE1-SG 3.36Å; Y128-C130 PolarHBondContact O-N 3.23Å; Y128-C130 VanDerWaalsContact O-N 3.08Å; C130-Q132 VanDerWaalsContact C-N 3.34Å; C130-Q132 HydrophobicContact CB-CB 4.45Å; C130-Q132 PolarHBondContact O-N 2.94Å; C130-Y271 HydrophobicContact CB-CE2 4.32Å; C130-C285 HydrophobicContact CB-CB 4.32Å; C130-C285 WeakPolarHBondContact CB-SG 3.05Å; C130-C285 WeakPolarHBondContact SG-CB 3.22Å; C130-C285 CovalentContact SG-SG 2.03Å; C130-C285 PolarHBondContact SG-SG 3.2Å
131	R	80.7	Confident	82	Confident	55 Å²	55	32.1 Å²	32.1	21%	0.208	17%	0.167	C	C	.	.	S	Bend	trans	-68.5	92.4	165.7	-70.7	-62.5	-164	169.5	3.1	109.5	H92 D102 G104 F107 M219	H92-R131 PolarHBondContact CD2-NH1 2.84Å; H92-R131 PolarHBondContact NE2-NH1 3.01Å; D102-R131 PolarHBondContact O-NH2 2.77Å; D102-R131 IonicContact OD1-CZ 3.85Å; D102-R131 IonicContact OD1-NH1 3.95Å; D102-R131 PolarHBondContact OD1-NH1 3.22Å; D102-R131 IonicContact OD1-NH2 3.66Å; D102-R131 PolarHBondContact OD1-NH2 3.29Å; D102-R131 IonicContact OD2-CZ 3.78Å; D102-R131 VanDerWaalsContact OD2-CZ 3.23Å; D102-R131 IonicContact OD2-NH1 3.3Å; D102-R131 PolarHBondContact OD2-NH1 3.02Å; D102-R131 IonicContact OD2-NH2 2.67Å; D102-R131 PolarHBondContact OD2-NH2 3.05Å; G104-R131 PolarHBondContact O-NH2 2.84Å; F107-R131 HydrophobicContact CE2-CG 4.48Å; F107-R131 HydrophobicContact CZ-CG 4.35Å; R131-M219 HydrophobicContact CB-CB 4.21Å; R131-M219 WeakPolarHBondContact O-CB 3.46Å; R131-M219 PolarHBondContact O-N 3.14Å
132	Q	81.8	Confident	81.8	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.009	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	158.7	-174.5	70.5	-150.6	-20.5	0	0	112	V91 H92 Y128 C130 V216 T217 Y247 Y271	V91-Q132 HydrophobicContact CG1-CG 4.35Å; V91-Q132 WeakPolarHBondContact CG1-O 3.12Å; V91-Q132 WeakPolarHBondContact O-CG 3.24Å; V91-Q132 PolarHBondContact O-NE2 2.93Å; H92-Q132 PolarHBondContact CE1-O 2.97Å; H92-Q132 PolarHBondContact ND1-O 2.81Å; H92-Q132 VanDerWaalsContact ND1-O 3.11Å; H92-Q132 PolarHBondContact O-NE2 2.78Å; Y128-Q132 PolarHBondContact O-NE2 2.93Å; C130-Q132 VanDerWaalsContact C-N 3.34Å; C130-Q132 HydrophobicContact CB-CB 4.45Å; C130-Q132 PolarHBondContact O-N 2.94Å; Q132-V216 HydrophobicContact CG-CB 4.22Å; Q132-V216 HydrophobicContact CG-CG2 4.31Å; Q132-T217 CarbonylContact C-O 3.6Å; Q132-T217 WeakPolarHBondContact CA-O 3.34Å; Q132-T217 VanDerWaalsContact CB-O 3.24Å; Q132-T217 WeakPolarHBondContact CB-O 3.24Å; Q132-Y247 PolarHBondContact NE2-OH 3.05Å; Q132-Y271 PolarHBondContact OE1-OH 3.4Å
133	R	82.2	Confident	81.7	Confident	48 Å²	48	32.1 Å²	32.1	18%	0.181	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	164.2	174	61.6	169.8	-176.5	76	-1.9	109.8	S136 V216 T217 A221 E226	R133-S136 PolarHBondContact NH1-OG 3.1Å; R133-V216 CarbonylContact O-C 3.54Å; R133-V216 WeakPolarHBondContact O-CA 3.29Å; R133-T217 HydrophobicContact CG-CG2 4.18Å; R133-T217 PolarHBondContact N-O 3.41Å; R133-T217 PolarHBondContact O-N 3.07Å; R133-T217 VanDerWaalsContact O-O 3.11Å; R133-A221 PolarHBondContact NH2-O 2.91Å; R133-E226 IonicContact CZ-OE1 3.94Å; R133-E226 IonicContact NH1-OE1 3.8Å; R133-E226 PolarHBondContact NH1-OE1 2.74Å; R133-E226 IonicContact NH2-OE1 3.89Å; R133-E226 PolarHBondContact NH2-OE1 2.72Å
134	P	83.2	Confident	81.7	Confident	19 Å²	19	31.7 Å²	31.7	12%	0.123	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	151.3	163.6	-18.2	33.2	0	0	0	110.1	L65 Q142 I144	L65-P134 HydrophobicContact CD1-CG 3.93Å; P134-Q142 HydrophobicContact CB-CG 4.44Å; P134-I144 HydrophobicContact CG-CD1 4.23Å
135	M	78.9	Confident	81.6	Confident	31 Å²	31	32.7 Å²	32.7	15%	0.153	17%	0.168	C	C	.	.			trans	-53.6	161	159.8	176.8	170.1	-93.7	0	0	110.5	I137 Q142 N215 E226 L242 T244	M135-I137 HydrophobicContact CG-CB 4.21Å; M135-I137 HydrophobicContact SD-CB 4.35Å; M135-Q142 VanDerWaalsContact C-CD 3.47Å; M135-Q142 VanDerWaalsContact C-OE1 3.24Å; M135-Q142 HydrophobicContact CB-CB 4.21Å; M135-Q142 PolarHBondContact O-NE2 2.83Å; M135-Q142 PolarHBondContact O-OE1 2.86Å; M135-Q142 VanDerWaalsContact O-OE1 3.12Å; M135-N215 WeakPolarHBondContact CB-O 3.47Å; M135-N215 PolarHBondContact N-O 3.2Å; M135-E226 VanDerWaalsContact CG-OE2 3.29Å; M135-E226 WeakPolarHBondContact CG-OE2 3.18Å; M135-L242 HydrophobicContact CE-CB 4.07Å; M135-L242 HydrophobicContact CE-CD2 3.52Å; M135-L242 HydrophobicContact CE-CG 4.41Å; M135-T244 HydrophobicContact CE-CG2 3.51Å; M135-T244 HydrophobicContact SD-CG2 4.45Å
136	S	73.7	Confident	81.6	Confident	53 Å²	53	32.7 Å²	32.7	37%	0.371	17%	0.168	S	C	.	.	S	Bend	trans	-98.2	-40.3	174.7	-64.2	0	0	0	0	111.9	R133 N138 Q142 N223 E226	R133-S136 PolarHBondContact NH1-OG 3.1Å; S136-N138 PolarHBondContact O-N 3.11Å; S136-Q142 PolarHBondContact O-NE2 2.75Å; S136-N223 PolarHBondContact OG-OD1 2.86Å; S136-E226 WeakPolarHBondContact CA-OE2 3.39Å; S136-E226 WeakPolarHBondContact CB-OE2 3.5Å; S136-E226 PolarHBondContact N-OE1 3.16Å; S136-E226 PolarHBondContact N-OE2 3.2Å
137	I	65.7	Low	81.7	Confident	87 Å²	87	33.1 Å²	33.1	45%	0.446	17%	0.169	S	C	.	.	S	Bend	trans	-57.7	-32.9	-166.9	-74.5	177.7	0	0	0	116.5	M135 E226	M135-I137 HydrophobicContact CG-CB 4.21Å; M135-I137 HydrophobicContact SD-CB 4.35Å; I137-E226 VanDerWaalsContact CD1-C 3.47Å; I137-E226 HydrophobicContact CD1-CB 3.76Å; I137-E226 WeakPolarHBondContact CD1-O 3.36Å; I137-E226 HydrophobicContact CG1-CB 4.12Å; I137-E226 PolarHBondContact N-OE2 3.38Å
138	N	67.3	Low	81.8	Confident	71 Å²	71	33.1 Å²	33.1	38%	0.38	17%	0.169	S	C	.	.			trans	-136.1	76.8	-168.9	-163.7	0.4	0	0	0	113.1	S136 D140 Y141 Q142	S136-N138 PolarHBondContact O-N 3.11Å; N138-D140 PolarHBondContact O-N 3.08Å; N138-Y141 WeakPolarHBondContact ND2-CD2 3.34Å; N138-Y141 PolarHBondContact O-N 2.84Å; N138-Q142 VanDerWaalsContact O-CG 3.28Å; N138-Q142 WeakPolarHBondContact O-CG 3.42Å; N138-Q142 PolarHBondContact O-N 3.01Å; N138-Q142 PolarHBondContact O-OE1 2.91Å
139	P	65.5	Low	82.1	Confident	81 Å²	81	33 Å²	33	53%	0.526	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-57.4	-20.8	-171.4	20.3	-32.9	0	0	0	115.9	K59 Q142	K59-P139 PolarHBondContact NZ-O 2.93Å; P139-Q142 VanDerWaalsContact CA-NE2 3.3Å
140	D	68.7	Low	82.3	Confident	94 Å²	94	33.4 Å²	33.4	50%	0.503	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-79.9	-16.3	178	-100.1	31.7	0	0	0	114.5	K53 N138	K53-D140 IonicContact NZ-OD2 3.03Å; K53-D140 PolarHBondContact NZ-OD2 2.79Å; N138-D140 PolarHBondContact O-N 3.08Å
141	Y	74.7	Confident	82.6	Confident	100 Å²	100	33.6 Å²	33.6	39%	0.392	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-137.6	36	-173.5	-60.4	-88.8	0	0	0	112.3	N138 E214 N215	N138-Y141 WeakPolarHBondContact ND2-CD2 3.34Å; N138-Y141 PolarHBondContact O-N 2.84Å; Y141-E214 VanDerWaalsContact C-CD 3.5Å; Y141-N215 PolarHBondContact O-ND2 2.88Å
142	Q	82.2	Confident	82.7	Confident	15 Å²	15	32.3 Å²	32.3	7%	0.07	18%	0.175	C	C	.	.			trans	-149.1	139.8	179.3	74	-159.6	11.2	0	0	110.4	K59 P134 M135 S136 N138 P139 N215	K59-Q142 WeakPolarHBondContact CE-O 3.42Å; K59-Q142 PolarHBondContact NZ-O 2.73Å; P134-Q142 HydrophobicContact CB-CG 4.44Å; M135-Q142 VanDerWaalsContact C-CD 3.47Å; M135-Q142 VanDerWaalsContact C-OE1 3.24Å; M135-Q142 HydrophobicContact CB-CB 4.21Å; M135-Q142 PolarHBondContact O-NE2 2.83Å; M135-Q142 PolarHBondContact O-OE1 2.86Å; M135-Q142 VanDerWaalsContact O-OE1 3.12Å; S136-Q142 PolarHBondContact O-NE2 2.75Å; N138-Q142 VanDerWaalsContact O-CG 3.28Å; N138-Q142 WeakPolarHBondContact O-CG 3.42Å; N138-Q142 PolarHBondContact O-N 3.01Å; N138-Q142 PolarHBondContact O-OE1 2.91Å; P139-Q142 VanDerWaalsContact CA-NE2 3.3Å; Q142-N215 HydrophobicContact CB-CB 4.36Å
143	G	86.2	Confident	82.5	Confident	2 Å²	2	36.3 Å²	36.3	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	131.9	-153.5	175.5	0	0	0	0	0	113.3	E214	G143-E214 PolarHBondContact N-O 2.9Å; G143-E214 PolarHBondContact O-N 3.46Å
144	I	90.9	Very high	82.3	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	111.1	-171.7	-45.3	81.7	0	0	0	107.4	K59 L60 L65 V91 P134 V211 T212 W213	K59-I144 WeakPolarHBondContact CA-O 3.41Å; L60-I144 HydrophobicContact CB-CB 4.27Å; L60-I144 HydrophobicContact CD1-CB 3.72Å; L60-I144 HydrophobicContact CD1-CG1 4.46Å; L60-I144 HydrophobicContact CD1-CG2 3.64Å; L60-I144 PolarHBondContact N-O 2.82Å; L60-I144 VanDerWaalsContact N-O 3.12Å; L65-I144 HydrophobicContact CD2-CD1 4.13Å; V91-I144 HydrophobicContact CB-CD1 4.16Å; V91-I144 HydrophobicContact CG1-CD1 4.05Å; V91-I144 HydrophobicContact CG2-CD1 3.33Å; V91-I144 HydrophobicContact CG2-CG1 4.03Å; P134-I144 HydrophobicContact CG-CD1 4.23Å; I144-V211 HydrophobicContact CG2-CG1 3.93Å; I144-T212 WeakPolarHBondContact CA-O 3.21Å; I144-W213 HydrophobicContact CB-CB 4.34Å; I144-W213 HydrophobicContact CB-CG 4.32Å; I144-W213 HydrophobicContact CG1-CB 3.92Å; I144-W213 HydrophobicContact CG1-CG 3.86Å; I144-W213 HydrophobicContact CG2-CB 4.13Å; I144-W213 HydrophobicContact CG2-CD2 4.05Å; I144-W213 HydrophobicContact CG2-CG 3.73Å
145	H	92.9	Very high	81.9	Confident	21 Å²	21	36 Å²	36	10%	0.097	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	132.1	-175.5	-69.9	-92	0	0	0	109.3	Y51 D57 E58 V211 T212	Y51-H145 HydrophobicContact CD2-CB 4.26Å; D57-H145 HydrophobicContact CB-CB 4.29Å; E58-H145 WeakPolarHBondContact O-CA 3.34Å; H145-V211 CarbonylContact O-C 3.6Å; H145-V211 WeakPolarHBondContact O-CA 3.26Å; H145-T212 PolarHBondContact N-O 3.2Å; H145-T212 PolarHBondContact O-N 2.85Å
146	Y	94.5	Very high	81.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	147.7	-180	71.1	-88.6	0	0	0	112.9	D57 E58 L60 R69 I71 L89 Y177 V210	D57-Y146 CarbonylContact C-O 3.57Å; D57-Y146 WeakPolarHBondContact CA-O 3.41Å; E58-Y146 HydrophobicContact CB-CE1 4.01Å; E58-Y146 HydrophobicContact CB-CE2 4.2Å; E58-Y146 VanDerWaalsContact CD-OH 3.25Å; E58-Y146 HydrophobicContact CG-CE1 4.43Å; E58-Y146 PolarHBondContact N-O 2.76Å; E58-Y146 WeakPolarHBondContact O-CD1 3.49Å; E58-Y146 PolarHBondContact O-N 2.89Å; E58-Y146 PolarHBondContact OE1-OH 3.17Å; L60-Y146 HydrophobicContact CD1-CD1 4.46Å; L60-Y146 HydrophobicContact CG-CD1 4.4Å; L60-Y146 HydrophobicContact CG-CE1 4.24Å; R69-Y146 PolarHBondContact NE-OH 3.35Å; R69-Y146 PolarHBondContact NH2-OH 2.86Å; I71-Y146 HydrophobicContact CD1-CD1 4.23Å; I71-Y146 HydrophobicContact CD1-CD2 3.43Å; I71-Y146 VanDerWaalsContact CD1-CD2 3.43Å; I71-Y146 HydrophobicContact CD1-CE1 4.24Å; I71-Y146 HydrophobicContact CD1-CE2 3.42Å; I71-Y146 VanDerWaalsContact CD1-CE2 3.42Å; I71-Y146 HydrophobicContact CD1-CG 3.84Å; I71-Y146 HydrophobicContact CG1-CE2 4.1Å; I71-Y146 HydrophobicContact CG2-CE2 4.5Å; L89-Y146 HydrophobicContact CD1-CD1 4.43Å; L89-Y146 HydrophobicContact CD1-CG 4.1Å; Y146-Y177 HydrophobicContact CD2-CG 4.33Å; Y146-Y177 AromaticContact CE2-CD1 3.84Å; Y146-Y177 HydrophobicContact CE2-CD1 3.84Å; Y146-Y177 HydrophobicContact CE2-CD2 4.23Å; Y146-Y177 AromaticContact CE2-CG 3.67Å; Y146-Y177 HydrophobicContact CE2-CG 3.67Å; Y146-V210 WeakPolarHBondContact CA-O 3.49Å
147	R	95.1	Very high	80.5	Confident	9 Å²	9	38.5 Å²	38.5	3%	0.034	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	160.6	166.9	62.5	173.9	157.3	138.1	4.9	111.5	Q50 T56 D57 V149 Y177 D179 V210	Q50-R147 PolarHBondContact O-NH2 2.83Å; T56-R147 VanDerWaalsContact OG1-CD 3.32Å; T56-R147 WeakPolarHBondContact OG1-CD 3.22Å; D57-R147 WeakPolarHBondContact OD1-CD 3.32Å; D57-R147 WeakPolarHBondContact OD1-CG 3.4Å; D57-R147 IonicContact OD1-NE 2.92Å; D57-R147 PolarHBondContact OD1-NE 2.82Å; R147-V149 HydrophobicContact CG-CG2 3.94Å; R147-Y177 CarbonylContact C-O 3.53Å; R147-Y177 VanDerWaalsContact CA-O 3.28Å; R147-Y177 WeakPolarHBondContact CA-O 3.37Å; R147-Y177 VanDerWaalsContact CB-O 3.3Å; R147-Y177 WeakPolarHBondContact CB-O 3.45Å; R147-D179 IonicContact NH1-OD2 3.85Å; R147-D179 PolarHBondContact NH1-OD2 2.98Å; R147-V210 HydrophobicContact CG-CB 4.11Å; R147-V210 HydrophobicContact CG-CG2 4.45Å; R147-V210 PolarHBondContact N-O 3.47Å; R147-V210 PolarHBondContact O-N 2.9Å
148	L	94.8	Very high	79.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	122.8	173.7	-176.5	66.7	0	0	0	108	L73 F74 F77 F150 Y177 V178 D179 V207 L209	L73-L148 HydrophobicContact CD2-CD1 4.2Å; L73-L148 WeakPolarHBondContact O-CD2 3.27Å; F74-L148 HydrophobicContact CD2-CD2 3.89Å; F74-L148 HydrophobicContact CE2-CD2 4.49Å; F77-L148 HydrophobicContact CE2-CD1 4.31Å; F77-L148 HydrophobicContact CZ-CD1 4.27Å; L148-F150 HydrophobicContact CD2-CE2 3.57Å; L148-F150 HydrophobicContact CD2-CZ 4.03Å; L148-F150 HydrophobicContact CG-CD2 4.35Å; L148-F150 HydrophobicContact CG-CE2 3.66Å; L148-F150 HydrophobicContact CG-CZ 4.34Å; L148-Y177 HydrophobicContact CB-CD2 3.95Å; L148-Y177 HydrophobicContact CB-CE2 4.12Å; L148-Y177 HydrophobicContact CD2-CE2 4.21Å; L148-Y177 PolarHBondContact N-O 2.97Å; L148-V178 CarbonylContact O-C 3.58Å; L148-V178 WeakPolarHBondContact O-CA 3.49Å; L148-D179 PolarHBondContact O-N 3.28Å; L148-V207 HydrophobicContact CD1-CG1 3.92Å; L148-V207 HydrophobicContact CG-CG1 4.38Å; L148-L209 HydrophobicContact CD1-CB 4.12Å
149	V	94.8	Very high	78.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	121.1	-169	-176.1	0	0	0	0	110	R147 D179 G182 F185 L186 V207 A208 V210	R147-V149 HydrophobicContact CG-CG2 3.94Å; V149-D179 WeakPolarHBondContact CA-O 3.45Å; V149-D179 HydrophobicContact CB-CB 4.31Å; V149-D179 HydrophobicContact CG1-CB 4.22Å; V149-D179 HydrophobicContact CG2-CB 4.03Å; V149-G182 VanDerWaalsContact CG1-CA 3.44Å; V149-F185 HydrophobicContact CB-CD1 4.38Å; V149-F185 HydrophobicContact CG1-CD1 4Å; V149-F185 HydrophobicContact CG2-CD1 4.16Å; V149-F185 HydrophobicContact CG2-CE1 4.14Å; V149-L186 HydrophobicContact CG1-CD1 4.34Å; V149-L186 HydrophobicContact CG1-CD2 4.41Å; V149-L186 HydrophobicContact CG1-CG 4.13Å; V149-V207 CarbonylContact O-C 3.53Å; V149-V207 VanDerWaalsContact O-CA 3.22Å; V149-V207 WeakPolarHBondContact O-CA 2.97Å; V149-A208 WeakPolarHBondContact CB-O 3.23Å; V149-A208 PolarHBondContact N-O 2.8Å; V149-A208 PolarHBondContact O-N 2.76Å; V149-V210 HydrophobicContact CG2-CG2 4.31Å
150	F	92.2	Very high	77.9	Confident	9 Å²	9	46.3 Å²	46.3	4%	0.039	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	150.3	175.5	-73	-97.9	0	0	0	111.9	F74 L148 M154 I155 V178 D179 G182 V207	F74-F150 HydrophobicContact CB-CZ 4.16Å; L148-F150 HydrophobicContact CD2-CE2 3.57Å; L148-F150 HydrophobicContact CD2-CZ 4.03Å; L148-F150 HydrophobicContact CG-CD2 4.35Å; L148-F150 HydrophobicContact CG-CE2 3.66Å; L148-F150 HydrophobicContact CG-CZ 4.34Å; F150-M154 HydrophobicContact CD1-CB 4.33Å; F150-M154 HydrophobicContact CD1-CE 4.14Å; F150-M154 HydrophobicContact CD1-SD 4.23Å; F150-M154 HydrophobicContact CE1-CE 4.28Å; F150-I155 HydrophobicContact CB-CD1 3.74Å; F150-I155 HydrophobicContact CD1-CD1 4.44Å; F150-I155 HydrophobicContact CD2-CD1 4.09Å; F150-I155 HydrophobicContact CG-CD1 3.85Å; F150-V178 HydrophobicContact CD2-CG1 3.53Å; F150-V178 HydrophobicContact CE2-CG1 3.71Å; F150-D179 PolarHBondContact N-O 2.66Å; F150-G182 WeakPolarHBondContact O-CA 3.21Å; F150-G182 PolarHBondContact O-N 2.81Å; F150-V207 HydrophobicContact CD1-CB 4.34Å; F150-V207 HydrophobicContact CD1-CG1 3.93Å; F150-V207 HydrophobicContact CD1-CG2 3.51Å; F150-V207 HydrophobicContact CD2-CG1 4.24Å; F150-V207 HydrophobicContact CE1-CB 4.31Å; F150-V207 HydrophobicContact CE1-CG1 3.7Å; F150-V207 HydrophobicContact CE1-CG2 3.55Å; F150-V207 HydrophobicContact CE2-CG1 4.06Å; F150-V207 HydrophobicContact CG-CG1 4.18Å; F150-V207 HydrophobicContact CG-CG2 4.36Å; F150-V207 HydrophobicContact CZ-CG1 3.76Å; F150-V207 HydrophobicContact CZ-CG2 4.42Å
151	R	88	Confident	76.6	Confident	7 Å²	7	45.4 Å²	45.4	3%	0.026	25%	0.249	C	C	.	.			trans	-67.9	136.3	163.2	-164.5	174.5	-71.8	-77.9	1.7	110	N153 M154 D183 L186 D187 A205 D206	R151-N153 WeakPolarHBondContact CD-OD1 3.39Å; R151-N153 WeakPolarHBondContact CG-OD1 3.3Å; R151-N153 PolarHBondContact O-N 2.84Å; R151-M154 WeakPolarHBondContact O-CB 3.32Å; R151-M154 PolarHBondContact O-N 2.83Å; R151-D183 WeakPolarHBondContact CG-OD1 3.19Å; R151-D183 WeakPolarHBondContact CG-OD2 3.48Å; R151-D183 IonicContact CZ-OD2 3.25Å; R151-D183 IonicContact NH1-OD2 2.83Å; R151-D183 PolarHBondContact NH1-OD2 3.34Å; R151-L186 HydrophobicContact CB-CD1 3.94Å; R151-L186 VanDerWaalsContact N-CD1 3.29Å; R151-D187 IonicContact CZ-OD1 3.79Å; R151-D187 IonicContact NH1-OD1 2.78Å; R151-D187 PolarHBondContact NH1-OD1 3.4Å; R151-D187 IonicContact NH2-OD1 2.9Å; R151-D187 PolarHBondContact NH2-OD1 3.1Å; R151-A205 PolarHBondContact NH2-O 2.88Å; R151-D206 WeakPolarHBondContact CD-OD1 3.47Å; R151-D206 IonicContact CZ-OD1 2.73Å; R151-D206 PolarHBondContact N-O 2.94Å; R151-D206 IonicContact NE-OD1 3.22Å; R151-D206 PolarHBondContact NE-OD1 2.78Å
152	G	82.5	Confident	74.9	Confident	28 Å²	28	47.8 Å²	47.8	29%	0.289	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-62.4	-20.8	-171	0	0	0	0	0	115.1	M154 H180 D183	G152-M154 VanDerWaalsContact C-N 3.29Å; G152-M154 PolarHBondContact O-N 2.86Å; G152-H180 VanDerWaalsContact CA-O 3.29Å; G152-H180 WeakPolarHBondContact CA-O 3.49Å; G152-D183 PolarHBondContact N-OD1 3.36Å
153	N	79.3	Confident	73	Confident	87 Å²	87	49 Å²	49	47%	0.465	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-84.4	7.3	176	71.4	-4	0	0	0	114.7	R151 R255	R151-N153 WeakPolarHBondContact CD-OD1 3.39Å; R151-N153 WeakPolarHBondContact CG-OD1 3.3Å; R151-N153 PolarHBondContact O-N 2.84Å; N153-R255 PolarHBondContact O-NH1 3.31Å
154	M	77.7	Confident	71.1	Confident	44 Å²	44	57.1 Å²	57.1	22%	0.217	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-97.9	-16.1	171.1	-69.6	-170.3	62.7	0	0	113.6	F150 R151 G152 D206 V207 R255	F150-M154 HydrophobicContact CD1-CB 4.33Å; F150-M154 HydrophobicContact CD1-CE 4.14Å; F150-M154 HydrophobicContact CD1-SD 4.23Å; F150-M154 HydrophobicContact CE1-CE 4.28Å; R151-M154 WeakPolarHBondContact O-CB 3.32Å; R151-M154 PolarHBondContact O-N 2.83Å; G152-M154 VanDerWaalsContact C-N 3.29Å; G152-M154 PolarHBondContact O-N 2.86Å; M154-D206 HydrophobicContact SD-CB 3.79Å; M154-V207 HydrophobicContact CE-CG2 3.81Å; M154-V207 HydrophobicContact SD-CG2 3.74Å; M154-R255 HydrophobicContact CE-CG 4.13Å; M154-R255 HydrophobicContact SD-CB 4.4Å; M154-R255 HydrophobicContact SD-CG 4.2Å
155	I	74	Confident	68.9	Low	17 Å²	17	63.3 Å²	63.3	9%	0.087	35%	0.352	C	S	.	.			trans	-119.5	111.8	-175.4	-68.3	166.6	0	0	0	108.3	F150 R171 L174 H180	F150-I155 HydrophobicContact CB-CD1 3.74Å; F150-I155 HydrophobicContact CD1-CD1 4.44Å; F150-I155 HydrophobicContact CD2-CD1 4.09Å; F150-I155 HydrophobicContact CG-CD1 3.85Å; I155-R171 HydrophobicContact CG2-CB 4.17Å; I155-R171 HydrophobicContact CG2-CG 4.11Å; I155-L174 HydrophobicContact CD1-CD1 4.07Å; I155-L174 HydrophobicContact CD1-CD2 4.47Å; I155-L174 HydrophobicContact CG2-CD1 3.99Å; I155-H180 HydrophobicContact CD1-CB 3.53Å
156	S	63.5	Low	66.7	Low	38 Å²	38	64.5 Å²	64.5	27%	0.266	37%	0.37	S	S	.	.			trans	-102.4	148.4	178.1	37.3	0	0	0	0	112
157	D	58.9	Low	64.4	Low	97 Å²	97	69.3 Å²	69.3	52%	0.519	40%	0.401	S	S	.	.	S	Bend	trans	-83.3	-33.3	167.7	-73.5	-63.9	0	0	0	111.3	R171	D157-R171 WeakPolarHBondContact OD1-CB 3.1Å; D157-R171 WeakPolarHBondContact OD1-CD 3.44Å; D157-R171 WeakPolarHBondContact OD2-CD 3.4Å; D157-R171 IonicContact OD2-CZ 3.51Å; D157-R171 IonicContact OD2-NE 3.53Å; D157-R171 IonicContact OD2-NH1 2.72Å; D157-R171 PolarHBondContact OD2-NH1 3.12Å
158	D	53.2	Low	62.1	Low	135 Å²	135	72.3 Å²	72.3	72%	0.722	42%	0.422	S	S	*	.	S	Bend	trans	-84	138.5	178.2	-68.1	-49.5	0	0	0	113.3
159	S	44.3	Very low	60.4	Low	86 Å²	86	74.5 Å²	74.5	60%	0.601	43%	0.433	S	S	*	.	S	Bend	trans	-88	-0.7	-169.5	43.6	0	0	0	0	116.9
160	E	47.1	Very low	58.8	Low	183 Å²	183	79.6 Å²	79.6	86%	0.855	46%	0.455	S	S	*	.			trans	-95.6	-18.9	-171.2	-60.4	-164.9	147.2	0	0	114.4	L162	E160-L162 PolarHBondContact O-N 2.88Å; E160-L162 VanDerWaalsContact O-N 3.09Å
161	S	41.8	Very low	57.5	Low	74 Å²	74	83.4 Å²	83.4	52%	0.517	47%	0.469	S	S	.	.			trans	-82.1	85.9	175.9	65.9	0	0	0	0	111.5	P163	S161-P163 VanDerWaalsContact O-CD 3.31Å; S161-P163 WeakPolarHBondContact O-CD 3.41Å
162	L	39.8	Very low	56.4	Low	150 Å²	150	87.7 Å²	87.7	79%	0.785	50%	0.5	S	S	*	.			trans	-56	120.3	170.7	-81.2	163.6	0	0	0	111.1	E160	E160-L162 PolarHBondContact O-N 2.88Å; E160-L162 VanDerWaalsContact O-N 3.09Å
163	P	40.8	Very low	56	Low	40 Å²	40	92.5 Å²	92.5	26%	0.26	52%	0.519	S	S	.	.			trans	-66	135.5	165	-13.5	28.9	0	0	0	108.9	S161 N165 P168	S161-P163 VanDerWaalsContact O-CD 3.31Å; S161-P163 WeakPolarHBondContact O-CD 3.41Å; P163-N165 PolarHBondContact O-N 3.28Å; P163-N165 VanDerWaalsContact O-N 3.07Å; P163-P168 HydrophobicContact CG-CB 4.29Å
164	L	46.3	Very low	55.9	Low	173 Å²	173	89.8 Å²	89.8	91%	0.906	50%	0.504	S	S	*	.	S	Bend	trans	-67.4	-11.1	-176.8	-142.5	78.5	0	0	0	113.9
165	N	45.3	Very low	56.3	Low	132 Å²	132	89.8 Å²	89.8	71%	0.706	51%	0.507	S	S	*	.	S	Bend	trans	-150.3	136.8	168.7	-84.6	-70.2	0	0	0	109.2	P163	P163-N165 PolarHBondContact O-N 3.28Å; P163-N165 VanDerWaalsContact O-N 3.07Å
166	G	46.1	Very low	57	Low	46 Å²	46	97 Å²	97	47%	0.474	54%	0.538	S	S	.	.	S	Bend	trans	95.4	149.4	178.1	0	0	0	0	0	114.6
167	P	46.1	Very low	58.3	Low	100 Å²	100	96 Å²	96	65%	0.649	53%	0.528	S	S	*	.			trans	-71	137.6	179.4	29.8	-34.2	0	0	0	111.4	M169	P167-M169 PolarHBondContact O-N 3.16Å; P167-M169 VanDerWaalsContact O-N 3.15Å
168	P	48.3	Very low	59.8	Low	73 Å²	73	91.7 Å²	91.7	47%	0.474	51%	0.506	S	S	.	.			trans	-69	111.1	179.4	26.7	-33.4	0	0	0	111.4	P163 K170	P163-P168 HydrophobicContact CG-CB 4.29Å; P168-K170 PolarHBondContact O-N 3.32Å
169	M	57.5	Low	61.6	Low	46 Å²	46	86.5 Å²	86.5	23%	0.227	48%	0.478	C	S	.	.			trans	-80.1	108.5	174.5	-67.8	-156.7	89	0	0	111.4	F74 P167 R171 L174	F74-M169 HydrophobicContact CB-CE 4.35Å; F74-M169 HydrophobicContact CB-SD 3.43Å; F74-M169 WeakPolarHBondContact CB-SD 3.48Å; F74-M169 HydrophobicContact CD1-CE 3.41Å; F74-M169 VanDerWaalsContact CD1-CE 3.41Å; F74-M169 HydrophobicContact CD1-SD 3.67Å; F74-M169 HydrophobicContact CD2-CE 3.91Å; F74-M169 HydrophobicContact CD2-SD 3.78Å; F74-M169 HydrophobicContact CE1-CE 3.55Å; F74-M169 HydrophobicContact CE1-SD 4.39Å; F74-M169 HydrophobicContact CE2-CE 4.03Å; F74-M169 HydrophobicContact CE2-SD 4.47Å; F74-M169 HydrophobicContact CG-CE 3.62Å; F74-M169 HydrophobicContact CG-SD 3.32Å; F74-M169 WeakPolarHBondContact CG-SD 3.25Å; F74-M169 HydrophobicContact CZ-CE 3.87Å; P167-M169 PolarHBondContact O-N 3.16Å; P167-M169 VanDerWaalsContact O-N 3.15Å; M169-R171 PolarHBondContact O-N 3.06Å; M169-L174 HydrophobicContact CB-CD2 4.19Å; M169-L174 HydrophobicContact CE-CD2 3.65Å; M169-L174 HydrophobicContact SD-CD2 3.66Å
170	K	61.7	Low	63.5	Low	106 Å²	106	84.8 Å²	84.8	46%	0.461	46%	0.461	S	S	.	.			trans	-65.8	127.8	166.9	-73.6	-167.4	170	-166.7	0	110.6	P168 S172 N173	P168-K170 PolarHBondContact O-N 3.32Å; K170-S172 PolarHBondContact O-N 2.81Å; K170-N173 PolarHBondContact O-N 2.82Å
171	R	64.5	Low	65.3	Low	90 Å²	90	81.1 Å²	81.1	34%	0.34	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-51.3	-32.7	-178.7	-156.3	178.3	-168.4	161.5	4.7	114	I155 D157 M169 N173 L174 H180	I155-R171 HydrophobicContact CG2-CB 4.17Å; I155-R171 HydrophobicContact CG2-CG 4.11Å; D157-R171 WeakPolarHBondContact OD1-CB 3.1Å; D157-R171 WeakPolarHBondContact OD1-CD 3.44Å; D157-R171 WeakPolarHBondContact OD2-CD 3.4Å; D157-R171 IonicContact OD2-CZ 3.51Å; D157-R171 IonicContact OD2-NE 3.53Å; D157-R171 IonicContact OD2-NH1 2.72Å; D157-R171 PolarHBondContact OD2-NH1 3.12Å; M169-R171 PolarHBondContact O-N 3.06Å; R171-N173 PolarHBondContact O-N 3.26Å; R171-L174 HydrophobicContact CG-CD1 4.19Å; R171-H180 PolarHBondContact NE-CD2 2.99Å; R171-H180 PolarHBondContact NE-NE2 2.9Å; R171-H180 PolarHBondContact NH2-CD2 3.1Å; R171-H180 PolarHBondContact NH2-NE2 2.93Å
172	S	65.6	Low	67.5	Low	97 Å²	97	77.6 Å²	77.6	68%	0.678	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-62.7	-21.8	178.2	60.4	0	0	0	0	115.1	K170	K170-S172 PolarHBondContact O-N 2.81Å
173	N	74.5	Confident	69.8	Low	129 Å²	129	73.2 Å²	73.2	69%	0.69	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-113.7	10.3	-171.4	-65.4	26.2	0	0	0	112.6	K170 R171	K170-N173 PolarHBondContact O-N 2.82Å; R171-N173 PolarHBondContact O-N 3.26Å
174	L	77.1	Confident	72.1	Confident	30 Å²	30	75.7 Å²	75.7	16%	0.157	42%	0.418	C	S	.	.			trans	-70.4	133.7	179.1	-71.7	171	0	0	0	111.5	I155 M169 R171 V178 H180	I155-L174 HydrophobicContact CD1-CD1 4.07Å; I155-L174 HydrophobicContact CD1-CD2 4.47Å; I155-L174 HydrophobicContact CG2-CD1 3.99Å; M169-L174 HydrophobicContact CB-CD2 4.19Å; M169-L174 HydrophobicContact CE-CD2 3.65Å; M169-L174 HydrophobicContact SD-CD2 3.66Å; R171-L174 HydrophobicContact CG-CD1 4.19Å; L174-V178 HydrophobicContact CB-CB 4.47Å; L174-V178 HydrophobicContact CD2-CB 4.38Å; L174-V178 HydrophobicContact CD2-CG1 4.12Å; L174-H180 HydrophobicContact CD1-CB 4.33Å
175	P	86.5	Confident	74.4	Confident	43 Å²	43	68.6 Å²	68.6	28%	0.279	38%	0.38	S	S	.	.			trans	-59.3	151.3	168.2	-23.6	33.8	0	0	0	112.2	F74 Y177 V178	F74-P175 HydrophobicContact CE2-CG 3.96Å; F74-P175 HydrophobicContact CZ-CG 3.75Å; P175-Y177 HydrophobicContact CB-CD1 3.56Å; P175-Y177 HydrophobicContact CB-CE1 3.32Å; P175-Y177 HydrophobicContact CB-CE2 4.48Å; P175-Y177 HydrophobicContact CB-CG 4.25Å; P175-Y177 HydrophobicContact CG-CE1 3.87Å; P175-Y177 PolarHBondContact O-N 3.4Å; P175-Y177 VanDerWaalsContact O-N 3.13Å; P175-V178 HydrophobicContact CB-CG2 4.33Å; P175-V178 HydrophobicContact CG-CG2 4.43Å; P175-V178 WeakPolarHBondContact O-CB 3.01Å; P175-V178 PolarHBondContact O-N 3.28Å
176	K	87.8	Confident	76.6	Confident	168 Å²	168	62.3 Å²	62.3	73%	0.73	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-32	-177.1	-172.4	-177.3	174.4	-169.3	0	113.6	V178	K176-V178 PolarHBondContact O-N 2.84Å
177	Y	90.9	Very high	78.7	Confident	17 Å²	17	62.9 Å²	62.9	7%	0.067	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-5.4	177.6	67.7	-104.9	0	0	0	114.3	I71 D72 F74 Y146 R147 L148 P175	I71-Y177 HydrophobicContact CG2-CD2 4.43Å; I71-Y177 HydrophobicContact CG2-CE1 4.39Å; I71-Y177 HydrophobicContact CG2-CE2 3.71Å; D72-Y177 PolarHBondContact O-OH 3.43Å; F74-Y177 HydrophobicContact CE2-CE2 4.18Å; F74-Y177 WeakPolarHBondContact CE2-OH 3.11Å; Y146-Y177 HydrophobicContact CD2-CG 4.33Å; Y146-Y177 AromaticContact CE2-CD1 3.84Å; Y146-Y177 HydrophobicContact CE2-CD1 3.84Å; Y146-Y177 HydrophobicContact CE2-CD2 4.23Å; Y146-Y177 AromaticContact CE2-CG 3.67Å; Y146-Y177 HydrophobicContact CE2-CG 3.67Å; R147-Y177 CarbonylContact C-O 3.53Å; R147-Y177 VanDerWaalsContact CA-O 3.28Å; R147-Y177 WeakPolarHBondContact CA-O 3.37Å; R147-Y177 VanDerWaalsContact CB-O 3.3Å; R147-Y177 WeakPolarHBondContact CB-O 3.45Å; L148-Y177 HydrophobicContact CB-CD2 3.95Å; L148-Y177 HydrophobicContact CB-CE2 4.12Å; L148-Y177 HydrophobicContact CD2-CE2 4.21Å; L148-Y177 PolarHBondContact N-O 2.97Å; P175-Y177 HydrophobicContact CB-CD1 3.56Å; P175-Y177 HydrophobicContact CB-CE1 3.32Å; P175-Y177 HydrophobicContact CB-CE2 4.48Å; P175-Y177 HydrophobicContact CB-CG 4.25Å; P175-Y177 HydrophobicContact CG-CE1 3.87Å; P175-Y177 PolarHBondContact O-N 3.4Å; P175-Y177 VanDerWaalsContact O-N 3.13Å
178	V	90.9	Very high	80.9	Confident	7 Å²	7	63.4 Å²	63.4	4%	0.042	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	108.9	-179.3	-170.6	0	0	0	0	111.5	F74 L148 F150 L174 P175 K176	F74-V178 HydrophobicContact CD2-CG2 4.41Å; F74-V178 HydrophobicContact CE2-CG2 4.06Å; L148-V178 CarbonylContact O-C 3.58Å; L148-V178 WeakPolarHBondContact O-CA 3.49Å; F150-V178 HydrophobicContact CD2-CG1 3.53Å; F150-V178 HydrophobicContact CE2-CG1 3.71Å; L174-V178 HydrophobicContact CB-CB 4.47Å; L174-V178 HydrophobicContact CD2-CB 4.38Å; L174-V178 HydrophobicContact CD2-CG1 4.12Å; P175-V178 HydrophobicContact CB-CG2 4.33Å; P175-V178 HydrophobicContact CG-CG2 4.43Å; P175-V178 WeakPolarHBondContact O-CB 3.01Å; P175-V178 PolarHBondContact O-N 3.28Å; K176-V178 PolarHBondContact O-N 2.84Å
179	D	91	Very high	83	Confident	27 Å²	27	60 Å²	60	14%	0.144	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	122.8	164.8	-163.9	-20.2	0	0	0	109.2	T56 R147 L148 V149 F150 N181	T56-D179 HydrophobicContact CG2-CB 4.11Å; T56-D179 WeakPolarHBondContact OG1-CB 3.46Å; R147-D179 IonicContact NH1-OD2 3.85Å; R147-D179 PolarHBondContact NH1-OD2 2.98Å; L148-D179 PolarHBondContact O-N 3.28Å; V149-D179 WeakPolarHBondContact CA-O 3.45Å; V149-D179 HydrophobicContact CB-CB 4.31Å; V149-D179 HydrophobicContact CG1-CB 4.22Å; V149-D179 HydrophobicContact CG2-CB 4.03Å; F150-D179 PolarHBondContact N-O 2.66Å; D179-N181 PolarHBondContact OD1-N 2.8Å; D179-N181 VanDerWaalsContact OD1-N 3.15Å
180	H	83.8	Confident	84.7	Confident	50 Å²	50	58.5 Å²	58.5	23%	0.231	30%	0.298	C	S	.	.	S	Bend	trans	-111.8	3.9	-177.8	64.6	-96.6	0	0	0	113.3	G152 I155 R171 L174	G152-H180 VanDerWaalsContact CA-O 3.29Å; G152-H180 WeakPolarHBondContact CA-O 3.49Å; I155-H180 HydrophobicContact CD1-CB 3.53Å; R171-H180 PolarHBondContact NE-CD2 2.99Å; R171-H180 PolarHBondContact NE-NE2 2.9Å; R171-H180 PolarHBondContact NH2-CD2 3.1Å; R171-H180 PolarHBondContact NH2-NE2 2.93Å; L174-H180 HydrophobicContact CD1-CB 4.33Å
181	N	85.2	Confident	85.9	Confident	105 Å²	105	58 Å²	58	56%	0.561	30%	0.297	S	S	*	.			trans	-119	38.2	176.8	-71.5	-22.2	0	0	0	110.4	D179 D183	D179-N181 PolarHBondContact OD1-N 2.8Å; D179-N181 VanDerWaalsContact OD1-N 3.15Å; N181-D183 VanDerWaalsContact C-N 3.3Å; N181-D183 PolarHBondContact O-N 3.24Å
182	G	86.9	Confident	87.2	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.01	28%	0.284	C	S	.	.			trans	-75.6	-2	-165.9	0	0	0	0	0	117.2	V149 F150 S184 F185 L186	V149-G182 VanDerWaalsContact CG1-CA 3.44Å; F150-G182 WeakPolarHBondContact O-CA 3.21Å; F150-G182 PolarHBondContact O-N 2.81Å; G182-S184 PolarHBondContact O-N 3.42Å; G182-S184 VanDerWaalsContact O-N 3.17Å; G182-F185 WeakPolarHBondContact O-CA 3.42Å; G182-F185 WeakPolarHBondContact O-CB 3.48Å; G182-F185 PolarHBondContact O-N 3.37Å; G182-L186 PolarHBondContact O-N 2.9Å
183	D	89.7	Confident	88.6	Confident	58 Å²	58	49.6 Å²	49.6	31%	0.31	25%	0.251	S	S	.	.	H	α-helix	trans	-48.7	-47	-168.1	-79.5	66.3	0	0	0	115	R151 G152 N181 F185 L186 D187	R151-D183 WeakPolarHBondContact CG-OD1 3.19Å; R151-D183 WeakPolarHBondContact CG-OD2 3.48Å; R151-D183 IonicContact CZ-OD2 3.25Å; R151-D183 IonicContact NH1-OD2 2.83Å; R151-D183 PolarHBondContact NH1-OD2 3.34Å; G152-D183 PolarHBondContact N-OD1 3.36Å; N181-D183 VanDerWaalsContact C-N 3.3Å; N181-D183 PolarHBondContact O-N 3.24Å; D183-F185 VanDerWaalsContact C-N 3.28Å; D183-F185 PolarHBondContact O-N 2.79Å; D183-L186 PolarHBondContact O-N 3.39Å; D183-D187 VanDerWaalsContact O-CB 3.28Å; D183-D187 WeakPolarHBondContact O-CB 3.4Å; D183-D187 PolarHBondContact O-N 3.05Å
184	S	89.6	Confident	89.2	Confident	92 Å²	92	46 Å²	46	64%	0.643	23%	0.228	S	C	*	.	H	α-helix	trans	-73.9	-18.5	-178.5	64.8	0	0	0	0	114	G182	G182-S184 PolarHBondContact O-N 3.42Å; G182-S184 VanDerWaalsContact O-N 3.17Å
185	F	92.6	Very high	89.8	Confident	23 Å²	23	46 Å²	46	10%	0.101	23%	0.229	C	C	.	.	H	α-helix	trans	-85.8	-43.1	174.4	-176.1	-97.5	0	0	0	110.8	Y49 V149 G182 D183 R188 I189 V210	Y49-F185 HydrophobicContact CG-CE2 4.43Å; Y49-F185 HydrophobicContact CG-CZ 4.4Å; V149-F185 HydrophobicContact CB-CD1 4.38Å; V149-F185 HydrophobicContact CG1-CD1 4Å; V149-F185 HydrophobicContact CG2-CD1 4.16Å; V149-F185 HydrophobicContact CG2-CE1 4.14Å; G182-F185 WeakPolarHBondContact O-CA 3.42Å; G182-F185 WeakPolarHBondContact O-CB 3.48Å; G182-F185 PolarHBondContact O-N 3.37Å; D183-F185 VanDerWaalsContact C-N 3.28Å; D183-F185 PolarHBondContact O-N 2.79Å; F185-R188 PolarHBondContact O-N 3.38Å; F185-I189 HydrophobicContact CD1-CD1 3.67Å; F185-I189 HydrophobicContact CE1-CD1 3.38Å; F185-I189 HydrophobicContact CE1-CG1 4.47Å; F185-I189 HydrophobicContact CZ-CD1 4.11Å; F185-I189 PolarHBondContact O-N 3.02Å; F185-V210 HydrophobicContact CE1-CG2 3.55Å; F185-V210 HydrophobicContact CZ-CG2 3.64Å
186	L	93.4	Very high	89.9	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.9	-43.3	176.8	-68.3	169.5	0	0	0	112.1	V149 R151 G182 D183 R188 I189 Q190 A205 D206 A208	V149-L186 HydrophobicContact CG1-CD1 4.34Å; V149-L186 HydrophobicContact CG1-CD2 4.41Å; V149-L186 HydrophobicContact CG1-CG 4.13Å; R151-L186 HydrophobicContact CB-CD1 3.94Å; R151-L186 VanDerWaalsContact N-CD1 3.29Å; G182-L186 PolarHBondContact O-N 2.9Å; D183-L186 PolarHBondContact O-N 3.39Å; L186-R188 PolarHBondContact O-N 2.96Å; L186-I189 PolarHBondContact O-N 3.01Å; L186-I189 VanDerWaalsContact O-N 3.16Å; L186-Q190 WeakPolarHBondContact O-CB 3.32Å; L186-Q190 PolarHBondContact O-N 3.05Å; L186-A205 HydrophobicContact CB-CB 4.21Å; L186-A205 HydrophobicContact CD2-CB 4.21Å; L186-D206 WeakPolarHBondContact CD1-O 3.45Å; L186-A208 HydrophobicContact CD2-CB 3.57Å
187	D	90.3	Very high	90.1	Very high	58 Å²	58	36.3 Å²	36.3	31%	0.31	18%	0.182	S	C	.	.	H	α-helix	trans	-58.4	-35.1	173.9	-80.3	18.3	0	0	0	111.1	R151 D183 Q190 E191 K518	R151-D187 IonicContact CZ-OD1 3.79Å; R151-D187 IonicContact NH1-OD1 2.78Å; R151-D187 PolarHBondContact NH1-OD1 3.4Å; R151-D187 IonicContact NH2-OD1 2.9Å; R151-D187 PolarHBondContact NH2-OD1 3.1Å; D183-D187 VanDerWaalsContact O-CB 3.28Å; D183-D187 WeakPolarHBondContact O-CB 3.4Å; D183-D187 PolarHBondContact O-N 3.05Å; D187-Q190 PolarHBondContact O-N 2.7Å; D187-E191 WeakPolarHBondContact O-CB 3.39Å; D187-E191 PolarHBondContact O-N 3.34Å; D187-K518 VanDerWaalsContact CG-NZ 3.29Å; D187-K518 IonicContact OD1-NZ 2.77Å; D187-K518 PolarHBondContact OD1-NZ 3.22Å; D187-K518 VanDerWaalsContact OD1-NZ 3.12Å; D187-K518 IonicContact OD2-NZ 2.88Å; D187-K518 PolarHBondContact OD2-NZ 3.28Å
188	R	91.1	Very high	90	Very high	112 Å²	112	36.1 Å²	36.1	42%	0.423	18%	0.182	S	C	.	.	H	α-helix	trans	-71.3	-40.2	175.1	-168.8	-175.3	-56.8	-174.2	4.4	112.9	F185 L186 Q190 E191 D192	F185-R188 PolarHBondContact O-N 3.38Å; L186-R188 PolarHBondContact O-N 2.96Å; R188-Q190 VanDerWaalsContact C-N 3.3Å; R188-E191 WeakPolarHBondContact O-CB 3.47Å; R188-E191 PolarHBondContact O-N 2.83Å; R188-D192 PolarHBondContact O-N 3.02Å
189	I	93.4	Very high	89.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.5	-43.8	172.6	-75.9	164.1	0	0	0	110.2	Y49 F185 L186 E191 D192 L193 A205 A208 V250 T252 I263	Y49-I189 HydrophobicContact CE1-CG1 4.32Å; Y49-I189 HydrophobicContact CE2-CG1 4.48Å; F185-I189 HydrophobicContact CD1-CD1 3.67Å; F185-I189 HydrophobicContact CE1-CD1 3.38Å; F185-I189 HydrophobicContact CE1-CG1 4.47Å; F185-I189 HydrophobicContact CZ-CD1 4.11Å; F185-I189 PolarHBondContact O-N 3.02Å; L186-I189 PolarHBondContact O-N 3.01Å; L186-I189 VanDerWaalsContact O-N 3.16Å; I189-E191 VanDerWaalsContact C-N 3.34Å; I189-E191 PolarHBondContact O-N 3.19Å; I189-D192 PolarHBondContact O-N 2.82Å; I189-L193 HydrophobicContact CG2-CD1 3.92Å; I189-L193 HydrophobicContact CG2-CG 4.47Å; I189-L193 WeakPolarHBondContact O-CB 3.22Å; I189-L193 VanDerWaalsContact O-CG 3.26Å; I189-L193 WeakPolarHBondContact O-CG 3.48Å; I189-L193 PolarHBondContact O-N 2.81Å; I189-A205 HydrophobicContact CG2-CB 4.25Å; I189-A208 HydrophobicContact CD1-CB 3.95Å; I189-V250 HydrophobicContact CD1-CG1 3.78Å; I189-T252 HydrophobicContact CG2-CG2 3.79Å; I189-I263 HydrophobicContact CG2-CD1 4.03Å
190	Q	91.4	Very high	89.4	Confident	15 Å²	15	34.9 Å²	34.9	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-62.4	-40.3	177.1	-170.9	178.9	-6.2	0	0	111.7	L186 D187 R188 L193 R194 F203 A205	L186-Q190 WeakPolarHBondContact O-CB 3.32Å; L186-Q190 PolarHBondContact O-N 3.05Å; D187-Q190 PolarHBondContact O-N 2.7Å; R188-Q190 VanDerWaalsContact C-N 3.3Å; Q190-L193 PolarHBondContact O-N 2.97Å; Q190-R194 WeakPolarHBondContact O-CB 3.16Å; Q190-R194 WeakPolarHBondContact O-CG 3.42Å; Q190-R194 PolarHBondContact O-N 2.89Å; Q190-F203 WeakPolarHBondContact CG-O 3.27Å; Q190-F203 PolarHBondContact NE2-O 3.04Å; Q190-A205 HydrophobicContact CB-CB 4.13Å
191	E	88.8	Confident	89.1	Confident	95 Å²	95	35 Å²	35	44%	0.444	18%	0.18	S	C	.	.	H	α-helix	trans	-62.6	-50.4	174	-164.2	-160.8	131.2	0	0	112.4	D187 R188 I189 L193 R194 D195 R320	D187-E191 WeakPolarHBondContact O-CB 3.39Å; D187-E191 PolarHBondContact O-N 3.34Å; R188-E191 WeakPolarHBondContact O-CB 3.47Å; R188-E191 PolarHBondContact O-N 2.83Å; I189-E191 VanDerWaalsContact C-N 3.34Å; I189-E191 PolarHBondContact O-N 3.19Å; E191-L193 VanDerWaalsContact C-N 3.27Å; E191-L193 PolarHBondContact O-N 2.84Å; E191-R194 PolarHBondContact O-N 2.84Å; E191-R194 VanDerWaalsContact O-N 3.14Å; E191-D195 PolarHBondContact O-N 3.01Å; E191-D195 VanDerWaalsContact O-N 3.11Å; E191-R320 IonicContact OE1-CZ 2.7Å; E191-R320 IonicContact OE1-NH1 3.39Å; E191-R320 PolarHBondContact OE1-NH1 2.84Å; E191-R320 IonicContact OE1-NH2 2.91Å; E191-R320 PolarHBondContact OE1-NH2 2.84Å
192	D	91.7	Very high	88.5	Confident	12 Å²	12	34 Å²	34	6%	0.064	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-29	178.7	-79.3	-33.3	0	0	0	112.6	Y49 R188 I189 G196 R320 R324	Y49-D192 PolarHBondContact OH-OD2 2.94Å; R188-D192 PolarHBondContact O-N 3.02Å; I189-D192 PolarHBondContact O-N 2.82Å; D192-G196 PolarHBondContact O-N 3.03Å; D192-R320 WeakPolarHBondContact OD1-CD 3.35Å; D192-R320 IonicContact OD1-CZ 3.75Å; D192-R320 IonicContact OD1-NE 3.44Å; D192-R320 IonicContact OD1-NH1 3.1Å; D192-R320 PolarHBondContact OD1-NH1 2.91Å; D192-R324 IonicContact OD1-NH1 3.21Å; D192-R324 IonicContact OD2-CZ 3.28Å; D192-R324 IonicContact OD2-NH1 2.67Å; D192-R324 PolarHBondContact OD2-NH1 3.36Å
193	L	93.4	Very high	88.5	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-73	-40.7	171	-72.4	170.8	0	0	0	112.4	I189 Q190 E191 D195 G196 I197 A200 F203 T252 Y261 I263 L326	I189-L193 HydrophobicContact CG2-CD1 3.92Å; I189-L193 HydrophobicContact CG2-CG 4.47Å; I189-L193 WeakPolarHBondContact O-CB 3.22Å; I189-L193 VanDerWaalsContact O-CG 3.26Å; I189-L193 WeakPolarHBondContact O-CG 3.48Å; I189-L193 PolarHBondContact O-N 2.81Å; Q190-L193 PolarHBondContact O-N 2.97Å; E191-L193 VanDerWaalsContact C-N 3.27Å; E191-L193 PolarHBondContact O-N 2.84Å; L193-D195 VanDerWaalsContact C-N 3.34Å; L193-D195 PolarHBondContact O-N 3.42Å; L193-G196 PolarHBondContact O-N 3.09Å; L193-I197 HydrophobicContact CD2-CD1 3.59Å; L193-I197 HydrophobicContact CD2-CG1 4.35Å; L193-I197 PolarHBondContact O-N 2.91Å; L193-A200 HydrophobicContact CB-CB 4.17Å; L193-F203 HydrophobicContact CD1-CD1 3.94Å; L193-F203 HydrophobicContact CD1-CE1 3.72Å; L193-T252 HydrophobicContact CD1-CG2 3.84Å; L193-Y261 HydrophobicContact CD1-CD2 4.48Å; L193-Y261 HydrophobicContact CD1-CG 4.13Å; L193-Y261 HydrophobicContact CD2-CD1 4.01Å; L193-Y261 HydrophobicContact CD2-CG 4.17Å; L193-I263 HydrophobicContact CD2-CD1 4.11Å; L193-I263 HydrophobicContact CD2-CG1 4.08Å; L193-I263 HydrophobicContact CG-CD1 4.2Å; L193-L326 HydrophobicContact CD2-CD2 4.38Å
194	R	88.9	Confident	88.3	Confident	52 Å²	52	35.2 Å²	35.2	20%	0.196	19%	0.185	C	C	.	.	H	α-helix	trans	-66.2	-31.1	179.3	-78.4	170.8	164.2	-175.7	-10.4	114	Q190 E191 A200 N201	Q190-R194 WeakPolarHBondContact O-CB 3.16Å; Q190-R194 WeakPolarHBondContact O-CG 3.42Å; Q190-R194 PolarHBondContact O-N 2.89Å; E191-R194 PolarHBondContact O-N 2.84Å; E191-R194 VanDerWaalsContact O-N 3.14Å; R194-A200 WeakPolarHBondContact CG-O 3.28Å; R194-N201 PolarHBondContact NE-O 2.97Å; R194-N201 VanDerWaalsContact NE-O 3.15Å; R194-N201 PolarHBondContact NH2-O 2.96Å
195	D	88.4	Confident	88.4	Confident	32 Å²	32	30.9 Å²	30.9	17%	0.171	16%	0.155	C	C	.	.	H	α-helix	trans	-83.3	-24.6	173.7	-95	-4.9	0	0	0	113.5	E191 L193 R320 K391 N392 I395	E191-D195 PolarHBondContact O-N 3.01Å; E191-D195 VanDerWaalsContact O-N 3.11Å; L193-D195 VanDerWaalsContact C-N 3.34Å; L193-D195 PolarHBondContact O-N 3.42Å; D195-R320 IonicContact OD2-CZ 2.69Å; D195-R320 VanDerWaalsContact OD2-CZ 3.29Å; D195-R320 IonicContact OD2-NE 3.33Å; D195-R320 PolarHBondContact OD2-NE 3Å; D195-R320 VanDerWaalsContact OD2-NE 3.07Å; D195-R320 IonicContact OD2-NH2 3.39Å; D195-R320 PolarHBondContact OD2-NH2 2.86Å; D195-K391 IonicContact OD1-NZ 3.26Å; D195-N392 PolarHBondContact O-ND2 3.08Å; D195-I395 VanDerWaalsContact O-CD1 3.24Å; D195-I395 WeakPolarHBondContact O-CD1 3.32Å
196	G	89.9	Confident	88.3	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-94.2	-31.3	-179	0	0	0	0	0	115.7	D192 L193 V317 G337 N366	D192-G196 PolarHBondContact O-N 3.03Å; L193-G196 PolarHBondContact O-N 3.09Å; G196-V317 VanDerWaalsContact CA-CG1 3.48Å; G196-G337 VanDerWaalsContact O-CA 3.27Å; G196-G337 WeakPolarHBondContact O-CA 3.5Å; G196-G337 PolarHBondContact O-N 3.47Å; G196-N366 PolarHBondContact O-ND2 3.32Å; G196-N366 PolarHBondContact O-OD1 3.41Å
197	I	90.9	Very high	88.3	Confident	7 Å²	7	30.1 Å²	30.1	4%	0.036	15%	0.152	C	C	.	.	S	Bend	trans	-128.4	110.9	-168.3	-37.5	-176.5	0	0	0	111.7	L193 G199 A200 Y261 L326	L193-I197 HydrophobicContact CD2-CD1 3.59Å; L193-I197 HydrophobicContact CD2-CG1 4.35Å; L193-I197 PolarHBondContact O-N 2.91Å; I197-G199 PolarHBondContact O-N 2.92Å; I197-A200 HydrophobicContact CB-CB 4.13Å; I197-A200 VanDerWaalsContact O-CB 3.28Å; I197-A200 WeakPolarHBondContact O-CB 3.38Å; I197-A200 PolarHBondContact O-N 2.9Å; I197-Y261 HydrophobicContact CD1-CD1 3.51Å; I197-Y261 HydrophobicContact CD1-CE1 3.74Å; I197-Y261 HydrophobicContact CG2-CE1 4.38Å; I197-L326 HydrophobicContact CD1-CB 3.92Å; I197-L326 HydrophobicContact CG1-CB 4.02Å; I197-L326 HydrophobicContact CG1-CD1 4.08Å
198	V	88.1	Confident	88.6	Confident	12 Å²	12	27.4 Å²	27.4	7%	0.073	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.6	121.7	161.7	160.1	0	0	0	0	110.9	N349 I350 Q364 N366 I395	V198-N349 HydrophobicContact CG1-CB 4.47Å; V198-I350 VanDerWaalsContact CG1-C 3.47Å; V198-Q364 WeakPolarHBondContact CG1-O 3.26Å; V198-Q364 VanDerWaalsContact CG2-C 3.46Å; V198-Q364 HydrophobicContact CG2-CB 3.76Å; V198-N366 HydrophobicContact CB-CB 4.38Å; V198-N366 WeakPolarHBondContact CB-OD1 3.47Å; V198-N366 HydrophobicContact CG2-CB 4.16Å; V198-N366 WeakPolarHBondContact CG2-OD1 3.26Å; V198-N366 PolarHBondContact N-OD1 2.79Å; V198-I395 HydrophobicContact CG2-CD1 4.22Å; V198-I395 HydrophobicContact CG2-CG1 4.21Å; V198-I395 HydrophobicContact CG2-CG2 3.99Å
199	G	83.4	Confident	88.9	Confident	9 Å²	9	22.1 Å²	22.1	9%	0.093	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	-5.3	-176.8	0	0	0	0	0	116.1	I197 N201	I197-G199 PolarHBondContact O-N 2.92Å; G199-N201 PolarHBondContact O-N 3.22Å
200	A	87	Confident	89.1	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-77.1	0.6	172.7	0	0	0	0	0	114	L193 R194 I197 S202 F203 Y261	L193-A200 HydrophobicContact CB-CB 4.17Å; R194-A200 WeakPolarHBondContact CG-O 3.28Å; I197-A200 HydrophobicContact CB-CB 4.13Å; I197-A200 VanDerWaalsContact O-CB 3.28Å; I197-A200 WeakPolarHBondContact O-CB 3.38Å; I197-A200 PolarHBondContact O-N 2.9Å; A200-S202 VanDerWaalsContact C-N 3.34Å; A200-S202 PolarHBondContact O-N 3.2Å; A200-F203 PolarHBondContact O-N 2.03Å; A200-Y261 HydrophobicContact CB-CE1 4.4Å
201	N	76.8	Confident	89.3	Confident	52 Å²	52	21.4 Å²	21.4	28%	0.278	11%	0.114	S	C	.	.	G	3₁₀ helix	trans	-59.6	-41.8	179.5	-63.2	-30.1	0	0	0	112.4	R194 G199 Q364	R194-N201 PolarHBondContact NE-O 2.97Å; R194-N201 VanDerWaalsContact NE-O 3.15Å; R194-N201 PolarHBondContact NH2-O 2.96Å; G199-N201 PolarHBondContact O-N 3.22Å; N201-Q364 PolarHBondContact ND2-OE1 2.92Å
202	S	74	Confident	89.6	Confident	85 Å²	85	16.9 Å²	16.9	59%	0.594	9%	0.093	S	C	*	.	G	3₁₀ helix	trans	-85.3	-6.6	177.2	48.3	0	0	0	0	114.4	A200	A200-S202 VanDerWaalsContact C-N 3.34Å; A200-S202 PolarHBondContact O-N 3.2Å
203	F	85.3	Confident	89.6	Confident	2 Å²	2	16.3 Å²	16.3	1%	0.009	9%	0.09	C	C	.	.			trans	-76.3	138.7	175.6	177.5	-108.2	0	0	0	110.8	Q190 L193 A200 A205 T252 D254 L259 Y261	Q190-F203 WeakPolarHBondContact CG-O 3.27Å; Q190-F203 PolarHBondContact NE2-O 3.04Å; L193-F203 HydrophobicContact CD1-CD1 3.94Å; L193-F203 HydrophobicContact CD1-CE1 3.72Å; A200-F203 PolarHBondContact O-N 2.03Å; F203-A205 HydrophobicContact CE1-CB 4.04Å; F203-T252 HydrophobicContact CE1-CG2 4Å; F203-T252 HydrophobicContact CZ-CG2 4.11Å; F203-D254 HydrophobicContact CD2-CB 4.35Å; F203-D254 HydrophobicContact CE2-CB 3.9Å; F203-L259 HydrophobicContact CD2-CB 3.9Å; F203-L259 HydrophobicContact CD2-CD1 4.2Å; F203-L259 HydrophobicContact CE2-CB 3.98Å; F203-Y261 HydrophobicContact CB-CE2 3.98Å; F203-Y261 AromaticContact CD1-CD2 3.87Å; F203-Y261 HydrophobicContact CD1-CD2 3.87Å; F203-Y261 AromaticContact CD1-CE2 3.84Å; F203-Y261 HydrophobicContact CD1-CE2 3.84Å; F203-Y261 AromaticContact CD2-CD2 3.89Å; F203-Y261 HydrophobicContact CD2-CD2 3.89Å; F203-Y261 AromaticContact CD2-CE2 3.49Å; F203-Y261 HydrophobicContact CD2-CE2 3.49Å; F203-Y261 VanDerWaalsContact CD2-CE2 3.49Å; F203-Y261 AromaticContact CE1-CD2 3.77Å; F203-Y261 HydrophobicContact CE1-CD2 3.77Å; F203-Y261 HydrophobicContact CE1-CE2 4.19Å; F203-Y261 AromaticContact CE2-CD2 3.77Å; F203-Y261 HydrophobicContact CE2-CD2 3.77Å; F203-Y261 AromaticContact CE2-CE2 3.84Å; F203-Y261 HydrophobicContact CE2-CE2 3.84Å; F203-Y261 AromaticContact CG-CD2 3.94Å; F203-Y261 HydrophobicContact CG-CD2 3.94Å; F203-Y261 AromaticContact CG-CE2 3.47Å; F203-Y261 HydrophobicContact CG-CE2 3.47Å; F203-Y261 VanDerWaalsContact CG-CE2 3.47Å; F203-Y261 AromaticContact CZ-CD2 3.71Å; F203-Y261 HydrophobicContact CZ-CD2 3.71Å; F203-Y261 HydrophobicContact CZ-CE2 4.19Å
204	Q	86.1	Confident	89.5	Confident	82 Å²	82	16.9 Å²	16.9	38%	0.383	9%	0.092	S	C	.	.			trans	-116.4	125.5	170.1	-175.3	171.6	-49	0	0	109.2	D206 D254	Q204-D206 WeakPolarHBondContact CG-OD1 3.49Å; Q204-D206 PolarHBondContact NE2-OD1 3.08Å; Q204-D206 PolarHBondContact O-N 2.88Å; Q204-D254 WeakPolarHBondContact O-CA 3.05Å
205	A	91.5	Very high	89.4	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.089	C	C	.	.			trans	-80.2	116.2	171.5	0	0	0	0	0	108.2	R151 L186 I189 Q190 F203	R151-A205 PolarHBondContact NH2-O 2.88Å; L186-A205 HydrophobicContact CB-CB 4.21Å; L186-A205 HydrophobicContact CD2-CB 4.21Å; I189-A205 HydrophobicContact CG2-CB 4.25Å; Q190-A205 HydrophobicContact CB-CB 4.13Å; F203-A205 HydrophobicContact CE1-CB 4.04Å
206	D	91.1	Very high	89.3	Confident	8 Å²	8	14 Å²	14	4%	0.043	8%	0.081	C	C	.	.			trans	-119.3	-28.6	179.5	-69.5	-47.1	0	0	0	112.4	R151 M154 L186 Q204 T253 R255	R151-D206 WeakPolarHBondContact CD-OD1 3.47Å; R151-D206 IonicContact CZ-OD1 2.73Å; R151-D206 PolarHBondContact N-O 2.94Å; R151-D206 IonicContact NE-OD1 3.22Å; R151-D206 PolarHBondContact NE-OD1 2.78Å; M154-D206 HydrophobicContact SD-CB 3.79Å; L186-D206 WeakPolarHBondContact CD1-O 3.45Å; Q204-D206 WeakPolarHBondContact CG-OD1 3.49Å; Q204-D206 PolarHBondContact NE2-OD1 3.08Å; Q204-D206 PolarHBondContact O-N 2.88Å; D206-T253 PolarHBondContact N-O 2.83Å; D206-R255 HydrophobicContact CB-CB 4.1Å; D206-R255 WeakPolarHBondContact OD2-CB 3.47Å; D206-R255 PolarHBondContact OD2-N 3.08Å; D206-R255 VanDerWaalsContact OD2-N 3.09Å
207	V	94.1	Very high	88.9	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	141	170	-164	0	0	0	0	110.5	T75 F77 L148 V149 F150 M154 T252 T253	T75-V207 HydrophobicContact CG2-CB 4.06Å; T75-V207 HydrophobicContact CG2-CG1 4.04Å; T75-V207 HydrophobicContact CG2-CG2 3.9Å; F77-V207 HydrophobicContact CE2-CG1 4.25Å; F77-V207 HydrophobicContact CZ-CB 4.21Å; F77-V207 HydrophobicContact CZ-CG1 3.93Å; L148-V207 HydrophobicContact CD1-CG1 3.92Å; L148-V207 HydrophobicContact CG-CG1 4.38Å; V149-V207 CarbonylContact O-C 3.53Å; V149-V207 VanDerWaalsContact O-CA 3.22Å; V149-V207 WeakPolarHBondContact O-CA 2.97Å; F150-V207 HydrophobicContact CD1-CB 4.34Å; F150-V207 HydrophobicContact CD1-CG1 3.93Å; F150-V207 HydrophobicContact CD1-CG2 3.51Å; F150-V207 HydrophobicContact CD2-CG1 4.24Å; F150-V207 HydrophobicContact CE1-CB 4.31Å; F150-V207 HydrophobicContact CE1-CG1 3.7Å; F150-V207 HydrophobicContact CE1-CG2 3.55Å; F150-V207 HydrophobicContact CE2-CG1 4.06Å; F150-V207 HydrophobicContact CG-CG1 4.18Å; F150-V207 HydrophobicContact CG-CG2 4.36Å; F150-V207 HydrophobicContact CZ-CG1 3.76Å; F150-V207 HydrophobicContact CZ-CG2 4.42Å; M154-V207 HydrophobicContact CE-CG2 3.81Å; M154-V207 HydrophobicContact SD-CG2 3.74Å; V207-T252 CarbonylContact O-C 3.57Å; V207-T252 WeakPolarHBondContact O-CA 3.2Å; V207-T252 WeakPolarHBondContact O-CB 3.36Å; V207-T252 PolarHBondContact O-OG1 2.67Å; V207-T253 HydrophobicContact CB-CG2 4.15Å; V207-T253 PolarHBondContact N-O 2.85Å; V207-T253 VanDerWaalsContact N-O 3.17Å; V207-T253 PolarHBondContact O-N 2.83Å
208	A	96.6	Very high	88.2	Confident	0 Å²	0	15 Å²	15	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	122.2	174.3	0	0	0	0	0	113.2	V149 L186 I189 V250 L251	V149-A208 WeakPolarHBondContact CB-O 3.23Å; V149-A208 PolarHBondContact N-O 2.8Å; V149-A208 PolarHBondContact O-N 2.76Å; L186-A208 HydrophobicContact CD2-CB 3.57Å; I189-A208 HydrophobicContact CD1-CB 3.95Å; A208-V250 HydrophobicContact CB-CG1 4.15Å; A208-L251 CarbonylContact C-O 3.52Å; A208-L251 VanDerWaalsContact CA-O 3.28Å; A208-L251 WeakPolarHBondContact CA-O 3.33Å
209	L	96.6	Very high	87.5	Confident	2 Å²	2	18.9 Å²	18.9	1%	0.01	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	130.4	163.5	175.8	73.4	0	0	0	109.1	L73 T87 L148 V211 V250 L251	L73-L209 HydrophobicContact CD2-CB 4.48Å; L73-L209 HydrophobicContact CD2-CD1 4.26Å; L73-L209 HydrophobicContact CD2-CD2 4.21Å; T87-L209 HydrophobicContact CG2-CD2 3.82Å; L148-L209 HydrophobicContact CD1-CB 4.12Å; L209-V211 HydrophobicContact CD1-CG2 4.26Å; L209-V211 HydrophobicContact CD2-CG2 4.13Å; L209-V211 HydrophobicContact CG-CG2 3.98Å; L209-V250 CarbonylContact O-C 3.45Å; L209-V250 VanDerWaalsContact O-CA 3.26Å; L209-V250 WeakPolarHBondContact O-CA 3.1Å; L209-L251 HydrophobicContact CB-CB 4.44Å; L209-L251 PolarHBondContact N-O 3.29Å; L209-L251 PolarHBondContact O-N 2.81Å
210	V	96.8	Very high	86.8	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	131	174.2	-177.9	0	0	0	0	108.4	Y146 R147 V149 F185 V250	Y146-V210 WeakPolarHBondContact CA-O 3.49Å; R147-V210 HydrophobicContact CG-CB 4.11Å; R147-V210 HydrophobicContact CG-CG2 4.45Å; R147-V210 PolarHBondContact N-O 3.47Å; R147-V210 PolarHBondContact O-N 2.9Å; V149-V210 HydrophobicContact CG2-CG2 4.31Å; F185-V210 HydrophobicContact CE1-CG2 3.55Å; F185-V210 HydrophobicContact CZ-CG2 3.64Å; V210-V250 HydrophobicContact CG1-CG2 4.23Å; V210-V250 HydrophobicContact CG2-CG1 4.28Å; V210-V250 HydrophobicContact CG2-CG2 4.17Å
211	V	95.9	Very high	85.8	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	124.5	177	-171.2	0	0	0	0	109.8	L89 I144 H145 L209 W213 Q248 L249	L89-V211 HydrophobicContact CD1-CB 4.35Å; L89-V211 HydrophobicContact CD1-CG1 3.81Å; L89-V211 HydrophobicContact CD1-CG2 3.55Å; L89-V211 HydrophobicContact CD2-CG1 4.5Å; L89-V211 HydrophobicContact CD2-CG2 3.89Å; L89-V211 HydrophobicContact CG-CG2 4.4Å; I144-V211 HydrophobicContact CG2-CG1 3.93Å; H145-V211 CarbonylContact O-C 3.6Å; H145-V211 WeakPolarHBondContact O-CA 3.26Å; L209-V211 HydrophobicContact CD1-CG2 4.26Å; L209-V211 HydrophobicContact CD2-CG2 4.13Å; L209-V211 HydrophobicContact CG-CG2 3.98Å; V211-W213 HydrophobicContact CB-CH2 4.08Å; V211-W213 HydrophobicContact CB-CZ3 3.93Å; V211-W213 HydrophobicContact CG1-CD2 4.24Å; V211-W213 HydrophobicContact CG1-CE3 3.94Å; V211-W213 HydrophobicContact CG1-CH2 3.58Å; V211-W213 HydrophobicContact CG1-CZ2 3.93Å; V211-W213 HydrophobicContact CG1-CZ3 3.6Å; V211-Q248 CarbonylContact O-C 3.51Å; V211-Q248 VanDerWaalsContact O-CA 3.27Å; V211-Q248 WeakPolarHBondContact O-CA 3.29Å; V211-Q248 WeakPolarHBondContact O-CG 3.38Å; V211-L249 PolarHBondContact N-O 3.49Å; V211-L249 PolarHBondContact O-N 3.36Å
212	T	95.3	Very high	85.2	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	113.4	-177.1	-48.4	0	0	0	0	112.2	L48 Y51 I144 H145 E214 Q248	L48-T212 HydrophobicContact CD1-CG2 4.39Å; Y51-T212 HydrophobicContact CD1-CG2 3.88Å; Y51-T212 HydrophobicContact CD2-CG2 3.71Å; Y51-T212 HydrophobicContact CE1-CG2 3.77Å; Y51-T212 HydrophobicContact CE2-CG2 3.59Å; Y51-T212 HydrophobicContact CG-CG2 3.84Å; I144-T212 WeakPolarHBondContact CA-O 3.21Å; H145-T212 PolarHBondContact N-O 3.2Å; H145-T212 PolarHBondContact O-N 2.85Å; T212-E214 PolarHBondContact O-N 2.95Å; T212-Q248 HydrophobicContact CG2-CB 4.22Å; T212-Q248 PolarHBondContact OG1-NE2 3.4Å
213	W	92.7	Very high	84.8	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	92.4	164.6	60.8	166.3	0	0	0	111.2	S90 V127 I144 V211 V216 T246 Y247 L249	S90-W213 PolarHBondContact O-NE1 3.39Å; V127-W213 HydrophobicContact CB-CH2 4.34Å; V127-W213 HydrophobicContact CB-CZ3 4.3Å; V127-W213 HydrophobicContact CG1-CZ3 4.41Å; V127-W213 HydrophobicContact CG2-CH2 3.72Å; V127-W213 HydrophobicContact CG2-CZ3 3.96Å; I144-W213 HydrophobicContact CB-CB 4.34Å; I144-W213 HydrophobicContact CB-CG 4.32Å; I144-W213 HydrophobicContact CG1-CB 3.92Å; I144-W213 HydrophobicContact CG1-CG 3.86Å; I144-W213 HydrophobicContact CG2-CB 4.13Å; I144-W213 HydrophobicContact CG2-CD2 4.05Å; I144-W213 HydrophobicContact CG2-CG 3.73Å; V211-W213 HydrophobicContact CB-CH2 4.08Å; V211-W213 HydrophobicContact CB-CZ3 3.93Å; V211-W213 HydrophobicContact CG1-CD2 4.24Å; V211-W213 HydrophobicContact CG1-CE3 3.94Å; V211-W213 HydrophobicContact CG1-CH2 3.58Å; V211-W213 HydrophobicContact CG1-CZ2 3.93Å; V211-W213 HydrophobicContact CG1-CZ3 3.6Å; W213-V216 HydrophobicContact CB-CG1 4.18Å; W213-T246 CarbonylContact O-C 3.47Å; W213-T246 WeakPolarHBondContact O-CA 3.43Å; W213-Y247 VanDerWaalsContact CA-O 3.23Å; W213-Y247 WeakPolarHBondContact CA-O 3.2Å; W213-Y247 HydrophobicContact CD2-CD2 4.29Å; W213-Y247 AromaticContact CD2-CE2 3.49Å; W213-Y247 HydrophobicContact CD2-CE2 3.49Å; W213-Y247 VanDerWaalsContact CD2-CE2 3.49Å; W213-Y247 AromaticContact CD2-CZ 3.97Å; W213-Y247 AromaticContact CE3-CD2 3.69Å; W213-Y247 HydrophobicContact CE3-CD2 3.69Å; W213-Y247 AromaticContact CE3-CE2 3.29Å; W213-Y247 HydrophobicContact CE3-CE2 3.29Å; W213-Y247 AromaticContact CG-CE2 3.99Å; W213-Y247 HydrophobicContact CG-CE2 3.99Å; W213-Y247 AromaticContact CG-CZ 3.99Å; W213-Y247 HydrophobicContact CZ3-CD2 4.2Å; W213-Y247 AromaticContact CZ3-CE2 3.88Å; W213-Y247 HydrophobicContact CZ3-CE2 3.88Å; W213-Y247 PolarHBondContact N-O 2.88Å; W213-Y247 PolarHBondContact O-N 3.02Å; W213-L249 HydrophobicContact CH2-CB 4.45Å; W213-L249 HydrophobicContact CZ3-CB 4.09Å
214	E	90.8	Very high	83.5	Confident	11 Å²	11	30.3 Å²	30.3	5%	0.051	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.3	178.2	-169.2	177.8	-155.2	0	0	113.1	Y51 Y141 G143 T212 V216	Y51-E214 HydrophobicContact CE2-CB 4.21Å; Y51-E214 HydrophobicContact CE2-CG 4.43Å; Y51-E214 PolarHBondContact OH-OE1 3.48Å; Y141-E214 VanDerWaalsContact C-CD 3.5Å; G143-E214 PolarHBondContact N-O 2.9Å; G143-E214 PolarHBondContact O-N 3.46Å; T212-E214 PolarHBondContact O-N 2.95Å; E214-V216 VanDerWaalsContact C-N 3.28Å; E214-V216 PolarHBondContact O-N 2.82Å
215	N	87.5	Confident	82.2	Confident	25 Å²	25	29.3 Å²	29.3	13%	0.134	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	48.1	44.3	172.1	-68.7	-52.6	0	0	0	114.4	M135 Y141 Q142 T244 A245 T246	M135-N215 WeakPolarHBondContact CB-O 3.47Å; M135-N215 PolarHBondContact N-O 3.2Å; Y141-N215 PolarHBondContact O-ND2 2.88Å; Q142-N215 HydrophobicContact CB-CB 4.36Å; N215-T244 HydrophobicContact CB-CG2 4.46Å; N215-T244 PolarHBondContact OD1-OG1 2.79Å; N215-A245 WeakPolarHBondContact CA-O 3.42Å; N215-A245 PolarHBondContact N-O 3.14Å; N215-T246 PolarHBondContact N-OG1 3.43Å; N215-T246 PolarHBondContact OD1-OG1 2.83Å
216	V	86.3	Confident	80.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	145.7	172.4	-68.2	0	0	0	0	111.2	V91 Q132 R133 W213 E214 T244 A245 Y247 Y271	V91-V216 HydrophobicContact CG1-CG1 4.44Å; Q132-V216 HydrophobicContact CG-CB 4.22Å; Q132-V216 HydrophobicContact CG-CG2 4.31Å; R133-V216 CarbonylContact O-C 3.54Å; R133-V216 WeakPolarHBondContact O-CA 3.29Å; W213-V216 HydrophobicContact CB-CG1 4.18Å; E214-V216 VanDerWaalsContact C-N 3.28Å; E214-V216 PolarHBondContact O-N 2.82Å; V216-T244 CarbonylContact O-C 3.54Å; V216-T244 WeakPolarHBondContact O-CA 3.5Å; V216-A245 HydrophobicContact CG2-CB 4.18Å; V216-A245 WeakPolarHBondContact CG2-O 3.33Å; V216-A245 PolarHBondContact N-O 3.42Å; V216-A245 PolarHBondContact O-N 3.31Å; V216-Y247 HydrophobicContact CG2-CE1 3.87Å; V216-Y271 PolarHBondContact O-OH 2.65Å
217	T	80	Confident	79	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	157.8	179.8	-170	0	0	0	0	110.4	Q132 R133 A221	Q132-T217 CarbonylContact C-O 3.6Å; Q132-T217 WeakPolarHBondContact CA-O 3.34Å; Q132-T217 VanDerWaalsContact CB-O 3.24Å; Q132-T217 WeakPolarHBondContact CB-O 3.24Å; R133-T217 HydrophobicContact CG-CG2 4.18Å; R133-T217 PolarHBondContact N-O 3.41Å; R133-T217 PolarHBondContact O-N 3.07Å; R133-T217 VanDerWaalsContact O-O 3.11Å; T217-A221 HydrophobicContact CG2-CB 4.03Å
218	F	75.7	Confident	77.1	Confident	26 Å²	26	40.4 Å²	40.4	11%	0.114	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	143.5	-179.3	68.7	-75.9	0	0	0	112	Q220 A221 V231 I276	F218-Q220 HydrophobicContact CD2-CB 3.9Å; F218-Q220 VanDerWaalsContact CE2-C 3.5Å; F218-Q220 HydrophobicContact CE2-CB 3.94Å; F218-Q220 PolarHBondContact O-N 2.86Å; F218-Q220 VanDerWaalsContact O-N 3.08Å; F218-A221 HydrophobicContact CD1-CB 4.08Å; F218-A221 HydrophobicContact CD2-CB 4.42Å; F218-A221 HydrophobicContact CE1-CB 3.68Å; F218-A221 HydrophobicContact CE2-CB 4.08Å; F218-A221 VanDerWaalsContact CE2-N 3.27Å; F218-A221 HydrophobicContact CG-CB 4.42Å; F218-A221 HydrophobicContact CZ-CB 3.68Å; F218-A221 VanDerWaalsContact O-CB 3.29Å; F218-A221 WeakPolarHBondContact O-CB 3.46Å; F218-A221 PolarHBondContact O-N 2.71Å; F218-V231 HydrophobicContact CE1-CB 4.34Å; F218-V231 HydrophobicContact CE1-CG1 3.64Å; F218-V231 HydrophobicContact CE1-CG2 3.67Å; F218-V231 HydrophobicContact CZ-CG1 4.26Å; F218-V231 HydrophobicContact CZ-CG2 3.98Å; F218-I276 HydrophobicContact CB-CD1 4.33Å; F218-I276 HydrophobicContact CD2-CD1 3.67Å; F218-I276 HydrophobicContact CE2-CD1 4.28Å; F218-I276 HydrophobicContact CG-CD1 4.14Å
219	M	74.7	Confident	75	Confident	95 Å²	95	41.4 Å²	41.4	47%	0.468	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.5	-168.6	-174.3	177.6	-177.4	0	0	113.9	R131	R131-M219 HydrophobicContact CB-CB 4.21Å; R131-M219 WeakPolarHBondContact O-CB 3.46Å; R131-M219 PolarHBondContact O-N 3.14Å
220	Q	69.1	Low	72.5	Confident	149 Å²	149	49.8 Å²	49.8	70%	0.696	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	0.8	179.5	-62	176.5	-5.2	0	0	113.7	F218 S222	F218-Q220 HydrophobicContact CD2-CB 3.9Å; F218-Q220 VanDerWaalsContact CE2-C 3.5Å; F218-Q220 HydrophobicContact CE2-CB 3.94Å; F218-Q220 PolarHBondContact O-N 2.86Å; F218-Q220 VanDerWaalsContact O-N 3.08Å; Q220-S222 PolarHBondContact O-N 3.32Å
221	A	64.9	Low	69.9	Low	7 Å²	7	50.4 Å²	50.4	6%	0.058	25%	0.252	C	S	.	.			trans	-62.7	123.8	175.5	0	0	0	0	0	110.1	R133 T217 F218	R133-A221 PolarHBondContact NH2-O 2.91Å; T217-A221 HydrophobicContact CG2-CB 4.03Å; F218-A221 HydrophobicContact CD1-CB 4.08Å; F218-A221 HydrophobicContact CD2-CB 4.42Å; F218-A221 HydrophobicContact CE1-CB 3.68Å; F218-A221 HydrophobicContact CE2-CB 4.08Å; F218-A221 VanDerWaalsContact CE2-N 3.27Å; F218-A221 HydrophobicContact CG-CB 4.42Å; F218-A221 HydrophobicContact CZ-CB 3.68Å; F218-A221 VanDerWaalsContact O-CB 3.29Å; F218-A221 WeakPolarHBondContact O-CB 3.46Å; F218-A221 PolarHBondContact O-N 2.71Å
222	S	63.9	Low	67.3	Low	49 Å²	49	54.1 Å²	54.1	34%	0.343	28%	0.277	S	S	.	.			trans	-73.2	147.9	173.1	-172.3	0	0	0	0	111	Q220 D224 D225 E226	Q220-S222 PolarHBondContact O-N 3.32Å; S222-D224 PolarHBondContact O-N 3.32Å; S222-D224 PolarHBondContact OG-N 2.82Å; S222-D225 WeakPolarHBondContact CB-OD2 3.43Å; S222-D225 PolarHBondContact O-N 2.98Å; S222-D225 VanDerWaalsContact O-N 3.08Å; S222-E226 PolarHBondContact O-N 3.48Å
223	N	65.8	Low	64.7	Low	86 Å²	86	57.5 Å²	57.5	46%	0.46	30%	0.295	S	S	.	.	H	α-helix	trans	-61.4	-33	167.6	-71.3	-16.8	0	0	0	111	S136 D225 E226 D227	S136-N223 PolarHBondContact OG-OD1 2.86Å; N223-D225 VanDerWaalsContact C-N 3.26Å; N223-D225 PolarHBondContact O-N 2.69Å; N223-E226 WeakPolarHBondContact O-CB 3.26Å; N223-E226 PolarHBondContact O-N 2.79Å; N223-D227 PolarHBondContact O-N 2.96Å
224	D	58.8	Low	62.1	Low	96 Å²	96	65.3 Å²	65.3	51%	0.513	34%	0.336	S	S	.	.	H	α-helix	trans	-64.6	-27.3	173.1	-94.6	-56.2	0	0	0	113.7	S222 K228	S222-D224 PolarHBondContact O-N 3.32Å; S222-D224 PolarHBondContact OG-N 2.82Å; D224-K228 VanDerWaalsContact CG-NZ 3.29Å; D224-K228 WeakPolarHBondContact O-CB 3.24Å; D224-K228 WeakPolarHBondContact O-CD 3.35Å; D224-K228 VanDerWaalsContact O-CG 3.27Å; D224-K228 WeakPolarHBondContact O-CG 3.44Å; D224-K228 PolarHBondContact O-NZ 3.29Å; D224-K228 IonicContact OD1-NZ 2.66Å; D224-K228 PolarHBondContact OD1-NZ 2.75Å
225	D	57.3	Low	59.8	Low	62 Å²	62	73.5 Å²	73.5	33%	0.332	37%	0.374	S	S	.	.	H	α-helix	trans	-83.8	-32.6	176.5	-66.5	-37.7	0	0	0	110.8	S222 N223 G229 R230 V231	S222-D225 WeakPolarHBondContact CB-OD2 3.43Å; S222-D225 PolarHBondContact O-N 2.98Å; S222-D225 VanDerWaalsContact O-N 3.08Å; N223-D225 VanDerWaalsContact C-N 3.26Å; N223-D225 PolarHBondContact O-N 2.69Å; D225-G229 CarbonylContact O-C 3.39Å; D225-G229 PolarHBondContact O-N 2.79Å; D225-G229 VanDerWaalsContact O-N 3.16Å; D225-R230 PolarHBondContact O-N 2.92Å; D225-V231 HydrophobicContact CB-CG2 4.47Å
226	E	60.2	Low	57.4	Low	5 Å²	5	80.5 Å²	80.5	2%	0.023	41%	0.406	C	S	.	.	H	α-helix	trans	-60.5	-58.8	167.9	-68.1	-162.1	-164.1	0	0	111.6	R133 M135 S136 I137 S222 N223 K228 G229 L242	R133-E226 IonicContact CZ-OE1 3.94Å; R133-E226 IonicContact NH1-OE1 3.8Å; R133-E226 PolarHBondContact NH1-OE1 2.74Å; R133-E226 IonicContact NH2-OE1 3.89Å; R133-E226 PolarHBondContact NH2-OE1 2.72Å; M135-E226 VanDerWaalsContact CG-OE2 3.29Å; M135-E226 WeakPolarHBondContact CG-OE2 3.18Å; S136-E226 WeakPolarHBondContact CA-OE2 3.39Å; S136-E226 WeakPolarHBondContact CB-OE2 3.5Å; S136-E226 PolarHBondContact N-OE1 3.16Å; S136-E226 PolarHBondContact N-OE2 3.2Å; I137-E226 VanDerWaalsContact CD1-C 3.47Å; I137-E226 HydrophobicContact CD1-CB 3.76Å; I137-E226 WeakPolarHBondContact CD1-O 3.36Å; I137-E226 HydrophobicContact CG1-CB 4.12Å; I137-E226 PolarHBondContact N-OE2 3.38Å; S222-E226 PolarHBondContact O-N 3.48Å; N223-E226 WeakPolarHBondContact O-CB 3.26Å; N223-E226 PolarHBondContact O-N 2.79Å; E226-K228 PolarHBondContact O-N 3.32Å; E226-G229 PolarHBondContact O-N 3.32Å; E226-L242 HydrophobicContact CG-CD1 4.36Å; E226-L242 HydrophobicContact CG-CD2 3.84Å
227	D	56.1	Low	55.1	Low	122 Å²	122	91.8 Å²	91.8	65%	0.652	45%	0.45	S	S	*	.	H	α-helix	trans	-61.2	-23.1	-173.4	-76.1	-19.9	0	0	0	112.8	N223	N223-D227 PolarHBondContact O-N 2.96Å
228	K	53.8	Low	53.1	Low	114 Å²	114	101.1 Å²	101.1	50%	0.496	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-2.1	177.2	-62.2	175.6	-164.1	110.4	0	113.3	D224 E226 R230	D224-K228 VanDerWaalsContact CG-NZ 3.29Å; D224-K228 WeakPolarHBondContact O-CB 3.24Å; D224-K228 WeakPolarHBondContact O-CD 3.35Å; D224-K228 VanDerWaalsContact O-CG 3.27Å; D224-K228 WeakPolarHBondContact O-CG 3.44Å; D224-K228 PolarHBondContact O-NZ 3.29Å; D224-K228 IonicContact OD1-NZ 2.66Å; D224-K228 PolarHBondContact OD1-NZ 2.75Å; E226-K228 PolarHBondContact O-N 3.32Å; K228-R230 HydrophobicContact CB-CB 4.38Å; K228-R230 HydrophobicContact CB-CG 4.03Å; K228-R230 PolarHBondContact O-N 2.77Å
229	G	53	Low	51.4	Low	20 Å²	20	104.9 Å²	104.9	21%	0.206	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	16.6	-175.1	0	0	0	0	0	114.5	D225 E226 V231 G240	D225-G229 CarbonylContact O-C 3.39Å; D225-G229 PolarHBondContact O-N 2.79Å; D225-G229 VanDerWaalsContact O-N 3.16Å; E226-G229 PolarHBondContact O-N 3.32Å; G229-V231 PolarHBondContact O-N 2.72Å; G229-G240 CarbonylContact O-C 3.53Å
230	R	44.1	Very low	49.8	Very low	179 Å²	179	103 Å²	103	68%	0.675	52%	0.522	S	S	*	.			trans	-96.3	65	-168.2	-73.8	-173.8	178	-167.4	-0.8	113	D225 K228	D225-R230 PolarHBondContact O-N 2.92Å; K228-R230 HydrophobicContact CB-CB 4.38Å; K228-R230 HydrophobicContact CB-CG 4.03Å; K228-R230 PolarHBondContact O-N 2.77Å
231	V	42.9	Very low	48.9	Very low	13 Å²	13	104 Å²	104	8%	0.079	52%	0.519	C	S	.	.			trans	-107	86.7	154.8	171.6	0	0	0	0	107.5	F218 D225 G229 L242 Q243	F218-V231 HydrophobicContact CE1-CB 4.34Å; F218-V231 HydrophobicContact CE1-CG1 3.64Å; F218-V231 HydrophobicContact CE1-CG2 3.67Å; F218-V231 HydrophobicContact CZ-CG1 4.26Å; F218-V231 HydrophobicContact CZ-CG2 3.98Å; D225-V231 HydrophobicContact CB-CG2 4.47Å; G229-V231 PolarHBondContact O-N 2.72Å; V231-L242 HydrophobicContact CB-CD1 3.81Å; V231-L242 HydrophobicContact CB-CG 4.04Å; V231-L242 HydrophobicContact CG2-CD1 3.35Å; V231-L242 HydrophobicContact CG2-CG 3.78Å; V231-Q243 HydrophobicContact CG1-CB 4.17Å; V231-Q243 HydrophobicContact CG1-CG 4.4Å
232	C	40.2	Very low	48.5	Very low	77 Å²	77	104.5 Å²	104.5	52%	0.52	52%	0.521	S	S	.	.			trans	-127	119.3	171	-70.9	0	0	0	0	108.4
233	L	40.5	Very low	48.8	Very low	72 Å²	72	105.5 Å²	105.5	38%	0.377	52%	0.52	S	S	.	.			trans	-123.9	113.5	164.5	-70.4	169.3	0	0	0	107.1	E235 D275 M277	L233-E235 PolarHBondContact O-N 3.07Å; L233-D275 WeakPolarHBondContact CD1-O 3.48Å; L233-M277 HydrophobicContact CD1-CG 4.48Å; L233-M277 HydrophobicContact CD2-CG 4.31Å; L233-M277 HydrophobicContact CD2-SD 3.85Å
234	L	39.4	Very low	49.5	Very low	164 Å²	164	101.8 Å²	101.8	86%	0.859	50%	0.5	S	S	*	.	S	Bend	trans	23.6	92.9	158.5	-55.8	164.8	0	0	0	113.7
235	E	41.1	Very low	50.8	Low	182 Å²	182	97.2 Å²	97.2	85%	0.85	48%	0.476	S	S	*	.	S	Bend		-155	6	69.8	-87.2	-174.4	148.4	0	0	116.1	L233	L233-E235 PolarHBondContact O-N 3.07Å
236	H	37.9	Very low	52.5	Low	172 Å²	172	94.3 Å²	94.3	80%	0.796	46%	0.46	S	S	*	.			trans	-118.6	110.1	-176.8	-93.6	36.7	0	0	0	114.5	F238	H236-F238 VanDerWaalsContact C-N 3.35Å; H236-F238 PolarHBondContact O-N 3.24Å
237	Y	37.6	Very low	54.1	Low	238 Å²	238	94.1 Å²	94.1	93%	0.933	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	11.8	-167.3	-150.4	-98.5	0	0	0	115.2
238	F	38.7	Very low	56	Low	195 Å²	195	88.3 Å²	88.3	86%	0.855	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-2.4	-163.1	-122.9	-91.4	0	0	0	117.4	H236	H236-F238 VanDerWaalsContact C-N 3.35Å; H236-F238 PolarHBondContact O-N 3.24Å
239	T	38.6	Very low	58.1	Low	105 Å²	105	82.9 Å²	82.9	64%	0.644	41%	0.405	S	S	*	.			trans	-140.1	88.9	172.1	57.2	0	0	0	0	111.5	R241	T239-R241 VanDerWaalsContact C-N 3.31Å; T239-R241 PolarHBondContact O-N 3.48Å
240	G	41.2	Very low	60.2	Low	57 Å²	57	82 Å²	82	59%	0.588	40%	0.395	S	S	*	.			trans	-70.2	83.6	171.8	0	0	0	0	0	111.5	G229	G229-G240 CarbonylContact O-C 3.53Å
241	R	50.2	Low	62.7	Low	170 Å²	170	73.5 Å²	73.5	64%	0.642	36%	0.363	S	S	*	.			trans	-139.6	138	176.1	-81.5	-173.1	169.3	-174.1	-3.9	109.8	T239 Q243	T239-R241 VanDerWaalsContact C-N 3.31Å; T239-R241 PolarHBondContact O-N 3.48Å; R241-Q243 PolarHBondContact O-N 2.79Å
242	L	56.7	Low	65.3	Low	17 Å²	17	72.9 Å²	72.9	9%	0.089	36%	0.36	C	S	.	.			trans	-58.2	134.3	-179.8	-135.2	84.5	0	0	0	112.6	M135 E226 V231 T244 K268	M135-L242 HydrophobicContact CE-CB 4.07Å; M135-L242 HydrophobicContact CE-CD2 3.52Å; M135-L242 HydrophobicContact CE-CG 4.41Å; E226-L242 HydrophobicContact CG-CD1 4.36Å; E226-L242 HydrophobicContact CG-CD2 3.84Å; V231-L242 HydrophobicContact CB-CD1 3.81Å; V231-L242 HydrophobicContact CB-CG 4.04Å; V231-L242 HydrophobicContact CG2-CD1 3.35Å; V231-L242 HydrophobicContact CG2-CG 3.78Å; L242-T244 VanDerWaalsContact C-N 3.32Å; L242-T244 HydrophobicContact CD2-CG2 4.42Å; L242-T244 PolarHBondContact O-N 3.24Å; L242-K268 PolarHBondContact O-NZ 2.86Å
243	Q	70.2	Confident	67.9	Low	69 Å²	69	69.2 Å²	69.2	32%	0.322	34%	0.335	S	S	.	.			trans	-74.4	85.9	168.8	-71.3	-176.5	-14.2	0	0	109.6	V231 R241 G270 Y271	V231-Q243 HydrophobicContact CG1-CB 4.17Å; V231-Q243 HydrophobicContact CG1-CG 4.4Å; R241-Q243 PolarHBondContact O-N 2.79Å; Q243-G270 WeakPolarHBondContact CB-O 3.19Å; Q243-G270 VanDerWaalsContact CG-O 3.24Å; Q243-G270 WeakPolarHBondContact CG-O 3.4Å; Q243-G270 PolarHBondContact NE2-O 2.99Å; Q243-G270 PolarHBondContact OE1-O 2.74Å; Q243-Y271 HydrophobicContact CB-CD1 4.19Å; Q243-Y271 WeakPolarHBondContact O-CD1 3.41Å; Q243-Y271 VanDerWaalsContact O-CE1 3.32Å; Q243-Y271 WeakPolarHBondContact O-CE1 3.28Å
244	T	81	Confident	70.3	Confident	8 Å²	8	67 Å²	67	5%	0.049	32%	0.323	C	S	.	.			trans	-88.4	154.4	165.7	62.6	0	0	0	0	112.1	M135 N215 V216 L242 K268 G270	M135-T244 HydrophobicContact CE-CG2 3.51Å; M135-T244 HydrophobicContact SD-CG2 4.45Å; N215-T244 HydrophobicContact CB-CG2 4.46Å; N215-T244 PolarHBondContact OD1-OG1 2.79Å; V216-T244 CarbonylContact O-C 3.54Å; V216-T244 WeakPolarHBondContact O-CA 3.5Å; L242-T244 VanDerWaalsContact C-N 3.32Å; L242-T244 HydrophobicContact CD2-CG2 4.42Å; L242-T244 PolarHBondContact O-N 3.24Å; T244-K268 VanDerWaalsContact O-CD 3.25Å; T244-K268 WeakPolarHBondContact O-CD 3.36Å; T244-K268 WeakPolarHBondContact O-CE 3.46Å; T244-K268 PolarHBondContact O-NZ 2.86Å; T244-K268 PolarHBondContact OG1-NZ 3.02Å; T244-G270 WeakPolarHBondContact O-CA 3.36Å; T244-G270 PolarHBondContact O-N 2.92Å
245	A	86.9	Confident	72.5	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	143.3	167.1	0	0	0	0	0	110.5	N215 V216 Y247 K268 L269 Y271	N215-A245 WeakPolarHBondContact CA-O 3.42Å; N215-A245 PolarHBondContact N-O 3.14Å; V216-A245 HydrophobicContact CG2-CB 4.18Å; V216-A245 WeakPolarHBondContact CG2-O 3.33Å; V216-A245 PolarHBondContact N-O 3.42Å; V216-A245 PolarHBondContact O-N 3.31Å; A245-Y247 HydrophobicContact CB-CD1 4.21Å; A245-Y247 HydrophobicContact CB-CE1 4.18Å; A245-K268 CarbonylContact C-O 3.56Å; A245-K268 VanDerWaalsContact CA-O 3.3Å; A245-K268 WeakPolarHBondContact CA-O 3.45Å; A245-L269 HydrophobicContact CB-CD2 3.96Å; A245-Y271 HydrophobicContact CB-CE1 3.87Å
246	T	91.6	Very high	74.4	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.012	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	121.1	176.3	-60	0	0	0	0	109.3	L48 W213 N215 H267 K268	L48-T246 HydrophobicContact CD1-CG2 3.97Å; W213-T246 CarbonylContact O-C 3.47Å; W213-T246 WeakPolarHBondContact O-CA 3.43Å; N215-T246 PolarHBondContact N-OG1 3.43Å; N215-T246 PolarHBondContact OD1-OG1 2.83Å; T246-H267 HydrophobicContact CG2-CB 4.23Å; T246-H267 WeakPolarHBondContact O-CA 3.19Å; T246-H267 WeakPolarHBondContact O-CB 3.42Å; T246-H267 PolarHBondContact O-N 2.94Å; T246-K268 PolarHBondContact N-O 2.94Å; T246-K268 PolarHBondContact O-N 2.91Å; T246-K268 VanDerWaalsContact O-N 3.1Å
247	Y	94.4	Very high	76.7	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	166.3	-172.1	58.2	-91.4	0	0	0	111.7	G93 V127 Y128 Q132 W213 V216 A245 N265 L269	G93-Y247 VanDerWaalsContact CA-OH 3.24Å; G93-Y247 WeakPolarHBondContact CA-OH 3.47Å; V127-Y247 HydrophobicContact CB-CD2 4.18Å; V127-Y247 HydrophobicContact CB-CE2 4.1Å; V127-Y247 HydrophobicContact CG1-CD2 3.64Å; V127-Y247 HydrophobicContact CG1-CE2 4.08Å; Y128-Y247 HydrophobicContact CD1-CE1 4.31Å; Q132-Y247 PolarHBondContact NE2-OH 3.05Å; W213-Y247 VanDerWaalsContact CA-O 3.23Å; W213-Y247 WeakPolarHBondContact CA-O 3.2Å; W213-Y247 HydrophobicContact CD2-CD2 4.29Å; W213-Y247 AromaticContact CD2-CE2 3.49Å; W213-Y247 HydrophobicContact CD2-CE2 3.49Å; W213-Y247 VanDerWaalsContact CD2-CE2 3.49Å; W213-Y247 AromaticContact CD2-CZ 3.97Å; W213-Y247 AromaticContact CE3-CD2 3.69Å; W213-Y247 HydrophobicContact CE3-CD2 3.69Å; W213-Y247 AromaticContact CE3-CE2 3.29Å; W213-Y247 HydrophobicContact CE3-CE2 3.29Å; W213-Y247 AromaticContact CG-CE2 3.99Å; W213-Y247 HydrophobicContact CG-CE2 3.99Å; W213-Y247 AromaticContact CG-CZ 3.99Å; W213-Y247 HydrophobicContact CZ3-CD2 4.2Å; W213-Y247 AromaticContact CZ3-CE2 3.88Å; W213-Y247 HydrophobicContact CZ3-CE2 3.88Å; W213-Y247 PolarHBondContact N-O 2.88Å; W213-Y247 PolarHBondContact O-N 3.02Å; V216-Y247 HydrophobicContact CG2-CE1 3.87Å; A245-Y247 HydrophobicContact CB-CD1 4.21Å; A245-Y247 HydrophobicContact CB-CE1 4.18Å; Y247-N265 CarbonylContact C-O 3.48Å; Y247-N265 WeakPolarHBondContact CA-O 3.42Å; Y247-N265 WeakPolarHBondContact CB-O 3.4Å; Y247-L269 HydrophobicContact CD1-CD2 3.88Å
248	Q	95.9	Very high	78.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	142.2	-171.6	178.4	-178.3	74.6	0	0	111.3	L48 Y49 V211 T212 V250 I264 N265	L48-Q248 HydrophobicContact CD2-CB 4.04Å; Y49-Q248 PolarHBondContact O-NE2 2.85Å; V211-Q248 CarbonylContact O-C 3.51Å; V211-Q248 VanDerWaalsContact O-CA 3.27Å; V211-Q248 WeakPolarHBondContact O-CA 3.29Å; V211-Q248 WeakPolarHBondContact O-CG 3.38Å; T212-Q248 HydrophobicContact CG2-CB 4.22Å; T212-Q248 PolarHBondContact OG1-NE2 3.4Å; Q248-V250 HydrophobicContact CG-CG2 4.44Å; Q248-I264 WeakPolarHBondContact O-CA 3.24Å; Q248-N265 HydrophobicContact CB-CB 4.3Å; Q248-N265 PolarHBondContact N-O 3.36Å; Q248-N265 PolarHBondContact O-N 3.09Å; Q248-N265 PolarHBondContact OE1-ND2 2.87Å
249	L	97.4	Very high	81.4	Confident	1 Å²	1	36 Å²	36	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	137.7	166.9	173.8	64	0	0	0	109	A95 I125 V127 V211 W213 A262 I263 I264	A95-L249 HydrophobicContact CB-CD2 3.78Å; I125-L249 HydrophobicContact CB-CD2 4.41Å; I125-L249 HydrophobicContact CD1-CD2 4.44Å; I125-L249 HydrophobicContact CG2-CD1 4.05Å; I125-L249 HydrophobicContact CG2-CD2 4.17Å; V127-L249 HydrophobicContact CG1-CB 4.4Å; V127-L249 HydrophobicContact CG2-CB 3.84Å; V127-L249 HydrophobicContact CG2-CD2 3.9Å; V127-L249 HydrophobicContact CG2-CG 4.3Å; V211-L249 PolarHBondContact N-O 3.49Å; V211-L249 PolarHBondContact O-N 3.36Å; W213-L249 HydrophobicContact CH2-CB 4.45Å; W213-L249 HydrophobicContact CZ3-CB 4.09Å; L249-A262 HydrophobicContact CD1-CB 4.4Å; L249-I263 CarbonylContact C-O 3.38Å; L249-I263 WeakPolarHBondContact CA-O 3.39Å; L249-I264 HydrophobicContact CD1-CG1 4.03Å
250	V	97.6	Very high	84	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	124.2	159.8	-177.3	0	0	0	0	108.1	Y49 I189 A208 L209 V210 Q248 A262 I263	Y49-V250 HydrophobicContact CD2-CG2 3.58Å; Y49-V250 HydrophobicContact CE2-CG2 3.91Å; I189-V250 HydrophobicContact CD1-CG1 3.78Å; A208-V250 HydrophobicContact CB-CG1 4.15Å; L209-V250 CarbonylContact O-C 3.45Å; L209-V250 VanDerWaalsContact O-CA 3.26Å; L209-V250 WeakPolarHBondContact O-CA 3.1Å; V210-V250 HydrophobicContact CG1-CG2 4.23Å; V210-V250 HydrophobicContact CG2-CG1 4.28Å; V210-V250 HydrophobicContact CG2-CG2 4.17Å; Q248-V250 HydrophobicContact CG-CG2 4.44Å; V250-A262 CarbonylContact O-C 3.48Å; V250-A262 WeakPolarHBondContact O-CA 3.35Å; V250-I263 HydrophobicContact CB-CB 4.26Å; V250-I263 PolarHBondContact N-O 3.01Å; V250-I263 PolarHBondContact O-N 2.8Å
251	L	97.3	Very high	86.7	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.01	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	123.8	173.2	-178.5	73.5	0	0	0	107.4	F77 F97 I125 A208 L209 Y261 A262 V329	F77-L251 HydrophobicContact CB-CD2 4.21Å; F77-L251 HydrophobicContact CD1-CD2 3.7Å; F77-L251 HydrophobicContact CD1-CG 3.71Å; F77-L251 HydrophobicContact CE1-CD2 4.33Å; F77-L251 HydrophobicContact CE1-CG 4.1Å; F77-L251 WeakPolarHBondContact CE1-O 3.2Å; F77-L251 HydrophobicContact CG-CD2 4.13Å; F97-L251 HydrophobicContact CE1-CD2 4.39Å; F97-L251 HydrophobicContact CZ-CD2 3.91Å; I125-L251 HydrophobicContact CD1-CD1 4.04Å; A208-L251 CarbonylContact C-O 3.52Å; A208-L251 VanDerWaalsContact CA-O 3.28Å; A208-L251 WeakPolarHBondContact CA-O 3.33Å; L209-L251 HydrophobicContact CB-CB 4.44Å; L209-L251 PolarHBondContact N-O 3.29Å; L209-L251 PolarHBondContact O-N 2.81Å; L251-Y261 WeakPolarHBondContact CA-O 3.49Å; L251-A262 HydrophobicContact CD1-CB 4.11Å; L251-V329 HydrophobicContact CD1-CG2 4.03Å
252	T	96.7	Very high	88.9	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	147.2	-176.7	-174.7	0	0	0	0	111.9	I189 L193 F203 V207 S260 Y261	I189-T252 HydrophobicContact CG2-CG2 3.79Å; L193-T252 HydrophobicContact CD1-CG2 3.84Å; F203-T252 HydrophobicContact CE1-CG2 4Å; F203-T252 HydrophobicContact CZ-CG2 4.11Å; V207-T252 CarbonylContact O-C 3.57Å; V207-T252 WeakPolarHBondContact O-CA 3.2Å; V207-T252 WeakPolarHBondContact O-CB 3.36Å; V207-T252 PolarHBondContact O-OG1 2.67Å; T252-S260 CarbonylContact O-C 3.49Å; T252-S260 VanDerWaalsContact O-CA 3.26Å; T252-S260 WeakPolarHBondContact O-CA 3.28Å; T252-Y261 PolarHBondContact N-O 2.83Å; T252-Y261 PolarHBondContact O-N 2.89Å
253	T	95.3	Very high	90.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	161.2	178.1	-164.9	0	0	0	0	111.8	T75 F77 D206 V207 L259 S260	T75-T253 HydrophobicContact CG2-CG2 3.91Å; F77-T253 HydrophobicContact CD1-CG2 3.76Å; F77-T253 HydrophobicContact CD2-CG2 4.2Å; F77-T253 HydrophobicContact CE1-CG2 3.63Å; F77-T253 HydrophobicContact CE2-CG2 4.08Å; F77-T253 HydrophobicContact CG-CG2 4.08Å; F77-T253 HydrophobicContact CZ-CG2 3.81Å; D206-T253 PolarHBondContact N-O 2.83Å; V207-T253 HydrophobicContact CB-CG2 4.15Å; V207-T253 PolarHBondContact N-O 2.85Å; V207-T253 VanDerWaalsContact N-O 3.17Å; V207-T253 PolarHBondContact O-N 2.83Å; T253-L259 VanDerWaalsContact CA-O 3.26Å; T253-L259 WeakPolarHBondContact CA-O 3.49Å; T253-L259 WeakPolarHBondContact CB-O 3.35Å; T253-L259 PolarHBondContact OG1-O 3.02Å; T253-S260 PolarHBondContact OG1-OG 2.95Å
254	D	90.9	Very high	92	Very high	24 Å²	24	16.3 Å²	16.3	13%	0.128	8%	0.081	C	C	.	.			trans	-79.6	163	173.2	72.9	-62.6	0	0	0	111.5	F203 Q204 A256 G257 Q258 L259	F203-D254 HydrophobicContact CD2-CB 4.35Å; F203-D254 HydrophobicContact CE2-CB 3.9Å; Q204-D254 WeakPolarHBondContact O-CA 3.05Å; D254-A256 PolarHBondContact O-N 3.35Å; D254-A256 VanDerWaalsContact O-N 3.08Å; D254-A256 WeakPolarHBondContact OD2-CA 3.5Å; D254-A256 VanDerWaalsContact OD2-CB 3.27Å; D254-A256 WeakPolarHBondContact OD2-CB 3.39Å; D254-A256 PolarHBondContact OD2-N 3.23Å; D254-G257 PolarHBondContact O-N 2.86Å; D254-G257 PolarHBondContact OD1-N 2.9Å; D254-Q258 PolarHBondContact OD1-N 2.78Å; D254-L259 PolarHBondContact N-O 3.44Å; D254-L259 PolarHBondContact OD1-N 2.84Å
255	R	85	Confident	92.7	Very high	120 Å²	120	16 Å²	16	45%	0.453	8%	0.079	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-26.7	178.8	-176.6	172.5	-174.4	150.4	7.7	114.6	N153 M154 D206	N153-R255 PolarHBondContact O-NH1 3.31Å; M154-R255 HydrophobicContact CE-CG 4.13Å; M154-R255 HydrophobicContact SD-CB 4.4Å; M154-R255 HydrophobicContact SD-CG 4.2Å; D206-R255 HydrophobicContact CB-CB 4.1Å; D206-R255 WeakPolarHBondContact OD2-CB 3.47Å; D206-R255 PolarHBondContact OD2-N 3.08Å; D206-R255 VanDerWaalsContact OD2-N 3.09Å
256	A	82.1	Confident	93	Very high	41 Å²	41	16 Å²	16	34%	0.339	8%	0.079	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-6.7	179.6	0	0	0	0	0	113.7	R83 D254 Q258	R83-A256 PolarHBondContact NH2-O 2.97Å; D254-A256 PolarHBondContact O-N 3.35Å; D254-A256 VanDerWaalsContact O-N 3.08Å; D254-A256 WeakPolarHBondContact OD2-CA 3.5Å; D254-A256 VanDerWaalsContact OD2-CB 3.27Å; D254-A256 WeakPolarHBondContact OD2-CB 3.39Å; D254-A256 PolarHBondContact OD2-N 3.23Å; A256-Q258 HydrophobicContact CB-CG 4.05Å
257	G	85.5	Confident	93	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.01	9%	0.087	C	C	.	.	S	Bend	trans	58.8	49.3	-176.3	0	0	0	0	0	111.8	F76 P78 R83 D254	F76-G257 WeakPolarHBondContact O-CA 3.4Å; P78-G257 WeakPolarHBondContact CG-O 3.38Å; R83-G257 PolarHBondContact NE-O 2.83Å; R83-G257 PolarHBondContact NH2-O 2.83Å; D254-G257 PolarHBondContact O-N 2.86Å; D254-G257 PolarHBondContact OD1-N 2.9Å
258	Q	84.1	Confident	92.6	Very high	96 Å²	96	21.4 Å²	21.4	45%	0.449	10%	0.103	S	C	.	.			trans	-119.9	-30.8	179.9	-66.4	-166.8	8	0	0	113	D254 A256	D254-Q258 PolarHBondContact OD1-N 2.78Å; A256-Q258 HydrophobicContact CB-CG 4.05Å
259	L	90.1	Very high	92	Very high	44 Å²	44	21.7 Å²	21.7	23%	0.23	10%	0.104	C	C	.	.			trans	-119.7	134.3	178.6	-64.5	178.4	0	0	0	109.5	F203 T253 D254 Y261	F203-L259 HydrophobicContact CD2-CB 3.9Å; F203-L259 HydrophobicContact CD2-CD1 4.2Å; F203-L259 HydrophobicContact CE2-CB 3.98Å; T253-L259 VanDerWaalsContact CA-O 3.26Å; T253-L259 WeakPolarHBondContact CA-O 3.49Å; T253-L259 WeakPolarHBondContact CB-O 3.35Å; T253-L259 PolarHBondContact OG1-O 3.02Å; D254-L259 PolarHBondContact N-O 3.44Å; D254-L259 PolarHBondContact OD1-N 2.84Å; L259-Y261 HydrophobicContact CB-CE2 4.43Å
260	S	94.8	Very high	90.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.1	177.9	-76.9	0	0	0	0	111.7	P78 T252 T253 V329	P78-S260 VanDerWaalsContact CD-OG 3.28Å; P78-S260 WeakPolarHBondContact CD-OG 3.35Å; P78-S260 WeakPolarHBondContact O-CB 3.29Å; P78-S260 PolarHBondContact O-OG 2.87Å; P78-S260 VanDerWaalsContact O-OG 3.08Å; T252-S260 CarbonylContact O-C 3.49Å; T252-S260 VanDerWaalsContact O-CA 3.26Å; T252-S260 WeakPolarHBondContact O-CA 3.28Å; T253-S260 PolarHBondContact OG1-OG 2.95Å; S260-V329 PolarHBondContact O-N 2.93Å
261	Y	96.8	Very high	89.6	Confident	4 Å²	4	22.8 Å²	22.8	2%	0.016	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	140.8	-179.8	-68.3	-95.9	0	0	0	110.8	L193 I197 A200 F203 L251 T252 L259 F327 R328	L193-Y261 HydrophobicContact CD1-CD2 4.48Å; L193-Y261 HydrophobicContact CD1-CG 4.13Å; L193-Y261 HydrophobicContact CD2-CD1 4.01Å; L193-Y261 HydrophobicContact CD2-CG 4.17Å; I197-Y261 HydrophobicContact CD1-CD1 3.51Å; I197-Y261 HydrophobicContact CD1-CE1 3.74Å; I197-Y261 HydrophobicContact CG2-CE1 4.38Å; A200-Y261 HydrophobicContact CB-CE1 4.4Å; F203-Y261 HydrophobicContact CB-CE2 3.98Å; F203-Y261 AromaticContact CD1-CD2 3.87Å; F203-Y261 HydrophobicContact CD1-CD2 3.87Å; F203-Y261 AromaticContact CD1-CE2 3.84Å; F203-Y261 HydrophobicContact CD1-CE2 3.84Å; F203-Y261 AromaticContact CD2-CD2 3.89Å; F203-Y261 HydrophobicContact CD2-CD2 3.89Å; F203-Y261 AromaticContact CD2-CE2 3.49Å; F203-Y261 HydrophobicContact CD2-CE2 3.49Å; F203-Y261 VanDerWaalsContact CD2-CE2 3.49Å; F203-Y261 AromaticContact CE1-CD2 3.77Å; F203-Y261 HydrophobicContact CE1-CD2 3.77Å; F203-Y261 HydrophobicContact CE1-CE2 4.19Å; F203-Y261 AromaticContact CE2-CD2 3.77Å; F203-Y261 HydrophobicContact CE2-CD2 3.77Å; F203-Y261 AromaticContact CE2-CE2 3.84Å; F203-Y261 HydrophobicContact CE2-CE2 3.84Å; F203-Y261 AromaticContact CG-CD2 3.94Å; F203-Y261 HydrophobicContact CG-CD2 3.94Å; F203-Y261 AromaticContact CG-CE2 3.47Å; F203-Y261 HydrophobicContact CG-CE2 3.47Å; F203-Y261 VanDerWaalsContact CG-CE2 3.47Å; F203-Y261 AromaticContact CZ-CD2 3.71Å; F203-Y261 HydrophobicContact CZ-CD2 3.71Å; F203-Y261 HydrophobicContact CZ-CE2 4.19Å; L251-Y261 WeakPolarHBondContact CA-O 3.49Å; T252-Y261 PolarHBondContact N-O 2.83Å; T252-Y261 PolarHBondContact O-N 2.89Å; L259-Y261 HydrophobicContact CB-CE2 4.43Å; Y261-F327 CarbonylContact C-O 3.53Å; Y261-F327 WeakPolarHBondContact CA-O 3.25Å; Y261-R328 HydrophobicContact CD1-CB 3.86Å; Y261-R328 HydrophobicContact CD1-CG 4.48Å; Y261-R328 HydrophobicContact CE1-CB 3.65Å; Y261-R328 HydrophobicContact CE1-CG 4.09Å
262	A	96.8	Very high	87.9	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.6	174.8	0	0	0	0	0	110.5	I125 L249 V250 L251 L326 F327 V329	I125-A262 HydrophobicContact CD1-CB 4.39Å; L249-A262 HydrophobicContact CD1-CB 4.4Å; V250-A262 CarbonylContact O-C 3.48Å; V250-A262 WeakPolarHBondContact O-CA 3.35Å; L251-A262 HydrophobicContact CD1-CB 4.11Å; A262-L326 CarbonylContact O-C 3.43Å; A262-F327 HydrophobicContact CB-CB 4.43Å; A262-F327 PolarHBondContact N-O 3.21Å; A262-F327 PolarHBondContact O-N 2.72Å; A262-V329 HydrophobicContact CB-CG1 3.84Å
263	I	96.7	Very high	85.8	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123.8	174	-53.1	175.8	0	0	0	107.3	Y49 I189 L193 L249 V250 R324 Y325 L326	Y49-I263 HydrophobicContact CE2-CD1 4.18Å; Y49-I263 HydrophobicContact CE2-CG2 4.1Å; Y49-I263 WeakPolarHBondContact OH-CD1 3.38Å; I189-I263 HydrophobicContact CG2-CD1 4.03Å; L193-I263 HydrophobicContact CD2-CD1 4.11Å; L193-I263 HydrophobicContact CD2-CG1 4.08Å; L193-I263 HydrophobicContact CG-CD1 4.2Å; L249-I263 CarbonylContact C-O 3.38Å; L249-I263 WeakPolarHBondContact CA-O 3.39Å; V250-I263 HydrophobicContact CB-CB 4.26Å; V250-I263 PolarHBondContact N-O 3.01Å; V250-I263 PolarHBondContact O-N 2.8Å; I263-R324 HydrophobicContact CG2-CG 4.04Å; I263-Y325 WeakPolarHBondContact CA-O 3.35Å; I263-L326 HydrophobicContact CB-CD2 4.07Å; I263-L326 HydrophobicContact CD1-CD2 4.24Å; I263-L326 HydrophobicContact CG1-CD2 3.65Å; I263-L326 HydrophobicContact CG2-CD2 3.73Å
264	I	95.8	Very high	83.6	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.3	176.3	-63.4	172.4	0	0	0	108.1	I125 V127 Q248 L249 Y266 V300 R324 Y325 F327	I125-I264 HydrophobicContact CG2-CD1 4.34Å; V127-I264 HydrophobicContact CG1-CG1 4.35Å; V127-I264 HydrophobicContact CG1-CG2 3.71Å; Q248-I264 WeakPolarHBondContact O-CA 3.24Å; L249-I264 HydrophobicContact CD1-CG1 4.03Å; I264-Y266 HydrophobicContact CG2-CD1 4.43Å; I264-Y266 HydrophobicContact CG2-CD2 4.15Å; I264-Y266 HydrophobicContact CG2-CE1 3.87Å; I264-Y266 HydrophobicContact CG2-CE2 3.56Å; I264-Y266 VanDerWaalsContact CG2-CZ 3.41Å; I264-V300 HydrophobicContact CD1-CG2 3.78Å; I264-R324 CarbonylContact O-C 3.55Å; I264-R324 WeakPolarHBondContact O-CA 3.35Å; I264-Y325 PolarHBondContact N-O 3.04Å; I264-Y325 PolarHBondContact O-N 3.2Å; I264-F327 HydrophobicContact CD1-CE2 4.19Å
265	N	95.7	Very high	81.5	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	116.1	178	-56.9	-49.6	0	0	0	110.2	L48 Y49 Y247 Q248 G323 R324	L48-N265 HydrophobicContact CD2-CB 3.59Å; Y49-N265 WeakPolarHBondContact CD2-ND2 3.46Å; Y247-N265 CarbonylContact C-O 3.48Å; Y247-N265 WeakPolarHBondContact CA-O 3.42Å; Y247-N265 WeakPolarHBondContact CB-O 3.4Å; Q248-N265 HydrophobicContact CB-CB 4.3Å; Q248-N265 PolarHBondContact N-O 3.36Å; Q248-N265 PolarHBondContact O-N 3.09Å; Q248-N265 PolarHBondContact OE1-ND2 2.87Å; N265-G323 CarbonylContact C-O 3.49Å; N265-G323 WeakPolarHBondContact CA-O 3.21Å; N265-R324 WeakPolarHBondContact OD1-CG 3.35Å; N265-R324 PolarHBondContact OD1-NE 3.29Å
266	Y	92.7	Very high	79.6	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	120.2	172.1	-55.4	-76.2	0	0	0	110.6	N47 V127 I264 L269 V300 L311 G323 Y325	N47-Y266 PolarHBondContact ND2-O 3.42Å; V127-Y266 WeakPolarHBondContact O-CE1 3.22Å; V127-Y266 PolarHBondContact O-OH 2.99Å; I264-Y266 HydrophobicContact CG2-CD1 4.43Å; I264-Y266 HydrophobicContact CG2-CD2 4.15Å; I264-Y266 HydrophobicContact CG2-CE1 3.87Å; I264-Y266 HydrophobicContact CG2-CE2 3.56Å; I264-Y266 VanDerWaalsContact CG2-CZ 3.41Å; Y266-L269 HydrophobicContact CD1-CD1 3.66Å; Y266-L269 HydrophobicContact CD1-CD2 3.99Å; Y266-L269 HydrophobicContact CD1-CG 3.98Å; Y266-L269 HydrophobicContact CE1-CD1 3.94Å; Y266-L269 HydrophobicContact CG-CD1 4.22Å; Y266-V300 HydrophobicContact CE2-CG1 4.1Å; Y266-L311 HydrophobicContact CD2-CB 3.8Å; Y266-L311 HydrophobicContact CE1-CD1 4.48Å; Y266-L311 HydrophobicContact CE2-CB 3.88Å; Y266-L311 HydrophobicContact CE2-CD1 4.08Å; Y266-L311 HydrophobicContact CE2-CD2 3.98Å; Y266-L311 HydrophobicContact CE2-CG 4.21Å; Y266-L311 HydrophobicContact CG-CB 4.24Å; Y266-G323 WeakPolarHBondContact CD2-O 3.08Å; Y266-G323 PolarHBondContact N-O 3.02Å; Y266-Y325 AromaticContact CD2-CD2 3.81Å; Y266-Y325 HydrophobicContact CD2-CD2 3.81Å; Y266-Y325 AromaticContact CD2-CE2 3.8Å; Y266-Y325 HydrophobicContact CD2-CE2 3.8Å; Y266-Y325 AromaticContact CE2-CD2 3.66Å; Y266-Y325 HydrophobicContact CE2-CD2 3.66Å; Y266-Y325 AromaticContact CE2-CE2 3.88Å; Y266-Y325 HydrophobicContact CE2-CE2 3.88Å
267	H	90.7	Very high	77.8	Confident	40 Å²	40	31.1 Å²	31.1	19%	0.185	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-46.1	171.9	-176.1	74.8	0	0	0	111.9	Y45 N47 L48 T246 R322	Y45-H267 AromaticContact CD1-CD2 3.58Å; Y45-H267 AromaticContact CD1-CE1 3.62Å; Y45-H267 AromaticContact CD1-CG 3.93Å; Y45-H267 AromaticContact CD1-ND1 3.96Å; Y45-H267 AromaticContact CD1-NE2 3.41Å; Y45-H267 WeakPolarHBondContact CD1-NE2 3.47Å; Y45-H267 AromaticContact CE1-NE2 3.99Å; N47-H267 PolarHBondContact OD1-ND1 3.25Å; L48-H267 HydrophobicContact CD1-CB 4.14Å; L48-H267 HydrophobicContact CD2-CB 4.14Å; L48-H267 HydrophobicContact CG-CB 4.18Å; T246-H267 HydrophobicContact CG2-CB 4.23Å; T246-H267 WeakPolarHBondContact O-CA 3.19Å; T246-H267 WeakPolarHBondContact O-CB 3.42Å; T246-H267 PolarHBondContact O-N 2.94Å; H267-R322 PolarHBondContact CE1-NH2 3.27Å; H267-R322 PolarHBondContact O-NH1 3.28Å; H267-R322 PolarHBondContact O-NH2 3.08Å
268	K	87.1	Confident	75.7	Confident	77 Å²	77	34.6 Å²	34.6	34%	0.335	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	131.8	-179.8	177.4	-169	175.3	-163.1	0	107.8	L242 T244 A245 T246	L242-K268 PolarHBondContact O-NZ 2.86Å; T244-K268 VanDerWaalsContact O-CD 3.25Å; T244-K268 WeakPolarHBondContact O-CD 3.36Å; T244-K268 WeakPolarHBondContact O-CE 3.46Å; T244-K268 PolarHBondContact O-NZ 2.86Å; T244-K268 PolarHBondContact OG1-NZ 3.02Å; A245-K268 CarbonylContact C-O 3.56Å; A245-K268 VanDerWaalsContact CA-O 3.3Å; A245-K268 WeakPolarHBondContact CA-O 3.45Å; T246-K268 PolarHBondContact N-O 2.94Å; T246-K268 PolarHBondContact O-N 2.91Å; T246-K268 VanDerWaalsContact O-N 3.1Å
269	L	82.8	Confident	73.5	Confident	5 Å²	5	34.1 Å²	34.1	3%	0.026	21%	0.208	C	C	.	.			trans	-118.1	108.4	164.2	-66.6	-177.2	0	0	0	106.7	Y128 A245 Y247 Y266 P308 L311	Y128-L269 HydrophobicContact CD1-CD2 3.6Å; Y128-L269 HydrophobicContact CD2-CD1 3.82Å; Y128-L269 HydrophobicContact CD2-CD2 4.14Å; Y128-L269 HydrophobicContact CE1-CD2 3.9Å; Y128-L269 HydrophobicContact CE2-CD1 3.83Å; Y128-L269 HydrophobicContact CE2-CD2 4.45Å; Y128-L269 HydrophobicContact CG-CD1 4.28Å; Y128-L269 HydrophobicContact CG-CD2 3.74Å; A245-L269 HydrophobicContact CB-CD2 3.96Å; Y247-L269 HydrophobicContact CD1-CD2 3.88Å; Y266-L269 HydrophobicContact CD1-CD1 3.66Å; Y266-L269 HydrophobicContact CD1-CD2 3.99Å; Y266-L269 HydrophobicContact CD1-CG 3.98Å; Y266-L269 HydrophobicContact CE1-CD1 3.94Å; Y266-L269 HydrophobicContact CG-CD1 4.22Å; L269-P308 HydrophobicContact CB-CB 4.19Å; L269-P308 HydrophobicContact CD1-CB 4.08Å; L269-P308 WeakPolarHBondContact CD1-O 3.32Å; L269-L311 HydrophobicContact CD1-CB 4.03Å; L269-L311 HydrophobicContact CD1-CD1 4.13Å
270	G	72.8	Confident	71.4	Confident	11 Å²	11	34.9 Å²	34.9	11%	0.113	22%	0.221	C	C	.	.			trans	-83.8	-27.6	-167	0	0	0	0	0	115.2	Q243 T244	Q243-G270 WeakPolarHBondContact CB-O 3.19Å; Q243-G270 VanDerWaalsContact CG-O 3.24Å; Q243-G270 WeakPolarHBondContact CG-O 3.4Å; Q243-G270 PolarHBondContact NE2-O 2.99Å; Q243-G270 PolarHBondContact OE1-O 2.74Å; T244-G270 WeakPolarHBondContact O-CA 3.36Å; T244-G270 PolarHBondContact O-N 2.92Å
271	Y	71.5	Confident	68.9	Low	13 Å²	13	45.7 Å²	45.7	5%	0.051	26%	0.262	C	S	.	.			trans	-137.1	144.4	-170.8	45.5	-88.8	0	0	0	110.4	Y128 C130 Q132 V216 Q243 A245	Y128-Y271 HydrophobicContact CE1-CD2 4.39Å; Y128-Y271 HydrophobicContact CE1-CE2 4.06Å; Y128-Y271 PolarHBondContact OH-O 2.96Å; C130-Y271 HydrophobicContact CB-CE2 4.32Å; Q132-Y271 PolarHBondContact OE1-OH 3.4Å; V216-Y271 PolarHBondContact O-OH 2.65Å; Q243-Y271 HydrophobicContact CB-CD1 4.19Å; Q243-Y271 WeakPolarHBondContact O-CD1 3.41Å; Q243-Y271 VanDerWaalsContact O-CE1 3.32Å; Q243-Y271 WeakPolarHBondContact O-CE1 3.28Å; A245-Y271 HydrophobicContact CB-CE1 3.87Å
272	A	61.5	Low	66.4	Low	17 Å²	17	54.3 Å²	54.3	14%	0.14	29%	0.294	C	S	.	.			trans	-101.7	140.1	152.6	0	0	0	0	0	108.6	S274 D275 P308	A272-S274 WeakPolarHBondContact CB-OG 3.44Å; A272-S274 PolarHBondContact O-N 2.76Å; A272-D275 WeakPolarHBondContact CB-OD2 3.48Å; A272-D275 PolarHBondContact N-OD2 3.17Å; A272-D275 VanDerWaalsContact O-CB 3.32Å; A272-D275 WeakPolarHBondContact O-CB 3.43Å; A272-D275 PolarHBondContact O-N 3.15Å; A272-P308 HydrophobicContact CB-CG 3.94Å
273	G	53.1	Low	64.4	Low	10 Å²	10	55.4 Å²	55.4	10%	0.103	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-64.6	-11.3	-177.3	0	0	0	0	0	114.9	D275 G283	G273-D275 PolarHBondContact O-N 3.4Å; G273-G283 WeakPolarHBondContact CA-O 2.96Å
274	S	49.5	Very low	63	Low	55 Å²	55	63.3 Å²	63.3	39%	0.385	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-62.1	-26.1	167.4	40.5	0	0	0	0	114.4	A272 I276	A272-S274 WeakPolarHBondContact CB-OG 3.44Å; A272-S274 PolarHBondContact O-N 2.76Å; S274-I276 PolarHBondContact O-N 3.28Å
275	D	47.4	Very low	62.2	Low	77 Å²	77	64.4 Å²	64.4	41%	0.412	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-84.3	-4.3	-161.8	-48	-16.7	0	0	0	111.2	L233 A272 G273 M277	L233-D275 WeakPolarHBondContact CD1-O 3.48Å; A272-D275 WeakPolarHBondContact CB-OD2 3.48Å; A272-D275 PolarHBondContact N-OD2 3.17Å; A272-D275 VanDerWaalsContact O-CB 3.32Å; A272-D275 WeakPolarHBondContact O-CB 3.43Å; A272-D275 PolarHBondContact O-N 3.15Å; G273-D275 PolarHBondContact O-N 3.4Å; D275-M277 PolarHBondContact O-N 3.33Å
276	I	44.9	Very low	61.6	Low	49 Å²	49	66.4 Å²	66.4	25%	0.251	35%	0.352	S	S	.	.	S	Bend	trans	-81.8	102.9	-176.6	-55.7	179.7	0	0	0	110.6	F218 S274 G278	F218-I276 HydrophobicContact CB-CD1 4.33Å; F218-I276 HydrophobicContact CD2-CD1 3.67Å; F218-I276 HydrophobicContact CE2-CD1 4.28Å; F218-I276 HydrophobicContact CG-CD1 4.14Å; S274-I276 PolarHBondContact O-N 3.28Å; I276-G278 VanDerWaalsContact C-N 3.32Å; I276-G278 PolarHBondContact O-N 3.08Å
277	M	43.1	Very low	61.4	Low	154 Å²	154	66.5 Å²	66.5	76%	0.759	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	29.4	166.4	-64.1	-80.3	-89.1	0	0	115.4	L233 D275 S279	L233-M277 HydrophobicContact CD1-CG 4.48Å; L233-M277 HydrophobicContact CD2-CG 4.31Å; L233-M277 HydrophobicContact CD2-SD 3.85Å; D275-M277 PolarHBondContact O-N 3.33Å; M277-S279 PolarHBondContact O-N 3.14Å
278	G	41.6	Very low	61.3	Low	74 Å²	74	65.1 Å²	65.1	76%	0.763	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	2.5	168.8	0	0	0	0	0	116.2	I276 A280	I276-G278 VanDerWaalsContact C-N 3.32Å; I276-G278 PolarHBondContact O-N 3.08Å; G278-A280 PolarHBondContact O-N 2.85Å
279	S	39.2	Very low	61.6	Low	86 Å²	86	61.5 Å²	61.5	60%	0.601	33%	0.33	S	S	*	.			trans	-98.7	85.3	-179.3	-155.1	0	0	0	0	110.1	M277 R281	M277-S279 PolarHBondContact O-N 3.14Å; S279-R281 PolarHBondContact O-N 3.06Å
280	A	44.3	Very low	62	Low	61 Å²	61	61.3 Å²	61.3	50%	0.504	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	31.7	-167.7	0	0	0	0	0	116.7	G278 R284	G278-A280 PolarHBondContact O-N 2.85Å; A280-R284 PolarHBondContact O-NH2 3.06Å
281	R	43.2	Very low	62.9	Low	227 Å²	227	61 Å²	61	86%	0.857	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.2	2.1	-169.3	-72.1	-168.6	174.4	-157.8	-0.8	115.9	S279	S279-R281 PolarHBondContact O-N 3.06Å
282	R	44.8	Very low	63.7	Low	184 Å²	184	60.4 Å²	60.4	69%	0.694	32%	0.324	S	S	*	.	S	Bend	trans	-142.4	140.8	179.9	-72.5	179.8	168.8	174.4	-2.2	112.2	T105 D106	T105-R282 HydrophobicContact CG2-CG 4.44Å; D106-R282 WeakPolarHBondContact OD2-CA 3.36Å
283	G	53.7	Low	64.8	Low	23 Å²	23	61.4 Å²	61.4	24%	0.237	33%	0.327	C	S	.	.			trans	82.7	32.3	166.9	0	0	0	0	0	116.8	D106 G273 C285	D106-G283 WeakPolarHBondContact OD1-CA 3.45Å; D106-G283 PolarHBondContact OD1-N 2.82Å; D106-G283 PolarHBondContact OD2-N 2.91Å; G273-G283 WeakPolarHBondContact CA-O 2.96Å; G283-C285 PolarHBondContact O-N 3.27Å
284	R	67.4	Low	66.3	Low	166 Å²	166	62.3 Å²	62.3	63%	0.626	33%	0.334	S	S	*	.			trans	-67.9	117.2	-178.9	-70.1	-169.6	-176.6	-172.3	2.6	112.2	D106 A280	D106-R284 PolarHBondContact OD1-N 2.83Å; A280-R284 PolarHBondContact O-NH2 3.06Å
285	C	79.4	Confident	67.8	Low	24 Å²	24	59.9 Å²	59.9	16%	0.162	32%	0.316	C	S	.	.			trans	-62.8	143.5	171.2	-71.2	0	0	0	0	112.2	Y128 A129 C130 G283	Y128-C285 HydrophobicContact CE1-CB 4.4Å; Y128-C285 HydrophobicContact CE2-CB 3.96Å; A129-C285 VanDerWaalsContact O-CA 3.24Å; A129-C285 WeakPolarHBondContact O-CA 3.41Å; C130-C285 HydrophobicContact CB-CB 4.32Å; C130-C285 WeakPolarHBondContact CB-SG 3.05Å; C130-C285 WeakPolarHBondContact SG-CB 3.22Å; C130-C285 CovalentContact SG-SG 2.03Å; C130-C285 PolarHBondContact SG-SG 3.2Å; G283-C285 PolarHBondContact O-N 3.27Å
286	K	82.6	Confident	69.6	Low	41 Å²	41	56.3 Å²	56.3	18%	0.178	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	148.9	177.4	-72.7	175.6	165.1	-178.1	0	112.2	F107 F109 Y128 A129 E288	F107-K286 PolarHBondContact O-NZ 2.97Å; F109-K286 HydrophobicContact CD2-CD 4.2Å; F109-K286 HydrophobicContact CE2-CB 4.27Å; F109-K286 HydrophobicContact CE2-CD 3.49Å; F109-K286 VanDerWaalsContact CE2-CD 3.49Å; F109-K286 HydrophobicContact CZ-CB 4.24Å; F109-K286 HydrophobicContact CZ-CD 3.77Å; F109-K286 PolarHBondContact O-NZ 2.92Å; Y128-K286 CarbonylContact C-O 3.58Å; A129-K286 HydrophobicContact CB-CB 4.27Å; A129-K286 PolarHBondContact N-O 3.11Å; A129-K286 PolarHBondContact O-N 3.45Å; K286-E288 WeakPolarHBondContact CD-OE2 3.28Å
287	A	88.3	Confident	71.6	Confident	2 Å²	2	55.1 Å²	55.1	2%	0.017	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	90.5	175.5	0	0	0	0	0	109.2	A126 V300 S305 L311	A126-A287 CarbonylContact O-C 3.54Å; A126-A287 WeakPolarHBondContact O-CA 3.33Å; A287-V300 HydrophobicContact CB-CB 4.47Å; A287-V300 HydrophobicContact CB-CG2 4.35Å; A287-V300 PolarHBondContact O-N 3.46Å; A287-S305 PolarHBondContact O-OG 3.14Å; A287-L311 HydrophobicContact CB-CD1 3.98Å
288	E	89.7	Confident	73.7	Confident	12 Å²	12	47.9 Å²	47.9	6%	0.056	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	160.8	-167.9	68.2	-168.2	-121.3	0	0	112.9	F109 A126 K286 V298 L299	F109-E288 HydrophobicContact CD2-CG 4.43Å; F109-E288 WeakPolarHBondContact CD2-OE1 3.47Å; F109-E288 HydrophobicContact CE2-CG 3.8Å; F109-E288 WeakPolarHBondContact CE2-OE1 3.36Å; A126-E288 CarbonylContact C-O 3.59Å; A126-E288 WeakPolarHBondContact CA-O 3.41Å; A126-E288 HydrophobicContact CB-CG 4.05Å; A126-E288 WeakPolarHBondContact CB-O 3.42Å; A126-E288 PolarHBondContact N-O 3.33Å; A126-E288 PolarHBondContact O-N 2.98Å; K286-E288 WeakPolarHBondContact CD-OE2 3.28Å; E288-V298 CarbonylContact C-O 3.58Å; E288-V298 VanDerWaalsContact CA-O 3.28Å; E288-V298 WeakPolarHBondContact CA-O 3.15Å; E288-L299 HydrophobicContact CB-CD2 4Å
289	L	92.8	Very high	75.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	117.4	171.3	-63.9	89.4	0	0	0	106.5	Y79 Y80 I125 S297 V298 V300 F327 V329 V333	Y79-L289 HydrophobicContact CE2-CD2 4.41Å; Y79-L289 WeakPolarHBondContact OH-CA 3.27Å; Y79-L289 WeakPolarHBondContact OH-CB 3.38Å; Y80-L289 HydrophobicContact CE2-CB 4.28Å; Y80-L289 PolarHBondContact OH-O 2.86Å; Y80-L289 VanDerWaalsContact OH-O 3.13Å; I125-L289 HydrophobicContact CG2-CG 4.45Å; L289-S297 CarbonylContact O-C 3.47Å; L289-S297 VanDerWaalsContact O-CA 3.26Å; L289-S297 WeakPolarHBondContact O-CA 3.21Å; L289-V298 PolarHBondContact N-O 2.88Å; L289-V298 PolarHBondContact O-N 3.26Å; L289-V300 HydrophobicContact CD1-CG2 4Å; L289-F327 HydrophobicContact CD1-CD1 4.18Å; L289-F327 HydrophobicContact CD1-CD2 4.23Å; L289-F327 HydrophobicContact CD1-CE1 4.11Å; L289-F327 HydrophobicContact CD1-CE2 4.16Å; L289-F327 HydrophobicContact CD1-CG 4.27Å; L289-F327 HydrophobicContact CD1-CZ 4.12Å; L289-F327 HydrophobicContact CD2-CB 4.28Å; L289-F327 HydrophobicContact CD2-CD2 4.39Å; L289-F327 HydrophobicContact CD2-CG 4.15Å; L289-V329 HydrophobicContact CD2-CG1 3.76Å; L289-V333 HydrophobicContact CB-CG2 4.19Å; L289-V333 HydrophobicContact CD2-CG1 4.1Å; L289-V333 HydrophobicContact CD2-CG2 4.1Å
290	N	92	Very high	78.1	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	124.1	-179.5	-175.6	43.3	0	0	0	110.9	Y79 G110 D121 P122 A123 L124 G292	Y79-N290 WeakPolarHBondContact CE1-O 3.34Å; Y79-N290 PolarHBondContact OH-N 2.98Å; Y79-N290 PolarHBondContact OH-O 2.74Å; G110-N290 VanDerWaalsContact CA-OD1 3.31Å; G110-N290 WeakPolarHBondContact CA-OD1 3.48Å; G110-N290 PolarHBondContact N-ND2 3.33Å; D121-N290 PolarHBondContact OD1-ND2 2.81Å; P122-N290 PolarHBondContact O-ND2 2.97Å; A123-N290 CarbonylContact C-O 3.53Å; A123-N290 WeakPolarHBondContact CA-O 3.4Å; L124-N290 HydrophobicContact CD1-CB 4.48Å; L124-N290 PolarHBondContact N-O 3.42Å; L124-N290 PolarHBondContact O-N 3.36Å; N290-G292 PolarHBondContact ND2-N 3.48Å; N290-G292 PolarHBondContact O-N 2.87Å
291	G	90.2	Very high	79.9	Confident	4 Å²	4	39.6 Å²	39.6	4%	0.041	18%	0.181	C	C	.	.			trans	-74.2	-10.9	179.3	0	0	0	0	0	115.4	Y80 A123 T295 G296	Y80-G291 VanDerWaalsContact CD1-CA 3.42Å; A123-G291 WeakPolarHBondContact CB-O 3.28Å; G291-T295 WeakPolarHBondContact CA-OG1 3.41Å; G291-T295 PolarHBondContact O-OG1 3.05Å; G291-G296 PolarHBondContact N-O 3.12Å
292	G	88	Confident	81.2	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.01	15%	0.145	C	C	.	.	S	Bend	trans	69.9	172.6	-173.7	0	0	0	0	0	113	D121 N290 A294 T295	D121-G292 CarbonylContact O-C 3.57Å; D121-G292 WeakPolarHBondContact O-CA 3.41Å; D121-G292 VanDerWaalsContact OD2-CA 3.23Å; D121-G292 WeakPolarHBondContact OD2-CA 3.15Å; N290-G292 PolarHBondContact ND2-N 3.48Å; N290-G292 PolarHBondContact O-N 2.87Å; G292-A294 PolarHBondContact O-N 2.8Å; G292-T295 VanDerWaalsContact O-CB 3.3Å; G292-T295 WeakPolarHBondContact O-CB 3.42Å; G292-T295 VanDerWaalsContact O-CG2 3.23Å; G292-T295 WeakPolarHBondContact O-CG2 3.39Å; G292-T295 PolarHBondContact O-N 2.69Å; G292-T295 PolarHBondContact O-OG1 3.44Å
293	N	85.3	Confident	82.4	Confident	38 Å²	38	23 Å²	23	20%	0.203	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	34.7	-179.2	-70.6	-35.1	0	0	0	114.2	W116 D121 T295 Q833 K867 T869	W116-N293 WeakPolarHBondContact CZ2-O 3.47Å; D121-N293 PolarHBondContact O-N 2.84Å; D121-N293 PolarHBondContact OD2-N 3.08Å; D121-N293 VanDerWaalsContact OD2-N 3.13Å; N293-T295 HydrophobicContact CB-CG2 4.34Å; N293-T295 PolarHBondContact O-N 3.45Å; N293-Q833 PolarHBondContact OD1-NE2 2.89Å; N293-K867 PolarHBondContact O-NZ 2.88Å; N293-T869 PolarHBondContact ND2-OG1 2.88Å
294	A	83.9	Confident	83.2	Confident	30 Å²	30	23 Å²	23	25%	0.248	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.7	43.4	-171.1	0	0	0	0	0	112.8	W116 D121 G292 G296 K867	W116-A294 HydrophobicContact CD2-CB 3.55Å; W116-A294 HydrophobicContact CE3-CB 3.57Å; W116-A294 HydrophobicContact CG-CB 4.19Å; W116-A294 HydrophobicContact CH2-CB 3.81Å; W116-A294 HydrophobicContact CZ2-CB 3.82Å; W116-A294 HydrophobicContact CZ3-CB 3.71Å; D121-A294 WeakPolarHBondContact OD2-CA 3.25Å; D121-A294 PolarHBondContact OD2-N 2.86Å; G292-A294 PolarHBondContact O-N 2.8Å; A294-G296 VanDerWaalsContact C-N 3.31Å; A294-K867 PolarHBondContact O-NZ 2.66Å
295	T	82.4	Confident	83.4	Confident	3 Å²	3	15.9 Å²	15.9	2%	0.018	9%	0.094	C	C	.	.	S	Bend	trans	-86.9	-5	173.9	62.9	0	0	0	0	112.8	G291 G292 N293 K867 R870	G291-T295 WeakPolarHBondContact CA-OG1 3.41Å; G291-T295 PolarHBondContact O-OG1 3.05Å; G292-T295 VanDerWaalsContact O-CB 3.3Å; G292-T295 WeakPolarHBondContact O-CB 3.42Å; G292-T295 VanDerWaalsContact O-CG2 3.23Å; G292-T295 WeakPolarHBondContact O-CG2 3.39Å; G292-T295 PolarHBondContact O-N 2.69Å; G292-T295 PolarHBondContact O-OG1 3.44Å; N293-T295 HydrophobicContact CB-CG2 4.34Å; N293-T295 PolarHBondContact O-N 3.45Å; T295-K867 HydrophobicContact CG2-CD 3.82Å; T295-R870 HydrophobicContact CG2-CG 4.27Å
296	G	85.5	Confident	82.8	Confident	3 Å²	3	22 Å²	22	3%	0.031	12%	0.118	C	C	.	.			trans	116.4	152.9	172.8	0	0	0	0	0	113.3	Y80 G291 A294	Y80-G296 WeakPolarHBondContact CE1-O 3.29Å; Y80-G296 VanDerWaalsContact CZ-O 3.23Å; Y80-G296 PolarHBondContact OH-O 2.98Å; Y80-G296 VanDerWaalsContact OH-O 3.13Å; G291-G296 PolarHBondContact N-O 3.12Å; A294-G296 VanDerWaalsContact C-N 3.31Å
297	S	86.6	Confident	82.2	Confident	23 Å²	23	25 Å²	25	16%	0.161	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	141.4	178.6	52.2	0	0	0	0	111.4	L289	L289-S297 CarbonylContact O-C 3.47Å; L289-S297 VanDerWaalsContact O-CA 3.26Å; L289-S297 WeakPolarHBondContact O-CA 3.21Å
298	V	86.7	Confident	81.2	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.012	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.7	179.4	170.5	0	0	0	0	110.2	Y80 E288 L289 V333 Y346 P1036	Y80-V298 PolarHBondContact OH-N 3.17Å; E288-V298 CarbonylContact C-O 3.58Å; E288-V298 VanDerWaalsContact CA-O 3.28Å; E288-V298 WeakPolarHBondContact CA-O 3.15Å; L289-V298 PolarHBondContact N-O 2.88Å; L289-V298 PolarHBondContact O-N 3.26Å; V298-V333 HydrophobicContact CB-CB 4.27Å; V298-V333 HydrophobicContact CB-CG1 3.94Å; V298-V333 HydrophobicContact CG1-CG1 3.86Å; V298-V333 HydrophobicContact CG2-CB 4.06Å; V298-V333 HydrophobicContact CG2-CG1 4.18Å; V298-Y346 HydrophobicContact CG1-CE1 3.9Å; V298-P1036 HydrophobicContact CG2-CB 4.17Å; V298-P1036 HydrophobicContact CG2-CG 3.81Å
299	L	85.3	Confident	80.4	Confident	46 Å²	46	30.6 Å²	30.6	24%	0.241	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	139.9	173.4	-62	179.5	0	0	0	110.5	E288 D301	E288-L299 HydrophobicContact CB-CD2 4Å; L299-D301 VanDerWaalsContact C-N 3.26Å; L299-D301 PolarHBondContact O-N 2.91Å
300	V	87.4	Confident	79.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	-56.9	-41.7	177.8	172.9	0	0	0	0	111.2	I264 Y266 A287 L289 L311 Y325 F327 K335	I264-V300 HydrophobicContact CD1-CG2 3.78Å; Y266-V300 HydrophobicContact CE2-CG1 4.1Å; A287-V300 HydrophobicContact CB-CB 4.47Å; A287-V300 HydrophobicContact CB-CG2 4.35Å; A287-V300 PolarHBondContact O-N 3.46Å; L289-V300 HydrophobicContact CD1-CG2 4Å; V300-L311 HydrophobicContact CG1-CD2 4.21Å; V300-Y325 HydrophobicContact CG1-CD1 3.91Å; V300-Y325 HydrophobicContact CG1-CD2 4.06Å; V300-Y325 HydrophobicContact CG1-CG 3.64Å; V300-F327 HydrophobicContact CB-CZ 4.23Å; V300-F327 HydrophobicContact CG1-CE2 4.19Å; V300-F327 HydrophobicContact CG1-CZ 3.96Å; V300-F327 HydrophobicContact CG2-CE2 4.5Å; V300-F327 HydrophobicContact CG2-CZ 4.36Å; V300-K335 PolarHBondContact O-NZ 3.4Å
301	D	81.5	Confident	79.4	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.177	C	C	.	.			trans	-146.2	132.2	159.5	-171.1	-79.7	0	0	0	111.1	L299 V303 Y304 S305 L311 Y325 K335 S339	L299-D301 VanDerWaalsContact C-N 3.26Å; L299-D301 PolarHBondContact O-N 2.91Å; D301-V303 PolarHBondContact O-N 2.94Å; D301-V303 VanDerWaalsContact O-N 3.14Å; D301-V303 WeakPolarHBondContact OD1-CB 3.28Å; D301-V303 PolarHBondContact OD1-N 2.97Å; D301-Y304 HydrophobicContact CB-CD2 3.93Å; D301-Y304 HydrophobicContact CB-CG 4.34Å; D301-Y304 VanDerWaalsContact CG-CD2 3.45Å; D301-Y304 PolarHBondContact O-N 3.25Å; D301-Y304 WeakPolarHBondContact OD1-CD2 3.4Å; D301-Y304 PolarHBondContact OD1-N 3.41Å; D301-S305 PolarHBondContact N-OG 2.78Å; D301-S305 WeakPolarHBondContact O-CB 3.44Å; D301-S305 PolarHBondContact O-N 2.97Å; D301-S305 PolarHBondContact O-OG 3.43Å; D301-S305 VanDerWaalsContact O-OG 3.13Å; D301-L311 HydrophobicContact CB-CD2 4.33Å; D301-Y325 HydrophobicContact CB-CE1 4.15Å; D301-K335 IonicContact OD2-NZ 3.23Å; D301-K335 PolarHBondContact OD2-NZ 3.08Å; D301-S339 PolarHBondContact OD2-OG 2.92Å; D301-S339 VanDerWaalsContact OD2-OG 3.09Å
302	P	70.9	Confident	79.2	Confident	16 Å²	16	33.8 Å²	33.8	10%	0.104	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-17	-173.1	30.8	-38.6	0	0	0	113.8	K306 T342 Y346	P302-K306 WeakPolarHBondContact O-CE 3.41Å; P302-K306 PolarHBondContact O-NZ 2.99Å; P302-T342 HydrophobicContact CG-CG2 3.74Å; P302-Y346 HydrophobicContact CB-CE2 4.12Å; P302-Y346 HydrophobicContact CG-CD2 4.24Å; P302-Y346 HydrophobicContact CG-CE2 3.74Å
303	V	69.9	Low	79	Confident	47 Å²	47	39.3 Å²	39.3	29%	0.285	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-58.7	172.1	-174.7	0	0	0	0	109.4	D301 S305 K306 L341	D301-V303 PolarHBondContact O-N 2.94Å; D301-V303 VanDerWaalsContact O-N 3.14Å; D301-V303 WeakPolarHBondContact OD1-CB 3.28Å; D301-V303 PolarHBondContact OD1-N 2.97Å; V303-S305 PolarHBondContact O-N 3.1Å; V303-K306 WeakPolarHBondContact O-CB 3.47Å; V303-K306 PolarHBondContact O-N 3.47Å; V303-K306 VanDerWaalsContact O-N 3.14Å; V303-L341 HydrophobicContact CB-CD1 4.42Å; V303-L341 HydrophobicContact CG1-CD1 4.02Å; V303-L341 HydrophobicContact CG2-CB 3.79Å; V303-L341 HydrophobicContact CG2-CD1 4.15Å
304	Y	72.2	Confident	79.1	Confident	24 Å²	24	41.5 Å²	41.5	9%	0.094	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-73.5	-25.6	-168.2	-50.3	-46.4	0	0	0	114	D301 K306 M307 Q310 M314 L341	D301-Y304 HydrophobicContact CB-CD2 3.93Å; D301-Y304 HydrophobicContact CB-CG 4.34Å; D301-Y304 VanDerWaalsContact CG-CD2 3.45Å; D301-Y304 PolarHBondContact O-N 3.25Å; D301-Y304 WeakPolarHBondContact OD1-CD2 3.4Å; D301-Y304 PolarHBondContact OD1-N 3.41Å; Y304-K306 PolarHBondContact O-N 3.4Å; Y304-K306 VanDerWaalsContact O-N 3.07Å; Y304-M307 CarbonylContact O-C 3.59Å; Y304-M307 VanDerWaalsContact O-C 3.26Å; Y304-M307 PolarHBondContact O-N 2.81Å; Y304-Q310 HydrophobicContact CD1-CB 3.78Å; Y304-Q310 VanDerWaalsContact CD1-OE1 3.27Å; Y304-Q310 HydrophobicContact CG-CB 4.27Å; Y304-M314 HydrophobicContact CD1-CG 4.34Å; Y304-M314 HydrophobicContact CD2-CB 3.97Å; Y304-M314 HydrophobicContact CD2-CG 4.2Å; Y304-M314 HydrophobicContact CE1-CG 3.96Å; Y304-M314 HydrophobicContact CE2-CB 3.74Å; Y304-M314 HydrophobicContact CE2-CG 3.81Å; Y304-M314 HydrophobicContact CG-CG 4.47Å; Y304-L341 HydrophobicContact CE1-CD1 4.39Å
305	S	70.2	Confident	79.3	Confident	16 Å²	16	40.8 Å²	40.8	11%	0.112	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-62.1	-14.5	171.7	-66.5	0	0	0	0	113.4	A287 D301 V303	A287-S305 PolarHBondContact O-OG 3.14Å; D301-S305 PolarHBondContact N-OG 2.78Å; D301-S305 WeakPolarHBondContact O-CB 3.44Å; D301-S305 PolarHBondContact O-N 2.97Å; D301-S305 PolarHBondContact O-OG 3.43Å; D301-S305 VanDerWaalsContact O-OG 3.13Å; V303-S305 PolarHBondContact O-N 3.1Å
306	K	66.4	Low	79.6	Confident	152 Å²	152	40.7 Å²	40.7	66%	0.661	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-93.4	-6.2	173.8	-62.1	165.5	-175.6	149.6	0	113.2	P302 V303 Y304	P302-K306 WeakPolarHBondContact O-CE 3.41Å; P302-K306 PolarHBondContact O-NZ 2.99Å; V303-K306 WeakPolarHBondContact O-CB 3.47Å; V303-K306 PolarHBondContact O-N 3.47Å; V303-K306 VanDerWaalsContact O-N 3.14Å; Y304-K306 PolarHBondContact O-N 3.4Å; Y304-K306 VanDerWaalsContact O-N 3.07Å
307	M	70.9	Confident	79.8	Confident	105 Å²	105	40.6 Å²	40.6	52%	0.517	21%	0.206	S	C	.	.	S	Bend	trans	-139.6	76.3	-178.9	-65.4	-173.1	-174.5	0	0	110.2	Y304 M309 Q310	Y304-M307 CarbonylContact O-C 3.59Å; Y304-M307 VanDerWaalsContact O-C 3.26Å; Y304-M307 PolarHBondContact O-N 2.81Å; M307-M309 VanDerWaalsContact C-N 3.33Å; M307-M309 PolarHBondContact O-N 3.42Å; M307-Q310 HydrophobicContact CB-CB 4.43Å; M307-Q310 HydrophobicContact CB-CG 4.1Å; M307-Q310 WeakPolarHBondContact O-CB 3.37Å; M307-Q310 PolarHBondContact O-N 3.23Å; M307-Q310 PolarHBondContact SD-NE2 3.12Å; M307-Q310 VanDerWaalsContact SD-NE2 3.43Å
308	P	67.8	Low	80	Confident	16 Å²	16	40.4 Å²	40.4	10%	0.104	20%	0.204	C	C	.	.	H	α-helix	trans	-52.9	-37.2	-163.3	-32.4	38.2	0	0	0	116.7	Y128 L269 A272 Q310 L311	Y128-P308 HydrophobicContact CE2-CB 3.86Å; Y128-P308 HydrophobicContact CE2-CG 4.03Å; Y128-P308 WeakPolarHBondContact OH-CB 3.39Å; Y128-P308 WeakPolarHBondContact OH-CG 3.35Å; L269-P308 HydrophobicContact CB-CB 4.19Å; L269-P308 HydrophobicContact CD1-CB 4.08Å; L269-P308 WeakPolarHBondContact CD1-O 3.32Å; A272-P308 HydrophobicContact CB-CG 3.94Å; P308-Q310 PolarHBondContact O-N 3.4Å; P308-Q310 VanDerWaalsContact O-N 3.14Å; P308-L311 WeakPolarHBondContact O-CB 3.44Å; P308-L311 PolarHBondContact O-N 3.11Å; P308-L311 VanDerWaalsContact O-N 3.08Å
309	M	72.4	Confident	80	Confident	115 Å²	115	41.5 Å²	41.5	57%	0.567	21%	0.209	S	C	*	.	H	α-helix	trans	-56.6	-31.3	175.4	-73.8	-177.9	66.8	0	0	113.1	M307 A312 M313	M307-M309 VanDerWaalsContact C-N 3.33Å; M307-M309 PolarHBondContact O-N 3.42Å; M309-A312 PolarHBondContact O-N 3.48Å; M309-M313 HydrophobicContact CE-CE 4.08Å; M309-M313 WeakPolarHBondContact O-CG 3.46Å; M309-M313 PolarHBondContact O-N 3.41Å
310	Q	80	Confident	80.1	Confident	65 Å²	65	42.2 Å²	42.2	30%	0.304	21%	0.209	S	C	.	.	H	α-helix	trans	-72.3	-30	179.7	-61.1	-176.7	-2.5	0	0	112.3	Y304 M307 P308 A312 M313 M314	Y304-Q310 HydrophobicContact CD1-CB 3.78Å; Y304-Q310 VanDerWaalsContact CD1-OE1 3.27Å; Y304-Q310 HydrophobicContact CG-CB 4.27Å; M307-Q310 HydrophobicContact CB-CB 4.43Å; M307-Q310 HydrophobicContact CB-CG 4.1Å; M307-Q310 WeakPolarHBondContact O-CB 3.37Å; M307-Q310 PolarHBondContact O-N 3.23Å; M307-Q310 PolarHBondContact SD-NE2 3.12Å; M307-Q310 VanDerWaalsContact SD-NE2 3.43Å; P308-Q310 PolarHBondContact O-N 3.4Å; P308-Q310 VanDerWaalsContact O-N 3.14Å; Q310-A312 PolarHBondContact O-N 3.26Å; Q310-M313 PolarHBondContact O-N 3.09Å; Q310-M313 VanDerWaalsContact O-N 3.08Å; Q310-M314 WeakPolarHBondContact O-CB 3.49Å; Q310-M314 WeakPolarHBondContact O-CG 3.44Å; Q310-M314 PolarHBondContact O-N 2.88Å
311	L	84.3	Confident	80.3	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-60.6	-31	172.7	-75.6	171.4	0	0	0	112.3	Y266 L269 A287 V300 D301 P308 G323 Y325	Y266-L311 HydrophobicContact CD2-CB 3.8Å; Y266-L311 HydrophobicContact CE1-CD1 4.48Å; Y266-L311 HydrophobicContact CE2-CB 3.88Å; Y266-L311 HydrophobicContact CE2-CD1 4.08Å; Y266-L311 HydrophobicContact CE2-CD2 3.98Å; Y266-L311 HydrophobicContact CE2-CG 4.21Å; Y266-L311 HydrophobicContact CG-CB 4.24Å; L269-L311 HydrophobicContact CD1-CB 4.03Å; L269-L311 HydrophobicContact CD1-CD1 4.13Å; A287-L311 HydrophobicContact CB-CD1 3.98Å; V300-L311 HydrophobicContact CG1-CD2 4.21Å; D301-L311 HydrophobicContact CB-CD2 4.33Å; P308-L311 WeakPolarHBondContact O-CB 3.44Å; P308-L311 PolarHBondContact O-N 3.11Å; P308-L311 VanDerWaalsContact O-N 3.08Å; L311-G323 WeakPolarHBondContact O-CA 3.48Å; L311-Y325 HydrophobicContact CD2-CE1 4.29Å; L311-Y325 HydrophobicContact CD2-CE2 3.91Å; L311-Y325 WeakPolarHBondContact O-CE2 3.07Å
312	A	85.7	Confident	80.7	Confident	6 Å²	6	49.1 Å²	49.1	5%	0.05	24%	0.239	C	C	.	.	H	α-helix	trans	-83.7	-15.8	176.1	0	0	0	0	0	113.9	M309 Q310 R322	M309-A312 PolarHBondContact O-N 3.48Å; Q310-A312 PolarHBondContact O-N 3.26Å; A312-R322 PolarHBondContact O-NH1 2.99Å
313	M	84.5	Confident	81.6	Confident	117 Å²	117	48.4 Å²	48.4	58%	0.576	23%	0.234	S	C	*	.	H	α-helix	trans	-96.4	-43.1	179.6	-66.1	178.8	-179.1	0	0	112.1	M309 Q310	M309-M313 HydrophobicContact CE-CE 4.08Å; M309-M313 WeakPolarHBondContact O-CG 3.46Å; M309-M313 PolarHBondContact O-N 3.41Å; Q310-M313 PolarHBondContact O-N 3.09Å; Q310-M313 VanDerWaalsContact O-N 3.08Å
314	M	85.6	Confident	82.7	Confident	83 Å²	83	46.5 Å²	46.5	41%	0.409	22%	0.222	S	C	.	.			trans	-84.4	172.5	179.4	-56.1	-59.2	177.4	0	0	111.4	Y304 Q310 G323	Y304-M314 HydrophobicContact CD1-CG 4.34Å; Y304-M314 HydrophobicContact CD2-CB 3.97Å; Y304-M314 HydrophobicContact CD2-CG 4.2Å; Y304-M314 HydrophobicContact CE1-CG 3.96Å; Y304-M314 HydrophobicContact CE2-CB 3.74Å; Y304-M314 HydrophobicContact CE2-CG 3.81Å; Y304-M314 HydrophobicContact CG-CG 4.47Å; Q310-M314 WeakPolarHBondContact O-CB 3.49Å; Q310-M314 WeakPolarHBondContact O-CG 3.44Å; Q310-M314 PolarHBondContact O-N 2.88Å; M314-G323 WeakPolarHBondContact O-CA 3.27Å; M314-G323 PolarHBondContact O-N 3.14Å
315	S	88	Confident	83.7	Confident	16 Å²	16	45.5 Å²	45.5	11%	0.112	22%	0.217	C	C	.	.			trans	-159.8	148.2	-179.1	-175.2	0	0	0	0	109.2	V317 V321 R324	S315-V317 VanDerWaalsContact C-N 3.3Å; S315-V317 PolarHBondContact OG-N 3.28Å; S315-V317 VanDerWaalsContact OG-N 3.12Å; S315-V317 PolarHBondContact OG-O 2.95Å; S315-V321 WeakPolarHBondContact CB-O 3.32Å; S315-V321 PolarHBondContact OG-O 2.78Å; S315-R324 WeakPolarHBondContact CA-O 3.48Å; S315-R324 PolarHBondContact OG-N 3.12Å; S315-R324 PolarHBondContact OG-O 3.22Å; S315-R324 VanDerWaalsContact OG-O 3.05Å
316	S	89.1	Confident	84.9	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	-82.2	-11	166.8	79.2	0	0	0	0	112.7	P318 R324 G336 G337 C338	S316-P318 VanDerWaalsContact C-CD 3.44Å; S316-R324 PolarHBondContact N-O 3.41Å; S316-G336 WeakPolarHBondContact CB-O 3.4Å; S316-G336 PolarHBondContact OG-O 2.94Å; S316-G337 CarbonylContact O-C 3.46Å; S316-G337 WeakPolarHBondContact O-CA 3.39Å; S316-C338 VanDerWaalsContact CA-O 3.32Å; S316-C338 WeakPolarHBondContact CA-O 3.26Å; S316-C338 VanDerWaalsContact CB-O 3.26Å; S316-C338 WeakPolarHBondContact CB-O 3.41Å; S316-C338 PolarHBondContact O-N 3.13Å; S316-C338 PolarHBondContact O-SG 2.85Å; S316-C338 VanDerWaalsContact O-SG 3.4Å
317	V	91.1	Very high	86.2	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.006	18%	0.181	C	C	.	.			trans	-125	65.9	170.9	-73.4	0	0	0	0	111.2	G196 S315 H319 R320 V321 R324 L326	G196-V317 VanDerWaalsContact CA-CG1 3.48Å; S315-V317 VanDerWaalsContact C-N 3.3Å; S315-V317 PolarHBondContact OG-N 3.28Å; S315-V317 VanDerWaalsContact OG-N 3.12Å; S315-V317 PolarHBondContact OG-O 2.95Å; V317-H319 PolarHBondContact O-N 3.27Å; V317-H319 VanDerWaalsContact O-N 3.1Å; V317-R320 HydrophobicContact CB-CB 4.29Å; V317-R320 HydrophobicContact CG2-CB 4.25Å; V317-R320 PolarHBondContact O-N 2.87Å; V317-V321 PolarHBondContact O-N 2.6Å; V317-R324 HydrophobicContact CG2-CB 3.91Å; V317-R324 HydrophobicContact CG2-CG 3.7Å; V317-L326 HydrophobicContact CG1-CD1 3.53Å; V317-L326 HydrophobicContact CG1-CG 4.5Å; V317-L326 HydrophobicContact CG2-CD1 4.2Å
318	P	89.2	Confident	87.2	Confident	20 Å²	20	35.6 Å²	35.6	13%	0.13	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.7	-175	27.4	-35.5	0	0	0	113.6	N31 S316 A393	N31-P318 PolarHBondContact ND2-O 3.05Å; S316-P318 VanDerWaalsContact C-CD 3.44Å; P318-A393 HydrophobicContact CG-CB 4.14Å
319	H	88	Confident	88.5	Confident	24 Å²	24	34.9 Å²	34.9	11%	0.111	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-17.6	174.1	63.8	-93.2	0	0	0	113.5	V317 N392 A393	V317-H319 PolarHBondContact O-N 3.27Å; V317-H319 VanDerWaalsContact O-N 3.1Å; H319-N392 PolarHBondContact CE1-OD1 2.92Å; H319-N392 PolarHBondContact NE2-ND2 3.5Å; H319-A393 HydrophobicContact CB-CB 4.01Å
320	R	88	Confident	89.4	Confident	62 Å²	62	29.5 Å²	29.5	23%	0.234	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-68.9	174.4	-75.2	-73.8	-179	153.6	-22.3	111.1	E191 D192 D195 V317	E191-R320 IonicContact OE1-CZ 2.7Å; E191-R320 IonicContact OE1-NH1 3.39Å; E191-R320 PolarHBondContact OE1-NH1 2.84Å; E191-R320 IonicContact OE1-NH2 2.91Å; E191-R320 PolarHBondContact OE1-NH2 2.84Å; D192-R320 WeakPolarHBondContact OD1-CD 3.35Å; D192-R320 IonicContact OD1-CZ 3.75Å; D192-R320 IonicContact OD1-NE 3.44Å; D192-R320 IonicContact OD1-NH1 3.1Å; D192-R320 PolarHBondContact OD1-NH1 2.91Å; D195-R320 IonicContact OD2-CZ 2.69Å; D195-R320 VanDerWaalsContact OD2-CZ 3.29Å; D195-R320 IonicContact OD2-NE 3.33Å; D195-R320 PolarHBondContact OD2-NE 3Å; D195-R320 VanDerWaalsContact OD2-NE 3.07Å; D195-R320 IonicContact OD2-NH2 3.39Å; D195-R320 PolarHBondContact OD2-NH2 2.86Å; V317-R320 HydrophobicContact CB-CB 4.29Å; V317-R320 HydrophobicContact CG2-CB 4.25Å; V317-R320 PolarHBondContact O-N 2.87Å
321	V	90.6	Very high	89.8	Confident	35 Å²	35	26.6 Å²	26.6	21%	0.212	12%	0.123	C	C	.	.			trans	-151.8	158.3	-175.2	-66.1	0	0	0	0	112.3	N47 S315 V317 R324	N47-V321 HydrophobicContact CB-CB 4.05Å; N47-V321 HydrophobicContact CB-CG1 4.46Å; N47-V321 HydrophobicContact CB-CG2 4.47Å; S315-V321 WeakPolarHBondContact CB-O 3.32Å; S315-V321 PolarHBondContact OG-O 2.78Å; V317-V321 PolarHBondContact O-N 2.6Å; V321-R324 HydrophobicContact CG2-CB 3.63Å; V321-R324 HydrophobicContact CG2-CG 4.34Å
322	R	90.7	Very high	90	Very high	111 Å²	111	26.7 Å²	26.7	42%	0.419	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	154.4	169.2	74.7	173.2	179.2	86.7	1.2	112.1	N47 H267 A312 R324	N47-R322 WeakPolarHBondContact CB-O 3.38Å; N47-R322 PolarHBondContact ND2-O 3.45Å; H267-R322 PolarHBondContact CE1-NH2 3.27Å; H267-R322 PolarHBondContact O-NH1 3.28Å; H267-R322 PolarHBondContact O-NH2 3.08Å; A312-R322 PolarHBondContact O-NH1 2.99Å; R322-R324 VanDerWaalsContact C-N 3.27Å; R322-R324 PolarHBondContact O-N 2.72Å
323	G	89.6	Confident	90.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	5.8	172.6	0	0	0	0	0	116	N265 Y266 L311 M314	N265-G323 CarbonylContact C-O 3.49Å; N265-G323 WeakPolarHBondContact CA-O 3.21Å; Y266-G323 WeakPolarHBondContact CD2-O 3.08Å; Y266-G323 PolarHBondContact N-O 3.02Å; L311-G323 WeakPolarHBondContact O-CA 3.48Å; M314-G323 WeakPolarHBondContact O-CA 3.27Å; M314-G323 PolarHBondContact O-N 3.14Å
324	R	92.9	Very high	90.3	Very high	8 Å²	8	23.9 Å²	23.9	3%	0.03	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	132.7	-176	-180	171.1	-70.5	-176.1	-3.3	111.7	Y49 D192 I263 I264 N265 S315 S316 V317 V321 R322 L326	Y49-R324 PolarHBondContact OH-NH1 3.09Å; D192-R324 IonicContact OD1-NH1 3.21Å; D192-R324 IonicContact OD2-CZ 3.28Å; D192-R324 IonicContact OD2-NH1 2.67Å; D192-R324 PolarHBondContact OD2-NH1 3.36Å; I263-R324 HydrophobicContact CG2-CG 4.04Å; I264-R324 CarbonylContact O-C 3.55Å; I264-R324 WeakPolarHBondContact O-CA 3.35Å; N265-R324 WeakPolarHBondContact OD1-CG 3.35Å; N265-R324 PolarHBondContact OD1-NE 3.29Å; S315-R324 WeakPolarHBondContact CA-O 3.48Å; S315-R324 PolarHBondContact OG-N 3.12Å; S315-R324 PolarHBondContact OG-O 3.22Å; S315-R324 VanDerWaalsContact OG-O 3.05Å; S316-R324 PolarHBondContact N-O 3.41Å; V317-R324 HydrophobicContact CG2-CB 3.91Å; V317-R324 HydrophobicContact CG2-CG 3.7Å; V321-R324 HydrophobicContact CG2-CB 3.63Å; V321-R324 HydrophobicContact CG2-CG 4.34Å; R322-R324 VanDerWaalsContact C-N 3.27Å; R322-R324 PolarHBondContact O-N 2.72Å; R324-L326 HydrophobicContact CG-CD2 4.05Å; R324-L326 HydrophobicContact CG-CG 4.42Å
325	Y	93.4	Very high	90.3	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.008	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	144.7	174.3	-63	-95.1	0	0	0	109	I263 I264 Y266 V300 D301 L311	I263-Y325 WeakPolarHBondContact CA-O 3.35Å; I264-Y325 PolarHBondContact N-O 3.04Å; I264-Y325 PolarHBondContact O-N 3.2Å; Y266-Y325 AromaticContact CD2-CD2 3.81Å; Y266-Y325 HydrophobicContact CD2-CD2 3.81Å; Y266-Y325 AromaticContact CD2-CE2 3.8Å; Y266-Y325 HydrophobicContact CD2-CE2 3.8Å; Y266-Y325 AromaticContact CE2-CD2 3.66Å; Y266-Y325 HydrophobicContact CE2-CD2 3.66Å; Y266-Y325 AromaticContact CE2-CE2 3.88Å; Y266-Y325 HydrophobicContact CE2-CE2 3.88Å; V300-Y325 HydrophobicContact CG1-CD1 3.91Å; V300-Y325 HydrophobicContact CG1-CD2 4.06Å; V300-Y325 HydrophobicContact CG1-CG 3.64Å; D301-Y325 HydrophobicContact CB-CE1 4.15Å; L311-Y325 HydrophobicContact CD2-CE1 4.29Å; L311-Y325 HydrophobicContact CD2-CE2 3.91Å; L311-Y325 WeakPolarHBondContact O-CE2 3.07Å
326	L	93.9	Very high	90.3	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	142.6	-171.1	-59	177.4	0	0	0	109.7	L193 I197 A262 I263 V317 R324 G336	L193-L326 HydrophobicContact CD2-CD2 4.38Å; I197-L326 HydrophobicContact CD1-CB 3.92Å; I197-L326 HydrophobicContact CG1-CB 4.02Å; I197-L326 HydrophobicContact CG1-CD1 4.08Å; A262-L326 CarbonylContact O-C 3.43Å; I263-L326 HydrophobicContact CB-CD2 4.07Å; I263-L326 HydrophobicContact CD1-CD2 4.24Å; I263-L326 HydrophobicContact CG1-CD2 3.65Å; I263-L326 HydrophobicContact CG2-CD2 3.73Å; V317-L326 HydrophobicContact CG1-CD1 3.53Å; V317-L326 HydrophobicContact CG1-CG 4.5Å; V317-L326 HydrophobicContact CG2-CD1 4.2Å; R324-L326 HydrophobicContact CG-CD2 4.05Å; R324-L326 HydrophobicContact CG-CG 4.42Å; L326-G336 WeakPolarHBondContact O-CA 3.31Å; L326-G336 PolarHBondContact O-N 2.76Å
327	F	93.9	Very high	90.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	141.4	179.7	-57	-87.5	0	0	0	110.7	Y261 A262 I264 L289 V300 V329 V333 R334 K335	Y261-F327 CarbonylContact C-O 3.53Å; Y261-F327 WeakPolarHBondContact CA-O 3.25Å; A262-F327 HydrophobicContact CB-CB 4.43Å; A262-F327 PolarHBondContact N-O 3.21Å; A262-F327 PolarHBondContact O-N 2.72Å; I264-F327 HydrophobicContact CD1-CE2 4.19Å; L289-F327 HydrophobicContact CD1-CD1 4.18Å; L289-F327 HydrophobicContact CD1-CD2 4.23Å; L289-F327 HydrophobicContact CD1-CE1 4.11Å; L289-F327 HydrophobicContact CD1-CE2 4.16Å; L289-F327 HydrophobicContact CD1-CG 4.27Å; L289-F327 HydrophobicContact CD1-CZ 4.12Å; L289-F327 HydrophobicContact CD2-CB 4.28Å; L289-F327 HydrophobicContact CD2-CD2 4.39Å; L289-F327 HydrophobicContact CD2-CG 4.15Å; V300-F327 HydrophobicContact CB-CZ 4.23Å; V300-F327 HydrophobicContact CG1-CE2 4.19Å; V300-F327 HydrophobicContact CG1-CZ 3.96Å; V300-F327 HydrophobicContact CG2-CE2 4.5Å; V300-F327 HydrophobicContact CG2-CZ 4.36Å; F327-V329 HydrophobicContact CB-CG1 3.71Å; F327-V333 HydrophobicContact CB-CG1 4.36Å; F327-V333 HydrophobicContact CD1-CG1 3.77Å; F327-V333 HydrophobicContact CG-CG1 4.38Å; F327-R334 WeakPolarHBondContact CA-O 3.17Å; F327-K335 HydrophobicContact CD1-CB 4.28Å; F327-K335 HydrophobicContact CD1-CG 4.49Å; F327-K335 HydrophobicContact CE1-CB 4.12Å; F327-K335 HydrophobicContact CE1-CD 4.37Å; F327-K335 HydrophobicContact CE1-CG 3.99Å
328	R	93.4	Very high	89.9	Confident	66 Å²	66	20.5 Å²	20.5	25%	0.249	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.8	156.8	173.5	172.1	169.3	170.2	2.5	107.5	Y261 D330 V333 R334	Y261-R328 HydrophobicContact CD1-CB 3.86Å; Y261-R328 HydrophobicContact CD1-CG 4.48Å; Y261-R328 HydrophobicContact CE1-CB 3.65Å; Y261-R328 HydrophobicContact CE1-CG 4.09Å; R328-D330 WeakPolarHBondContact CG-OD1 3.23Å; R328-D330 IonicContact CZ-OD1 2.86Å; R328-D330 IonicContact CZ-OD2 3.53Å; R328-D330 IonicContact NE-OD1 3.35Å; R328-D330 PolarHBondContact NE-OD1 3.03Å; R328-D330 IonicContact NE-OD2 2.96Å; R328-D330 PolarHBondContact NE-OD2 3.29Å; R328-D330 IonicContact NH2-OD1 3.35Å; R328-D330 IonicContact NH2-OD2 2.7Å; R328-D330 PolarHBondContact NH2-OD2 2.99Å; R328-V333 WeakPolarHBondContact O-CA 3.49Å; R328-R334 HydrophobicContact CB-CB 4.44Å; R328-R334 PolarHBondContact N-O 3.44Å; R328-R334 PolarHBondContact O-N 3.06Å
329	V	93.9	Very high	89.3	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.085	C	C	.	.			trans	-131.2	3.1	-165.2	-53.9	0	0	0	0	115.2	Y79 Y80 L251 S260 A262 L289 F327 D331 V333	Y79-V329 CarbonylContact C-O 3.58Å; Y79-V329 WeakPolarHBondContact CA-O 3.45Å; Y79-V329 HydrophobicContact CD2-CB 3.86Å; Y79-V329 HydrophobicContact CD2-CG2 3.89Å; Y79-V329 HydrophobicContact CE2-CB 4.13Å; Y79-V329 HydrophobicContact CE2-CG2 4.49Å; Y80-V329 PolarHBondContact N-O 3.27Å; L251-V329 HydrophobicContact CD1-CG2 4.03Å; S260-V329 PolarHBondContact O-N 2.93Å; A262-V329 HydrophobicContact CB-CG1 3.84Å; L289-V329 HydrophobicContact CD2-CG1 3.76Å; F327-V329 HydrophobicContact CB-CG1 3.71Å; V329-D331 PolarHBondContact O-N 2.92Å; V329-V333 HydrophobicContact CB-CG2 4.23Å; V329-V333 HydrophobicContact CG1-CG2 4.12Å
330	D	91.5	Very high	88.3	Confident	3 Å²	3	23.1 Å²	23.1	2%	0.016	10%	0.102	C	C	.	.	S	Bend	trans	-62.3	-42.3	-170	60	-44.8	0	0	0	115.4	P78 G81 R328	P78-D330 HydrophobicContact CB-CB 4Å; G81-D330 WeakPolarHBondContact CA-O 3.4Å; G81-D330 PolarHBondContact N-O 3.08Å; R328-D330 WeakPolarHBondContact CG-OD1 3.23Å; R328-D330 IonicContact CZ-OD1 2.86Å; R328-D330 IonicContact CZ-OD2 3.53Å; R328-D330 IonicContact NE-OD1 3.35Å; R328-D330 PolarHBondContact NE-OD1 3.03Å; R328-D330 IonicContact NE-OD2 2.96Å; R328-D330 PolarHBondContact NE-OD2 3.29Å; R328-D330 IonicContact NH2-OD1 3.35Å; R328-D330 IonicContact NH2-OD2 2.7Å; R328-D330 PolarHBondContact NH2-OD2 2.99Å
331	D	89.3	Confident	87	Confident	3 Å²	3	24.9 Å²	24.9	2%	0.016	12%	0.116	C	C	.	.	S	Bend	trans	-129.3	-58.2	178.8	-167.5	16.7	0	0	0	112.3	Y80 G81 V329 R866 R870 Y874 Y886	Y80-D331 CarbonylContact C-O 3.58Å; Y80-D331 VanDerWaalsContact C-O 3.23Å; Y80-D331 VanDerWaalsContact CA-O 3.31Å; Y80-D331 WeakPolarHBondContact CA-O 3.19Å; G81-D331 WeakPolarHBondContact CA-OD1 3.45Å; V329-D331 PolarHBondContact O-N 2.92Å; D331-R866 VanDerWaalsContact CG-NH1 3.31Å; D331-R866 IonicContact OD1-CZ 3.32Å; D331-R866 IonicContact OD1-NH1 2.86Å; D331-R866 PolarHBondContact OD1-NH1 2.85Å; D331-R866 IonicContact OD1-NH2 2.66Å; D331-R866 IonicContact OD2-CZ 2.9Å; D331-R866 IonicContact OD2-NH1 2.83Å; D331-R866 PolarHBondContact OD2-NH1 2.79Å; D331-R866 VanDerWaalsContact OD2-NH1 3.15Å; D331-R866 IonicContact OD2-NH2 3.12Å; D331-R866 PolarHBondContact OD2-NH2 2.95Å; D331-R870 PolarHBondContact O-NH2 2.91Å; D331-R870 IonicContact OD1-CZ 3.19Å; D331-R870 IonicContact OD1-NH2 3.68Å; D331-R870 PolarHBondContact OD1-NH2 2.99Å; D331-Y874 WeakPolarHBondContact OD2-CE2 3.44Å; D331-Y886 WeakPolarHBondContact OD2-CE1 3.3Å; D331-Y886 PolarHBondContact OD2-OH 3.41Å
332	I	88	Confident	85.2	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.015	11%	0.11	C	C	.	.	S	Bend	trans	-119.7	141.4	167.3	57.1	168.2	0	0	0	109	R334 L884 E1037 L1040	I332-R334 HydrophobicContact CG1-CG 4.31Å; I332-R334 PolarHBondContact O-N 3.04Å; I332-R334 VanDerWaalsContact O-N 3.16Å; I332-L884 HydrophobicContact CD1-CD2 4.38Å; I332-L884 HydrophobicContact CG2-CD2 3.93Å; I332-E1037 HydrophobicContact CD1-CG 4.04Å; I332-E1037 WeakPolarHBondContact CD1-OE1 3.23Å; I332-L1040 HydrophobicContact CG2-CD1 4.24Å
333	V	89.3	Confident	83.2	Confident	2 Å²	2	22 Å²	22	1%	0.012	11%	0.111	C	C	.	.			trans	-71.1	112	178.7	170.9	0	0	0	0	109.8	Y80 L289 V298 F327 R328 V329 P1036	Y80-V333 HydrophobicContact CD2-CG2 3.76Å; Y80-V333 HydrophobicContact CE2-CB 4.2Å; Y80-V333 HydrophobicContact CE2-CG2 3.18Å; L289-V333 HydrophobicContact CB-CG2 4.19Å; L289-V333 HydrophobicContact CD2-CG1 4.1Å; L289-V333 HydrophobicContact CD2-CG2 4.1Å; V298-V333 HydrophobicContact CB-CB 4.27Å; V298-V333 HydrophobicContact CB-CG1 3.94Å; V298-V333 HydrophobicContact CG1-CG1 3.86Å; V298-V333 HydrophobicContact CG2-CB 4.06Å; V298-V333 HydrophobicContact CG2-CG1 4.18Å; F327-V333 HydrophobicContact CB-CG1 4.36Å; F327-V333 HydrophobicContact CD1-CG1 3.77Å; F327-V333 HydrophobicContact CG-CG1 4.38Å; R328-V333 WeakPolarHBondContact O-CA 3.49Å; V329-V333 HydrophobicContact CB-CG2 4.23Å; V329-V333 HydrophobicContact CG1-CG2 4.12Å; V333-P1036 WeakPolarHBondContact O-CG 3.46Å
334	R	86.6	Confident	81.2	Confident	63 Å²	63	22.9 Å²	22.9	24%	0.238	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123	173.1	-64.6	-177.8	176.9	103.4	-13.3	109.1	F327 R328 I332 Y886	F327-R334 WeakPolarHBondContact CA-O 3.17Å; R328-R334 HydrophobicContact CB-CB 4.44Å; R328-R334 PolarHBondContact N-O 3.44Å; R328-R334 PolarHBondContact O-N 3.06Å; I332-R334 HydrophobicContact CG1-CG 4.31Å; I332-R334 PolarHBondContact O-N 3.04Å; I332-R334 VanDerWaalsContact O-N 3.16Å; R334-Y886 VanDerWaalsContact NH2-CE2 3.27Å
335	K	85.9	Confident	79.2	Confident	20 Å²	20	24 Å²	24	9%	0.087	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	127.9	178.8	-178.4	165.6	176.9	159.3	0	111.3	V300 D301 F327 N349	V300-K335 PolarHBondContact O-NZ 3.4Å; D301-K335 IonicContact OD2-NZ 3.23Å; D301-K335 PolarHBondContact OD2-NZ 3.08Å; F327-K335 HydrophobicContact CD1-CB 4.28Å; F327-K335 HydrophobicContact CD1-CG 4.49Å; F327-K335 HydrophobicContact CE1-CB 4.12Å; F327-K335 HydrophobicContact CE1-CD 4.37Å; F327-K335 HydrophobicContact CE1-CG 3.99Å; K335-N349 PolarHBondContact O-ND2 2.85Å
336	G	87.7	Confident	77.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	161.7	173.6	0	0	0	0	0	112.5	S316 L326	S316-G336 WeakPolarHBondContact CB-O 3.4Å; S316-G336 PolarHBondContact OG-O 2.94Å; L326-G336 WeakPolarHBondContact O-CA 3.31Å; L326-G336 PolarHBondContact O-N 2.76Å
337	G	87.6	Confident	76.5	Confident	5 Å²	5	28.6 Å²	28.6	5%	0.052	15%	0.146	C	C	.	.	S	Bend	trans	72.6	-159.7	-167.4	0	0	0	0	0	112.3	G196 S316 N366	G196-G337 VanDerWaalsContact O-CA 3.27Å; G196-G337 WeakPolarHBondContact O-CA 3.5Å; G196-G337 PolarHBondContact O-N 3.47Å; S316-G337 CarbonylContact O-C 3.46Å; S316-G337 WeakPolarHBondContact O-CA 3.39Å; G337-N366 VanDerWaalsContact C-ND2 3.25Å; G337-N366 WeakPolarHBondContact CA-ND2 3.49Å; G337-N366 PolarHBondContact N-ND2 3.29Å; G337-N366 PolarHBondContact O-ND2 3.49Å
338	C	84.9	Confident	75.7	Confident	4 Å²	4	29.2 Å²	29.2	3%	0.027	15%	0.149	C	C	.	.			trans	-118.4	168.3	-177.4	62.1	0	0	0	0	113.2	S316 G367 C369 A393 A394	S316-C338 VanDerWaalsContact CA-O 3.32Å; S316-C338 WeakPolarHBondContact CA-O 3.26Å; S316-C338 VanDerWaalsContact CB-O 3.26Å; S316-C338 WeakPolarHBondContact CB-O 3.41Å; S316-C338 PolarHBondContact O-N 3.13Å; S316-C338 PolarHBondContact O-SG 2.85Å; S316-C338 VanDerWaalsContact O-SG 3.4Å; C338-G367 CarbonylContact C-O 3.55Å; C338-G367 WeakPolarHBondContact CA-O 3.32Å; C338-G367 WeakPolarHBondContact CB-O 3.45Å; C338-C369 HydrophobicContact CB-CB 3.84Å; C338-C369 WeakPolarHBondContact CB-SG 3.31Å; C338-C369 WeakPolarHBondContact SG-CA 3.34Å; C338-C369 WeakPolarHBondContact SG-CB 3.42Å; C338-C369 CovalentContact SG-SG 2.04Å; C338-C369 PolarHBondContact SG-SG 3.34Å; C338-A393 PolarHBondContact SG-O 3.45Å; C338-A394 HydrophobicContact CB-CB 3.99Å
339	S	76.9	Confident	75.2	Confident	7 Å²	7	27.6 Å²	27.6	5%	0.049	15%	0.145	C	C	.	.			trans	-153.8	140.3	164	-172.4	0	0	0	0	111.2	D301 L341 G367	D301-S339 PolarHBondContact OD2-OG 2.92Å; D301-S339 VanDerWaalsContact OD2-OG 3.09Å; S339-L341 VanDerWaalsContact C-N 3.31Å; S339-L341 PolarHBondContact O-N 2.95Å; S339-G367 PolarHBondContact N-O 3.13Å
340	N	66.4	Low	74.9	Confident	91 Å²	91	28.5 Å²	28.5	49%	0.487	15%	0.149	S	C	.	.	S	Bend	trans	-83	-4.5	-173.9	-75.3	-14.3	0	0	0	114.6	C369	N340-C369 WeakPolarHBondContact OD1-CA 3.47Å; N340-C369 WeakPolarHBondContact OD1-CB 3.46Å; N340-C369 PolarHBondContact OD1-N 2.84Å
341	L	61	Low	74.7	Confident	99 Å²	99	31.8 Å²	31.8	52%	0.518	16%	0.162	S	C	.	.	S	Bend	trans	-128.7	3.9	-172	-62.5	172.1	0	0	0	113.4	V303 Y304 S339 V343	V303-L341 HydrophobicContact CB-CD1 4.42Å; V303-L341 HydrophobicContact CG1-CD1 4.02Å; V303-L341 HydrophobicContact CG2-CB 3.79Å; V303-L341 HydrophobicContact CG2-CD1 4.15Å; Y304-L341 HydrophobicContact CE1-CD1 4.39Å; S339-L341 VanDerWaalsContact C-N 3.31Å; S339-L341 PolarHBondContact O-N 2.95Å; L341-V343 PolarHBondContact O-N 2.86Å; L341-V343 VanDerWaalsContact O-N 3.16Å
342	T	52.5	Low	74.4	Confident	14 Å²	14	32.6 Å²	32.6	9%	0.086	17%	0.168	C	C	.	.			trans	-88	39.8	180	55.2	0	0	0	0	113	P302 G344 T345 Y346	P302-T342 HydrophobicContact CG-CG2 3.74Å; T342-G344 PolarHBondContact O-N 2.73Å; T342-T345 VanDerWaalsContact CA-OG1 3.31Å; T342-T345 WeakPolarHBondContact CA-OG1 3.14Å; T342-Y346 HydrophobicContact CG2-CD2 4.13Å
343	V	48.5	Very low	74.2	Confident	72 Å²	72	36.1 Å²	36.1	44%	0.436	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	119.2	174.5	177.8	0	0	0	0	108.3	L341 T345 I425	L341-V343 PolarHBondContact O-N 2.86Å; L341-V343 VanDerWaalsContact O-N 3.16Å; V343-T345 PolarHBondContact O-N 3.04Å; V343-I425 HydrophobicContact CG1-CD1 4.2Å; V343-I425 HydrophobicContact CG1-CG2 3.8Å; V343-I425 HydrophobicContact CG2-CD1 3.85Å; V343-I425 HydrophobicContact CG2-CG2 4.43Å
344	G	48	Very low	74.1	Confident	19 Å²	19	36.2 Å²	36.2	20%	0.196	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	-39.4	179.6	0	0	0	0	0	116.2	T342 Y346 M1329	T342-G344 PolarHBondContact O-N 2.73Å; G344-Y346 VanDerWaalsContact C-N 3.33Å; G344-Y346 PolarHBondContact O-N 3.33Å; G344-M1329 WeakPolarHBondContact CA-SD 3.4Å
345	T	51.7	Low	74.2	Confident	32 Å²	32	33.5 Å²	33.5	20%	0.196	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-32.5	-174.1	43.2	0	0	0	0	114.6	T342 V343	T342-T345 VanDerWaalsContact CA-OG1 3.31Å; T342-T345 WeakPolarHBondContact CA-OG1 3.14Å; V343-T345 PolarHBondContact O-N 3.04Å
346	Y	60.5	Low	74.2	Confident	38 Å²	38	32.8 Å²	32.8	15%	0.149	18%	0.175	C	C	.	.	S	Bend	trans	-132	136	174.7	-67.7	-84.7	0	0	0	110.8	V298 P302 T342 G344	V298-Y346 HydrophobicContact CG1-CE1 3.9Å; P302-Y346 HydrophobicContact CB-CE2 4.12Å; P302-Y346 HydrophobicContact CG-CD2 4.24Å; P302-Y346 HydrophobicContact CG-CE2 3.74Å; T342-Y346 HydrophobicContact CG2-CD2 4.13Å; G344-Y346 VanDerWaalsContact C-N 3.33Å; G344-Y346 PolarHBondContact O-N 3.33Å
347	R	69.2	Low	74.1	Confident	60 Å²	60	33.1 Å²	33.1	23%	0.226	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-62.4	148.9	172	-71.6	159.9	151.3	-90	3	110.4	E883 W1035	R347-E883 IonicContact CZ-OE2 3.24Å; R347-E883 IonicContact NH1-OE1 3.31Å; R347-E883 PolarHBondContact NH1-OE1 3.17Å; R347-E883 IonicContact NH1-OE2 2.87Å; R347-E883 PolarHBondContact NH1-OE2 2.75Å; R347-E883 IonicContact NH2-OE2 3.51Å; R347-E883 PolarHBondContact NH2-OE2 2.85Å; R347-W1035 HydrophobicContact CG-CD2 4.45Å; R347-W1035 HydrophobicContact CG-CZ2 4.33Å; R347-W1035 VanDerWaalsContact NE-CE3 3.33Å
348	L	77.7	Confident	74	Confident	12 Å²	12	32.9 Å²	32.9	6%	0.063	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-65.8	151.6	167.3	-55.4	-177.3	0	0	0	110.1	V365 N366 G367 F413 Y427 V429	L348-V365 HydrophobicContact CB-CG1 4.42Å; L348-V365 HydrophobicContact CD1-CG1 3.85Å; L348-N366 WeakPolarHBondContact CB-O 3.33Å; L348-N366 VanDerWaalsContact CD2-O 3.3Å; L348-N366 WeakPolarHBondContact CD2-O 3.26Å; L348-G367 VanDerWaalsContact CD2-CA 3.41Å; L348-F413 HydrophobicContact CD1-CB 3.47Å; L348-F413 VanDerWaalsContact CD1-CB 3.47Å; L348-F413 HydrophobicContact CD1-CD1 3.97Å; L348-F413 HydrophobicContact CD1-CG 3.96Å; L348-Y427 HydrophobicContact CD1-CG 4.2Å; L348-Y427 HydrophobicContact CD2-CD1 3.91Å; L348-Y427 HydrophobicContact CD2-CG 3.99Å; L348-Y427 HydrophobicContact CG-CD1 4.47Å; L348-Y427 HydrophobicContact CG-CG 4.29Å; L348-V429 HydrophobicContact CB-CG1 4.1Å; L348-V429 HydrophobicContact CB-CG2 3.67Å; L348-V429 HydrophobicContact CD1-CG2 3.42Å; L348-V429 VanDerWaalsContact CD1-CG2 3.42Å; L348-V429 HydrophobicContact CG-CG2 3.9Å; L348-V429 WeakPolarHBondContact O-CG1 3.28Å
349	N	83.2	Confident	73.9	Confident	32 Å²	32	32.7 Å²	32.7	17%	0.171	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	134.7	162.5	-64.5	-64	0	0	0	108.8	V198 K335 V365 N366	V198-N349 HydrophobicContact CG1-CB 4.47Å; K335-N349 PolarHBondContact O-ND2 2.85Å; N349-V365 WeakPolarHBondContact O-CA 3.4Å; N349-N366 HydrophobicContact CB-CB 4.31Å; N349-N366 PolarHBondContact N-O 3.48Å; N349-N366 PolarHBondContact O-N 3.23Å
350	I	86.7	Confident	74.1	Confident	19 Å²	19	33 Å²	33	10%	0.097	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	139.4	175.5	-170.9	157	0	0	0	109	V198 D353 V363 Q364 V365 L378 V429 I431	V198-I350 VanDerWaalsContact CG1-C 3.47Å; I350-D353 HydrophobicContact CG2-CB 4.45Å; I350-V363 HydrophobicContact CD1-CB 4.22Å; I350-V363 HydrophobicContact CD1-CG2 3.99Å; I350-V363 HydrophobicContact CG1-CB 4.08Å; I350-V363 HydrophobicContact CG1-CG2 4.37Å; I350-Q364 WeakPolarHBondContact CA-O 3.16Å; I350-V365 HydrophobicContact CD1-CG2 4.02Å; I350-V365 HydrophobicContact CG1-CG2 4.12Å; I350-L378 HydrophobicContact CD1-CD2 4.07Å; I350-V429 HydrophobicContact CB-CG1 4.19Å; I350-V429 HydrophobicContact CG2-CB 4.47Å; I350-V429 HydrophobicContact CG2-CG1 3.69Å; I350-I431 HydrophobicContact CD1-CG2 3.63Å; I350-I431 HydrophobicContact CG1-CG2 4.35Å; I350-I431 HydrophobicContact CG2-CG2 4.2Å
351	Y	86.5	Confident	74.9	Confident	73 Å²	73	29.9 Å²	29.9	29%	0.286	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	136.6	175.7	-174.5	-87.4	0	0	0	111.6	Q364	Y351-Q364 PolarHBondContact N-O 3.38Å; Y351-Q364 PolarHBondContact O-N 2.83Å
352	P	84.6	Confident	75.9	Confident	20 Å²	20	26.4 Å²	26.4	13%	0.13	14%	0.141	C	C	.	.	S	Bend	cis	-63	144.8	-11.5	29.9	-36.2	0	0	0	110.6	I354 T361 T362 V363 Y441	P352-I354 VanDerWaalsContact C-N 3.31Å; P352-I354 WeakPolarHBondContact CB-O 3.46Å; P352-T361 HydrophobicContact CG-CG2 4.12Å; P352-T362 WeakPolarHBondContact CD-O 3.02Å; P352-V363 HydrophobicContact CG-CG1 4.34Å; P352-V363 WeakPolarHBondContact O-CG1 3.34Å; P352-Y441 HydrophobicContact CB-CD2 4.28Å; P352-Y441 HydrophobicContact CB-CE2 3.81Å
353	D	83.9	Confident	77.6	Confident	77 Å²	77	25.7 Å²	25.7	41%	0.412	14%	0.137	S	C	.	.	S	Bend	trans	-76.6	-23.9	173.4	59.6	-28.8	0	0	0	111.6	I350 I431 W432	I350-D353 HydrophobicContact CG2-CB 4.45Å; D353-I431 CarbonylContact O-C 3.6Å; D353-I431 WeakPolarHBondContact O-CA 3.34Å; D353-I431 WeakPolarHBondContact O-CB 3.46Å; D353-W432 PolarHBondContact O-N 2.91Å
354	I	86.4	Confident	79.5	Confident	3 Å²	3	23.3 Å²	23.3	2%	0.015	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	130.3	170.8	-59	163.4	0	0	0	109.1	P352 W432 V434 P440 Y441 T889 I890	P352-I354 VanDerWaalsContact C-N 3.31Å; P352-I354 WeakPolarHBondContact CB-O 3.46Å; I354-W432 WeakPolarHBondContact CA-O 3.34Å; I354-W432 HydrophobicContact CG1-CE3 4.19Å; I354-V434 HydrophobicContact CG2-CB 4.41Å; I354-V434 HydrophobicContact CG2-CG1 3.94Å; I354-V434 HydrophobicContact CG2-CG2 3.53Å; I354-P440 HydrophobicContact CD1-CG 4.28Å; I354-P440 HydrophobicContact CG2-CG 4.36Å; I354-Y441 HydrophobicContact CB-CD2 4.44Å; I354-Y441 HydrophobicContact CB-CE2 4Å; I354-Y441 HydrophobicContact CD1-CE2 4.4Å; I354-Y441 HydrophobicContact CG2-CE2 4.5Å; I354-T889 VanDerWaalsContact CD1-OG1 3.27Å; I354-T889 WeakPolarHBondContact CD1-OG1 3.42Å; I354-I890 HydrophobicContact CD1-CD1 3.86Å; I354-I890 HydrophobicContact CD1-CG1 4.16Å; I354-I890 HydrophobicContact CG1-CD1 4.39Å; I354-I890 HydrophobicContact CG2-CD1 4Å
355	V	87.9	Confident	81.4	Confident	6 Å²	6	22.4 Å²	22.4	4%	0.036	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	144.2	179.5	-56.8	0	0	0	0	111.6	V363 M400 I431 W432 A433 V434	V355-V363 HydrophobicContact CG1-CG1 3.52Å; V355-M400 HydrophobicContact CG1-CE 4.38Å; V355-M400 HydrophobicContact CG1-CG 4.23Å; V355-M400 HydrophobicContact CG2-CE 4.15Å; V355-I431 HydrophobicContact CG2-CD1 3.9Å; V355-W432 PolarHBondContact N-O 3.23Å; V355-A433 HydrophobicContact CG2-CB 4.32Å; V355-A433 WeakPolarHBondContact O-CA 3.26Å; V355-V434 VanDerWaalsContact O-CG2 3.31Å; V355-V434 WeakPolarHBondContact O-CG2 3.34Å; V355-V434 PolarHBondContact O-N 3.21Å
356	N	87.3	Confident	83	Confident	6 Å²	6	21 Å²	21	3%	0.032	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	132.3	176.2	-163.7	-55.4	0	0	0	110.3	M358 G359 T361 S436 D439	N356-M358 PolarHBondContact O-N 3.09Å; N356-M358 WeakPolarHBondContact OD1-CB 3.43Å; N356-M358 PolarHBondContact OD1-N 2.88Å; N356-G359 PolarHBondContact O-N 3.48Å; N356-T361 PolarHBondContact N-OG1 3.01Å; N356-S436 WeakPolarHBondContact ND2-CB 3.1Å; N356-S436 PolarHBondContact ND2-OG 3.3Å; N356-S436 PolarHBondContact OD1-OG 2.9Å; N356-D439 WeakPolarHBondContact CB-OD2 3.24Å; N356-D439 PolarHBondContact ND2-OD2 3.25Å
357	S	85.9	Confident	84	Confident	6 Å²	6	19.8 Å²	19.8	4%	0.042	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-18.7	-179.5	71.8	0	0	0	0	113.3	G359 Y403 V434	S357-G359 PolarHBondContact O-N 3.45Å; S357-Y403 WeakPolarHBondContact CA-O 3.4Å; S357-Y403 VanDerWaalsContact CB-O 3.29Å; S357-Y403 WeakPolarHBondContact CB-O 3.3Å; S357-Y403 CarbonylContact O-C 3.58Å; S357-Y403 PolarHBondContact O-N 3.34Å; S357-V434 PolarHBondContact N-O 2.7Å; S357-V434 PolarHBondContact OG-O 3.01Å
358	M	84.3	Confident	84.5	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-2.5	168.2	-67.1	-151.7	-80.4	0	0	114.2	N356 R402 S436 L502 F550 W566 M720	N356-M358 PolarHBondContact O-N 3.09Å; N356-M358 WeakPolarHBondContact OD1-CB 3.43Å; N356-M358 PolarHBondContact OD1-N 2.88Å; M358-R402 WeakPolarHBondContact O-CD 3.4Å; M358-R402 WeakPolarHBondContact O-CG 3.47Å; M358-R402 PolarHBondContact O-NE 3.36Å; M358-R402 VanDerWaalsContact O-NE 3.12Å; M358-S436 WeakPolarHBondContact CE-OG 3.27Å; M358-L502 HydrophobicContact SD-CD1 4.45Å; M358-L502 HydrophobicContact SD-CD2 3.56Å; M358-L502 VanDerWaalsContact SD-CD2 3.56Å; M358-F550 HydrophobicContact CE-CB 4.02Å; M358-F550 HydrophobicContact CE-CD1 3.49Å; M358-F550 VanDerWaalsContact CE-CD1 3.49Å; M358-F550 HydrophobicContact CE-CD2 4.04Å; M358-F550 HydrophobicContact CE-CE1 3.88Å; M358-F550 HydrophobicContact CE-CE2 4.39Å; M358-F550 HydrophobicContact CE-CG 3.57Å; M358-F550 HydrophobicContact CE-CZ 4.32Å; M358-F550 HydrophobicContact SD-CD2 4.15Å; M358-F550 HydrophobicContact SD-CE2 4.25Å; M358-F550 HydrophobicContact SD-CG 4.29Å; M358-F550 HydrophobicContact SD-CZ 4.49Å; M358-W566 HydrophobicContact CB-CD2 4.25Å; M358-W566 HydrophobicContact CB-CG 4.4Å; M358-W566 HydrophobicContact CB-CZ2 4.19Å; M358-W566 HydrophobicContact CE-CB 3.71Å; M358-W566 HydrophobicContact CE-CD2 3.46Å; M358-W566 VanDerWaalsContact CE-CD2 3.46Å; M358-W566 HydrophobicContact CE-CE3 3.41Å; M358-W566 VanDerWaalsContact CE-CE3 3.41Å; M358-W566 HydrophobicContact CE-CG 3.63Å; M358-W566 HydrophobicContact CE-CZ3 4.1Å; M358-W566 HydrophobicContact SD-CD2 4.21Å; M358-W566 HydrophobicContact SD-CE3 4.1Å; M358-W566 HydrophobicContact SD-CH2 4.47Å; M358-W566 HydrophobicContact SD-CZ3 4.22Å; M358-M720 HydrophobicContact CG-CE 3.42Å; M358-M720 VanDerWaalsContact CG-CE 3.42Å; M358-M720 HydrophobicContact SD-CE 3.34Å; M358-M720 WeakPolarHBondContact SD-CE 3.44Å
359	G	83.7	Confident	84.8	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.093	C	C	.	.			trans	65.9	-155.1	-178	0	0	0	0	0	112.5	N356 S357 T361 W566	N356-G359 PolarHBondContact O-N 3.48Å; S357-G359 PolarHBondContact O-N 3.45Å; G359-T361 PolarHBondContact O-N 2.94Å; G359-W566 PolarHBondContact O-NE1 2.95Å; G359-W566 VanDerWaalsContact O-NE1 3.1Å
360	D	81.3	Confident	85	Confident	13 Å²	13	15.6 Å²	15.6	7%	0.07	9%	0.085	C	C	.	.			trans	65.7	-11.1	-172	-75.4	-70.9	0	0	0	115.3	K399 M400 R402 K552 A564	D360-K399 WeakPolarHBondContact OD1-CE 3.24Å; D360-K399 IonicContact OD1-NZ 3.2Å; D360-K399 PolarHBondContact OD1-NZ 2.89Å; D360-M400 PolarHBondContact N-O 2.84Å; D360-R402 IonicContact OD2-CZ 2.72Å; D360-R402 IonicContact OD2-NE 2.65Å; D360-R402 IonicContact OD2-NH2 3.07Å; D360-R402 PolarHBondContact OD2-NH2 2.98Å; D360-K552 IonicContact OD1-NZ 3.04Å; D360-K552 PolarHBondContact OD1-NZ 3.49Å; D360-K552 VanDerWaalsContact OD1-NZ 3.11Å; D360-K552 IonicContact OD2-NZ 3.72Å; D360-K552 PolarHBondContact OD2-NZ 3.06Å; D360-A564 HydrophobicContact CB-CB 4.04Å
361	T	81.7	Confident	84.9	Confident	27 Å²	27	16 Å²	16	17%	0.166	9%	0.09	C	C	.	.			trans	-63.3	138.5	166.7	-43.9	0	0	0	0	111.3	P352 N356 G359 M400	P352-T361 HydrophobicContact CG-CG2 4.12Å; N356-T361 PolarHBondContact N-OG1 3.01Å; G359-T361 PolarHBondContact O-N 2.94Å; T361-M400 VanDerWaalsContact O-CB 3.28Å; T361-M400 WeakPolarHBondContact O-CB 3.27Å; T361-M400 WeakPolarHBondContact O-CG 3.45Å; T361-M400 PolarHBondContact O-N 3.08Å
362	T	83.2	Confident	84.9	Confident	25 Å²	25	18.6 Å²	18.6	15%	0.153	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	135	168.1	39.3	0	0	0	0	110.6	P352 C398 K399 N563	P352-T362 WeakPolarHBondContact CD-O 3.02Å; T362-C398 WeakPolarHBondContact CA-O 3.28Å; T362-K399 HydrophobicContact CG2-CB 4.19Å; T362-K399 HydrophobicContact CG2-CG 4.31Å; T362-N563 VanDerWaalsContact CG2-OD1 3.28Å; T362-N563 WeakPolarHBondContact CG2-OD1 3.48Å; T362-N563 VanDerWaalsContact OG1-CG 3.23Å; T362-N563 PolarHBondContact OG1-OD1 3.42Å
363	V	87.5	Confident	84.9	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	133.5	176.4	-62	0	0	0	0	110.1	I350 P352 V355 L378 C398 M400	I350-V363 HydrophobicContact CD1-CB 4.22Å; I350-V363 HydrophobicContact CD1-CG2 3.99Å; I350-V363 HydrophobicContact CG1-CB 4.08Å; I350-V363 HydrophobicContact CG1-CG2 4.37Å; P352-V363 HydrophobicContact CG-CG1 4.34Å; P352-V363 WeakPolarHBondContact O-CG1 3.34Å; V355-V363 HydrophobicContact CG1-CG1 3.52Å; V363-L378 HydrophobicContact CG2-CD2 3.8Å; V363-C398 HydrophobicContact CG2-CB 3.9Å; V363-C398 PolarHBondContact N-O 2.75Å; V363-C398 PolarHBondContact O-N 2.8Å; V363-M400 HydrophobicContact CG1-CG 3.97Å; V363-M400 HydrophobicContact CG1-SD 4.44Å; V363-M400 HydrophobicContact CG2-CG 4.08Å; V363-M400 HydrophobicContact CG2-SD 3.77Å
364	Q	88.5	Confident	84.9	Confident	22 Å²	22	20 Å²	20	10%	0.103	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	140.6	178.7	-62.3	176.9	-8.6	0	0	109.2	V198 N201 I350 Y351 I395 A396 E397	V198-Q364 WeakPolarHBondContact CG1-O 3.26Å; V198-Q364 VanDerWaalsContact CG2-C 3.46Å; V198-Q364 HydrophobicContact CG2-CB 3.76Å; N201-Q364 PolarHBondContact ND2-OE1 2.92Å; I350-Q364 WeakPolarHBondContact CA-O 3.16Å; Y351-Q364 PolarHBondContact N-O 3.38Å; Y351-Q364 PolarHBondContact O-N 2.83Å; Q364-I395 HydrophobicContact CB-CG2 3.94Å; Q364-I395 HydrophobicContact CG-CG2 4.44Å; Q364-A396 CarbonylContact C-O 3.59Å; Q364-A396 VanDerWaalsContact CA-O 3.29Å; Q364-A396 WeakPolarHBondContact CA-O 3.09Å; Q364-E397 HydrophobicContact CG-CB 4.39Å; Q364-E397 HydrophobicContact CG-CG 4.21Å; Q364-E397 PolarHBondContact NE2-OE1 2.91Å
365	V	88.2	Confident	84.9	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	127.1	-171.5	-175.1	0	0	0	0	111.6	L348 N349 I350 I395 A396 F413	L348-V365 HydrophobicContact CB-CG1 4.42Å; L348-V365 HydrophobicContact CD1-CG1 3.85Å; N349-V365 WeakPolarHBondContact O-CA 3.4Å; I350-V365 HydrophobicContact CD1-CG2 4.02Å; I350-V365 HydrophobicContact CG1-CG2 4.12Å; V365-I395 WeakPolarHBondContact O-CA 3.36Å; V365-A396 PolarHBondContact N-O 2.98Å; V365-A396 PolarHBondContact O-N 3.13Å; V365-A396 VanDerWaalsContact O-N 3.08Å; V365-F413 HydrophobicContact CB-CD2 4.5Å; V365-F413 HydrophobicContact CB-CE2 4.26Å; V365-F413 HydrophobicContact CG1-CD1 4.38Å; V365-F413 HydrophobicContact CG1-CD2 4.09Å; V365-F413 HydrophobicContact CG1-CE1 4.47Å; V365-F413 HydrophobicContact CG1-CE2 4.18Å; V365-F413 HydrophobicContact CG1-CG 4.18Å; V365-F413 HydrophobicContact CG1-CZ 4.37Å
366	N	85.8	Confident	84.8	Confident	3 Å²	3	23.4 Å²	23.4	2%	0.016	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134.4	173.8	-98.7	106.9	0	0	0	110.1	G196 V198 G337 L348 N349 A394	G196-N366 PolarHBondContact O-ND2 3.32Å; G196-N366 PolarHBondContact O-OD1 3.41Å; V198-N366 HydrophobicContact CB-CB 4.38Å; V198-N366 WeakPolarHBondContact CB-OD1 3.47Å; V198-N366 HydrophobicContact CG2-CB 4.16Å; V198-N366 WeakPolarHBondContact CG2-OD1 3.26Å; V198-N366 PolarHBondContact N-OD1 2.79Å; G337-N366 VanDerWaalsContact C-ND2 3.25Å; G337-N366 WeakPolarHBondContact CA-ND2 3.49Å; G337-N366 PolarHBondContact N-ND2 3.29Å; G337-N366 PolarHBondContact O-ND2 3.49Å; L348-N366 WeakPolarHBondContact CB-O 3.33Å; L348-N366 VanDerWaalsContact CD2-O 3.3Å; L348-N366 WeakPolarHBondContact CD2-O 3.26Å; N349-N366 HydrophobicContact CB-CB 4.31Å; N349-N366 PolarHBondContact N-O 3.48Å; N349-N366 PolarHBondContact O-N 3.23Å; N366-A394 PolarHBondContact ND2-O 3.32Å
367	G	79.8	Confident	84.8	Confident	11 Å²	11	24 Å²	24	11%	0.113	14%	0.137	C	C	.	.			trans	-175.4	-118.2	-178.3	0	0	0	0	0	116	C338 S339 L348	C338-G367 CarbonylContact C-O 3.55Å; C338-G367 WeakPolarHBondContact CA-O 3.32Å; C338-G367 WeakPolarHBondContact CB-O 3.45Å; S339-G367 PolarHBondContact N-O 3.13Å; L348-G367 VanDerWaalsContact CD2-CA 3.41Å
368	P	81.6	Confident	84.8	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.006	14%	0.135	C	C	.	.	S	Bend	trans	-62.2	153.2	171.1	29.7	-35.1	0	0	0	110.5	F413 V415 I418 Y427	P368-F413 HydrophobicContact CG-CE1 4.24Å; P368-V415 HydrophobicContact CG-CG2 3.96Å; P368-I418 HydrophobicContact CB-CD1 3.78Å; P368-I418 HydrophobicContact CG-CD1 4.06Å; P368-Y427 HydrophobicContact CG-CE2 3.98Å
369	C	83.5	Confident	84.8	Confident	15 Å²	15	26 Å²	26	10%	0.101	14%	0.144	C	C	.	.			trans	-76.2	139.2	171.2	-54.7	0	0	0	0	109.4	C338 N340 A393	C338-C369 HydrophobicContact CB-CB 3.84Å; C338-C369 WeakPolarHBondContact CB-SG 3.31Å; C338-C369 WeakPolarHBondContact SG-CA 3.34Å; C338-C369 WeakPolarHBondContact SG-CB 3.42Å; C338-C369 CovalentContact SG-SG 2.04Å; C338-C369 PolarHBondContact SG-SG 3.34Å; N340-C369 WeakPolarHBondContact OD1-CA 3.47Å; N340-C369 WeakPolarHBondContact OD1-CB 3.46Å; N340-C369 PolarHBondContact OD1-N 2.84Å; C369-A393 VanDerWaalsContact CA-O 3.28Å; C369-A393 WeakPolarHBondContact CA-O 3.47Å
370	M	86	Confident	84.5	Confident	1 Å²	1	26 Å²	26	1%	0.005	14%	0.144	C	C	.	.			trans	-122.1	146.2	-169.9	-68.5	167.1	-72.4	0	0	111.3	F33 P376 V390 A393 A396 F413 V415	F33-M370 WeakPolarHBondContact CE1-O 3.15Å; M370-P376 HydrophobicContact SD-CB 4.4Å; M370-P376 HydrophobicContact SD-CG 4.23Å; M370-V390 HydrophobicContact CB-CG1 4.12Å; M370-V390 HydrophobicContact CB-CG2 4.26Å; M370-A393 PolarHBondContact N-O 2.77Å; M370-A393 VanDerWaalsContact O-CA 3.29Å; M370-A393 WeakPolarHBondContact O-CA 3.43Å; M370-A396 HydrophobicContact CE-CB 3.87Å; M370-A396 HydrophobicContact SD-CB 3.88Å; M370-F413 HydrophobicContact SD-CE1 4.2Å; M370-F413 HydrophobicContact SD-CZ 3.87Å; M370-V415 HydrophobicContact CG-CG1 4.4Å; M370-V415 HydrophobicContact CG-CG2 4.49Å; M370-V415 HydrophobicContact SD-CG2 4.32Å
371	S	85.8	Confident	83.8	Confident	28 Å²	28	26.5 Å²	26.5	20%	0.196	15%	0.15	C	C	.	.			trans	-87.6	153.7	165	-178.4	0	0	0	0	110.6	T373 D374	S371-T373 WeakPolarHBondContact CB-OG1 3.26Å; S371-T373 PolarHBondContact O-N 3.48Å; S371-T373 VanDerWaalsContact O-N 3.09Å; S371-T373 PolarHBondContact OG-N 3.5Å; S371-T373 VanDerWaalsContact OG-N 3.16Å; S371-T373 PolarHBondContact OG-OG1 2.72Å; S371-D374 WeakPolarHBondContact CB-OD2 3.29Å; S371-D374 PolarHBondContact N-OD2 2.73Å; S371-D374 WeakPolarHBondContact O-CB 3.48Å; S371-D374 PolarHBondContact O-N 2.67Å
372	F	85.4	Confident	83.1	Confident	127 Å²	127	29.9 Å²	29.9	56%	0.557	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-10	166	-63.6	-73.9	0	0	0	113.2	V390	F372-V390 HydrophobicContact CD1-CB 4.39Å; F372-V390 HydrophobicContact CD1-CG1 4.11Å; F372-V390 HydrophobicContact CE1-CG1 4.4Å
373	T	85.2	Confident	82.2	Confident	102 Å²	102	34.2 Å²	34.2	63%	0.626	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-8.6	171.5	58.8	0	0	0	0	114.3	S371	S371-T373 WeakPolarHBondContact CB-OG1 3.26Å; S371-T373 PolarHBondContact O-N 3.48Å; S371-T373 VanDerWaalsContact O-N 3.09Å; S371-T373 PolarHBondContact OG-N 3.5Å; S371-T373 VanDerWaalsContact OG-N 3.16Å; S371-T373 PolarHBondContact OG-OG1 2.72Å
374	D	84.1	Confident	81.6	Confident	24 Å²	24	37.9 Å²	37.9	13%	0.128	20%	0.202	C	C	.	.			trans	-90.1	151.1	-173.8	-59.5	-20.6	0	0	0	110.6	S371 P376 V415	S371-D374 WeakPolarHBondContact CB-OD2 3.29Å; S371-D374 PolarHBondContact N-OD2 2.73Å; S371-D374 WeakPolarHBondContact O-CB 3.48Å; S371-D374 PolarHBondContact O-N 2.67Å; D374-P376 VanDerWaalsContact C-CD 3.48Å; D374-P376 WeakPolarHBondContact O-CD 3.29Å; D374-V415 HydrophobicContact CB-CG1 3.84Å
375	T	85.3	Confident	81.5	Confident	77 Å²	77	39 Å²	39	47%	0.472	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	86.5	-178.3	38.2	0	0	0	0	110.1	R416	T375-R416 PolarHBondContact O-N 3.34Å
376	P	86.5	Confident	81.3	Confident	3 Å²	3	39 Å²	39	2%	0.019	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	141.4	172.4	18.6	-20.1	0	0	0	112	M370 D374 C388 V390 A396 F413 S414 V415	M370-P376 HydrophobicContact SD-CB 4.4Å; M370-P376 HydrophobicContact SD-CG 4.23Å; D374-P376 VanDerWaalsContact C-CD 3.48Å; D374-P376 WeakPolarHBondContact O-CD 3.29Å; P376-C388 HydrophobicContact CB-CB 3.85Å; P376-C388 HydrophobicContact CG-CB 3.8Å; P376-C388 WeakPolarHBondContact O-CB 3.29Å; P376-C388 PolarHBondContact O-N 3.29Å; P376-V390 HydrophobicContact CG-CG2 3.75Å; P376-A396 HydrophobicContact CB-CB 4.26Å; P376-A396 HydrophobicContact CG-CB 3.92Å; P376-F413 HydrophobicContact CB-CE1 4.48Å; P376-F413 HydrophobicContact CB-CE2 3.63Å; P376-F413 HydrophobicContact CB-CZ 3.51Å; P376-F413 HydrophobicContact CG-CZ 4.49Å; P376-S414 WeakPolarHBondContact CA-O 3.42Å; P376-V415 HydrophobicContact CB-CG2 4.31Å
377	I	86.6	Confident	81.4	Confident	20 Å²	20	46.8 Å²	46.8	10%	0.103	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.9	174.5	-56.5	176.7	0	0	0	107.6	Y379 P385 S414	I377-Y379 HydrophobicContact CB-CE2 4.08Å; I377-Y379 HydrophobicContact CG2-CD1 4.42Å; I377-Y379 HydrophobicContact CG2-CD2 4.13Å; I377-Y379 HydrophobicContact CG2-CE1 4.06Å; I377-Y379 HydrophobicContact CG2-CE2 3.74Å; I377-Y379 HydrophobicContact CG2-CG 4.45Å; I377-P385 HydrophobicContact CG2-CB 3.69Å; I377-S414 PolarHBondContact N-O 3.43Å; I377-S414 PolarHBondContact O-N 3.4Å
378	L	86.7	Confident	81.8	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	108.2	173.1	-177.1	69	0	0	0	108.6	I350 V363 V380 A386 C398 M400 V411 F413	I350-L378 HydrophobicContact CD1-CD2 4.07Å; V363-L378 HydrophobicContact CG2-CD2 3.8Å; L378-V380 PolarHBondContact O-N 2.81Å; L378-A386 HydrophobicContact CB-CB 4.28Å; L378-A386 PolarHBondContact N-O 2.77Å; L378-A386 WeakPolarHBondContact O-CB 3.46Å; L378-A386 PolarHBondContact O-N 3Å; L378-C398 HydrophobicContact CB-CB 4.24Å; L378-C398 HydrophobicContact CD2-CB 4.16Å; L378-M400 HydrophobicContact CD2-SD 4.02Å; L378-V411 HydrophobicContact CD1-CB 3.89Å; L378-V411 HydrophobicContact CD1-CG2 3.91Å; L378-V411 HydrophobicContact CG-CB 4.34Å; L378-F413 HydrophobicContact CB-CD2 4.37Å; L378-F413 HydrophobicContact CD1-CB 3.97Å; L378-F413 HydrophobicContact CD1-CD2 4.16Å
379	Y	84.8	Confident	82.1	Confident	48 Å²	48	53.2 Å²	53.2	19%	0.188	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	116.9	175.7	-64.4	-85.9	0	0	0	109.9	I377 P385 V411 Y412 Y426	I377-Y379 HydrophobicContact CB-CE2 4.08Å; I377-Y379 HydrophobicContact CG2-CD1 4.42Å; I377-Y379 HydrophobicContact CG2-CD2 4.13Å; I377-Y379 HydrophobicContact CG2-CE1 4.06Å; I377-Y379 HydrophobicContact CG2-CE2 3.74Å; I377-Y379 HydrophobicContact CG2-CG 4.45Å; Y379-P385 HydrophobicContact CD1-CB 4.14Å; Y379-P385 HydrophobicContact CE1-CB 3.98Å; Y379-V411 WeakPolarHBondContact O-CA 3.4Å; Y379-Y412 PolarHBondContact N-O 2.8Å; Y379-Y412 PolarHBondContact O-N 2.99Å; Y379-Y426 HydrophobicContact CD2-CE1 4.13Å; Y379-Y426 HydrophobicContact CE2-CE1 4.11Å
380	V	76.2	Confident	82.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	155.1	168.2	-170.2	0	0	0	0	109	L378 N383 K384 M400 Y403	L378-V380 PolarHBondContact O-N 2.81Å; V380-N383 WeakPolarHBondContact O-CA 3.47Å; V380-N383 PolarHBondContact O-N 3.45Å; V380-K384 PolarHBondContact N-O 2.89Å; V380-K384 PolarHBondContact O-N 3.16Å; V380-M400 HydrophobicContact CG2-CE 3.66Å; V380-M400 HydrophobicContact CG2-SD 4.42Å; V380-Y403 HydrophobicContact CG1-CD1 3.97Å; V380-Y403 HydrophobicContact CG1-CD2 4.13Å; V380-Y403 HydrophobicContact CG1-CE1 4.03Å; V380-Y403 HydrophobicContact CG1-CE2 4.21Å; V380-Y403 HydrophobicContact CG1-CG 4.04Å
381	A	67.4	Low	82.4	Confident	23 Å²	23	56.4 Å²	56.4	19%	0.19	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-45.5	144.2	176.5	0	0	0	0	0	112.2	N383 Y403 K409	A381-N383 VanDerWaalsContact C-N 3.27Å; A381-Y403 WeakPolarHBondContact CB-OH 3.35Å; A381-Y403 WeakPolarHBondContact O-CE2 3.42Å; A381-K409 HydrophobicContact CB-CD 4.35Å
382	E	67.2	Low	82.5	Confident	98 Å²	98	55.5 Å²	55.5	46%	0.458	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	69	18.4	-162.6	-46.5	178	158.3	0	0	114.7	K384 H405	E382-K384 VanDerWaalsContact C-N 3.26Å; E382-K384 PolarHBondContact O-N 2.92Å; E382-K384 IonicContact OE2-NZ 3.82Å; E382-K384 PolarHBondContact OE2-NZ 2.95Å; E382-H405 IonicContact OE1-CE1 3.14Å; E382-H405 PolarHBondContact OE1-CE1 3.04Å; E382-H405 IonicContact OE1-NE2 3.22Å; E382-H405 IonicContact OE2-CE1 3.07Å; E382-H405 IonicContact OE2-NE2 4Å
383	N	65.1	Low	82.7	Confident	115 Å²	115	49.5 Å²	49.5	62%	0.615	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	59.7	25.9	176.5	-61.9	-19.7	0	0	0	115.1	V380 A381 P385	V380-N383 WeakPolarHBondContact O-CA 3.47Å; V380-N383 PolarHBondContact O-N 3.45Å; A381-N383 VanDerWaalsContact C-N 3.27Å; N383-P385 WeakPolarHBondContact O-CD 3.46Å
384	K	74.8	Confident	82.8	Confident	78 Å²	78	44.6 Å²	44.6	34%	0.339	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	116.7	173.4	-72.6	166.4	178.1	149.5	0	109.1	V380 E382 V401 Y403	V380-K384 PolarHBondContact N-O 2.89Å; V380-K384 PolarHBondContact O-N 3.16Å; E382-K384 VanDerWaalsContact C-N 3.26Å; E382-K384 PolarHBondContact O-N 2.92Å; E382-K384 IonicContact OE2-NZ 3.82Å; E382-K384 PolarHBondContact OE2-NZ 2.95Å; K384-V401 HydrophobicContact CB-CG2 4.3Å; K384-Y403 HydrophobicContact CD-CD2 3.92Å; K384-Y403 HydrophobicContact CD-CE2 4.33Å
385	P	84.9	Confident	83.1	Confident	46 Å²	46	43.5 Å²	43.5	30%	0.299	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	124.8	-176.3	31.2	-32.7	0	0	0	111.6	I377 Y379 N383	I377-P385 HydrophobicContact CG2-CB 3.69Å; Y379-P385 HydrophobicContact CD1-CB 4.14Å; Y379-P385 HydrophobicContact CE1-CB 3.98Å; N383-P385 WeakPolarHBondContact O-CD 3.46Å
386	A	85.7	Confident	83.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	123.2	158.2	0	0	0	0	0	108.6	L378 K399 M400	L378-A386 HydrophobicContact CB-CB 4.28Å; L378-A386 PolarHBondContact N-O 2.77Å; L378-A386 WeakPolarHBondContact O-CB 3.46Å; L378-A386 PolarHBondContact O-N 3Å; A386-K399 VanDerWaalsContact CB-O 3.3Å; A386-K399 WeakPolarHBondContact CB-O 3.45Å; A386-M400 HydrophobicContact CB-SD 4.3Å
387	Y	86.8	Confident	83.3	Confident	166 Å²	166	42.5 Å²	42.5	65%	0.651	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	142.8	177.9	-63.7	-79.4	0	0	0	110.5	K399	Y387-K399 PolarHBondContact O-N 2.94Å; Y387-K399 VanDerWaalsContact O-N 3.16Å
388	C	88.2	Confident	83.4	Confident	15 Å²	15	41.6 Å²	41.6	10%	0.101	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	142.3	-176	-44.7	0	0	0	0	112	P376 A396 E397 C398	P376-C388 HydrophobicContact CB-CB 3.85Å; P376-C388 HydrophobicContact CG-CB 3.8Å; P376-C388 WeakPolarHBondContact O-CB 3.29Å; P376-C388 PolarHBondContact O-N 3.29Å; C388-A396 HydrophobicContact CB-CB 4.4Å; C388-E397 CarbonylContact C-O 3.51Å; C388-E397 WeakPolarHBondContact CA-O 3.09Å; C388-C398 HydrophobicContact CB-CB 3.93Å; C388-C398 WeakPolarHBondContact CB-SG 3.47Å; C388-C398 WeakPolarHBondContact SG-CB 3.18Å; C388-C398 CovalentContact SG-SG 2.03Å; C388-C398 PolarHBondContact SG-SG 3.06Å
389	K	88.4	Confident	83.3	Confident	131 Å²	131	43.5 Å²	43.5	57%	0.57	21%	0.206	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	140.2	170.3	-63.9	177.9	-178.9	176.8	0	108.7	K391 E397 E561	K389-K391 PolarHBondContact O-N 3.2Å; K389-E397 PolarHBondContact N-O 2.8Å; K389-E397 PolarHBondContact O-N 3.31Å; K389-E561 IonicContact NZ-OE2 2.89Å; K389-E561 PolarHBondContact NZ-OE2 3.13Å
390	V	88.7	Confident	83.4	Confident	24 Å²	24	41.7 Å²	41.7	15%	0.145	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	111.6	177.2	177.9	0	0	0	0	108.7	M370 F372 P376 N392	M370-V390 HydrophobicContact CB-CG1 4.12Å; M370-V390 HydrophobicContact CB-CG2 4.26Å; F372-V390 HydrophobicContact CD1-CB 4.39Å; F372-V390 HydrophobicContact CD1-CG1 4.11Å; F372-V390 HydrophobicContact CE1-CG1 4.4Å; P376-V390 HydrophobicContact CG-CG2 3.75Å; V390-N392 VanDerWaalsContact CG1-O 3.26Å; V390-N392 WeakPolarHBondContact CG1-O 3.44Å
391	K	86.1	Confident	83.7	Confident	59 Å²	59	44.3 Å²	44.3	26%	0.257	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	-46.6	178.9	-178.1	-165.5	172.9	-159.3	0	110.4	D195 K389 I395	D195-K391 IonicContact OD1-NZ 3.26Å; K389-K391 PolarHBondContact O-N 3.2Å; K391-I395 HydrophobicContact CB-CG2 4.43Å; K391-I395 WeakPolarHBondContact CB-O 3.35Å; K391-I395 HydrophobicContact CD-CG2 4.3Å; K391-I395 PolarHBondContact N-O 2.96Å
392	N	89.4	Confident	84.4	Confident	9 Å²	9	48.1 Å²	48.1	5%	0.048	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	-179.6	173.2	67.8	39.1	0	0	0	109.4	D195 H319 V390 A394 I395	D195-N392 PolarHBondContact O-ND2 3.08Å; H319-N392 PolarHBondContact CE1-OD1 2.92Å; H319-N392 PolarHBondContact NE2-ND2 3.5Å; V390-N392 VanDerWaalsContact CG1-O 3.26Å; V390-N392 WeakPolarHBondContact CG1-O 3.44Å; N392-A394 PolarHBondContact O-N 2.93Å; N392-A394 PolarHBondContact OD1-N 3.14Å; N392-I395 PolarHBondContact N-O 3.28Å; N392-I395 PolarHBondContact O-N 3.4Å; N392-I395 PolarHBondContact OD1-N 3.07Å
393	A	88.6	Confident	84.9	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.008	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-7.5	-174.7	0	0	0	0	0	115.8	F33 P318 H319 C338 C369 M370	F33-A393 HydrophobicContact CB-CB 4.13Å; F33-A393 HydrophobicContact CD1-CB 4.12Å; F33-A393 HydrophobicContact CG-CB 4.07Å; P318-A393 HydrophobicContact CG-CB 4.14Å; H319-A393 HydrophobicContact CB-CB 4.01Å; C338-A393 PolarHBondContact SG-O 3.45Å; C369-A393 VanDerWaalsContact CA-O 3.28Å; C369-A393 WeakPolarHBondContact CA-O 3.47Å; M370-A393 PolarHBondContact N-O 2.77Å; M370-A393 VanDerWaalsContact O-CA 3.29Å; M370-A393 WeakPolarHBondContact O-CA 3.43Å
394	A	88.1	Confident	85.7	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116	-21.2	177.8	0	0	0	0	0	114.8	C338 N366 N392	C338-A394 HydrophobicContact CB-CB 3.99Å; N366-A394 PolarHBondContact ND2-O 3.32Å; N392-A394 PolarHBondContact O-N 2.93Å; N392-A394 PolarHBondContact OD1-N 3.14Å
395	I	88.8	Confident	86	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	124.4	-173.6	-57.6	-176.8	0	0	0	111	D195 V198 Q364 V365 K391 N392	D195-I395 VanDerWaalsContact O-CD1 3.24Å; D195-I395 WeakPolarHBondContact O-CD1 3.32Å; V198-I395 HydrophobicContact CG2-CD1 4.22Å; V198-I395 HydrophobicContact CG2-CG1 4.21Å; V198-I395 HydrophobicContact CG2-CG2 3.99Å; Q364-I395 HydrophobicContact CB-CG2 3.94Å; Q364-I395 HydrophobicContact CG-CG2 4.44Å; V365-I395 WeakPolarHBondContact O-CA 3.36Å; K391-I395 HydrophobicContact CB-CG2 4.43Å; K391-I395 WeakPolarHBondContact CB-O 3.35Å; K391-I395 HydrophobicContact CD-CG2 4.3Å; K391-I395 PolarHBondContact N-O 2.96Å; N392-I395 PolarHBondContact N-O 3.28Å; N392-I395 PolarHBondContact O-N 3.4Å; N392-I395 PolarHBondContact OD1-N 3.07Å
396	A	89.5	Confident	85.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	148	163.1	0	0	0	0	0	110.5	Q364 V365 M370 P376 C388 F413	Q364-A396 CarbonylContact C-O 3.59Å; Q364-A396 VanDerWaalsContact CA-O 3.29Å; Q364-A396 WeakPolarHBondContact CA-O 3.09Å; V365-A396 PolarHBondContact N-O 2.98Å; V365-A396 PolarHBondContact O-N 3.13Å; V365-A396 VanDerWaalsContact O-N 3.08Å; M370-A396 HydrophobicContact CE-CB 3.87Å; M370-A396 HydrophobicContact SD-CB 3.88Å; P376-A396 HydrophobicContact CB-CB 4.26Å; P376-A396 HydrophobicContact CG-CB 3.92Å; C388-A396 HydrophobicContact CB-CB 4.4Å; A396-F413 HydrophobicContact CB-CE2 4.08Å; A396-F413 HydrophobicContact CB-CZ 3.84Å
397	E	88.5	Confident	85.9	Confident	60 Å²	60	36.2 Å²	36.2	28%	0.28	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	113.2	178	-176.8	159.9	-116.8	0	0	109.3	Q364 C388 K389	Q364-E397 HydrophobicContact CG-CB 4.39Å; Q364-E397 HydrophobicContact CG-CG 4.21Å; Q364-E397 PolarHBondContact NE2-OE1 2.91Å; C388-E397 CarbonylContact C-O 3.51Å; C388-E397 WeakPolarHBondContact CA-O 3.09Å; K389-E397 PolarHBondContact N-O 2.8Å; K389-E397 PolarHBondContact O-N 3.31Å
398	C	88.2	Confident	85.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.9	-173.7	-56.8	0	0	0	0	110.3	T362 V363 L378 C388	T362-C398 WeakPolarHBondContact CA-O 3.28Å; V363-C398 HydrophobicContact CG2-CB 3.9Å; V363-C398 PolarHBondContact N-O 2.75Å; V363-C398 PolarHBondContact O-N 2.8Å; L378-C398 HydrophobicContact CB-CB 4.24Å; L378-C398 HydrophobicContact CD2-CB 4.16Å; C388-C398 HydrophobicContact CB-CB 3.93Å; C388-C398 WeakPolarHBondContact CB-SG 3.47Å; C388-C398 WeakPolarHBondContact SG-CB 3.18Å; C388-C398 CovalentContact SG-SG 2.03Å; C388-C398 PolarHBondContact SG-SG 3.06Å
399	K	84.9	Confident	85.7	Confident	41 Å²	41	30 Å²	30	18%	0.178	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	120.1	174.8	-174.5	165.1	-179.4	176.2	0	110.7	D360 T362 A386 Y387 E560 E561 G562	D360-K399 WeakPolarHBondContact OD1-CE 3.24Å; D360-K399 IonicContact OD1-NZ 3.2Å; D360-K399 PolarHBondContact OD1-NZ 2.89Å; T362-K399 HydrophobicContact CG2-CB 4.19Å; T362-K399 HydrophobicContact CG2-CG 4.31Å; A386-K399 VanDerWaalsContact CB-O 3.3Å; A386-K399 WeakPolarHBondContact CB-O 3.45Å; Y387-K399 PolarHBondContact O-N 2.94Å; Y387-K399 VanDerWaalsContact O-N 3.16Å; K399-E560 PolarHBondContact NZ-O 2.82Å; K399-E561 WeakPolarHBondContact CD-O 3.13Å; K399-G562 PolarHBondContact NZ-O 3.32Å
400	M	85.6	Confident	85.3	Confident	9 Å²	9	27.4 Å²	27.4	4%	0.044	12%	0.123	C	C	.	.	P	Polyproline II helix	trans	-74	128.4	-176.7	-63.5	-61.8	-73.2	0	0	111.7	V355 D360 T361 V363 L378 V380 A386 I431	V355-M400 HydrophobicContact CG1-CE 4.38Å; V355-M400 HydrophobicContact CG1-CG 4.23Å; V355-M400 HydrophobicContact CG2-CE 4.15Å; D360-M400 PolarHBondContact N-O 2.84Å; T361-M400 VanDerWaalsContact O-CB 3.28Å; T361-M400 WeakPolarHBondContact O-CB 3.27Å; T361-M400 WeakPolarHBondContact O-CG 3.45Å; T361-M400 PolarHBondContact O-N 3.08Å; V363-M400 HydrophobicContact CG1-CG 3.97Å; V363-M400 HydrophobicContact CG1-SD 4.44Å; V363-M400 HydrophobicContact CG2-CG 4.08Å; V363-M400 HydrophobicContact CG2-SD 3.77Å; L378-M400 HydrophobicContact CD2-SD 4.02Å; V380-M400 HydrophobicContact CG2-CE 3.66Å; V380-M400 HydrophobicContact CG2-SD 4.42Å; A386-M400 HydrophobicContact CB-SD 4.3Å; M400-I431 HydrophobicContact CE-CD1 3.56Å
401	V	83.5	Confident	84.9	Confident	55 Å²	55	26.2 Å²	26.2	33%	0.333	12%	0.116	S	C	.	.	P	Polyproline II helix	trans	-77.2	160.7	173.2	-62.6	0	0	0	0	111.3	K384 Y403	K384-V401 HydrophobicContact CB-CG2 4.3Å; V401-Y403 PolarHBondContact O-N 3.14Å
402	R	82.1	Confident	84.8	Confident	103 Å²	103	26.7 Å²	26.7	39%	0.389	12%	0.117	S	C	.	.	P	Polyproline II helix	trans	-64.8	129.6	178.4	-48.9	-145.4	166.4	108.9	13.9	110.5	M358 D360	M358-R402 WeakPolarHBondContact O-CD 3.4Å; M358-R402 WeakPolarHBondContact O-CG 3.47Å; M358-R402 PolarHBondContact O-NE 3.36Å; M358-R402 VanDerWaalsContact O-NE 3.12Å; D360-R402 IonicContact OD2-CZ 2.72Å; D360-R402 IonicContact OD2-NE 2.65Å; D360-R402 IonicContact OD2-NH2 3.07Å; D360-R402 PolarHBondContact OD2-NH2 2.98Å
403	Y	78	Confident	84.4	Confident	15 Å²	15	26.3 Å²	26.3	6%	0.059	12%	0.115	C	C	.	.			trans	-153.5	81	-170.5	-176.3	-105.3	0	0	0	109.4	S357 V380 A381 K384 V401 H405 K409 A433	S357-Y403 WeakPolarHBondContact CA-O 3.4Å; S357-Y403 VanDerWaalsContact CB-O 3.29Å; S357-Y403 WeakPolarHBondContact CB-O 3.3Å; S357-Y403 CarbonylContact O-C 3.58Å; S357-Y403 PolarHBondContact O-N 3.34Å; V380-Y403 HydrophobicContact CG1-CD1 3.97Å; V380-Y403 HydrophobicContact CG1-CD2 4.13Å; V380-Y403 HydrophobicContact CG1-CE1 4.03Å; V380-Y403 HydrophobicContact CG1-CE2 4.21Å; V380-Y403 HydrophobicContact CG1-CG 4.04Å; A381-Y403 WeakPolarHBondContact CB-OH 3.35Å; A381-Y403 WeakPolarHBondContact O-CE2 3.42Å; K384-Y403 HydrophobicContact CD-CD2 3.92Å; K384-Y403 HydrophobicContact CD-CE2 4.33Å; V401-Y403 PolarHBondContact O-N 3.14Å; Y403-H405 HydrophobicContact CD1-CB 4.13Å; Y403-H405 AromaticContact CD1-CD2 3.98Å; Y403-H405 AromaticContact CD2-CD2 3.48Å; Y403-H405 VanDerWaalsContact CD2-CD2 3.48Å; Y403-H405 WeakPolarHBondContact CD2-CD2 3.42Å; Y403-H405 AromaticContact CD2-NE2 3.86Å; Y403-H405 HydrophobicContact CE1-CB 3.55Å; Y403-H405 AromaticContact CE1-CD2 3.69Å; Y403-H405 AromaticContact CE1-CG 3.72Å; Y403-H405 AromaticContact CE2-CD2 3.13Å; Y403-H405 WeakPolarHBondContact CE2-CD2 3.46Å; Y403-H405 AromaticContact CE2-CG 3.82Å; Y403-H405 AromaticContact CE2-NE2 3.32Å; Y403-H405 VanDerWaalsContact CE2-NE2 3.32Å; Y403-H405 WeakPolarHBondContact CE2-NE2 3.42Å; Y403-H405 AromaticContact CG-CD2 3.87Å; Y403-H405 AromaticContact CZ-CD2 3.23Å; Y403-H405 AromaticContact CZ-CG 3.4Å; Y403-H405 AromaticContact CZ-ND1 3.94Å; Y403-H405 AromaticContact CZ-NE2 3.73Å; Y403-H405 PolarHBondContact O-N 3.04Å; Y403-K409 HydrophobicContact CE1-CD 3.93Å; Y403-K409 HydrophobicContact CE1-CG 3.99Å; Y403-A433 HydrophobicContact CD1-CB 4.31Å
404	Y	81.9	Confident	84	Confident	45 Å²	45	26.6 Å²	26.6	18%	0.176	12%	0.117	C	C	.	.			trans	-63.5	4.9	-171	-58.1	-52.1	0	0	0	116.6	P500 L717 P718 M720	Y404-P500 HydrophobicContact CE2-CG 4.28Å; Y404-L717 HydrophobicContact CD1-CD2 4.25Å; Y404-L717 HydrophobicContact CD2-CD2 3.72Å; Y404-L717 HydrophobicContact CE2-CD2 4.16Å; Y404-L717 HydrophobicContact CG-CD2 3.76Å; Y404-P718 VanDerWaalsContact O-CD 3.31Å; Y404-P718 WeakPolarHBondContact O-CD 3.42Å; Y404-M720 HydrophobicContact CD1-CE 4.31Å; Y404-M720 HydrophobicContact CD1-SD 4.35Å; Y404-M720 HydrophobicContact CE1-CE 4.02Å; Y404-M720 HydrophobicContact CE1-SD 4.22Å
405	H	80.2	Confident	83.5	Confident	9 Å²	9	27.2 Å²	27.2	4%	0.042	12%	0.121	C	C	.	.			trans	-74.9	147.7	175.9	-48.7	-123.5	0	0	0	109.6	E382 Y403 A433 F711	E382-H405 IonicContact OE1-CE1 3.14Å; E382-H405 PolarHBondContact OE1-CE1 3.04Å; E382-H405 IonicContact OE1-NE2 3.22Å; E382-H405 IonicContact OE2-CE1 3.07Å; E382-H405 IonicContact OE2-NE2 4Å; Y403-H405 HydrophobicContact CD1-CB 4.13Å; Y403-H405 AromaticContact CD1-CD2 3.98Å; Y403-H405 AromaticContact CD2-CD2 3.48Å; Y403-H405 VanDerWaalsContact CD2-CD2 3.48Å; Y403-H405 WeakPolarHBondContact CD2-CD2 3.42Å; Y403-H405 AromaticContact CD2-NE2 3.86Å; Y403-H405 HydrophobicContact CE1-CB 3.55Å; Y403-H405 AromaticContact CE1-CD2 3.69Å; Y403-H405 AromaticContact CE1-CG 3.72Å; Y403-H405 AromaticContact CE2-CD2 3.13Å; Y403-H405 WeakPolarHBondContact CE2-CD2 3.46Å; Y403-H405 AromaticContact CE2-CG 3.82Å; Y403-H405 AromaticContact CE2-NE2 3.32Å; Y403-H405 VanDerWaalsContact CE2-NE2 3.32Å; Y403-H405 WeakPolarHBondContact CE2-NE2 3.42Å; Y403-H405 AromaticContact CG-CD2 3.87Å; Y403-H405 AromaticContact CZ-CD2 3.23Å; Y403-H405 AromaticContact CZ-CG 3.4Å; Y403-H405 AromaticContact CZ-ND1 3.94Å; Y403-H405 AromaticContact CZ-NE2 3.73Å; Y403-H405 PolarHBondContact O-N 3.04Å; H405-A433 WeakPolarHBondContact O-CB 3.41Å; H405-F711 HydrophobicContact CB-CD2 3.61Å; H405-F711 HydrophobicContact CB-CE2 3.75Å; H405-F711 AromaticContact CG-CD2 3.6Å; H405-F711 AromaticContact ND1-CD2 3.48Å; H405-F711 WeakPolarHBondContact ND1-CD2 3.3Å; H405-F711 AromaticContact ND1-CE2 3.93Å
406	W	82.1	Confident	82.4	Confident	16 Å²	16	34.3 Å²	34.3	6%	0.061	15%	0.147	C	C	.	.			trans	-110.6	165	175.2	172.2	54.5	0	0	0	111.7	K409 W432 A433 P435 F706 P718 R894	W406-K409 WeakPolarHBondContact O-CE 3.31Å; W406-K409 PolarHBondContact O-NZ 2.78Å; W406-W432 AromaticContact CD1-NE1 3.96Å; W406-W432 AromaticContact NE1-NE1 3.8Å; W406-A433 WeakPolarHBondContact CA-O 3.44Å; W406-A433 VanDerWaalsContact CD1-O 3.24Å; W406-P435 HydrophobicContact CG-CG 4.48Å; W406-F706 HydrophobicContact CE3-CB 3.97Å; W406-F706 HydrophobicContact CE3-CD1 4.2Å; W406-F706 HydrophobicContact CE3-CG 4.19Å; W406-F706 HydrophobicContact CH2-CB 3.96Å; W406-F706 AromaticContact CH2-CD1 3.08Å; W406-F706 HydrophobicContact CH2-CD1 3.08Å; W406-F706 AromaticContact CH2-CD2 3.67Å; W406-F706 HydrophobicContact CH2-CD2 3.67Å; W406-F706 AromaticContact CH2-CE1 3.32Å; W406-F706 HydrophobicContact CH2-CE1 3.32Å; W406-F706 AromaticContact CH2-CE2 3.87Å; W406-F706 HydrophobicContact CH2-CE2 3.87Å; W406-F706 AromaticContact CH2-CG 3.27Å; W406-F706 HydrophobicContact CH2-CG 3.27Å; W406-F706 AromaticContact CH2-CZ 3.71Å; W406-F706 HydrophobicContact CH2-CZ 3.71Å; W406-F706 AromaticContact CZ2-CD1 3.76Å; W406-F706 HydrophobicContact CZ2-CD1 3.76Å; W406-F706 AromaticContact CZ2-CE1 3.74Å; W406-F706 HydrophobicContact CZ2-CE1 3.74Å; W406-F706 HydrophobicContact CZ2-CG 4.35Å; W406-F706 HydrophobicContact CZ2-CZ 4.32Å; W406-F706 HydrophobicContact CZ3-CB 3.29Å; W406-F706 AromaticContact CZ3-CD1 3.38Å; W406-F706 HydrophobicContact CZ3-CD1 3.38Å; W406-F706 AromaticContact CZ3-CD2 3.82Å; W406-F706 HydrophobicContact CZ3-CD2 3.82Å; W406-F706 HydrophobicContact CZ3-CE1 4.1Å; W406-F706 HydrophobicContact CZ3-CE2 4.47Å; W406-F706 AromaticContact CZ3-CG 3.19Å; W406-F706 HydrophobicContact CZ3-CG 3.19Å; W406-P718 HydrophobicContact CB-CB 4.05Å; W406-P718 HydrophobicContact CB-CG 3.74Å; W406-R894 HydrophobicContact CH2-CG 3.76Å; W406-R894 HydrophobicContact CZ2-CG 4.18Å; W406-R894 HydrophobicContact CZ3-CG 3.95Å
407	G	86.4	Confident	81	Confident	2 Å²	2	39.7 Å²	39.7	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	85.5	-175.8	179.4	0	0	0	0	0	112.5	K409 A433 R894	G407-K409 PolarHBondContact O-NZ 2.98Å; G407-A433 PolarHBondContact N-O 3.39Å; G407-A433 PolarHBondContact O-N 2.86Å; G407-R894 CarbonylContact C-O 3.58Å; G407-R894 WeakPolarHBondContact CA-O 3.24Å
408	V	86.3	Confident	79.3	Confident	17 Å²	17	39.8 Å²	39.8	10%	0.103	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	143.1	-172.7	179	0	0	0	0	110.9	V430 W432 R894 F895	V408-V430 HydrophobicContact CG1-CG1 3.14Å; V408-W432 HydrophobicContact CG2-CB 4.46Å; V408-W432 HydrophobicContact CG2-CG 4.27Å; V408-R894 PolarHBondContact N-O 2.97Å; V408-F895 HydrophobicContact CB-CD1 3.78Å; V408-F895 HydrophobicContact CB-CE1 3.86Å; V408-F895 HydrophobicContact CG1-CD1 3.98Å; V408-F895 HydrophobicContact CG1-CE1 3.87Å; V408-F895 HydrophobicContact CG2-CD1 3.88Å; V408-F895 HydrophobicContact CG2-CE1 3.52Å; V408-F895 HydrophobicContact CG2-CZ 3.99Å
409	K	84.2	Confident	77.2	Confident	35 Å²	35	49.7 Å²	49.7	15%	0.152	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	133.6	-172.5	-59.5	-70.3	165.3	-85.1	0	111.3	A381 Y403 W406 G407 V430 I431 A433	A381-K409 HydrophobicContact CB-CD 4.35Å; Y403-K409 HydrophobicContact CE1-CD 3.93Å; Y403-K409 HydrophobicContact CE1-CG 3.99Å; W406-K409 WeakPolarHBondContact O-CE 3.31Å; W406-K409 PolarHBondContact O-NZ 2.78Å; G407-K409 PolarHBondContact O-NZ 2.98Å; K409-V430 WeakPolarHBondContact O-CA 3.25Å; K409-I431 HydrophobicContact CB-CG1 4.09Å; K409-I431 PolarHBondContact N-O 3.36Å; K409-I431 PolarHBondContact O-N 2.96Å; K409-A433 HydrophobicContact CG-CB 4.49Å
410	Y	80.1	Confident	75.2	Confident	75 Å²	75	50.3 Å²	50.3	29%	0.294	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	134.4	168.6	-64.5	-80.3	0	0	0	110.3	V428 V429 V430 N881	Y410-V428 HydrophobicContact CD1-CG1 3.78Å; Y410-V429 WeakPolarHBondContact CA-O 3.48Å; Y410-V430 HydrophobicContact CD1-CG2 3.54Å; Y410-V430 HydrophobicContact CE1-CG2 3.49Å; Y410-V430 VanDerWaalsContact CE1-CG2 3.49Å; Y410-V430 HydrophobicContact CG-CG2 4.45Å; Y410-N881 PolarHBondContact OH-ND2 3.17Å; Y410-N881 VanDerWaalsContact OH-ND2 3.1Å
411	V	81.5	Confident	73	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	149.1	174.1	-65.5	0	0	0	0	110.3	L378 Y379 V428 V429 I431	L378-V411 HydrophobicContact CD1-CB 3.89Å; L378-V411 HydrophobicContact CD1-CG2 3.91Å; L378-V411 HydrophobicContact CG-CB 4.34Å; Y379-V411 WeakPolarHBondContact O-CA 3.4Å; V411-V428 WeakPolarHBondContact O-CA 3.23Å; V411-V429 HydrophobicContact CG2-CB 3.67Å; V411-V429 HydrophobicContact CG2-CG2 3.96Å; V411-V429 PolarHBondContact N-O 3.31Å; V411-V429 PolarHBondContact O-N 3.21Å; V411-I431 HydrophobicContact CG1-CD1 3.52Å; V411-I431 HydrophobicContact CG1-CG1 3.71Å; V411-I431 HydrophobicContact CG1-CG2 4.32Å; V411-I431 HydrophobicContact CG2-CG2 4.12Å
412	Y	82.4	Confident	70.8	Confident	69 Å²	69	60.8 Å²	60.8	27%	0.271	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	105.7	-175.4	-53.4	-90.5	0	0	0	109.7	Y379 Y427 V428	Y379-Y412 PolarHBondContact N-O 2.8Å; Y379-Y412 PolarHBondContact O-N 2.99Å; Y412-Y427 WeakPolarHBondContact CA-O 3.47Å; Y412-V428 HydrophobicContact CD1-CG2 3.92Å; Y412-V428 HydrophobicContact CE1-CG2 3.87Å
413	F	82.3	Confident	68.7	Low	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	135.5	175.1	-173.1	-108.4	0	0	0	110	L348 V365 P368 M370 P376 L378 A396 V415 Y426 Y427	L348-F413 HydrophobicContact CD1-CB 3.47Å; L348-F413 VanDerWaalsContact CD1-CB 3.47Å; L348-F413 HydrophobicContact CD1-CD1 3.97Å; L348-F413 HydrophobicContact CD1-CG 3.96Å; V365-F413 HydrophobicContact CB-CD2 4.5Å; V365-F413 HydrophobicContact CB-CE2 4.26Å; V365-F413 HydrophobicContact CG1-CD1 4.38Å; V365-F413 HydrophobicContact CG1-CD2 4.09Å; V365-F413 HydrophobicContact CG1-CE1 4.47Å; V365-F413 HydrophobicContact CG1-CE2 4.18Å; V365-F413 HydrophobicContact CG1-CG 4.18Å; V365-F413 HydrophobicContact CG1-CZ 4.37Å; P368-F413 HydrophobicContact CG-CE1 4.24Å; M370-F413 HydrophobicContact SD-CE1 4.2Å; M370-F413 HydrophobicContact SD-CZ 3.87Å; P376-F413 HydrophobicContact CB-CE1 4.48Å; P376-F413 HydrophobicContact CB-CE2 3.63Å; P376-F413 HydrophobicContact CB-CZ 3.51Å; P376-F413 HydrophobicContact CG-CZ 4.49Å; L378-F413 HydrophobicContact CB-CD2 4.37Å; L378-F413 HydrophobicContact CD1-CB 3.97Å; L378-F413 HydrophobicContact CD1-CD2 4.16Å; A396-F413 HydrophobicContact CB-CE2 4.08Å; A396-F413 HydrophobicContact CB-CZ 3.84Å; F413-V415 HydrophobicContact CD1-CG2 4.12Å; F413-V415 HydrophobicContact CE1-CG2 3.48Å; F413-V415 VanDerWaalsContact CE1-CG2 3.48Å; F413-V415 HydrophobicContact CZ-CG2 4.02Å; F413-Y426 WeakPolarHBondContact O-CA 3.44Å; F413-Y427 HydrophobicContact CD1-CD2 4.37Å; F413-Y427 PolarHBondContact N-O 2.98Å; F413-Y427 PolarHBondContact O-N 2.96Å
414	S	80.1	Confident	67.3	Low	7 Å²	7	61.1 Å²	61.1	5%	0.049	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	138	-178.2	-177.3	0	0	0	0	110.1	P376 I377	P376-S414 WeakPolarHBondContact CA-O 3.42Å; I377-S414 PolarHBondContact N-O 3.43Å; I377-S414 PolarHBondContact O-N 3.4Å
415	V	77	Confident	65.8	Low	13 Å²	13	60.8 Å²	60.8	8%	0.079	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	115.8	-178.6	-172.1	0	0	0	0	109.3	P368 M370 D374 P376 F413 I418	P368-V415 HydrophobicContact CG-CG2 3.96Å; M370-V415 HydrophobicContact CG-CG1 4.4Å; M370-V415 HydrophobicContact CG-CG2 4.49Å; M370-V415 HydrophobicContact SD-CG2 4.32Å; D374-V415 HydrophobicContact CB-CG1 3.84Å; P376-V415 HydrophobicContact CB-CG2 4.31Å; F413-V415 HydrophobicContact CD1-CG2 4.12Å; F413-V415 HydrophobicContact CE1-CG2 3.48Å; F413-V415 VanDerWaalsContact CE1-CG2 3.48Å; F413-V415 HydrophobicContact CZ-CG2 4.02Å; V415-I418 HydrophobicContact CB-CD1 3.73Å; V415-I418 HydrophobicContact CB-CG1 4.04Å; V415-I418 HydrophobicContact CG1-CD1 4.06Å; V415-I418 HydrophobicContact CG1-CG1 3.96Å; V415-I418 HydrophobicContact CG2-CD1 4.21Å
416	R	65.7	Low	64.6	Low	150 Å²	150	66.5 Å²	66.5	57%	0.566	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	142.3	169.9	-69.2	-176.8	175.3	-164.6	-1.2	109.8	T375	T375-R416 PolarHBondContact O-N 3.34Å
417	N	59.6	Low	63.6	Low	112 Å²	112	66.7 Å²	66.7	60%	0.599	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	-2.6	-177.5	-57.5	-26.5	0	0	0	118.5	K419	N417-K419 PolarHBondContact O-N 2.04Å; N417-K419 VanDerWaalsContact O-N 3.11Å
418	I	53	Low	62.4	Low	63 Å²	63	69.7 Å²	69.7	32%	0.323	34%	0.34	S	S	.	.			trans	-64	116.8	166.6	-60.1	-177.6	0	0	0	108.9	P368 V415 S420	P368-I418 HydrophobicContact CB-CD1 3.78Å; P368-I418 HydrophobicContact CG-CD1 4.06Å; V415-I418 HydrophobicContact CB-CD1 3.73Å; V415-I418 HydrophobicContact CB-CG1 4.04Å; V415-I418 HydrophobicContact CG1-CD1 4.06Å; V415-I418 HydrophobicContact CG1-CG1 3.96Å; V415-I418 HydrophobicContact CG2-CD1 4.21Å; I418-S420 PolarHBondContact O-N 2.82Å
419	K	43.7	Very low	61.7	Low	207 Å²	207	69.1 Å²	69.1	90%	0.9	34%	0.337	S	S	*	.			trans	-78.3	45.1	-176.2	-67.5	-175.4	177.3	177.5	0	113.7	N417	N417-K419 PolarHBondContact O-N 2.04Å; N417-K419 VanDerWaalsContact O-N 3.11Å
420	S	43.4	Very low	61.3	Low	54 Å²	54	67.9 Å²	67.9	38%	0.378	33%	0.332	S	S	.	.			trans	-87.1	136.8	167.8	49.1	0	0	0	0	110.1	I418 V422	I418-S420 PolarHBondContact O-N 2.82Å; S420-V422 PolarHBondContact O-N 3.22Å; S420-V422 PolarHBondContact OG-O 3.37Å
421	Y	40.1	Very low	61.6	Low	249 Å²	249	64.5 Å²	64.5	98%	0.976	32%	0.319	S	S	*	.	S	Bend	trans	-69.2	0.6	178.5	-91.6	-100.3	0	0	0	114.5
422	V	36.4	Very low	61.7	Low	36 Å²	36	65.2 Å²	65.2	22%	0.218	32%	0.322	C	S	.	.	S	Bend	trans	-104.9	124.9	176.5	-175.4	0	0	0	0	107.9	S420 L1332	S420-V422 PolarHBondContact O-N 3.22Å; S420-V422 PolarHBondContact OG-O 3.37Å; V422-L1332 HydrophobicContact CG1-CB 3.94Å; V422-L1332 HydrophobicContact CG1-CD2 3.73Å; V422-L1332 HydrophobicContact CG1-CG 4.33Å; V422-L1332 WeakPolarHBondContact CG1-O 3.32Å
423	G	39.2	Very low	61.8	Low	60 Å²	60	62 Å²	62	62%	0.619	31%	0.309	S	S	*	.			trans	-66.7	147.3	-171.6	0	0	0	0	0	114.1	I425	G423-I425 PolarHBondContact O-N 3.25Å; G423-I425 VanDerWaalsContact O-N 3.12Å
424	S	46.9	Very low	62	Low	64 Å²	64	62 Å²	62	45%	0.448	31%	0.309	S	S	.	.			trans	15.2	77.4	173	-61.4	0	0	0	0	115.3	Y426	S424-Y426 WeakPolarHBondContact O-CD2 3.44Å; S424-Y426 WeakPolarHBondContact O-CE2 3.11Å; S424-Y426 PolarHBondContact O-N 3.5Å
425	I	52	Low	62.2	Low	39 Å²	39	61.7 Å²	61.7	20%	0.2	31%	0.308	C	S	.	.			trans	-65.5	109	179.8	-62.6	172.6	0	0	0	108.7	V343 G423 Y427	V343-I425 HydrophobicContact CG1-CD1 4.2Å; V343-I425 HydrophobicContact CG1-CG2 3.8Å; V343-I425 HydrophobicContact CG2-CD1 3.85Å; V343-I425 HydrophobicContact CG2-CG2 4.43Å; G423-I425 PolarHBondContact O-N 3.25Å; G423-I425 VanDerWaalsContact O-N 3.12Å; I425-Y427 HydrophobicContact CB-CE2 4.21Å; I425-Y427 HydrophobicContact CG2-CD2 4.19Å; I425-Y427 HydrophobicContact CG2-CE1 4.22Å; I425-Y427 HydrophobicContact CG2-CE2 3.79Å; I425-Y427 WeakPolarHBondContact O-CD2 3.44Å; I425-Y427 PolarHBondContact O-N 2.77Å
426	Y	54.8	Low	62.5	Low	128 Å²	128	61.3 Å²	61.3	50%	0.502	31%	0.305	S	S	.	.			trans	-84.6	103.9	176.6	-66.1	-73.2	0	0	0	109.7	Y379 F413 S424 V428	Y379-Y426 HydrophobicContact CD2-CE1 4.13Å; Y379-Y426 HydrophobicContact CE2-CE1 4.11Å; F413-Y426 WeakPolarHBondContact O-CA 3.44Å; S424-Y426 WeakPolarHBondContact O-CD2 3.44Å; S424-Y426 WeakPolarHBondContact O-CE2 3.11Å; S424-Y426 PolarHBondContact O-N 3.5Å; Y426-V428 PolarHBondContact O-N 2.88Å
427	Y	59.6	Low	63	Low	21 Å²	21	54.7 Å²	54.7	8%	0.082	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	117.6	174.2	-59.8	-96.6	0	0	0	109.1	L348 P368 Y412 F413 I425	L348-Y427 HydrophobicContact CD1-CG 4.2Å; L348-Y427 HydrophobicContact CD2-CD1 3.91Å; L348-Y427 HydrophobicContact CD2-CG 3.99Å; L348-Y427 HydrophobicContact CG-CD1 4.47Å; L348-Y427 HydrophobicContact CG-CG 4.29Å; P368-Y427 HydrophobicContact CG-CE2 3.98Å; Y412-Y427 WeakPolarHBondContact CA-O 3.47Å; F413-Y427 HydrophobicContact CD1-CD2 4.37Å; F413-Y427 PolarHBondContact N-O 2.98Å; F413-Y427 PolarHBondContact O-N 2.96Å; I425-Y427 HydrophobicContact CB-CE2 4.21Å; I425-Y427 HydrophobicContact CG2-CD2 4.19Å; I425-Y427 HydrophobicContact CG2-CE1 4.22Å; I425-Y427 HydrophobicContact CG2-CE2 3.79Å; I425-Y427 WeakPolarHBondContact O-CD2 3.44Å; I425-Y427 PolarHBondContact O-N 2.77Å
428	V	61.8	Low	64	Low	64 Å²	64	51.3 Å²	51.3	39%	0.388	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	129.7	179.9	-172.2	0	0	0	0	110.1	Y410 V411 Y412 Y426	Y410-V428 HydrophobicContact CD1-CG1 3.78Å; V411-V428 WeakPolarHBondContact O-CA 3.23Å; Y412-V428 HydrophobicContact CD1-CG2 3.92Å; Y412-V428 HydrophobicContact CE1-CG2 3.87Å; Y426-V428 PolarHBondContact O-N 2.88Å
429	V	71.2	Confident	65.4	Low	6 Å²	6	49.2 Å²	49.2	4%	0.036	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	169.5	168.2	-139.2	0	0	0	0	108.6	L348 I350 Y410 V411	L348-V429 HydrophobicContact CB-CG1 4.1Å; L348-V429 HydrophobicContact CB-CG2 3.67Å; L348-V429 HydrophobicContact CD1-CG2 3.42Å; L348-V429 VanDerWaalsContact CD1-CG2 3.42Å; L348-V429 HydrophobicContact CG-CG2 3.9Å; L348-V429 WeakPolarHBondContact O-CG1 3.28Å; I350-V429 HydrophobicContact CB-CG1 4.19Å; I350-V429 HydrophobicContact CG2-CB 4.47Å; I350-V429 HydrophobicContact CG2-CG1 3.69Å; Y410-V429 WeakPolarHBondContact CA-O 3.48Å; V411-V429 HydrophobicContact CG2-CB 3.67Å; V411-V429 HydrophobicContact CG2-CG2 3.96Å; V411-V429 PolarHBondContact N-O 3.31Å; V411-V429 PolarHBondContact O-N 3.21Å
430	V	77.1	Confident	67.2	Low	9 Å²	9	42.1 Å²	42.1	6%	0.055	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.1	173.4	179.4	0	0	0	0	109.2	V408 K409 Y410 E883	V408-V430 HydrophobicContact CG1-CG1 3.14Å; K409-V430 WeakPolarHBondContact O-CA 3.25Å; Y410-V430 HydrophobicContact CD1-CG2 3.54Å; Y410-V430 HydrophobicContact CE1-CG2 3.49Å; Y410-V430 VanDerWaalsContact CE1-CG2 3.49Å; Y410-V430 HydrophobicContact CG-CG2 4.45Å; V430-E883 WeakPolarHBondContact CB-OE1 3.35Å; V430-E883 VanDerWaalsContact CG2-OE2 3.25Å; V430-E883 WeakPolarHBondContact CG2-OE2 3.38Å
431	I	85.2	Confident	69	Low	4 Å²	4	43.2 Å²	43.2	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	169.4	167.6	63.9	174.3	0	0	0	109.3	I350 D353 V355 M400 K409 V411	I350-I431 HydrophobicContact CD1-CG2 3.63Å; I350-I431 HydrophobicContact CG1-CG2 4.35Å; I350-I431 HydrophobicContact CG2-CG2 4.2Å; D353-I431 CarbonylContact O-C 3.6Å; D353-I431 WeakPolarHBondContact O-CA 3.34Å; D353-I431 WeakPolarHBondContact O-CB 3.46Å; V355-I431 HydrophobicContact CG2-CD1 3.9Å; M400-I431 HydrophobicContact CE-CD1 3.56Å; K409-I431 HydrophobicContact CB-CG1 4.09Å; K409-I431 PolarHBondContact N-O 3.36Å; K409-I431 PolarHBondContact O-N 2.96Å; V411-I431 HydrophobicContact CG1-CD1 3.52Å; V411-I431 HydrophobicContact CG1-CG1 3.71Å; V411-I431 HydrophobicContact CG1-CG2 4.32Å; V411-I431 HydrophobicContact CG2-CG2 4.12Å
432	W	83.3	Confident	71.1	Confident	14 Å²	14	32.1 Å²	32.1	5%	0.053	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	113.4	169.6	-176	3.9	0	0	0	110.2	D353 I354 V355 W406 V408 V434 I890 T892 Q893	D353-W432 PolarHBondContact O-N 2.91Å; I354-W432 WeakPolarHBondContact CA-O 3.34Å; I354-W432 HydrophobicContact CG1-CE3 4.19Å; V355-W432 PolarHBondContact N-O 3.23Å; W406-W432 AromaticContact CD1-NE1 3.96Å; W406-W432 AromaticContact NE1-NE1 3.8Å; V408-W432 HydrophobicContact CG2-CB 4.46Å; V408-W432 HydrophobicContact CG2-CG 4.27Å; W432-V434 HydrophobicContact CD2-CG1 4.05Å; W432-V434 HydrophobicContact CG-CG1 4.13Å; W432-V434 HydrophobicContact CZ2-CG1 4.24Å; W432-I890 HydrophobicContact CE3-CD1 4.1Å; W432-I890 HydrophobicContact CH2-CB 3.37Å; W432-I890 HydrophobicContact CH2-CD1 3.8Å; W432-I890 HydrophobicContact CH2-CG1 4.16Å; W432-I890 HydrophobicContact CH2-CG2 3.37Å; W432-I890 HydrophobicContact CZ2-CB 4.34Å; W432-I890 HydrophobicContact CZ2-CD1 4.18Å; W432-I890 HydrophobicContact CZ2-CG2 3.97Å; W432-I890 HydrophobicContact CZ3-CB 3.57Å; W432-I890 HydrophobicContact CZ3-CD1 3.74Å; W432-I890 HydrophobicContact CZ3-CG1 4.09Å; W432-I890 HydrophobicContact CZ3-CG2 4.12Å; W432-T892 WeakPolarHBondContact CH2-O 3.07Å; W432-T892 WeakPolarHBondContact CZ2-O 3.35Å; W432-Q893 HydrophobicContact CD2-CG 4.19Å; W432-Q893 HydrophobicContact CE3-CG 3.71Å; W432-Q893 HydrophobicContact CH2-CB 4.25Å; W432-Q893 HydrophobicContact CH2-CG 3.22Å; W432-Q893 HydrophobicContact CZ2-CB 4.47Å; W432-Q893 HydrophobicContact CZ2-CG 3.81Å; W432-Q893 HydrophobicContact CZ3-CG 3.18Å
433	A	85.6	Confident	73.6	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.008	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	124.5	170.3	0	0	0	0	0	109.9	V355 Y403 H405 W406 G407 K409	V355-A433 HydrophobicContact CG2-CB 4.32Å; V355-A433 WeakPolarHBondContact O-CA 3.26Å; Y403-A433 HydrophobicContact CD1-CB 4.31Å; H405-A433 WeakPolarHBondContact O-CB 3.41Å; W406-A433 WeakPolarHBondContact CA-O 3.44Å; W406-A433 VanDerWaalsContact CD1-O 3.24Å; G407-A433 PolarHBondContact N-O 3.39Å; G407-A433 PolarHBondContact O-N 2.86Å; K409-A433 HydrophobicContact CG-CB 4.49Å
434	V	85.9	Confident	75.9	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	136.1	179.8	-69.7	0	0	0	0	111.7	I354 V355 S357 W432 D439 I890	I354-V434 HydrophobicContact CG2-CB 4.41Å; I354-V434 HydrophobicContact CG2-CG1 3.94Å; I354-V434 HydrophobicContact CG2-CG2 3.53Å; V355-V434 VanDerWaalsContact O-CG2 3.31Å; V355-V434 WeakPolarHBondContact O-CG2 3.34Å; V355-V434 PolarHBondContact O-N 3.21Å; S357-V434 PolarHBondContact N-O 2.7Å; S357-V434 PolarHBondContact OG-O 3.01Å; W432-V434 HydrophobicContact CD2-CG1 4.05Å; W432-V434 HydrophobicContact CG-CG1 4.13Å; W432-V434 HydrophobicContact CZ2-CG1 4.24Å; V434-D439 HydrophobicContact CG2-CB 3.82Å; V434-I890 HydrophobicContact CG1-CD1 3.7Å
435	P	85.4	Confident	77.7	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.013	15%	0.149	C	C	.	.			trans	-69.3	148.8	169.6	31.8	-35.5	0	0	0	109.8	W406 G437 L438 D439 P718	W406-P435 HydrophobicContact CG-CG 4.48Å; P435-G437 PolarHBondContact O-N 2.8Å; P435-L438 HydrophobicContact CG-CB 4.21Å; P435-L438 HydrophobicContact CG-CD1 3.98Å; P435-L438 HydrophobicContact CG-CG 4.29Å; P435-L438 CarbonylContact O-C 3.58Å; P435-L438 WeakPolarHBondContact O-CA 3.14Å; P435-L438 PolarHBondContact O-N 2.88Å; P435-D439 PolarHBondContact O-N 3.49Å; P435-P718 HydrophobicContact CB-CB 4.13Å; P435-P718 HydrophobicContact CG-CB 4.17Å
436	S	81.9	Confident	79.1	Confident	4 Å²	4	28.8 Å²	28.8	3%	0.028	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-16.9	-168.1	-32.6	0	0	0	0	114.1	N356 M358 L438 S567 P568	N356-S436 WeakPolarHBondContact ND2-CB 3.1Å; N356-S436 PolarHBondContact ND2-OG 3.3Å; N356-S436 PolarHBondContact OD1-OG 2.9Å; M358-S436 WeakPolarHBondContact CE-OG 3.27Å; S436-L438 VanDerWaalsContact C-N 3.28Å; S436-S567 WeakPolarHBondContact CB-O 3.21Å; S436-P568 WeakPolarHBondContact O-CA 3.2Å
437	G	77.8	Confident	80.3	Confident	11 Å²	11	27.6 Å²	27.6	11%	0.113	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	9.6	169.6	0	0	0	0	0	115.1	P435 R633	P435-G437 PolarHBondContact O-N 2.8Å; G437-R633 PolarHBondContact O-NE 3.11Å; G437-R633 PolarHBondContact O-NH2 3.1Å
438	L	79.4	Confident	81.2	Confident	41 Å²	41	29.2 Å²	29.2	22%	0.215	17%	0.17	C	C	.	.	S	Bend	trans	-140.8	12.4	173	-62.3	174.8	0	0	0	111.8	P435 S436 P632 R633 F706	P435-L438 HydrophobicContact CG-CB 4.21Å; P435-L438 HydrophobicContact CG-CD1 3.98Å; P435-L438 HydrophobicContact CG-CG 4.29Å; P435-L438 CarbonylContact O-C 3.58Å; P435-L438 WeakPolarHBondContact O-CA 3.14Å; P435-L438 PolarHBondContact O-N 2.88Å; S436-L438 VanDerWaalsContact C-N 3.28Å; L438-P632 HydrophobicContact CD2-CB 4.3Å; L438-R633 HydrophobicContact CD2-CG 4.43Å; L438-F706 HydrophobicContact CD1-CE1 4.07Å
439	D	83.7	Confident	81.9	Confident	20 Å²	20	27.2 Å²	27.2	11%	0.107	16%	0.157	C	C	.	.			trans	-85.6	116.4	-177.5	176.7	8.5	0	0	0	111	N356 V434 P435 Y441 A442	N356-D439 WeakPolarHBondContact CB-OD2 3.24Å; N356-D439 PolarHBondContact ND2-OD2 3.25Å; V434-D439 HydrophobicContact CG2-CB 3.82Å; P435-D439 PolarHBondContact O-N 3.49Å; D439-Y441 PolarHBondContact O-N 2.66Å; D439-Y441 PolarHBondContact OD1-N 3.05Å; D439-A442 HydrophobicContact CB-CB 4.17Å; D439-A442 VanDerWaalsContact O-CB 3.26Å; D439-A442 WeakPolarHBondContact O-CB 3.11Å; D439-A442 PolarHBondContact O-N 3.14Å
440	P	80	Confident	82.5	Confident	58 Å²	58	28.7 Å²	28.7	38%	0.377	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-12.4	-179.5	33.4	-38.9	0	0	0	113.3	I354 I890	I354-P440 HydrophobicContact CD1-CG 4.28Å; I354-P440 HydrophobicContact CG2-CG 4.36Å; P440-I890 HydrophobicContact CB-CG1 4.34Å; P440-I890 HydrophobicContact CG-CD1 3.79Å; P440-I890 HydrophobicContact CG-CG1 3.72Å
441	Y	81.2	Confident	82.8	Confident	76 Å²	76	28.4 Å²	28.4	30%	0.298	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	9.8	177	-54.6	-44.3	0	0	0	112.7	P352 I354 D439	P352-Y441 HydrophobicContact CB-CD2 4.28Å; P352-Y441 HydrophobicContact CB-CE2 3.81Å; I354-Y441 HydrophobicContact CB-CD2 4.44Å; I354-Y441 HydrophobicContact CB-CE2 4Å; I354-Y441 HydrophobicContact CD1-CE2 4.4Å; I354-Y441 HydrophobicContact CG2-CE2 4.5Å; D439-Y441 PolarHBondContact O-N 2.66Å; D439-Y441 PolarHBondContact OD1-N 3.05Å
442	A	84.9	Confident	82.8	Confident	16 Å²	16	28.9 Å²	28.9	13%	0.132	16%	0.164	C	C	.	.	S	Bend	trans	-61.2	160.5	173.7	0	0	0	0	0	112.8	D439 T444 W566	D439-A442 HydrophobicContact CB-CB 4.17Å; D439-A442 VanDerWaalsContact O-CB 3.26Å; D439-A442 WeakPolarHBondContact O-CB 3.11Å; D439-A442 PolarHBondContact O-N 3.14Å; A442-T444 PolarHBondContact O-N 3.39Å; A442-W566 CarbonylContact C-O 3.59Å; A442-W566 VanDerWaalsContact CA-O 3.29Å; A442-W566 WeakPolarHBondContact CA-O 3.41Å; A442-W566 WeakPolarHBondContact CB-O 3.06Å
443	L	87.7	Confident	82.6	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.016	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-56.7	124.8	170.5	-175.6	68.1	0	0	0	109.6	M445 I462 W464 L482 L551 L553 W566	L443-M445 HydrophobicContact CB-SD 4.5Å; L443-M445 HydrophobicContact CD2-SD 4Å; L443-M445 HydrophobicContact CG-SD 4.18Å; L443-M445 WeakPolarHBondContact O-CG 3.02Å; L443-M445 PolarHBondContact O-N 3.26Å; L443-I462 HydrophobicContact CD1-CB 4.35Å; L443-I462 HydrophobicContact CD1-CD1 4.34Å; L443-I462 HydrophobicContact CD2-CB 4.17Å; L443-I462 HydrophobicContact CD2-CD1 3.93Å; L443-I462 HydrophobicContact CD2-CG2 4.17Å; L443-I462 HydrophobicContact CG-CB 4.23Å; L443-W464 HydrophobicContact CD1-CB 4.18Å; L443-W464 HydrophobicContact CD1-CE3 4.29Å; L443-L482 HydrophobicContact CD2-CD1 4.3Å; L443-L551 HydrophobicContact CD2-CB 3.95Å; L443-L551 HydrophobicContact CD2-CD1 3.99Å; L443-L553 HydrophobicContact CD1-CD2 3.95Å; L443-W566 PolarHBondContact N-O 3.4Å
444	T	87.9	Confident	82.3	Confident	73 Å²	73	34.1 Å²	34.1	45%	0.448	19%	0.188	S	C	.	.	B	Isolated β-bridge	trans	-76.1	118.5	-179.6	-61.6	0	0	0	0	109.2	A442 G446 I462 M463	A442-T444 PolarHBondContact O-N 3.39Å; T444-G446 PolarHBondContact O-N 3Å; T444-I462 CarbonylContact O-C 3.57Å; T444-I462 VanDerWaalsContact O-CA 3.3Å; T444-I462 WeakPolarHBondContact O-CA 3.13Å; T444-M463 WeakPolarHBondContact CB-O 3.29Å; T444-M463 HydrophobicContact CG2-CB 4.38Å; T444-M463 PolarHBondContact N-O 2.97Å; T444-M463 PolarHBondContact O-N 2.83Å
445	M	85.7	Confident	81.9	Confident	8 Å²	8	40.3 Å²	40.3	4%	0.039	22%	0.217	C	C	.	.			trans	-92.8	12.2	-168.5	-61.7	-62.3	-86.8	0	0	114.5	L443 I448 W451 K461 I462 L551 S567 P568 I570	L443-M445 HydrophobicContact CB-SD 4.5Å; L443-M445 HydrophobicContact CD2-SD 4Å; L443-M445 HydrophobicContact CG-SD 4.18Å; L443-M445 WeakPolarHBondContact O-CG 3.02Å; L443-M445 PolarHBondContact O-N 3.26Å; M445-I448 HydrophobicContact CB-CD1 3.8Å; M445-I448 HydrophobicContact CG-CD1 3.99Å; M445-W451 HydrophobicContact CE-CD2 3.95Å; M445-W451 HydrophobicContact CE-CE3 4.21Å; M445-W451 HydrophobicContact CE-CH2 3.68Å; M445-W451 HydrophobicContact CE-CZ2 3.34Å; M445-W451 HydrophobicContact CE-CZ3 4.1Å; M445-W451 PolarHBondContact O-NE1 2.94Å; M445-W451 HydrophobicContact SD-CZ2 4.22Å; M445-K461 CarbonylContact C-O 3.6Å; M445-K461 VanDerWaalsContact C-O 3.23Å; M445-I462 HydrophobicContact SD-CG2 3.86Å; M445-L551 HydrophobicContact CE-CD1 3.7Å; M445-L551 HydrophobicContact CE-CG 4.11Å; M445-L551 HydrophobicContact SD-CD1 4.1Å; M445-S567 WeakPolarHBondContact SD-CB 3.27Å; M445-P568 HydrophobicContact CG-CG 4.49Å; M445-I570 HydrophobicContact CE-CD1 4.35Å; M445-I570 HydrophobicContact CE-CG2 3.56Å
446	G	81.7	Confident	81.3	Confident	45 Å²	45	41.6 Å²	41.6	46%	0.464	23%	0.225	S	C	.	.	S	Bend	trans	72	-140.7	-164.7	0	0	0	0	0	110.4	T444 I448 K461	T444-G446 PolarHBondContact O-N 3Å; G446-I448 PolarHBondContact O-N 2.91Å; G446-K461 PolarHBondContact N-O 3.17Å
447	Q	80	Confident	80.8	Confident	104 Å²	104	45.5 Å²	45.5	49%	0.486	25%	0.25	S	S	.	.	S	Bend	trans	-71.5	112.1	161.4	-72.3	167.3	-96.4	0	0	107.8	D449 H450	Q447-D449 PolarHBondContact O-N 3.11Å; Q447-H450 PolarHBondContact NE2-NE2 3.14Å; Q447-H450 PolarHBondContact O-N 3.07Å; Q447-H450 PolarHBondContact OE1-CE1 2.65Å
448	I	78.5	Confident	80.9	Confident	54 Å²	54	46.7 Å²	46.7	28%	0.277	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-62.7	-28.8	-178	-173.7	61.1	0	0	0	111.4	M445 G446 H450 W451 F452 I570	M445-I448 HydrophobicContact CB-CD1 3.8Å; M445-I448 HydrophobicContact CG-CD1 3.99Å; G446-I448 PolarHBondContact O-N 2.91Å; I448-H450 VanDerWaalsContact C-N 3.3Å; I448-H450 PolarHBondContact O-N 3.31Å; I448-W451 HydrophobicContact CD1-CG 4.42Å; I448-W451 VanDerWaalsContact O-CB 3.25Å; I448-W451 WeakPolarHBondContact O-CB 3.5Å; I448-W451 PolarHBondContact O-N 3.32Å; I448-F452 HydrophobicContact CD1-CE2 4.37Å; I448-F452 HydrophobicContact CG1-CE2 4.19Å; I448-I570 HydrophobicContact CD1-CG2 4.31Å
449	D	76.8	Confident	81.2	Confident	22 Å²	22	49.2 Å²	49.2	12%	0.118	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-61.7	-37.1	-177.4	-44	-62.2	0	0	0	111.4	Q447 W451 F452 E453 H642	Q447-D449 PolarHBondContact O-N 3.11Å; D449-W451 PolarHBondContact O-N 3.44Å; D449-F452 PolarHBondContact O-N 3.17Å; D449-E453 PolarHBondContact O-N 3.42Å; D449-H642 IonicContact OD2-CD2 3.34Å; D449-H642 IonicContact OD2-CG 2.7Å
450	H	83.1	Confident	81.3	Confident	37 Å²	37	48.6 Å²	48.6	17%	0.171	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-63.9	-4.6	173.4	-56.9	172.2	0	0	0	114.5	Q447 I448 E453 P456 P457 L460 R574	Q447-H450 PolarHBondContact NE2-NE2 3.14Å; Q447-H450 PolarHBondContact O-N 3.07Å; Q447-H450 PolarHBondContact OE1-CE1 2.65Å; I448-H450 VanDerWaalsContact C-N 3.3Å; I448-H450 PolarHBondContact O-N 3.31Å; H450-E453 WeakPolarHBondContact CA-OE2 3.33Å; H450-E453 IonicContact CD2-OE1 2.75Å; H450-E453 IonicContact CD2-OE2 2.97Å; H450-E453 PolarHBondContact CD2-OE2 3.33Å; H450-E453 IonicContact CG-OE2 2.67Å; H450-P456 VanDerWaalsContact O-CB 3.31Å; H450-P456 WeakPolarHBondContact O-CB 3.03Å; H450-P457 VanDerWaalsContact CE1-CG 3.5Å; H450-P457 WeakPolarHBondContact CE1-CG 3.33Å; H450-L460 HydrophobicContact CB-CD2 3.94Å; H450-R574 PolarHBondContact O-NH1 3.35Å
451	W	84.1	Confident	81.8	Confident	3 Å²	3	49.4 Å²	49.4	1%	0.011	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-89.5	-20.4	169.1	-66.8	76.4	0	0	0	113.1	M445 I448 D449 L460 I462 I527 L551 I570 P571 F575	M445-W451 HydrophobicContact CE-CD2 3.95Å; M445-W451 HydrophobicContact CE-CE3 4.21Å; M445-W451 HydrophobicContact CE-CH2 3.68Å; M445-W451 HydrophobicContact CE-CZ2 3.34Å; M445-W451 HydrophobicContact CE-CZ3 4.1Å; M445-W451 PolarHBondContact O-NE1 2.94Å; M445-W451 HydrophobicContact SD-CZ2 4.22Å; I448-W451 HydrophobicContact CD1-CG 4.42Å; I448-W451 VanDerWaalsContact O-CB 3.25Å; I448-W451 WeakPolarHBondContact O-CB 3.5Å; I448-W451 PolarHBondContact O-N 3.32Å; D449-W451 PolarHBondContact O-N 3.44Å; W451-L460 HydrophobicContact CD2-CD1 3.6Å; W451-L460 HydrophobicContact CD2-CD2 4.38Å; W451-L460 HydrophobicContact CE3-CD1 3.69Å; W451-L460 HydrophobicContact CG-CD1 4.31Å; W451-L460 HydrophobicContact CG-CD2 4.37Å; W451-L460 HydrophobicContact CH2-CD1 3.68Å; W451-L460 HydrophobicContact CZ2-CB 4.04Å; W451-L460 HydrophobicContact CZ2-CD1 3.6Å; W451-L460 HydrophobicContact CZ2-CG 4.3Å; W451-L460 HydrophobicContact CZ3-CD1 3.72Å; W451-I462 HydrophobicContact CZ2-CG2 3.98Å; W451-I527 HydrophobicContact CH2-CD1 3.69Å; W451-I527 HydrophobicContact CZ2-CD1 4.17Å; W451-L551 HydrophobicContact CH2-CD1 3.78Å; W451-L551 HydrophobicContact CZ2-CD1 4.38Å; W451-I570 HydrophobicContact CB-CG2 4.28Å; W451-I570 HydrophobicContact CD2-CG2 3.96Å; W451-I570 HydrophobicContact CE3-CB 4.1Å; W451-I570 HydrophobicContact CE3-CD1 3.88Å; W451-I570 HydrophobicContact CE3-CG2 3.8Å; W451-I570 HydrophobicContact CG-CG2 4.19Å; W451-I570 HydrophobicContact CH2-CD1 4.41Å; W451-I570 HydrophobicContact CZ3-CD1 3.59Å; W451-I570 HydrophobicContact CZ3-CG2 4.45Å; W451-P571 WeakPolarHBondContact O-CG 3.46Å; W451-F575 HydrophobicContact CZ3-CZ 4.19Å
452	F	84.3	Confident	82.2	Confident	15 Å²	15	45.8 Å²	45.8	7%	0.066	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-14.7	-179.8	-65	-97.2	0	0	0	112.8	I448 D449 P571 Y723 L728 Y731 W736	I448-F452 HydrophobicContact CD1-CE2 4.37Å; I448-F452 HydrophobicContact CG1-CE2 4.19Å; D449-F452 PolarHBondContact O-N 3.17Å; F452-P571 HydrophobicContact CD1-CG 4.14Å; F452-P571 HydrophobicContact CE1-CG 4.29Å; F452-P571 HydrophobicContact CG-CG 4.47Å; F452-Y723 HydrophobicContact CE1-CE1 4.48Å; F452-Y723 HydrophobicContact CZ-CE1 4.11Å; F452-L728 HydrophobicContact CD1-CD2 4.29Å; F452-L728 HydrophobicContact CE1-CD2 3.84Å; F452-Y731 HydrophobicContact CB-CD1 4Å; F452-Y731 HydrophobicContact CB-CE1 3.56Å; F452-Y731 HydrophobicContact CD1-CD1 4.25Å; F452-Y731 AromaticContact CD1-CD2 3.81Å; F452-Y731 HydrophobicContact CD1-CD2 3.81Å; F452-Y731 HydrophobicContact CD1-CE1 4.16Å; F452-Y731 AromaticContact CD1-CE2 3.67Å; F452-Y731 HydrophobicContact CD1-CE2 3.67Å; F452-Y731 HydrophobicContact CD1-CG 4.12Å; F452-Y731 AromaticContact CD1-CZ 3.87Å; F452-Y731 HydrophobicContact CE1-CD2 4.37Å; F452-Y731 HydrophobicContact CE1-CE2 4.23Å; F452-Y731 HydrophobicContact CG-CE1 4.21Å; F452-Y731 HydrophobicContact CG-CE2 4.31Å; F452-W736 PolarHBondContact O-NE1 3.11Å
453	E	79.5	Confident	82.5	Confident	69 Å²	69	47.4 Å²	47.4	32%	0.322	26%	0.262	S	S	.	.			trans	-57.6	146.2	168	-75.6	177.1	156.8	0	0	113.3	D449 H450 P456 P457	D449-E453 PolarHBondContact O-N 3.42Å; H450-E453 WeakPolarHBondContact CA-OE2 3.33Å; H450-E453 IonicContact CD2-OE1 2.75Å; H450-E453 IonicContact CD2-OE2 2.97Å; H450-E453 PolarHBondContact CD2-OE2 3.33Å; H450-E453 IonicContact CG-OE2 2.67Å; E453-P456 HydrophobicContact CB-CB 4.47Å; E453-P457 WeakPolarHBondContact OE2-CD 3.37Å
454	K	78.8	Confident	82.5	Confident	55 Å²	55	47.6 Å²	47.6	24%	0.239	26%	0.262	C	S	.	.	S	Bend	trans	-76.7	-35	179.1	-171.3	175.9	-179.3	174	0	113	L583 E584 W736	K454-L583 HydrophobicContact CG-CD2 4.29Å; K454-E584 VanDerWaalsContact CE-CG 3.42Å; K454-E584 WeakPolarHBondContact CE-OE1 3.28Å; K454-E584 VanDerWaalsContact NZ-CG 3.27Å; K454-E584 IonicContact NZ-OE1 3.35Å; K454-E584 PolarHBondContact NZ-OE1 3.11Å; K454-W736 VanDerWaalsContact CE-O 3.3Å; K454-W736 WeakPolarHBondContact CE-O 3.15Å; K454-W736 PolarHBondContact NZ-O 2.65Å
455	E	77.8	Confident	82.3	Confident	131 Å²	131	51 Å²	51	61%	0.612	27%	0.268	S	S	*	.	S	Bend	trans	-130.7	84.3	175.1	-76.6	-175.5	-109.2	0	0	108.9	K580	E455-K580 HydrophobicContact CG-CD 4.08Å; E455-K580 WeakPolarHBondContact OE1-CD 3.3Å; E455-K580 WeakPolarHBondContact OE1-CE 3.35Å; E455-K580 IonicContact OE1-NZ 3.15Å; E455-K580 PolarHBondContact OE1-NZ 3.29Å
456	P	73.1	Confident	81.9	Confident	28 Å²	28	50.8 Å²	50.8	18%	0.182	27%	0.267	C	S	.	.			trans	-73.6	144.8	-173.4	29.8	-36.4	0	0	0	112	H450 E453 G458 R574	H450-P456 VanDerWaalsContact O-CB 3.31Å; H450-P456 WeakPolarHBondContact O-CB 3.03Å; E453-P456 HydrophobicContact CB-CB 4.47Å; P456-G458 VanDerWaalsContact C-N 3.29Å; P456-G458 PolarHBondContact O-N 3.04Å; P456-R574 VanDerWaalsContact CG-NH1 3.34Å
457	P	70.8	Confident	81.6	Confident	87 Å²	87	51.7 Å²	51.7	57%	0.565	26%	0.261	S	S	*	.	S	Bend	trans	-73.7	75.6	-172.6	29.6	-36.8	0	0	0	112.9	H450 E453	H450-P457 VanDerWaalsContact CE1-CG 3.5Å; H450-P457 WeakPolarHBondContact CE1-CG 3.33Å; E453-P457 WeakPolarHBondContact OE2-CD 3.37Å
458	G	79.7	Confident	81.4	Confident	36 Å²	36	49.5 Å²	49.5	37%	0.371	25%	0.253	S	S	.	.	S	Bend	trans	76.4	-147.5	177.7	0	0	0	0	0	113.6	P456 N529	P456-G458 VanDerWaalsContact C-N 3.29Å; P456-G458 PolarHBondContact O-N 3.04Å; G458-N529 PolarHBondContact O-ND2 2.83Å; G458-N529 PolarHBondContact O-OD1 2.82Å
459	N	85.8	Confident	81.4	Confident	93 Å²	93	47.6 Å²	47.6	50%	0.497	24%	0.243	S	C	.	.	S	Bend	trans	-75.2	139.3	-173.8	-63.5	-21.1	0	0	0	111.7	I526 S528 N529	N459-I526 HydrophobicContact CB-CG2 3.57Å; N459-S528 WeakPolarHBondContact OD1-CA 3.22Å; N459-N529 PolarHBondContact OD1-N 3.16Å
460	L	87.2	Confident	80.9	Confident	7 Å²	7	47.7 Å²	47.7	4%	0.037	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	151.1	175.9	-65.6	164.3	0	0	0	111.1	H450 W451 I526 I527 R574	H450-L460 HydrophobicContact CB-CD2 3.94Å; W451-L460 HydrophobicContact CD2-CD1 3.6Å; W451-L460 HydrophobicContact CD2-CD2 4.38Å; W451-L460 HydrophobicContact CE3-CD1 3.69Å; W451-L460 HydrophobicContact CG-CD1 4.31Å; W451-L460 HydrophobicContact CG-CD2 4.37Å; W451-L460 HydrophobicContact CH2-CD1 3.68Å; W451-L460 HydrophobicContact CZ2-CB 4.04Å; W451-L460 HydrophobicContact CZ2-CD1 3.6Å; W451-L460 HydrophobicContact CZ2-CG 4.3Å; W451-L460 HydrophobicContact CZ3-CD1 3.72Å; L460-I526 CarbonylContact O-C 3.59Å; L460-I526 WeakPolarHBondContact O-CA 3.41Å; L460-I527 HydrophobicContact CB-CB 4.27Å; L460-I527 PolarHBondContact N-O 3.14Å; L460-I527 PolarHBondContact O-N 3.01Å; L460-R574 VanDerWaalsContact CD1-NH1 3.32Å
461	K	88.6	Confident	79.7	Confident	75 Å²	75	48.2 Å²	48.2	33%	0.326	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.8	175.7	-169.3	-176.7	-174.6	-176.6	0	110	M445 G446 M463 E524	M445-K461 CarbonylContact C-O 3.6Å; M445-K461 VanDerWaalsContact C-O 3.23Å; G446-K461 PolarHBondContact N-O 3.17Å; K461-M463 HydrophobicContact CD-CG 4.11Å; K461-M463 HydrophobicContact CD-SD 3.73Å; K461-M463 WeakPolarHBondContact CE-SD 3.33Å; K461-M463 HydrophobicContact CG-CG 4.1Å; K461-M463 HydrophobicContact CG-SD 4.32Å; K461-E524 WeakPolarHBondContact CE-OE2 3.35Å; K461-E524 IonicContact NZ-OE2 2.58Å; K461-E524 PolarHBondContact NZ-OE2 2.99Å
462	I	91.1	Very high	78.1	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	146.2	164.9	62.1	165.2	0	0	0	110.1	L443 T444 M445 W451 W464 L482 E524 Y525 I527 L551	L443-I462 HydrophobicContact CD1-CB 4.35Å; L443-I462 HydrophobicContact CD1-CD1 4.34Å; L443-I462 HydrophobicContact CD2-CB 4.17Å; L443-I462 HydrophobicContact CD2-CD1 3.93Å; L443-I462 HydrophobicContact CD2-CG2 4.17Å; L443-I462 HydrophobicContact CG-CB 4.23Å; T444-I462 CarbonylContact O-C 3.57Å; T444-I462 VanDerWaalsContact O-CA 3.3Å; T444-I462 WeakPolarHBondContact O-CA 3.13Å; M445-I462 HydrophobicContact SD-CG2 3.86Å; W451-I462 HydrophobicContact CZ2-CG2 3.98Å; I462-W464 HydrophobicContact CD1-CZ3 4.49Å; I462-W464 HydrophobicContact CG1-CZ3 4.42Å; I462-L482 HydrophobicContact CD1-CD1 3.66Å; I462-L482 HydrophobicContact CD1-CD2 3.64Å; I462-L482 HydrophobicContact CD1-CG 4.29Å; I462-E524 WeakPolarHBondContact O-CA 3.44Å; I462-Y525 HydrophobicContact CD1-CD1 4.03Å; I462-Y525 HydrophobicContact CG1-CD1 4.17Å; I462-Y525 HydrophobicContact CG1-CG 4.5Å; I462-Y525 WeakPolarHBondContact CG1-O 3.4Å; I462-Y525 PolarHBondContact N-O 3.43Å; I462-Y525 PolarHBondContact O-N 2.86Å; I462-I527 HydrophobicContact CD1-CD1 4.4Å; I462-I527 HydrophobicContact CG1-CD1 4.34Å; I462-I527 HydrophobicContact CG2-CD1 3.77Å; I462-L551 HydrophobicContact CG2-CD1 4.01Å
463	M	90.7	Very high	76.4	Confident	50 Å²	50	56.5 Å²	56.5	25%	0.246	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	148	-177.4	-68.2	170.3	62.4	0	0	111	T444 K461 I522 G523 E524	T444-M463 WeakPolarHBondContact CB-O 3.29Å; T444-M463 HydrophobicContact CG2-CB 4.38Å; T444-M463 PolarHBondContact N-O 2.97Å; T444-M463 PolarHBondContact O-N 2.83Å; K461-M463 HydrophobicContact CD-CG 4.11Å; K461-M463 HydrophobicContact CD-SD 3.73Å; K461-M463 WeakPolarHBondContact CE-SD 3.33Å; K461-M463 HydrophobicContact CG-CG 4.1Å; K461-M463 HydrophobicContact CG-SD 4.32Å; M463-I522 HydrophobicContact CB-CG2 4.26Å; M463-I522 HydrophobicContact CE-CG2 3.6Å; M463-G523 VanDerWaalsContact CA-O 3.28Å; M463-G523 WeakPolarHBondContact CA-O 3.44Å; M463-E524 HydrophobicContact CG-CB 4.2Å
464	W	88.4	Confident	75.1	Confident	7 Å²	7	57.8 Å²	57.8	3%	0.027	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	155.4	177.9	63.5	95.1	0	0	0	110.9	L443 I462 A466 F469 L480 I512 N514 I522 G523 L553 L565	L443-W464 HydrophobicContact CD1-CB 4.18Å; L443-W464 HydrophobicContact CD1-CE3 4.29Å; I462-W464 HydrophobicContact CD1-CZ3 4.49Å; I462-W464 HydrophobicContact CG1-CZ3 4.42Å; W464-A466 PolarHBondContact O-N 3.17Å; W464-F469 AromaticContact CD1-CD2 3.7Å; W464-F469 AromaticContact CD1-CE2 3.66Å; W464-F469 HydrophobicContact CG-CE2 4.13Å; W464-F469 AromaticContact NE1-CD2 3.98Å; W464-L480 HydrophobicContact CZ2-CD1 3.89Å; W464-I512 HydrophobicContact CH2-CG2 3.78Å; W464-I512 HydrophobicContact CZ2-CG2 4.17Å; W464-N514 PolarHBondContact NE1-OD1 3.45Å; W464-I522 CarbonylContact O-C 3.58Å; W464-I522 WeakPolarHBondContact O-CA 3.49Å; W464-G523 PolarHBondContact N-O 3Å; W464-G523 PolarHBondContact O-N 3.09Å; W464-L553 HydrophobicContact CB-CD2 4.32Å; W464-L553 HydrophobicContact CD2-CD2 3.49Å; W464-L553 VanDerWaalsContact CD2-CD2 3.49Å; W464-L553 HydrophobicContact CE3-CD2 3.6Å; W464-L553 HydrophobicContact CG-CD2 3.81Å; W464-L553 HydrophobicContact CZ2-CD2 4.49Å; W464-L553 HydrophobicContact CZ3-CD2 4.16Å; W464-L565 HydrophobicContact CB-CD1 3.85Å
465	Y	82.3	Confident	73.6	Confident	146 Å²	146	65.8 Å²	65.8	57%	0.573	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	124.4	168	-67.1	-73.6	0	0	0	109.7	D467 N468 N521 I522	Y465-D467 PolarHBondContact O-N 3.05Å; Y465-N468 WeakPolarHBondContact O-CB 3.47Å; Y465-N468 PolarHBondContact O-N 2.94Å; Y465-N468 VanDerWaalsContact O-N 3.14Å; Y465-N521 CarbonylContact C-O 3.52Å; Y465-N521 WeakPolarHBondContact CA-O 3.15Å; Y465-I522 HydrophobicContact CD1-CG1 4.24Å; Y465-I522 HydrophobicContact CE1-CD1 4.48Å; Y465-I522 HydrophobicContact CE1-CG1 4.25Å
466	A	78.6	Confident	72.4	Confident	2 Å²	2	69 Å²	69	2%	0.017	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-58.1	-39.4	-176.2	0	0	0	0	0	111.5	W464 N468 F469 T470 N514 P515 N521	W464-A466 PolarHBondContact O-N 3.17Å; A466-N468 PolarHBondContact O-N 3.25Å; A466-F469 PolarHBondContact O-N 2.68Å; A466-T470 PolarHBondContact O-N 3.11Å; A466-T470 PolarHBondContact O-OG1 3.07Å; A466-N514 WeakPolarHBondContact CA-OD1 3.2Å; A466-N514 PolarHBondContact O-ND2 3.37Å; A466-P515 HydrophobicContact CB-CG 4.02Å; A466-N521 PolarHBondContact N-O 2.7Å
467	D	74.1	Confident	71.7	Confident	64 Å²	64	70.8 Å²	70.8	34%	0.342	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-55.7	-21.2	179.2	-64.1	-39.7	0	0	0	114.1	Y465 F469 T470	Y465-D467 PolarHBondContact O-N 3.05Å; D467-F469 PolarHBondContact O-N 3.13Å; D467-T470 PolarHBondContact O-N 3.28Å
468	N	76.8	Confident	71.6	Confident	59 Å²	59	66.9 Å²	66.9	32%	0.316	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-66.6	-19.3	174.6	-66.8	-1.1	0	0	0	112.9	Y465 A466 N563 L565	Y465-N468 WeakPolarHBondContact O-CB 3.47Å; Y465-N468 PolarHBondContact O-N 2.94Å; Y465-N468 VanDerWaalsContact O-N 3.14Å; A466-N468 PolarHBondContact O-N 3.25Å; N468-N563 PolarHBondContact O-ND2 3.2Å; N468-L565 HydrophobicContact CB-CD1 4.11Å; N468-L565 HydrophobicContact CB-CD2 4.39Å; N468-L565 WeakPolarHBondContact ND2-CD1 3.5Å
469	F	77.4	Confident	71.7	Confident	14 Å²	14	68.7 Å²	68.7	6%	0.061	34%	0.341	C	S	.	.	S	Bend	trans	-125.1	4	178.6	-52.8	-79.8	0	0	0	113.8	W464 A466 D467 S478 L480 L553 N563 L565	W464-F469 AromaticContact CD1-CD2 3.7Å; W464-F469 AromaticContact CD1-CE2 3.66Å; W464-F469 HydrophobicContact CG-CE2 4.13Å; W464-F469 AromaticContact NE1-CD2 3.98Å; A466-F469 PolarHBondContact O-N 2.68Å; D467-F469 PolarHBondContact O-N 3.13Å; F469-S478 WeakPolarHBondContact CB-OG 3.43Å; F469-S478 WeakPolarHBondContact O-CB 3.31Å; F469-S478 PolarHBondContact O-OG 2.75Å; F469-L480 HydrophobicContact CB-CD1 4.46Å; F469-L480 HydrophobicContact CB-CD2 3.8Å; F469-L480 HydrophobicContact CD1-CD2 3.76Å; F469-L480 HydrophobicContact CD2-CD1 3.68Å; F469-L480 HydrophobicContact CD2-CD2 4.16Å; F469-L480 HydrophobicContact CE1-CD2 4.32Å; F469-L480 HydrophobicContact CE2-CD1 3.99Å; F469-L480 HydrophobicContact CG-CD1 4.06Å; F469-L480 HydrophobicContact CG-CD2 3.66Å; F469-L553 HydrophobicContact CE2-CD2 3.76Å; F469-L553 HydrophobicContact CE2-CG 4.12Å; F469-L553 HydrophobicContact CZ-CB 4.27Å; F469-L553 HydrophobicContact CZ-CD2 3.96Å; F469-L553 HydrophobicContact CZ-CG 3.84Å; F469-L553 WeakPolarHBondContact CZ-O 3.25Å; F469-N563 HydrophobicContact CD1-CB 4.34Å; F469-L565 HydrophobicContact CE2-CD1 3.63Å; F469-L565 HydrophobicContact CE2-CG 4.05Å; F469-L565 HydrophobicContact CZ-CB 4.26Å; F469-L565 HydrophobicContact CZ-CD1 3.78Å; F469-L565 HydrophobicContact CZ-CG 3.66Å
470	T	67	Low	71.8	Confident	24 Å²	24	64.3 Å²	64.3	15%	0.147	32%	0.317	C	S	.	.			trans	-93.8	115.1	177.8	-35.2	0	0	0	0	110.3	A466 D467 F474 N514	A466-T470 PolarHBondContact O-N 3.11Å; A466-T470 PolarHBondContact O-OG1 3.07Å; D467-T470 PolarHBondContact O-N 3.28Å; T470-F474 HydrophobicContact CG2-CD1 3.92Å; T470-F474 HydrophobicContact CG2-CE1 4.23Å; T470-N514 PolarHBondContact OG1-ND2 2.95Å
471	G	58.3	Low	72	Confident	47 Å²	47	64.6 Å²	64.6	49%	0.485	32%	0.319	S	S	.	.			trans	-68	156.8	173.4	0	0	0	0	0	112.7	D473 F474	G471-D473 PolarHBondContact O-N 2.62Å; G471-F474 PolarHBondContact O-N 2.94Å
472	A	49.9	Very low	72.2	Confident	71 Å²	71	61 Å²	61	59%	0.587	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-26.2	-173.1	0	0	0	0	0	115.3	F474	A472-F474 WeakPolarHBondContact O-CD2 3.48Å; A472-F474 PolarHBondContact O-N 2.83Å
473	D	49.7	Very low	72.3	Confident	121 Å²	121	61.5 Å²	61.5	65%	0.647	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-14.2	177.2	-70.5	-34.3	0	0	0	114.4	G471 R475	G471-D473 PolarHBondContact O-N 2.62Å; D473-R475 WeakPolarHBondContact O-CG 3.03Å; D473-R475 PolarHBondContact O-N 2.79Å
474	F	51.1	Low	72.5	Confident	97 Å²	97	59.2 Å²	59.2	43%	0.425	30%	0.295	S	S	.	.	S	Bend	trans	53	0.7	-173	-75.5	-85.9	0	0	0	116.8	T470 G471 A472 M516	T470-F474 HydrophobicContact CG2-CD1 3.92Å; T470-F474 HydrophobicContact CG2-CE1 4.23Å; G471-F474 PolarHBondContact O-N 2.94Å; A472-F474 WeakPolarHBondContact O-CD2 3.48Å; A472-F474 PolarHBondContact O-N 2.83Å; F474-M516 WeakPolarHBondContact O-CE 3.48Å
475	R	48	Very low	72.7	Confident	222 Å²	222	60.6 Å²	60.6	84%	0.838	30%	0.3	S	S	*	.			trans	-100.6	-8.7	-173.9	-73.2	173.6	-179.5	-160.1	0.4	114.9	D473	D473-R475 WeakPolarHBondContact O-CG 3.03Å; D473-R475 PolarHBondContact O-N 2.79Å
476	R	52.9	Low	73.2	Confident	200 Å²	200	53.6 Å²	53.6	76%	0.755	27%	0.272	S	S	*	.			trans	-104.8	103.7	174.5	-66.3	-172.9	-172.5	-176.1	4.3	109.2	S478	R476-S478 PolarHBondContact O-N 3.23Å; R476-S478 VanDerWaalsContact O-N 3.12Å
477	S	57.5	Low	73.8	Confident	64 Å²	64	53.5 Å²	53.5	45%	0.448	27%	0.272	S	S	.	.			trans	-66.8	104.9	162.7	56.8	0	0	0	0	108.2	Q479 M516	S477-Q479 PolarHBondContact O-N 3.03Å; S477-M516 PolarHBondContact N-SD 3.25Å
478	S	68.5	Low	74.4	Confident	6 Å²	6	51.6 Å²	51.6	4%	0.042	26%	0.26	C	S	.	.			trans	-59.5	130.4	169.7	37.3	0	0	0	0	109.5	F469 R476 N514 D555	F469-S478 WeakPolarHBondContact CB-OG 3.43Å; F469-S478 WeakPolarHBondContact O-CB 3.31Å; F469-S478 PolarHBondContact O-OG 2.75Å; R476-S478 PolarHBondContact O-N 3.23Å; R476-S478 VanDerWaalsContact O-N 3.12Å; S478-N514 PolarHBondContact O-N 3.48Å; S478-D555 WeakPolarHBondContact CB-OD2 3.43Å
479	Q	81.9	Confident	74.8	Confident	74 Å²	74	49.3 Å²	49.3	35%	0.346	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	112.5	172.4	-70.6	-178.6	-10.6	0	0	106.8	S477 N511 M556	S477-Q479 PolarHBondContact O-N 3.03Å; Q479-N511 VanDerWaalsContact CG-OD1 3.29Å; Q479-N511 WeakPolarHBondContact CG-OD1 3.28Å; Q479-N511 PolarHBondContact NE2-OD1 2.7Å; Q479-N511 PolarHBondContact OE1-OD1 3.16Å; Q479-M556 HydrophobicContact CB-CE 3.75Å; Q479-M556 WeakPolarHBondContact O-CB 3.39Å; Q479-M556 WeakPolarHBondContact O-CG 3.37Å; Q479-M556 PolarHBondContact O-N 2.74Å; Q479-M556 VanDerWaalsContact OE1-CE 3.25Å
480	L	88.3	Confident	74.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	155	-172.6	-50.5	-179.1	0	0	0	111.3	W464 F469 N511 I512 N514 L553 A554 D555	W464-L480 HydrophobicContact CZ2-CD1 3.89Å; F469-L480 HydrophobicContact CB-CD1 4.46Å; F469-L480 HydrophobicContact CB-CD2 3.8Å; F469-L480 HydrophobicContact CD1-CD2 3.76Å; F469-L480 HydrophobicContact CD2-CD1 3.68Å; F469-L480 HydrophobicContact CD2-CD2 4.16Å; F469-L480 HydrophobicContact CE1-CD2 4.32Å; F469-L480 HydrophobicContact CE2-CD1 3.99Å; F469-L480 HydrophobicContact CG-CD1 4.06Å; F469-L480 HydrophobicContact CG-CD2 3.66Å; L480-N511 PolarHBondContact O-N 3.07Å; L480-I512 HydrophobicContact CB-CB 4.18Å; L480-I512 PolarHBondContact N-O 3.31Å; L480-I512 WeakPolarHBondContact O-CB 3.28Å; L480-I512 PolarHBondContact O-N 3.29Å; L480-N514 HydrophobicContact CD1-CB 4.05Å; L480-N514 HydrophobicContact CG-CB 4.32Å; L480-L553 HydrophobicContact CB-CD1 3.81Å; L480-L553 HydrophobicContact CB-CG 4.45Å; L480-L553 HydrophobicContact CD1-CD1 4.36Å; L480-L553 HydrophobicContact CD1-CD2 4.24Å; L480-L553 HydrophobicContact CD1-CG 4.35Å; L480-A554 CarbonylContact C-O 3.6Å; L480-A554 VanDerWaalsContact CA-O 3.29Å; L480-A554 WeakPolarHBondContact CA-O 3.35Å; L480-D555 HydrophobicContact CD2-CB 4.48Å
481	Q	90.7	Very high	74.3	Confident	14 Å²	14	62.6 Å²	62.6	7%	0.065	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.5	177.6	-179.5	170	28.4	0	0	110.4	T483 K507 G509 L553 A554 M556	Q481-T483 HydrophobicContact CG-CG2 4.18Å; Q481-K507 VanDerWaalsContact NE2-CD 3.32Å; Q481-G509 WeakPolarHBondContact CA-O 3.4Å; Q481-L553 WeakPolarHBondContact O-CA 3.25Å; Q481-A554 PolarHBondContact N-O 3.26Å; Q481-A554 PolarHBondContact O-N 3.19Å; Q481-M556 HydrophobicContact CB-CG 3.62Å; Q481-M556 HydrophobicContact CB-SD 4.29Å
482	L	93.1	Very high	74.4	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.8	179.2	-170.3	69.2	0	0	0	109.2	L443 I462 I508 G509 I512 Y525 I527 L551 L553	L443-L482 HydrophobicContact CD2-CD1 4.3Å; I462-L482 HydrophobicContact CD1-CD1 3.66Å; I462-L482 HydrophobicContact CD1-CD2 3.64Å; I462-L482 HydrophobicContact CD1-CG 4.29Å; L482-I508 HydrophobicContact CD2-CB 4.02Å; L482-I508 HydrophobicContact CD2-CG2 3.8Å; L482-I508 HydrophobicContact CG-CB 4.22Å; L482-I508 PolarHBondContact O-N 3.15Å; L482-G509 PolarHBondContact N-O 3.16Å; L482-G509 PolarHBondContact O-N 2.73Å; L482-I512 HydrophobicContact CB-CD1 3.91Å; L482-Y525 HydrophobicContact CD2-CD1 3.86Å; L482-Y525 HydrophobicContact CD2-CE1 3.8Å; L482-I527 HydrophobicContact CD2-CD1 4.04Å; L482-I527 HydrophobicContact CD2-CG1 4.43Å; L482-L551 HydrophobicContact CD1-CB 4.04Å; L482-L551 HydrophobicContact CD1-CD1 4.22Å; L482-L551 HydrophobicContact CD2-CD1 4.48Å; L482-L553 HydrophobicContact CB-CD1 4.43Å; L482-L553 HydrophobicContact CD1-CB 4.19Å; L482-L553 HydrophobicContact CD1-CD1 4.27Å
483	T	93.2	Very high	74.8	Confident	9 Å²	9	64.8 Å²	64.8	6%	0.055	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	148.8	-178.5	54	0	0	0	0	111.6	Q481 W485 L504 G506 K507 L551 K552	Q481-T483 HydrophobicContact CG-CG2 4.18Å; T483-W485 PolarHBondContact OG1-NE1 2.82Å; T483-W485 VanDerWaalsContact OG1-NE1 3.09Å; T483-L504 HydrophobicContact CG2-CD1 4.04Å; T483-G506 WeakPolarHBondContact CA-O 3.2Å; T483-K507 HydrophobicContact CG2-CG 4.33Å; T483-L551 WeakPolarHBondContact O-CA 3.1Å; T483-K552 PolarHBondContact N-O 3.08Å; T483-K552 PolarHBondContact O-N 3.09Å; T483-K552 PolarHBondContact OG1-O 2.8Å; T483-K552 VanDerWaalsContact OG1-O 3.13Å
484	L	94.3	Very high	75.3	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.5	175.5	-173.4	64.7	0	0	0	110.1	L505 G506 I508 L533 L551 I570 I572 F575	L484-L505 HydrophobicContact CB-CB 4.48Å; L484-L505 HydrophobicContact CD2-CB 4.31Å; L484-L505 HydrophobicContact CD2-CD1 4Å; L484-L505 HydrophobicContact CG-CB 4.37Å; L484-L505 HydrophobicContact CG-CD1 4.19Å; L484-L505 PolarHBondContact O-N 2.7Å; L484-G506 PolarHBondContact N-O 2.81Å; L484-I508 HydrophobicContact CB-CD1 3.84Å; L484-I508 HydrophobicContact CB-CG1 4.35Å; L484-I508 HydrophobicContact CD1-CD1 4.31Å; L484-L533 HydrophobicContact CB-CD1 3.77Å; L484-L533 HydrophobicContact CD2-CD1 3.88Å; L484-L533 HydrophobicContact CD2-CD2 4.12Å; L484-L551 HydrophobicContact CD1-CD2 4.03Å; L484-I570 HydrophobicContact CD1-CD1 4.42Å; L484-I572 HydrophobicContact CD1-CG2 4.25Å; L484-F575 HydrophobicContact CD1-CD2 3.93Å; L484-F575 HydrophobicContact CD1-CE2 3.58Å; L484-F575 HydrophobicContact CD1-CZ 4.14Å; L484-F575 HydrophobicContact CD2-CB 4.08Å; L484-F575 HydrophobicContact CD2-CD1 4.44Å; L484-F575 HydrophobicContact CD2-CD2 3.48Å; L484-F575 VanDerWaalsContact CD2-CD2 3.48Å; L484-F575 HydrophobicContact CD2-CE2 4.01Å; L484-F575 HydrophobicContact CD2-CG 3.73Å; L484-F575 HydrophobicContact CG-CD2 4.36Å; L484-F575 HydrophobicContact CG-CE2 4.44Å
485	W	93.2	Very high	75.4	Confident	36 Å²	36	70 Å²	70	14%	0.136	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.9	174.8	-66.9	70.7	0	0	0	109.8	T483 L502 E503 L504 G549 F550 K552 W566	T483-W485 PolarHBondContact OG1-NE1 2.82Å; T483-W485 VanDerWaalsContact OG1-NE1 3.09Å; W485-L502 HydrophobicContact CB-CD1 4.1Å; W485-L502 HydrophobicContact CB-CG 4.4Å; W485-L502 HydrophobicContact CE3-CG 4.12Å; W485-E503 CarbonylContact C-O 3.56Å; W485-E503 VanDerWaalsContact CA-O 3.26Å; W485-E503 WeakPolarHBondContact CA-O 3.34Å; W485-L504 HydrophobicContact CD2-CB 4.19Å; W485-L504 HydrophobicContact CD2-CD1 4.49Å; W485-L504 HydrophobicContact CE3-CB 4.18Å; W485-L504 HydrophobicContact CH2-CB 4.07Å; W485-L504 HydrophobicContact CZ2-CB 4.06Å; W485-L504 HydrophobicContact CZ2-CD1 4.31Å; W485-L504 HydrophobicContact CZ3-CB 4.13Å; W485-G549 CarbonylContact O-C 3.56Å; W485-G549 WeakPolarHBondContact O-CA 3.42Å; W485-F550 PolarHBondContact N-O 2.98Å; W485-F550 PolarHBondContact O-N 3.38Å; W485-K552 HydrophobicContact CZ2-CD 4.27Å; W485-W566 HydrophobicContact CB-CZ3 4.06Å; W485-W566 AromaticContact CD1-CZ3 3.76Å; W485-W566 AromaticContact CD2-CH2 3.92Å; W485-W566 HydrophobicContact CD2-CH2 3.92Å; W485-W566 HydrophobicContact CD2-CZ3 4.05Å; W485-W566 HydrophobicContact CE3-CH2 4.36Å; W485-W566 HydrophobicContact CG-CH2 4.07Å; W485-W566 AromaticContact CG-CZ3 3.68Å; W485-W566 HydrophobicContact CG-CZ3 3.68Å
486	G	92.9	Very high	75.7	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	141.5	179.3	0	0	0	0	0	111.1	L502 E503	G486-L502 WeakPolarHBondContact O-CA 3.44Å; G486-E503 PolarHBondContact N-O 2.96Å; G486-E503 PolarHBondContact O-N 3Å
487	Y	91.4	Very high	75.9	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135.3	177.4	176.5	-91.3	0	0	0	112	E489 P500 T501 L502 L548 L717 M720 Y724	Y487-E489 HydrophobicContact CE1-CG 3.96Å; Y487-E489 WeakPolarHBondContact OH-CG 3.19Å; Y487-E489 PolarHBondContact OH-OE1 2.82Å; Y487-P500 HydrophobicContact CE2-CB 3.94Å; Y487-T501 WeakPolarHBondContact CA-O 3.38Å; Y487-L502 HydrophobicContact CD2-CD1 4.5Å; Y487-L548 HydrophobicContact CD1-CD1 4Å; Y487-L548 HydrophobicContact CD1-CD2 3.81Å; Y487-L548 HydrophobicContact CD1-CG 3.89Å; Y487-L548 HydrophobicContact CE1-CD2 4.42Å; Y487-L548 HydrophobicContact CG-CD1 4.02Å; Y487-L548 HydrophobicContact CG-CG 4.32Å; Y487-L548 PolarHBondContact N-O 2.77Å; Y487-L717 HydrophobicContact CE2-CD2 4.4Å; Y487-M720 HydrophobicContact CD1-CB 4.49Å; Y487-M720 HydrophobicContact CD2-CB 4.49Å; Y487-M720 HydrophobicContact CD2-SD 3.89Å; Y487-M720 HydrophobicContact CE1-CB 3.93Å; Y487-M720 HydrophobicContact CE2-CB 3.93Å; Y487-M720 HydrophobicContact CE2-CG 4.3Å; Y487-M720 HydrophobicContact CE2-SD 3.58Å; Y487-M720 VanDerWaalsContact CE2-SD 3.58Å; Y487-Y724 HydrophobicContact CD1-CD2 4.17Å; Y487-Y724 HydrophobicContact CE1-CD2 4.35Å; Y487-Y724 HydrophobicContact CE1-CG 4.48Å
488	K	87.2	Confident	76.4	Confident	24 Å²	24	59.9 Å²	59.9	10%	0.104	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	147	172.5	66.5	-165.7	173.7	-147.7	0	110	T501 E503 F546 Y724	K488-T501 WeakPolarHBondContact CE-OG1 3.27Å; K488-T501 WeakPolarHBondContact CG-OG1 3.03Å; K488-T501 PolarHBondContact N-O 3.1Å; K488-T501 VanDerWaalsContact N-O 3.08Å; K488-T501 PolarHBondContact O-N 2.73Å; K488-T501 PolarHBondContact O-OG1 3.1Å; K488-E503 WeakPolarHBondContact CE-OE1 3.47Å; K488-E503 IonicContact NZ-OE1 3.39Å; K488-E503 PolarHBondContact NZ-OE1 3.08Å; K488-E503 IonicContact NZ-OE2 2.82Å; K488-E503 PolarHBondContact NZ-OE2 2.92Å; K488-F546 HydrophobicContact CB-CD1 4.05Å; K488-F546 HydrophobicContact CD-CD1 3.71Å; K488-F546 HydrophobicContact CD-CE1 3.58Å; K488-F546 HydrophobicContact CD-CG 4.28Å; K488-F546 HydrophobicContact CD-CZ 4.05Å; K488-F546 HydrophobicContact CG-CD1 3.93Å; K488-F546 HydrophobicContact CG-CE1 4.01Å; K488-F546 VanDerWaalsContact NZ-CE1 3.33Å; K488-Y724 HydrophobicContact CB-CE2 4.18Å
489	E	84.5	Confident	76.5	Confident	11 Å²	11	63 Å²	63	5%	0.051	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	102.2	171.4	-66.6	-177.2	173.3	0	0	108.6	Y487 F498 Q714 F715 S721 H725	Y487-E489 HydrophobicContact CE1-CG 3.96Å; Y487-E489 WeakPolarHBondContact OH-CG 3.19Å; Y487-E489 PolarHBondContact OH-OE1 2.82Å; E489-F498 HydrophobicContact CB-CD1 4.49Å; E489-Q714 WeakPolarHBondContact OE2-CA 3.48Å; E489-Q714 WeakPolarHBondContact OE2-CG 3.49Å; E489-F715 PolarHBondContact OE1-N 2.83Å; E489-F715 PolarHBondContact OE2-N 2.83Å; E489-S721 WeakPolarHBondContact OE1-CB 3.45Å; E489-S721 PolarHBondContact OE1-OG 3.24Å; E489-H725 IonicContact OE1-NE2 2.61Å; E489-H725 IonicContact OE2-CD2 3.6Å; E489-H725 IonicContact OE2-CE1 2.66Å; E489-H725 IonicContact OE2-NE2 2.7Å; E489-H725 PolarHBondContact OE2-NE2 2.88Å
490	R	68.8	Low	76.4	Confident	166 Å²	166	60.4 Å²	60.4	63%	0.626	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.9	-175.8	-178.2	175.3	-178.9	154	6.6	110.7	D492 F498 I499 T501	R490-D492 PolarHBondContact O-N 3.3Å; R490-F498 CarbonylContact O-C 3.58Å; R490-F498 VanDerWaalsContact O-CA 3.31Å; R490-F498 WeakPolarHBondContact O-CA 3.47Å; R490-I499 PolarHBondContact N-O 3.2Å; R490-I499 PolarHBondContact O-N 3.48Å; R490-T501 HydrophobicContact CB-CG2 4.44Å
491	R	64.7	Low	76.2	Confident	151 Å²	151	61.8 Å²	61.8	57%	0.57	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	121.4	164.6	179.1	174.3	164.1	147.9	1	110.3	D493 F498	R491-D493 IonicContact CZ-OD1 3.93Å; R491-D493 IonicContact NE-OD1 2.75Å; R491-D493 PolarHBondContact NE-OD1 3.47Å; R491-D493 IonicContact NH2-OD1 3.17Å; R491-D493 PolarHBondContact NH2-OD1 3.15Å; R491-D493 VanDerWaalsContact NH2-OD1 3.17Å; R491-F498 HydrophobicContact CB-CD1 4.01Å; R491-F498 HydrophobicContact CB-CE1 3.74Å; R491-F498 HydrophobicContact CB-CE2 4.28Å; R491-F498 HydrophobicContact CB-CG 4.4Å; R491-F498 HydrophobicContact CB-CZ 3.88Å; R491-F498 HydrophobicContact CG-CE2 4.47Å; R491-F498 HydrophobicContact CG-CZ 4.4Å
492	D	60.3	Low	76	Confident	51 Å²	51	62.1 Å²	62.1	27%	0.273	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	111.7	165.4	-172.9	-11.6	0	0	0	109.1	R490 R494 E495 T496 K497 I499	R490-D492 PolarHBondContact O-N 3.3Å; D492-R494 PolarHBondContact O-N 3.37Å; D492-R494 VanDerWaalsContact OD1-CB 3.29Å; D492-R494 WeakPolarHBondContact OD1-CB 3.05Å; D492-R494 PolarHBondContact OD1-N 3.16Å; D492-E495 HydrophobicContact CB-CB 4.4Å; D492-E495 PolarHBondContact O-N 3.43Å; D492-T496 WeakPolarHBondContact O-CA 3.29Å; D492-T496 PolarHBondContact O-N 2.79Å; D492-K497 PolarHBondContact N-O 3.03Å; D492-K497 PolarHBondContact O-N 2.71Å; D492-I499 HydrophobicContact CB-CD1 3.84Å; D492-I499 HydrophobicContact CB-CG1 4.35Å
493	D	59	Low	75.9	Confident	112 Å²	112	64.5 Å²	64.5	60%	0.599	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-13.5	179.3	-65.2	-58.3	0	0	0	113.6	R491	R491-D493 IonicContact CZ-OD1 3.93Å; R491-D493 IonicContact NE-OD1 2.75Å; R491-D493 PolarHBondContact NE-OD1 3.47Å; R491-D493 IonicContact NH2-OD1 3.17Å; R491-D493 PolarHBondContact NH2-OD1 3.15Å; R491-D493 VanDerWaalsContact NH2-OD1 3.17Å
494	R	59.6	Low	75.8	Confident	233 Å²	233	67.6 Å²	67.6	88%	0.879	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-40.9	173.6	-61.3	178.3	171.7	-175.1	-1.8	112.3	D492	D492-R494 PolarHBondContact O-N 3.37Å; D492-R494 VanDerWaalsContact OD1-CB 3.29Å; D492-R494 WeakPolarHBondContact OD1-CB 3.05Å; D492-R494 PolarHBondContact OD1-N 3.16Å
495	E	54.1	Low	75.8	Confident	96 Å²	96	67.5 Å²	67.5	45%	0.449	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-13.7	-179.7	-83.6	-74.4	133.6	0	0	112.6	D492 K497	D492-E495 HydrophobicContact CB-CB 4.4Å; D492-E495 PolarHBondContact O-N 3.43Å; E495-K497 HydrophobicContact CB-CB 4.27Å; E495-K497 HydrophobicContact CB-CD 4.25Å; E495-K497 WeakPolarHBondContact O-CE 3.46Å; E495-K497 WeakPolarHBondContact O-CG 3.16Å; E495-K497 PolarHBondContact O-N 3.36Å; E495-K497 WeakPolarHBondContact OE2-CE 3.21Å; E495-K497 IonicContact OE2-NZ 3.53Å; E495-K497 PolarHBondContact OE2-NZ 3.25Å
496	T	53.9	Low	75.8	Confident	120 Å²	120	66 Å²	66	74%	0.736	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	29.8	-169.3	58.7	0	0	0	0	113.6	D492	D492-T496 WeakPolarHBondContact O-CA 3.29Å; D492-T496 PolarHBondContact O-N 2.79Å
497	K	56.1	Low	75.7	Confident	93 Å²	93	69 Å²	69	40%	0.404	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	151.4	-176	-66.6	159.2	-155.1	160.7	0	109.5	D492 E495	D492-K497 PolarHBondContact N-O 3.03Å; D492-K497 PolarHBondContact O-N 2.71Å; E495-K497 HydrophobicContact CB-CB 4.27Å; E495-K497 HydrophobicContact CB-CD 4.25Å; E495-K497 WeakPolarHBondContact O-CE 3.46Å; E495-K497 WeakPolarHBondContact O-CG 3.16Å; E495-K497 PolarHBondContact O-N 3.36Å; E495-K497 WeakPolarHBondContact OE2-CE 3.21Å; E495-K497 IonicContact OE2-NZ 3.53Å; E495-K497 PolarHBondContact OE2-NZ 3.25Å
498	F	68.6	Low	75.7	Confident	60 Å²	60	69.2 Å²	69.2	26%	0.263	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	134.8	164.1	-69.8	-107.1	0	0	0	109.1	E489 R490 R491 Q714	E489-F498 HydrophobicContact CB-CD1 4.49Å; R490-F498 CarbonylContact O-C 3.58Å; R490-F498 VanDerWaalsContact O-CA 3.31Å; R490-F498 WeakPolarHBondContact O-CA 3.47Å; R491-F498 HydrophobicContact CB-CD1 4.01Å; R491-F498 HydrophobicContact CB-CE1 3.74Å; R491-F498 HydrophobicContact CB-CE2 4.28Å; R491-F498 HydrophobicContact CB-CG 4.4Å; R491-F498 HydrophobicContact CB-CZ 3.88Å; R491-F498 HydrophobicContact CG-CE2 4.47Å; R491-F498 HydrophobicContact CG-CZ 4.4Å; F498-Q714 HydrophobicContact CB-CB 3.72Å; F498-Q714 HydrophobicContact CB-CG 3.9Å; F498-Q714 HydrophobicContact CD1-CG 3.95Å; F498-Q714 HydrophobicContact CD2-CB 4.12Å; F498-Q714 HydrophobicContact CD2-CG 4.09Å; F498-Q714 HydrophobicContact CG-CB 3.93Å; F498-Q714 HydrophobicContact CG-CG 3.72Å
499	I	72.1	Confident	75.8	Confident	71 Å²	71	68.3 Å²	68.3	36%	0.364	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	129.8	178.3	-57.4	178.5	0	0	0	107.9	R490 D492 T501	R490-I499 PolarHBondContact N-O 3.2Å; R490-I499 PolarHBondContact O-N 3.48Å; D492-I499 HydrophobicContact CB-CD1 3.84Å; D492-I499 HydrophobicContact CB-CG1 4.35Å; I499-T501 PolarHBondContact O-N 3.21Å
500	P	79.5	Confident	75.9	Confident	20 Å²	20	70.9 Å²	70.9	13%	0.13	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	117.6	172.8	29.5	-36.1	0	0	0	109.8	Y404 Y487 A712 L717	Y404-P500 HydrophobicContact CE2-CG 4.28Å; Y487-P500 HydrophobicContact CE2-CB 3.94Å; P500-A712 WeakPolarHBondContact CD-O 3.1Å; P500-L717 HydrophobicContact CB-CD1 3.92Å; P500-L717 HydrophobicContact CB-CD2 3.47Å; P500-L717 VanDerWaalsContact CB-CD2 3.47Å; P500-L717 HydrophobicContact CB-CG 4.36Å; P500-L717 HydrophobicContact CG-CD1 3.88Å; P500-L717 HydrophobicContact CG-CD2 3.82Å; P500-L717 HydrophobicContact CG-CG 4.5Å
501	T	83.5	Confident	76.7	Confident	29 Å²	29	67 Å²	67	18%	0.178	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129.5	179.3	53.4	0	0	0	0	110.8	Y487 K488 R490 I499	Y487-T501 WeakPolarHBondContact CA-O 3.38Å; K488-T501 WeakPolarHBondContact CE-OG1 3.27Å; K488-T501 WeakPolarHBondContact CG-OG1 3.03Å; K488-T501 PolarHBondContact N-O 3.1Å; K488-T501 VanDerWaalsContact N-O 3.08Å; K488-T501 PolarHBondContact O-N 2.73Å; K488-T501 PolarHBondContact O-OG1 3.1Å; R490-T501 HydrophobicContact CB-CG2 4.44Å; I499-T501 PolarHBondContact O-N 3.21Å
502	L	87.2	Confident	77.8	Confident	21 Å²	21	60.4 Å²	60.4	11%	0.11	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	103.4	178.4	-176.1	72.4	0	0	0	107.7	M358 W485 G486 Y487 F550 W566	M358-L502 HydrophobicContact SD-CD1 4.45Å; M358-L502 HydrophobicContact SD-CD2 3.56Å; M358-L502 VanDerWaalsContact SD-CD2 3.56Å; W485-L502 HydrophobicContact CB-CD1 4.1Å; W485-L502 HydrophobicContact CB-CG 4.4Å; W485-L502 HydrophobicContact CE3-CG 4.12Å; G486-L502 WeakPolarHBondContact O-CA 3.44Å; Y487-L502 HydrophobicContact CD2-CD1 4.5Å; L502-F550 HydrophobicContact CD1-CD2 3.77Å; L502-F550 HydrophobicContact CD1-CE2 4.08Å; L502-W566 HydrophobicContact CD2-CH2 4.05Å; L502-W566 HydrophobicContact CD2-CZ3 4.38Å
503	E	90	Very high	78.9	Confident	50 Å²	50	68 Å²	68	23%	0.234	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.3	-169.2	-68.6	170.3	-145.9	0	0	110.9	W485 G486 K488 L505 Y538 F546	W485-E503 CarbonylContact C-O 3.56Å; W485-E503 VanDerWaalsContact CA-O 3.26Å; W485-E503 WeakPolarHBondContact CA-O 3.34Å; G486-E503 PolarHBondContact N-O 2.96Å; G486-E503 PolarHBondContact O-N 3Å; K488-E503 WeakPolarHBondContact CE-OE1 3.47Å; K488-E503 IonicContact NZ-OE1 3.39Å; K488-E503 PolarHBondContact NZ-OE1 3.08Å; K488-E503 IonicContact NZ-OE2 2.82Å; K488-E503 PolarHBondContact NZ-OE2 2.92Å; E503-L505 PolarHBondContact O-N 3.17Å; E503-Y538 WeakPolarHBondContact CB-OH 3.28Å; E503-Y538 PolarHBondContact OE2-OH 2.82Å; E503-F546 HydrophobicContact CB-CE1 4.02Å; E503-F546 HydrophobicContact CB-CZ 4.03Å; E503-F546 HydrophobicContact CG-CE1 4.42Å; E503-F546 HydrophobicContact CG-CZ 4.49Å; E503-F546 WeakPolarHBondContact OE2-CZ 3.46Å
504	L	92.1	Very high	79.9	Confident	73 Å²	73	63 Å²	63	38%	0.382	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	111	175.1	171.2	62.7	0	0	0	109.5	T483 W485	T483-L504 HydrophobicContact CG2-CD1 4.04Å; W485-L504 HydrophobicContact CD2-CB 4.19Å; W485-L504 HydrophobicContact CD2-CD1 4.49Å; W485-L504 HydrophobicContact CE3-CB 4.18Å; W485-L504 HydrophobicContact CH2-CB 4.07Å; W485-L504 HydrophobicContact CZ2-CB 4.06Å; W485-L504 HydrophobicContact CZ2-CD1 4.31Å; W485-L504 HydrophobicContact CZ3-CB 4.13Å
505	L	93.1	Very high	80.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-30.5	-179.3	-56.6	-175.3	0	0	0	112.8	L484 E503 L533 T536 Y538 L543 F546 I572	L484-L505 HydrophobicContact CB-CB 4.48Å; L484-L505 HydrophobicContact CD2-CB 4.31Å; L484-L505 HydrophobicContact CD2-CD1 4Å; L484-L505 HydrophobicContact CG-CB 4.37Å; L484-L505 HydrophobicContact CG-CD1 4.19Å; L484-L505 PolarHBondContact O-N 2.7Å; E503-L505 PolarHBondContact O-N 3.17Å; L505-L533 HydrophobicContact CB-CD2 3.99Å; L505-T536 VanDerWaalsContact O-CA 3.29Å; L505-T536 WeakPolarHBondContact O-CA 3.38Å; L505-T536 WeakPolarHBondContact O-CB 3.39Å; L505-T536 PolarHBondContact O-OG1 2.73Å; L505-Y538 HydrophobicContact CD2-CD2 3.94Å; L505-Y538 HydrophobicContact CD2-CE2 3.77Å; L505-L543 HydrophobicContact CB-CD2 4.27Å; L505-L543 HydrophobicContact CD1-CD2 4Å; L505-L543 HydrophobicContact CD2-CD2 4.17Å; L505-L543 HydrophobicContact CG-CD2 4.37Å; L505-F546 HydrophobicContact CD2-CD2 3.96Å; L505-F546 HydrophobicContact CD2-CE1 4.08Å; L505-F546 HydrophobicContact CD2-CE2 3.48Å; L505-F546 VanDerWaalsContact CD2-CE2 3.48Å; L505-F546 HydrophobicContact CD2-CG 4.43Å; L505-F546 HydrophobicContact CD2-CZ 3.49Å; L505-F546 VanDerWaalsContact CD2-CZ 3.49Å; L505-I572 HydrophobicContact CD1-CD1 3.72Å
506	G	92.6	Very high	81.2	Confident	4 Å²	4	53.5 Å²	53.5	4%	0.041	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.2	-166.4	179.9	0	0	0	0	0	113.7	T483 L484 E534	T483-G506 WeakPolarHBondContact CA-O 3.2Å; L484-G506 PolarHBondContact N-O 2.81Å; G506-E534 WeakPolarHBondContact CA-O 3.25Å
507	K	91.9	Very high	81.5	Confident	63 Å²	63	53.7 Å²	53.7	27%	0.274	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	143.2	-175.7	-59.2	162.6	-178.2	178	0	110.6	Q481 T483 E534 D535	Q481-K507 VanDerWaalsContact NE2-CD 3.32Å; T483-K507 HydrophobicContact CG2-CG 4.33Å; K507-E534 HydrophobicContact CB-CB 4.09Å; K507-E534 PolarHBondContact N-O 3.04Å; K507-E534 PolarHBondContact O-N 2.77Å; K507-D535 HydrophobicContact CD-CB 4.12Å; K507-D535 WeakPolarHBondContact CD-OD2 3.47Å; K507-D535 WeakPolarHBondContact CE-OD2 3.38Å; K507-D535 IonicContact NZ-OD2 3.45Å; K507-D535 PolarHBondContact NZ-OD2 2.92Å
508	I	91.5	Very high	81.4	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.026	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-29.9	177.8	-64.6	161.7	0	0	0	110.9	L482 L484 Y525 I527 V531 L533 L551 F575	L482-I508 HydrophobicContact CD2-CB 4.02Å; L482-I508 HydrophobicContact CD2-CG2 3.8Å; L482-I508 HydrophobicContact CG-CB 4.22Å; L482-I508 PolarHBondContact O-N 3.15Å; L484-I508 HydrophobicContact CB-CD1 3.84Å; L484-I508 HydrophobicContact CB-CG1 4.35Å; L484-I508 HydrophobicContact CD1-CD1 4.31Å; I508-Y525 PolarHBondContact O-OH 3.14Å; I508-I527 HydrophobicContact CG2-CG2 4.5Å; I508-V531 HydrophobicContact CG2-CG2 3.84Å; I508-L533 HydrophobicContact CG1-CD1 4.09Å; I508-L551 HydrophobicContact CD1-CD2 3.39Å; I508-F575 HydrophobicContact CD1-CD1 4.19Å; I508-F575 HydrophobicContact CD1-CE1 3.44Å; I508-F575 VanDerWaalsContact CD1-CE1 3.44Å; I508-F575 HydrophobicContact CD1-CZ 3.66Å; I508-F575 HydrophobicContact CG1-CD1 4.26Å; I508-F575 HydrophobicContact CG1-CE1 3.85Å; I508-F575 HydrophobicContact CG2-CE1 4.44Å
509	G	88	Confident	80.5	Confident	5 Å²	5	62 Å²	62	5%	0.052	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	145.1	174.6	0	0	0	0	0	111.2	Q481 L482	Q481-G509 WeakPolarHBondContact CA-O 3.4Å; L482-G509 PolarHBondContact N-O 3.16Å; L482-G509 PolarHBondContact O-N 2.73Å
510	S	86.9	Confident	79.6	Confident	65 Å²	65	65 Å²	65	46%	0.455	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	160.6	178.2	61.5	0	0	0	0	110.7	I512	S510-I512 PolarHBondContact O-N 3.21Å
511	N	85.9	Confident	79.2	Confident	84 Å²	84	67 Å²	67	45%	0.449	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.4	38.1	-178.7	-163.2	3.2	0	0	0	113.6	Q479 L480 R513 M556	Q479-N511 VanDerWaalsContact CG-OD1 3.29Å; Q479-N511 WeakPolarHBondContact CG-OD1 3.28Å; Q479-N511 PolarHBondContact NE2-OD1 2.7Å; Q479-N511 PolarHBondContact OE1-OD1 3.16Å; L480-N511 PolarHBondContact O-N 3.07Å; N511-R513 PolarHBondContact O-N 2.88Å; N511-M556 HydrophobicContact CB-CE 4.25Å; N511-M556 HydrophobicContact CB-SD 4.41Å; N511-M556 PolarHBondContact N-SD 2.7Å
512	I	87.4	Confident	79	Confident	14 Å²	14	69.1 Å²	69.1	7%	0.072	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	120.4	175.2	-59	169.9	0	0	0	107.4	W464 L480 L482 S510 N514 Y525 L553	W464-I512 HydrophobicContact CH2-CG2 3.78Å; W464-I512 HydrophobicContact CZ2-CG2 4.17Å; L480-I512 HydrophobicContact CB-CB 4.18Å; L480-I512 PolarHBondContact N-O 3.31Å; L480-I512 WeakPolarHBondContact O-CB 3.28Å; L480-I512 PolarHBondContact O-N 3.29Å; L482-I512 HydrophobicContact CB-CD1 3.91Å; S510-I512 PolarHBondContact O-N 3.21Å; I512-N514 PolarHBondContact O-N 3.14Å; I512-Y525 HydrophobicContact CD1-CD1 4.31Å; I512-Y525 HydrophobicContact CD1-CD2 3.76Å; I512-Y525 HydrophobicContact CD1-CE1 4.36Å; I512-Y525 HydrophobicContact CD1-CE2 3.83Å; I512-Y525 HydrophobicContact CD1-CG 4.01Å; I512-Y525 HydrophobicContact CG1-CD2 3.9Å; I512-Y525 HydrophobicContact CG1-CE2 3.88Å; I512-Y525 HydrophobicContact CG2-CD2 4.14Å; I512-L553 HydrophobicContact CD1-CD1 4.43Å
513	R	83.2	Confident	78.9	Confident	210 Å²	210	68.2 Å²	68.2	79%	0.792	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	119	-178	-76.6	-178.7	-96.2	176.9	-6.2	110.9	N511	N511-R513 PolarHBondContact O-N 2.88Å
514	N	81.4	Confident	78.8	Confident	6 Å²	6	69.4 Å²	69.4	3%	0.032	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-67.1	129.4	166.2	-158.6	38	0	0	0	109.4	W464 A466 T470 S478 L480 I512	W464-N514 PolarHBondContact NE1-OD1 3.45Å; A466-N514 WeakPolarHBondContact CA-OD1 3.2Å; A466-N514 PolarHBondContact O-ND2 3.37Å; T470-N514 PolarHBondContact OG1-ND2 2.95Å; S478-N514 PolarHBondContact O-N 3.48Å; L480-N514 HydrophobicContact CD1-CB 4.05Å; L480-N514 HydrophobicContact CG-CB 4.32Å; I512-N514 PolarHBondContact O-N 3.14Å
515	P	77.1	Confident	78.8	Confident	35 Å²	35	68.8 Å²	68.8	23%	0.227	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-69.4	148.8	177.9	29	-34.3	0	0	0	111.3	A466	A466-P515 HydrophobicContact CB-CG 4.02Å
516	M	63.1	Low	78.7	Confident	96 Å²	96	73.6 Å²	73.6	47%	0.473	34%	0.34	S	S	.	.			trans	-122.5	13.3	179.8	-50.4	-156.2	-36.5	0	0	113.9	F474 S477	F474-M516 WeakPolarHBondContact O-CE 3.48Å; S477-M516 PolarHBondContact N-SD 3.25Å
517	E	61.4	Low	78.5	Confident	123 Å²	123	73.7 Å²	73.7	58%	0.575	34%	0.34	S	S	*	.			trans	-77.2	125.2	178	-64.3	177.7	156.7	0	0	109.9	Y519 R520	E517-Y519 PolarHBondContact O-N 2.96Å; E517-R520 HydrophobicContact CB-CB 4.05Å; E517-R520 PolarHBondContact O-N 3.03Å
518	K	52.9	Low	78.3	Confident	116 Å²	116	72.8 Å²	72.8	50%	0.504	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-6.9	-178.8	-166.3	177.4	178.7	-173.4	0	114.7	D187 N521	D187-K518 VanDerWaalsContact CG-NZ 3.29Å; D187-K518 IonicContact OD1-NZ 2.77Å; D187-K518 PolarHBondContact OD1-NZ 3.22Å; D187-K518 VanDerWaalsContact OD1-NZ 3.12Å; D187-K518 IonicContact OD2-NZ 2.88Å; D187-K518 PolarHBondContact OD2-NZ 3.28Å; K518-N521 PolarHBondContact O-OD1 3.35Å
519	Y	48.9	Very low	77.7	Confident	213 Å²	213	75.1 Å²	75.1	84%	0.835	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	-4.4	179	-54	-66.3	0	0	0	113.8	E517	E517-Y519 PolarHBondContact O-N 2.96Å
520	R	54.7	Low	77.3	Confident	132 Å²	132	81 Å²	81	50%	0.498	38%	0.384	S	S	.	.			trans	-127.9	55	-176.8	-160.2	175.1	178.6	165.3	-0.9	110.4	E517 I522 E524	E517-R520 HydrophobicContact CB-CB 4.05Å; E517-R520 PolarHBondContact O-N 3.03Å; R520-I522 PolarHBondContact O-N 2.89Å; R520-E524 IonicContact CZ-OE1 2.8Å; R520-E524 IonicContact NH2-OE1 3.85Å; R520-E524 PolarHBondContact NH2-OE1 2.94Å
521	N	69.6	Low	77.1	Confident	64 Å²	64	79.2 Å²	79.2	34%	0.342	37%	0.37	S	S	.	.			trans	-67.9	15	-176.4	-52.4	26.6	0	0	0	114.1	Y465 A466 K518	Y465-N521 CarbonylContact C-O 3.52Å; Y465-N521 WeakPolarHBondContact CA-O 3.15Å; A466-N521 PolarHBondContact N-O 2.7Å; K518-N521 PolarHBondContact O-OD1 3.35Å
522	I	79.8	Confident	76.8	Confident	73 Å²	73	83 Å²	83	37%	0.374	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	113	-178.5	-55.2	177.4	0	0	0	107.9	M463 W464 Y465 R520	M463-I522 HydrophobicContact CB-CG2 4.26Å; M463-I522 HydrophobicContact CE-CG2 3.6Å; W464-I522 CarbonylContact O-C 3.58Å; W464-I522 WeakPolarHBondContact O-CA 3.49Å; Y465-I522 HydrophobicContact CD1-CG1 4.24Å; Y465-I522 HydrophobicContact CE1-CD1 4.48Å; Y465-I522 HydrophobicContact CE1-CG1 4.25Å; R520-I522 PolarHBondContact O-N 2.89Å
523	G	85.8	Confident	76.9	Confident	1 Å²	1	83.5 Å²	83.5	1%	0.01	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	149.2	168.8	0	0	0	0	0	111.2	M463 W464	M463-G523 VanDerWaalsContact CA-O 3.28Å; M463-G523 WeakPolarHBondContact CA-O 3.44Å; W464-G523 PolarHBondContact N-O 3Å; W464-G523 PolarHBondContact O-N 3.09Å
524	E	88.8	Confident	77.1	Confident	76 Å²	76	78.2 Å²	78.2	36%	0.355	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	141.8	179.6	62.5	-165.7	155.4	0	0	110.7	K461 I462 M463 R520	K461-E524 WeakPolarHBondContact CE-OE2 3.35Å; K461-E524 IonicContact NZ-OE2 2.58Å; K461-E524 PolarHBondContact NZ-OE2 2.99Å; I462-E524 WeakPolarHBondContact O-CA 3.44Å; M463-E524 HydrophobicContact CG-CB 4.2Å; R520-E524 IonicContact CZ-OE1 2.8Å; R520-E524 IonicContact NH2-OE1 3.85Å; R520-E524 PolarHBondContact NH2-OE1 2.94Å
525	Y	91	Very high	77.4	Confident	59 Å²	59	83.6 Å²	83.6	23%	0.231	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	135.7	172.3	-179.7	-102	0	0	0	109.1	I462 L482 I508 I512 I527	I462-Y525 HydrophobicContact CD1-CD1 4.03Å; I462-Y525 HydrophobicContact CG1-CD1 4.17Å; I462-Y525 HydrophobicContact CG1-CG 4.5Å; I462-Y525 WeakPolarHBondContact CG1-O 3.4Å; I462-Y525 PolarHBondContact N-O 3.43Å; I462-Y525 PolarHBondContact O-N 2.86Å; L482-Y525 HydrophobicContact CD2-CD1 3.86Å; L482-Y525 HydrophobicContact CD2-CE1 3.8Å; I508-Y525 PolarHBondContact O-OH 3.14Å; I512-Y525 HydrophobicContact CD1-CD1 4.31Å; I512-Y525 HydrophobicContact CD1-CD2 3.76Å; I512-Y525 HydrophobicContact CD1-CE1 4.36Å; I512-Y525 HydrophobicContact CD1-CE2 3.83Å; I512-Y525 HydrophobicContact CD1-CG 4.01Å; I512-Y525 HydrophobicContact CG1-CD2 3.9Å; I512-Y525 HydrophobicContact CG1-CE2 3.88Å; I512-Y525 HydrophobicContact CG2-CD2 4.14Å; Y525-I527 HydrophobicContact CD1-CG1 3.76Å; Y525-I527 HydrophobicContact CE1-CG1 3.83Å
526	I	90.5	Very high	77.9	Confident	102 Å²	102	84.4 Å²	84.4	52%	0.523	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	118.8	-175.3	-62.2	176.3	0	0	0	108.1	N459 L460	N459-I526 HydrophobicContact CB-CG2 3.57Å; L460-I526 CarbonylContact O-C 3.59Å; L460-I526 WeakPolarHBondContact O-CA 3.41Å
527	I	89.3	Confident	79.1	Confident	6 Å²	6	84.8 Å²	84.8	3%	0.031	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	109	-177.8	-58.9	174.9	0	0	0	107.2	W451 L460 I462 L482 I508 Y525 V531 L551	W451-I527 HydrophobicContact CH2-CD1 3.69Å; W451-I527 HydrophobicContact CZ2-CD1 4.17Å; L460-I527 HydrophobicContact CB-CB 4.27Å; L460-I527 PolarHBondContact N-O 3.14Å; L460-I527 PolarHBondContact O-N 3.01Å; I462-I527 HydrophobicContact CD1-CD1 4.4Å; I462-I527 HydrophobicContact CG1-CD1 4.34Å; I462-I527 HydrophobicContact CG2-CD1 3.77Å; L482-I527 HydrophobicContact CD2-CD1 4.04Å; L482-I527 HydrophobicContact CD2-CG1 4.43Å; I508-I527 HydrophobicContact CG2-CG2 4.5Å; Y525-I527 HydrophobicContact CD1-CG1 3.76Å; Y525-I527 HydrophobicContact CE1-CG1 3.83Å; I527-V531 HydrophobicContact CG2-CB 4.37Å; I527-V531 HydrophobicContact CG2-CG1 3.68Å; I527-L551 HydrophobicContact CD1-CD1 4.11Å
528	S	86.4	Confident	80.4	Confident	44 Å²	44	81.4 Å²	81.4	31%	0.308	40%	0.395	S	S	.	.			trans	-65.4	146	177	179.8	0	0	0	0	111.4	N459 D530 V531	N459-S528 WeakPolarHBondContact OD1-CA 3.22Å; S528-D530 PolarHBondContact O-N 2.81Å; S528-D530 VanDerWaalsContact O-N 3.15Å; S528-D530 PolarHBondContact OG-N 3Å; S528-V531 VanDerWaalsContact O-CB 3.28Å; S528-V531 WeakPolarHBondContact O-CB 3.21Å; S528-V531 VanDerWaalsContact O-CG1 3.27Å; S528-V531 WeakPolarHBondContact O-CG1 3.49Å; S528-V531 PolarHBondContact O-N 2.78Å
529	N	79.4	Confident	82.1	Confident	53 Å²	53	78.6 Å²	78.6	28%	0.283	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.3	171.1	-74.7	-18	0	0	0	113.3	G458 N459 R574 R578	G458-N529 PolarHBondContact O-ND2 2.83Å; G458-N529 PolarHBondContact O-OD1 2.82Å; N459-N529 PolarHBondContact OD1-N 3.16Å; N529-R574 PolarHBondContact OD1-NH2 3.35Å; N529-R578 PolarHBondContact O-NH1 2.85Å
530	D	79.1	Confident	83.8	Confident	130 Å²	130	72.7 Å²	72.7	70%	0.695	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	0.1	175.8	-57.8	-47.8	0	0	0	114.1	S528 K532	S528-D530 PolarHBondContact O-N 2.81Å; S528-D530 VanDerWaalsContact O-N 3.15Å; S528-D530 PolarHBondContact OG-N 3Å; D530-K532 PolarHBondContact O-N 3.08Å
531	V	83.3	Confident	85.2	Confident	26 Å²	26	72 Å²	72	16%	0.158	38%	0.375	C	S	.	.			trans	-59	126.6	-172.5	74.2	0	0	0	0	111.7	I508 I527 S528 F575 R578	I508-V531 HydrophobicContact CG2-CG2 3.84Å; I527-V531 HydrophobicContact CG2-CB 4.37Å; I527-V531 HydrophobicContact CG2-CG1 3.68Å; S528-V531 VanDerWaalsContact O-CB 3.28Å; S528-V531 WeakPolarHBondContact O-CB 3.21Å; S528-V531 VanDerWaalsContact O-CG1 3.27Å; S528-V531 WeakPolarHBondContact O-CG1 3.49Å; S528-V531 PolarHBondContact O-N 2.78Å; V531-F575 HydrophobicContact CG1-CD1 4.33Å; V531-F575 HydrophobicContact CG1-CE1 4.28Å; V531-R578 PolarHBondContact O-NH1 3.04Å; V531-R578 PolarHBondContact O-NH2 3.44Å
532	K	80.7	Confident	86.1	Confident	165 Å²	165	73.3 Å²	73.3	72%	0.717	38%	0.379	S	S	*	.			trans	-96.9	153.3	177.3	-68.1	-176.3	-179.8	178.8	0	110.6	D530 E534	D530-K532 PolarHBondContact O-N 3.08Å; K532-E534 PolarHBondContact O-N 3.15Å
533	L	87.6	Confident	86.4	Confident	23 Å²	23	70.4 Å²	70.4	12%	0.12	36%	0.364	C	S	.	.			trans	-82.7	108.8	174.5	-167.9	67.2	0	0	0	108.9	L484 L505 I508 T536	L484-L533 HydrophobicContact CB-CD1 3.77Å; L484-L533 HydrophobicContact CD2-CD1 3.88Å; L484-L533 HydrophobicContact CD2-CD2 4.12Å; L505-L533 HydrophobicContact CB-CD2 3.99Å; I508-L533 HydrophobicContact CG1-CD1 4.09Å; L533-T536 HydrophobicContact CD2-CG2 4.48Å
534	E	88.2	Confident	86.3	Confident	99 Å²	99	72.2 Å²	72.2	46%	0.463	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-79.2	151.9	178.1	-64.3	176.6	161.7	0	0	111	G506 K507 K532 T536	G506-E534 WeakPolarHBondContact CA-O 3.25Å; K507-E534 HydrophobicContact CB-CB 4.09Å; K507-E534 PolarHBondContact N-O 3.04Å; K507-E534 PolarHBondContact O-N 2.77Å; K532-E534 PolarHBondContact O-N 3.15Å; E534-T536 PolarHBondContact O-N 2.91Å; E534-T536 VanDerWaalsContact O-N 3.1Å
535	D	87.1	Confident	86.1	Confident	120 Å²	120	71.2 Å²	71.2	64%	0.642	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	31.5	178.2	-61	-15.1	0	0	0	115.4	K507 P537	K507-D535 HydrophobicContact CD-CB 4.12Å; K507-D535 WeakPolarHBondContact CD-OD2 3.47Å; K507-D535 WeakPolarHBondContact CE-OD2 3.38Å; K507-D535 IonicContact NZ-OD2 3.45Å; K507-D535 PolarHBondContact NZ-OD2 2.92Å; D535-P537 WeakPolarHBondContact O-CD 3.06Å
536	T	88.7	Confident	86	Confident	51 Å²	51	68.4 Å²	68.4	31%	0.313	36%	0.36	S	S	.	.			trans	-76.7	126.8	177	-167.8	0	0	0	0	111.6	L505 L533 E534 Y538	L505-T536 VanDerWaalsContact O-CA 3.29Å; L505-T536 WeakPolarHBondContact O-CA 3.38Å; L505-T536 WeakPolarHBondContact O-CB 3.39Å; L505-T536 PolarHBondContact O-OG1 2.73Å; L533-T536 HydrophobicContact CD2-CG2 4.48Å; E534-T536 PolarHBondContact O-N 2.91Å; E534-T536 VanDerWaalsContact O-N 3.1Å; T536-Y538 VanDerWaalsContact C-N 3.35Å
537	P	88.1	Confident	85.7	Confident	105 Å²	105	64.1 Å²	64.1	68%	0.682	34%	0.337	S	S	*	.			trans	-87.1	-4.3	175.3	35.2	-35.7	0	0	0	113.2	D535	D535-P537 WeakPolarHBondContact O-CD 3.06Å
538	Y	87.7	Confident	85.8	Confident	51 Å²	51	63.8 Å²	63.8	20%	0.2	34%	0.336	C	S	.	.	S	Bend	trans	-96.1	142.2	-172.8	-62.6	-85.6	0	0	0	112.2	E503 L505 T536 E542 L543 F546	E503-Y538 WeakPolarHBondContact CB-OH 3.28Å; E503-Y538 PolarHBondContact OE2-OH 2.82Å; L505-Y538 HydrophobicContact CD2-CD2 3.94Å; L505-Y538 HydrophobicContact CD2-CE2 3.77Å; T536-Y538 VanDerWaalsContact C-N 3.35Å; Y538-E542 HydrophobicContact CD1-CB 4.08Å; Y538-L543 HydrophobicContact CG-CD2 4.42Å; Y538-F546 HydrophobicContact CD1-CE2 4.35Å; Y538-F546 HydrophobicContact CE1-CE2 4.18Å; Y538-F546 HydrophobicContact CE1-CZ 4.18Å
539	S	89.5	Confident	86	Confident	57 Å²	57	61.7 Å²	61.7	40%	0.399	32%	0.321	S	S	.	.			trans	-72.9	162.1	166.2	68.1	0	0	0	0	111.9	N541 E542 L543	S539-N541 VanDerWaalsContact C-N 3.28Å; S539-N541 PolarHBondContact O-N 3.04Å; S539-E542 VanDerWaalsContact CB-OE2 3.27Å; S539-E542 WeakPolarHBondContact CB-OE2 3.46Å; S539-E542 PolarHBondContact N-OE2 2.96Å; S539-E542 PolarHBondContact O-N 3.27Å; S539-E542 WeakPolarHBondContact OG-CG 3.01Å; S539-E542 PolarHBondContact OG-OE2 3.43Å; S539-L543 PolarHBondContact O-N 2.7Å
540	F	84.2	Confident	86.7	Confident	90 Å²	90	59.2 Å²	59.2	40%	0.395	31%	0.308	S	S	.	.	H	α-helix	trans	-52.3	-45.4	176.5	-177.8	-92.2	0	0	0	112.5	E542 L543 Q544 F576	F540-E542 VanDerWaalsContact C-N 3.28Å; F540-E542 PolarHBondContact O-N 2.96Å; F540-L543 WeakPolarHBondContact O-CB 3.33Å; F540-L543 PolarHBondContact O-N 2.82Å; F540-Q544 HydrophobicContact CD1-CG 4.33Å; F540-Q544 HydrophobicContact CE1-CG 4.1Å; F540-Q544 WeakPolarHBondContact O-CG 3.14Å; F540-Q544 PolarHBondContact O-N 2.87Å; F540-F576 HydrophobicContact CD2-CB 4.07Å; F540-F576 HydrophobicContact CD2-CD2 4.13Å; F540-F576 HydrophobicContact CD2-CG 4.47Å; F540-F576 HydrophobicContact CE2-CB 4.04Å; F540-F576 AromaticContact CE2-CD2 3.63Å; F540-F576 HydrophobicContact CE2-CD2 3.63Å; F540-F576 HydrophobicContact CE2-CG 4.29Å; F540-F576 HydrophobicContact CZ-CD2 4.13Å
541	N	85	Confident	87.4	Confident	117 Å²	117	53 Å²	53	63%	0.626	28%	0.275	S	S	*	.	H	α-helix	trans	-65.7	-30	-179.7	-60.5	24.2	0	0	0	112.4	S539	S539-N541 VanDerWaalsContact C-N 3.28Å; S539-N541 PolarHBondContact O-N 3.04Å
542	E	86.9	Confident	87.8	Confident	91 Å²	91	52.2 Å²	52.2	43%	0.425	27%	0.269	S	S	.	.	H	α-helix	trans	-77.4	-37.6	174.8	-69.8	165.2	114.6	0	0	111.6	Y538 S539 F540 Q544 T545 F546	Y538-E542 HydrophobicContact CD1-CB 4.08Å; S539-E542 VanDerWaalsContact CB-OE2 3.27Å; S539-E542 WeakPolarHBondContact CB-OE2 3.46Å; S539-E542 PolarHBondContact N-OE2 2.96Å; S539-E542 PolarHBondContact O-N 3.27Å; S539-E542 WeakPolarHBondContact OG-CG 3.01Å; S539-E542 PolarHBondContact OG-OE2 3.43Å; F540-E542 VanDerWaalsContact C-N 3.28Å; F540-E542 PolarHBondContact O-N 2.96Å; E542-Q544 VanDerWaalsContact C-N 3.26Å; E542-Q544 PolarHBondContact O-N 2.84Å; E542-T545 WeakPolarHBondContact O-CB 3.32Å; E542-T545 PolarHBondContact O-N 2.83Å; E542-T545 PolarHBondContact O-OG1 3.29Å; E542-F546 WeakPolarHBondContact O-CD2 3.49Å
543	L	87.4	Confident	88.3	Confident	13 Å²	13	44.4 Å²	44.4	7%	0.068	24%	0.235	C	C	.	.	H	α-helix	trans	-59	-39.2	171.8	-67.1	171.9	0	0	0	111	L505 Y538 S539 F540 T545 F546 F576	L505-L543 HydrophobicContact CB-CD2 4.27Å; L505-L543 HydrophobicContact CD1-CD2 4Å; L505-L543 HydrophobicContact CD2-CD2 4.17Å; L505-L543 HydrophobicContact CG-CD2 4.37Å; Y538-L543 HydrophobicContact CG-CD2 4.42Å; S539-L543 PolarHBondContact O-N 2.7Å; F540-L543 WeakPolarHBondContact O-CB 3.33Å; F540-L543 PolarHBondContact O-N 2.82Å; L543-T545 PolarHBondContact O-N 3.38Å; L543-T545 VanDerWaalsContact O-N 3.08Å; L543-F546 PolarHBondContact O-N 3.04Å; L543-F546 VanDerWaalsContact O-N 3.1Å; L543-F576 HydrophobicContact CB-CD1 3.95Å; L543-F576 HydrophobicContact CB-CE1 3.86Å; L543-F576 HydrophobicContact CB-CG 4.49Å; L543-F576 HydrophobicContact CB-CZ 4.34Å; L543-F576 HydrophobicContact CD1-CB 4.43Å; L543-F576 HydrophobicContact CD1-CD1 4.2Å
544	Q	83.6	Confident	88.3	Confident	38 Å²	38	43.7 Å²	43.7	18%	0.178	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-3.4	172.3	-68.6	179.2	-61.4	0	0	115.2	F540 E542 F576 Y586 R593	F540-Q544 HydrophobicContact CD1-CG 4.33Å; F540-Q544 HydrophobicContact CE1-CG 4.1Å; F540-Q544 WeakPolarHBondContact O-CG 3.14Å; F540-Q544 PolarHBondContact O-N 2.87Å; E542-Q544 VanDerWaalsContact C-N 3.26Å; E542-Q544 PolarHBondContact O-N 2.84Å; Q544-F576 HydrophobicContact CG-CE2 3.86Å; Q544-F576 HydrophobicContact CG-CZ 4.39Å; Q544-Y586 HydrophobicContact CB-CE2 4.32Å; Q544-Y586 HydrophobicContact CG-CD2 4.49Å; Q544-Y586 HydrophobicContact CG-CE2 4Å; Q544-Y586 VanDerWaalsContact NE2-CD2 3.29Å; Q544-R593 PolarHBondContact O-NH2 2.84Å
545	T	84.6	Confident	88.1	Confident	55 Å²	55	40.8 Å²	40.8	34%	0.337	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-13.9	171.2	69.8	0	0	0	0	113.3	E542 L543	E542-T545 WeakPolarHBondContact O-CB 3.32Å; E542-T545 PolarHBondContact O-N 2.83Å; E542-T545 PolarHBondContact O-OG1 3.29Å; L543-T545 PolarHBondContact O-N 3.38Å; L543-T545 VanDerWaalsContact O-N 3.08Å
546	F	88.3	Confident	87.6	Confident	1 Å²	1	37.7 Å²	37.7	0%	0.004	20%	0.203	C	C	.	.			trans	-101.8	115.4	176.3	-57.7	-96.5	0	0	0	109	K488 E503 L505 Y538 E542 L543 I572	K488-F546 HydrophobicContact CB-CD1 4.05Å; K488-F546 HydrophobicContact CD-CD1 3.71Å; K488-F546 HydrophobicContact CD-CE1 3.58Å; K488-F546 HydrophobicContact CD-CG 4.28Å; K488-F546 HydrophobicContact CD-CZ 4.05Å; K488-F546 HydrophobicContact CG-CD1 3.93Å; K488-F546 HydrophobicContact CG-CE1 4.01Å; K488-F546 VanDerWaalsContact NZ-CE1 3.33Å; E503-F546 HydrophobicContact CB-CE1 4.02Å; E503-F546 HydrophobicContact CB-CZ 4.03Å; E503-F546 HydrophobicContact CG-CE1 4.42Å; E503-F546 HydrophobicContact CG-CZ 4.49Å; E503-F546 WeakPolarHBondContact OE2-CZ 3.46Å; L505-F546 HydrophobicContact CD2-CD2 3.96Å; L505-F546 HydrophobicContact CD2-CE1 4.08Å; L505-F546 HydrophobicContact CD2-CE2 3.48Å; L505-F546 VanDerWaalsContact CD2-CE2 3.48Å; L505-F546 HydrophobicContact CD2-CG 4.43Å; L505-F546 HydrophobicContact CD2-CZ 3.49Å; L505-F546 VanDerWaalsContact CD2-CZ 3.49Å; Y538-F546 HydrophobicContact CD1-CE2 4.35Å; Y538-F546 HydrophobicContact CE1-CE2 4.18Å; Y538-F546 HydrophobicContact CE1-CZ 4.18Å; E542-F546 WeakPolarHBondContact O-CD2 3.49Å; L543-F546 PolarHBondContact O-N 3.04Å; L543-F546 VanDerWaalsContact O-N 3.1Å; F546-I572 HydrophobicContact CB-CD1 3.59Å; F546-I572 VanDerWaalsContact O-CD1 3.28Å; F546-I572 WeakPolarHBondContact O-CD1 3.37Å; F546-I572 WeakPolarHBondContact O-CG1 3.45Å
547	R	84.9	Confident	86.5	Confident	11 Å²	11	41.6 Å²	41.6	4%	0.042	22%	0.222	C	C	.	.			trans	-75.8	-47.5	178.8	-66.6	-178	173.6	136.7	3.8	111.5	E590 E597 Y724 L728	R547-E590 IonicContact CZ-OE1 2.67Å; R547-E590 IonicContact NE-OE1 3.74Å; R547-E590 PolarHBondContact NE-OE1 3.47Å; R547-E590 IonicContact NH2-OE1 2.76Å; R547-E590 PolarHBondContact NH2-OE1 2.63Å; R547-E597 IonicContact CZ-OE2 2.69Å; R547-E597 IonicContact NH1-OE1 2.81Å; R547-E597 IonicContact NH1-OE2 3.71Å; R547-E597 PolarHBondContact NH1-OE2 3.48Å; R547-E597 IonicContact NH2-OE2 3.46Å; R547-E597 PolarHBondContact NH2-OE2 3.35Å; R547-Y724 HydrophobicContact CB-CD2 4.08Å; R547-Y724 HydrophobicContact CB-CE2 4.12Å; R547-Y724 HydrophobicContact CG-CD2 4.45Å; R547-Y724 HydrophobicContact CG-CE2 4.08Å; R547-L728 HydrophobicContact CB-CD1 3.92Å; R547-L728 WeakPolarHBondContact O-CD1 3.16Å
548	L	90.6	Very high	85	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	163.1	-177.9	75.1	96.9	0	0	0	112.4	Y487 F550 P569 M720 L728	Y487-L548 HydrophobicContact CD1-CD1 4Å; Y487-L548 HydrophobicContact CD1-CD2 3.81Å; Y487-L548 HydrophobicContact CD1-CG 3.89Å; Y487-L548 HydrophobicContact CE1-CD2 4.42Å; Y487-L548 HydrophobicContact CG-CD1 4.02Å; Y487-L548 HydrophobicContact CG-CG 4.32Å; Y487-L548 PolarHBondContact N-O 2.77Å; L548-F550 HydrophobicContact CD1-CD2 4.22Å; L548-F550 HydrophobicContact CD1-CE2 3.39Å; L548-F550 HydrophobicContact CD1-CZ 3.63Å; L548-P569 HydrophobicContact CD1-CB 4.43Å; L548-M720 WeakPolarHBondContact CD2-O 3.29Å; L548-L728 HydrophobicContact CB-CD1 3.57Å
549	G	92	Very high	83.3	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	-173.9	173.1	0	0	0	0	0	112.9	W485 I570	W485-G549 CarbonylContact O-C 3.56Å; W485-G549 WeakPolarHBondContact O-CA 3.42Å; G549-I570 PolarHBondContact N-O 2.79Å; G549-I570 WeakPolarHBondContact O-CG1 3.15Å; G549-I570 PolarHBondContact O-N 2.04Å
550	F	93.1	Very high	81.5	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	145.9	-174.2	-57.4	-88.2	0	0	0	109.9	M358 W485 L502 L548 W566 S567 P569 M720	M358-F550 HydrophobicContact CE-CB 4.02Å; M358-F550 HydrophobicContact CE-CD1 3.49Å; M358-F550 VanDerWaalsContact CE-CD1 3.49Å; M358-F550 HydrophobicContact CE-CD2 4.04Å; M358-F550 HydrophobicContact CE-CE1 3.88Å; M358-F550 HydrophobicContact CE-CE2 4.39Å; M358-F550 HydrophobicContact CE-CG 3.57Å; M358-F550 HydrophobicContact CE-CZ 4.32Å; M358-F550 HydrophobicContact SD-CD2 4.15Å; M358-F550 HydrophobicContact SD-CE2 4.25Å; M358-F550 HydrophobicContact SD-CG 4.29Å; M358-F550 HydrophobicContact SD-CZ 4.49Å; W485-F550 PolarHBondContact N-O 2.98Å; W485-F550 PolarHBondContact O-N 3.38Å; L502-F550 HydrophobicContact CD1-CD2 3.77Å; L502-F550 HydrophobicContact CD1-CE2 4.08Å; L548-F550 HydrophobicContact CD1-CD2 4.22Å; L548-F550 HydrophobicContact CD1-CE2 3.39Å; L548-F550 HydrophobicContact CD1-CZ 3.63Å; F550-W566 HydrophobicContact CB-CE3 4.09Å; F550-W566 HydrophobicContact CB-CZ3 4.43Å; F550-S567 WeakPolarHBondContact CD1-O 3.47Å; F550-P569 HydrophobicContact CE1-CB 3.95Å; F550-P569 HydrophobicContact CE1-CG 3.73Å; F550-P569 HydrophobicContact CZ-CB 4.28Å; F550-P569 HydrophobicContact CZ-CG 4.16Å; F550-M720 HydrophobicContact CE2-CE 4.07Å; F550-M720 HydrophobicContact CZ-CE 3.99Å; F550-M720 HydrophobicContact CZ-CG 4.14Å
551	L	93.1	Very high	80	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	139.4	162.5	-55.1	-173.9	0	0	0	109.5	L443 M445 W451 I462 L482 T483 L484 I508 I527 W566 S567 I570 F575	L443-L551 HydrophobicContact CD2-CB 3.95Å; L443-L551 HydrophobicContact CD2-CD1 3.99Å; M445-L551 HydrophobicContact CE-CD1 3.7Å; M445-L551 HydrophobicContact CE-CG 4.11Å; M445-L551 HydrophobicContact SD-CD1 4.1Å; W451-L551 HydrophobicContact CH2-CD1 3.78Å; W451-L551 HydrophobicContact CZ2-CD1 4.38Å; I462-L551 HydrophobicContact CG2-CD1 4.01Å; L482-L551 HydrophobicContact CD1-CB 4.04Å; L482-L551 HydrophobicContact CD1-CD1 4.22Å; L482-L551 HydrophobicContact CD2-CD1 4.48Å; T483-L551 WeakPolarHBondContact O-CA 3.1Å; L484-L551 HydrophobicContact CD1-CD2 4.03Å; I508-L551 HydrophobicContact CD1-CD2 3.39Å; I527-L551 HydrophobicContact CD1-CD1 4.11Å; L551-W566 CarbonylContact O-C 3.59Å; L551-W566 WeakPolarHBondContact O-CA 3.46Å; L551-S567 PolarHBondContact N-OG 3.06Å; L551-S567 PolarHBondContact O-N 3.27Å; L551-I570 HydrophobicContact CD2-CD1 3.81Å; L551-I570 HydrophobicContact CG-CD1 3.83Å; L551-F575 HydrophobicContact CD2-CZ 4.16Å
552	K	91.8	Very high	78.8	Confident	9 Å²	9	42.1 Å²	42.1	4%	0.039	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	119.9	165.4	-178.4	-176.8	178.3	175.5	0	109.1	D360 T483 W485 A564 L565 W566	D360-K552 IonicContact OD1-NZ 3.04Å; D360-K552 PolarHBondContact OD1-NZ 3.49Å; D360-K552 VanDerWaalsContact OD1-NZ 3.11Å; D360-K552 IonicContact OD2-NZ 3.72Å; D360-K552 PolarHBondContact OD2-NZ 3.06Å; T483-K552 PolarHBondContact N-O 3.08Å; T483-K552 PolarHBondContact O-N 3.09Å; T483-K552 PolarHBondContact OG1-O 2.8Å; T483-K552 VanDerWaalsContact OG1-O 3.13Å; W485-K552 HydrophobicContact CZ2-CD 4.27Å; K552-A564 HydrophobicContact CD-CB 4.2Å; K552-A564 HydrophobicContact CG-CB 3.9Å; K552-L565 WeakPolarHBondContact CA-O 3.21Å; K552-W566 HydrophobicContact CB-CD2 4.25Å; K552-W566 HydrophobicContact CB-CE3 3.72Å; K552-W566 HydrophobicContact CB-CH2 4.29Å; K552-W566 HydrophobicContact CB-CZ3 3.75Å; K552-W566 HydrophobicContact CD-CH2 3.8Å; K552-W566 HydrophobicContact CD-CZ2 3.82Å; K552-W566 HydrophobicContact CD-CZ3 4.16Å; K552-W566 HydrophobicContact CG-CD2 4.28Å; K552-W566 HydrophobicContact CG-CE3 4.21Å; K552-W566 HydrophobicContact CG-CH2 4.38Å; K552-W566 HydrophobicContact CG-CZ2 4.41Å; K552-W566 HydrophobicContact CG-CZ3 4.27Å
553	L	91.5	Very high	78.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	122.5	172.1	-176.9	66.7	0	0	0	108.7	L443 W464 F469 L480 Q481 L482 I512 A564 L565	L443-L553 HydrophobicContact CD1-CD2 3.95Å; W464-L553 HydrophobicContact CB-CD2 4.32Å; W464-L553 HydrophobicContact CD2-CD2 3.49Å; W464-L553 VanDerWaalsContact CD2-CD2 3.49Å; W464-L553 HydrophobicContact CE3-CD2 3.6Å; W464-L553 HydrophobicContact CG-CD2 3.81Å; W464-L553 HydrophobicContact CZ2-CD2 4.49Å; W464-L553 HydrophobicContact CZ3-CD2 4.16Å; F469-L553 HydrophobicContact CE2-CD2 3.76Å; F469-L553 HydrophobicContact CE2-CG 4.12Å; F469-L553 HydrophobicContact CZ-CB 4.27Å; F469-L553 HydrophobicContact CZ-CD2 3.96Å; F469-L553 HydrophobicContact CZ-CG 3.84Å; F469-L553 WeakPolarHBondContact CZ-O 3.25Å; L480-L553 HydrophobicContact CB-CD1 3.81Å; L480-L553 HydrophobicContact CB-CG 4.45Å; L480-L553 HydrophobicContact CD1-CD1 4.36Å; L480-L553 HydrophobicContact CD1-CD2 4.24Å; L480-L553 HydrophobicContact CD1-CG 4.35Å; Q481-L553 WeakPolarHBondContact O-CA 3.25Å; L482-L553 HydrophobicContact CB-CD1 4.43Å; L482-L553 HydrophobicContact CD1-CB 4.19Å; L482-L553 HydrophobicContact CD1-CD1 4.27Å; I512-L553 HydrophobicContact CD1-CD1 4.43Å; L553-A564 CarbonylContact O-C 3.56Å; L553-A564 WeakPolarHBondContact O-CA 3.45Å; L553-A564 WeakPolarHBondContact O-CB 3.44Å; L553-L565 PolarHBondContact N-O 3.21Å; L553-L565 PolarHBondContact O-N 3.2Å
554	A	88.6	Confident	78.1	Confident	9 Å²	9	40 Å²	40	7%	0.074	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	163.8	-175.9	0	0	0	0	0	112.6	L480 Q481 A564	L480-A554 CarbonylContact C-O 3.6Å; L480-A554 VanDerWaalsContact CA-O 3.29Å; L480-A554 WeakPolarHBondContact CA-O 3.35Å; Q481-A554 PolarHBondContact N-O 3.26Å; Q481-A554 PolarHBondContact O-N 3.19Å; A554-A564 HydrophobicContact CB-CB 3.85Å
555	D	83.5	Confident	78.3	Confident	37 Å²	37	39.4 Å²	39.4	20%	0.198	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	128.4	172.8	-170.8	-21.5	0	0	0	111.3	S478 L480 N557 G558 L559	S478-D555 WeakPolarHBondContact CB-OD2 3.43Å; L480-D555 HydrophobicContact CD2-CB 4.48Å; D555-N557 PolarHBondContact O-N 2.74Å; D555-N557 WeakPolarHBondContact OD1-CB 3.44Å; D555-N557 PolarHBondContact OD1-N 2.61Å; D555-N557 PolarHBondContact OD1-ND2 3.16Å; D555-G558 CarbonylContact O-C 3.21Å; D555-G558 PolarHBondContact O-N 2.84Å; D555-L559 PolarHBondContact O-N 3.48Å
556	M	76.9	Confident	78.6	Confident	56 Å²	56	36.9 Å²	36.9	28%	0.276	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-61.3	-26.6	177.2	-68.8	-168.5	-24.1	0	0	113.5	Q479 Q481 N511 G558 L559	Q479-M556 HydrophobicContact CB-CE 3.75Å; Q479-M556 WeakPolarHBondContact O-CB 3.39Å; Q479-M556 WeakPolarHBondContact O-CG 3.37Å; Q479-M556 PolarHBondContact O-N 2.74Å; Q479-M556 VanDerWaalsContact OE1-CE 3.25Å; Q481-M556 HydrophobicContact CB-CG 3.62Å; Q481-M556 HydrophobicContact CB-SD 4.29Å; N511-M556 HydrophobicContact CB-CE 4.25Å; N511-M556 HydrophobicContact CB-SD 4.41Å; N511-M556 PolarHBondContact N-SD 2.7Å; M556-G558 PolarHBondContact O-N 3.06Å; M556-L559 WeakPolarHBondContact O-CD1 3.38Å
557	N	65.3	Low	78.7	Confident	133 Å²	133	36.9 Å²	36.9	71%	0.711	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-73.5	-4.5	-179.6	-60.4	-79.7	0	0	0	113	D555	D555-N557 PolarHBondContact O-N 2.74Å; D555-N557 WeakPolarHBondContact OD1-CB 3.44Å; D555-N557 PolarHBondContact OD1-N 2.61Å; D555-N557 PolarHBondContact OD1-ND2 3.16Å
558	G	57	Low	78.9	Confident	19 Å²	19	37.8 Å²	37.8	20%	0.196	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-166.8	70.6	175.4	0	0	0	0	0	112.5	D555 M556 E560 E561 G562	D555-G558 CarbonylContact O-C 3.21Å; D555-G558 PolarHBondContact O-N 2.84Å; M556-G558 PolarHBondContact O-N 3.06Å; G558-E560 PolarHBondContact O-N 3.37Å; G558-E561 PolarHBondContact O-N 3.11Å; G558-G562 WeakPolarHBondContact O-CA 3.45Å; G558-G562 PolarHBondContact O-N 2.93Å
559	L	52.4	Low	78.9	Confident	82 Å²	82	37.8 Å²	37.8	43%	0.429	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-28.9	176.3	-80.6	94	0	0	0	113.5	D555 M556	D555-L559 PolarHBondContact O-N 3.48Å; M556-L559 WeakPolarHBondContact O-CD1 3.38Å
560	E	51.9	Low	78.8	Confident	178 Å²	178	37.9 Å²	37.9	83%	0.832	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-33	177.5	-59.4	-168.2	153	0	0	113.5	K399 G558	K399-E560 PolarHBondContact NZ-O 2.82Å; G558-E560 PolarHBondContact O-N 3.37Å
561	E	52.2	Low	78.7	Confident	131 Å²	131	37.9 Å²	37.9	61%	0.612	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-25.8	-175.3	-69.9	-154.1	171	0	0	115.6	K389 K399 G558	K389-E561 IonicContact NZ-OE2 2.89Å; K389-E561 PolarHBondContact NZ-OE2 3.13Å; K399-E561 WeakPolarHBondContact CD-O 3.13Å; G558-E561 PolarHBondContact O-N 3.11Å
562	G	60.2	Low	78.5	Confident	21 Å²	21	38 Å²	38	22%	0.216	20%	0.204	C	C	.	.	S	Bend	trans	-81.4	172.5	-172.5	0	0	0	0	0	114.6	K399 G558	K399-G562 PolarHBondContact NZ-O 3.32Å; G558-G562 WeakPolarHBondContact O-CA 3.45Å; G558-G562 PolarHBondContact O-N 2.93Å
563	N	74.4	Confident	78.2	Confident	54 Å²	54	38.3 Å²	38.3	29%	0.289	21%	0.206	S	C	.	.			trans	-63	146.4	173	-64	2.9	0	0	0	110.7	T362 N468 F469	T362-N563 VanDerWaalsContact CG2-OD1 3.28Å; T362-N563 WeakPolarHBondContact CG2-OD1 3.48Å; T362-N563 VanDerWaalsContact OG1-CG 3.23Å; T362-N563 PolarHBondContact OG1-OD1 3.42Å; N468-N563 PolarHBondContact O-ND2 3.2Å; F469-N563 HydrophobicContact CD1-CB 4.34Å
564	A	84.1	Confident	77.8	Confident	6 Å²	6	39.8 Å²	39.8	5%	0.05	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	151.8	167.8	0	0	0	0	0	112.7	D360 K552 L553 A554	D360-A564 HydrophobicContact CB-CB 4.04Å; K552-A564 HydrophobicContact CD-CB 4.2Å; K552-A564 HydrophobicContact CG-CB 3.9Å; L553-A564 CarbonylContact O-C 3.56Å; L553-A564 WeakPolarHBondContact O-CA 3.45Å; L553-A564 WeakPolarHBondContact O-CB 3.44Å; A554-A564 HydrophobicContact CB-CB 3.85Å
565	L	88.5	Confident	77.7	Confident	24 Å²	24	40 Å²	40	13%	0.126	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	135.6	169.6	-56.7	176.9	0	0	0	109.1	W464 N468 F469 K552 L553	W464-L565 HydrophobicContact CB-CD1 3.85Å; N468-L565 HydrophobicContact CB-CD1 4.11Å; N468-L565 HydrophobicContact CB-CD2 4.39Å; N468-L565 WeakPolarHBondContact ND2-CD1 3.5Å; F469-L565 HydrophobicContact CE2-CD1 3.63Å; F469-L565 HydrophobicContact CE2-CG 4.05Å; F469-L565 HydrophobicContact CZ-CB 4.26Å; F469-L565 HydrophobicContact CZ-CD1 3.78Å; F469-L565 HydrophobicContact CZ-CG 3.66Å; K552-L565 WeakPolarHBondContact CA-O 3.21Å; L553-L565 PolarHBondContact N-O 3.21Å; L553-L565 PolarHBondContact O-N 3.2Å
566	W	90.2	Very high	77.9	Confident	3 Å²	3	39.8 Å²	39.8	1%	0.011	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	150.1	175.3	-64	98	0	0	0	110.5	M358 G359 A442 L443 W485 L502 F550 L551 K552	M358-W566 HydrophobicContact CB-CD2 4.25Å; M358-W566 HydrophobicContact CB-CG 4.4Å; M358-W566 HydrophobicContact CB-CZ2 4.19Å; M358-W566 HydrophobicContact CE-CB 3.71Å; M358-W566 HydrophobicContact CE-CD2 3.46Å; M358-W566 VanDerWaalsContact CE-CD2 3.46Å; M358-W566 HydrophobicContact CE-CE3 3.41Å; M358-W566 VanDerWaalsContact CE-CE3 3.41Å; M358-W566 HydrophobicContact CE-CG 3.63Å; M358-W566 HydrophobicContact CE-CZ3 4.1Å; M358-W566 HydrophobicContact SD-CD2 4.21Å; M358-W566 HydrophobicContact SD-CE3 4.1Å; M358-W566 HydrophobicContact SD-CH2 4.47Å; M358-W566 HydrophobicContact SD-CZ3 4.22Å; G359-W566 PolarHBondContact O-NE1 2.95Å; G359-W566 VanDerWaalsContact O-NE1 3.1Å; A442-W566 CarbonylContact C-O 3.59Å; A442-W566 VanDerWaalsContact CA-O 3.29Å; A442-W566 WeakPolarHBondContact CA-O 3.41Å; A442-W566 WeakPolarHBondContact CB-O 3.06Å; L443-W566 PolarHBondContact N-O 3.4Å; W485-W566 HydrophobicContact CB-CZ3 4.06Å; W485-W566 AromaticContact CD1-CZ3 3.76Å; W485-W566 AromaticContact CD2-CH2 3.92Å; W485-W566 HydrophobicContact CD2-CH2 3.92Å; W485-W566 HydrophobicContact CD2-CZ3 4.05Å; W485-W566 HydrophobicContact CE3-CH2 4.36Å; W485-W566 HydrophobicContact CG-CH2 4.07Å; W485-W566 AromaticContact CG-CZ3 3.68Å; W485-W566 HydrophobicContact CG-CZ3 3.68Å; L502-W566 HydrophobicContact CD2-CH2 4.05Å; L502-W566 HydrophobicContact CD2-CZ3 4.38Å; F550-W566 HydrophobicContact CB-CE3 4.09Å; F550-W566 HydrophobicContact CB-CZ3 4.43Å; L551-W566 CarbonylContact O-C 3.59Å; L551-W566 WeakPolarHBondContact O-CA 3.46Å; K552-W566 HydrophobicContact CB-CD2 4.25Å; K552-W566 HydrophobicContact CB-CE3 3.72Å; K552-W566 HydrophobicContact CB-CH2 4.29Å; K552-W566 HydrophobicContact CB-CZ3 3.75Å; K552-W566 HydrophobicContact CD-CH2 3.8Å; K552-W566 HydrophobicContact CD-CZ2 3.82Å; K552-W566 HydrophobicContact CD-CZ3 4.16Å; K552-W566 HydrophobicContact CG-CD2 4.28Å; K552-W566 HydrophobicContact CG-CE3 4.21Å; K552-W566 HydrophobicContact CG-CH2 4.38Å; K552-W566 HydrophobicContact CG-CZ2 4.41Å; K552-W566 HydrophobicContact CG-CZ3 4.27Å
567	S	91.5	Very high	78.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-79.1	168.7	166.7	68.7	0	0	0	0	112.3	S436 M445 F550 L551	S436-S567 WeakPolarHBondContact CB-O 3.21Å; M445-S567 WeakPolarHBondContact SD-CB 3.27Å; F550-S567 WeakPolarHBondContact CD1-O 3.47Å; L551-S567 PolarHBondContact N-OG 3.06Å; L551-S567 PolarHBondContact O-N 3.27Å
568	P	89.1	Confident	78.8	Confident	30 Å²	30	36.6 Å²	36.6	20%	0.195	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-56.4	167.1	151.1	-22.6	35.5	0	0	0	112.1	S436 M445 I570	S436-P568 WeakPolarHBondContact O-CA 3.2Å; M445-P568 HydrophobicContact CG-CG 4.49Å; P568-I570 PolarHBondContact O-N 2.84Å
569	P	89.7	Confident	80.1	Confident	1 Å²	1	38 Å²	38	1%	0.006	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-58.9	137	173	-16.9	27.6	0	0	0	111.6	L548 F550 T719 Y723	L548-P569 HydrophobicContact CD1-CB 4.43Å; F550-P569 HydrophobicContact CE1-CB 3.95Å; F550-P569 HydrophobicContact CE1-CG 3.73Å; F550-P569 HydrophobicContact CZ-CB 4.28Å; F550-P569 HydrophobicContact CZ-CG 4.16Å; P569-T719 HydrophobicContact CG-CG2 3.58Å; P569-Y723 HydrophobicContact CB-CD1 3.6Å; P569-Y723 HydrophobicContact CB-CE1 3.86Å; P569-Y723 HydrophobicContact CB-CG 4.03Å; P569-Y723 HydrophobicContact CG-CD1 3.98Å; P569-Y723 HydrophobicContact CG-CD2 4.22Å; P569-Y723 HydrophobicContact CG-CE1 4.04Å; P569-Y723 HydrophobicContact CG-CE2 4.27Å; P569-Y723 HydrophobicContact CG-CG 4.06Å
570	I	90.4	Very high	81.5	Confident	1 Å²	1	38 Å²	38	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	152	173.8	53.5	166.4	0	0	0	111.3	M445 I448 W451 L484 G549 L551 P568 F575	M445-I570 HydrophobicContact CE-CD1 4.35Å; M445-I570 HydrophobicContact CE-CG2 3.56Å; I448-I570 HydrophobicContact CD1-CG2 4.31Å; W451-I570 HydrophobicContact CB-CG2 4.28Å; W451-I570 HydrophobicContact CD2-CG2 3.96Å; W451-I570 HydrophobicContact CE3-CB 4.1Å; W451-I570 HydrophobicContact CE3-CD1 3.88Å; W451-I570 HydrophobicContact CE3-CG2 3.8Å; W451-I570 HydrophobicContact CG-CG2 4.19Å; W451-I570 HydrophobicContact CH2-CD1 4.41Å; W451-I570 HydrophobicContact CZ3-CD1 3.59Å; W451-I570 HydrophobicContact CZ3-CG2 4.45Å; L484-I570 HydrophobicContact CD1-CD1 4.42Å; G549-I570 PolarHBondContact N-O 2.79Å; G549-I570 WeakPolarHBondContact O-CG1 3.15Å; G549-I570 PolarHBondContact O-N 2.04Å; L551-I570 HydrophobicContact CD2-CD1 3.81Å; L551-I570 HydrophobicContact CG-CD1 3.83Å; P568-I570 PolarHBondContact O-N 2.84Å; I570-F575 HydrophobicContact CD1-CE2 4.05Å; I570-F575 HydrophobicContact CD1-CZ 4.39Å
571	P	89.6	Confident	83.2	Confident	2 Å²	2	35 Å²	35	1%	0.013	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	128.1	172.7	32	-33.3	0	0	0	109.9	W451 F452 L728 W736	W451-P571 WeakPolarHBondContact O-CG 3.46Å; F452-P571 HydrophobicContact CD1-CG 4.14Å; F452-P571 HydrophobicContact CE1-CG 4.29Å; F452-P571 HydrophobicContact CG-CG 4.47Å; P571-L728 HydrophobicContact CB-CD2 4.07Å; P571-W736 HydrophobicContact CB-CH2 3.66Å; P571-W736 HydrophobicContact CB-CZ2 4.14Å; P571-W736 HydrophobicContact CG-CH2 4.25Å; P571-W736 HydrophobicContact CG-CZ2 4.22Å
572	I	89.4	Confident	84.9	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.01	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-84.8	-9.4	-172.8	65.8	158.9	0	0	0	114.5	L484 L505 F546 R574 F575 F576	L484-I572 HydrophobicContact CD1-CG2 4.25Å; L505-I572 HydrophobicContact CD1-CD1 3.72Å; F546-I572 HydrophobicContact CB-CD1 3.59Å; F546-I572 VanDerWaalsContact O-CD1 3.28Å; F546-I572 WeakPolarHBondContact O-CD1 3.37Å; F546-I572 WeakPolarHBondContact O-CG1 3.45Å; I572-R574 PolarHBondContact O-N 2.83Å; I572-F575 HydrophobicContact CB-CD2 4.46Å; I572-F575 WeakPolarHBondContact O-CD2 3.3Å; I572-F575 PolarHBondContact O-N 3.12Å; I572-F576 HydrophobicContact CB-CE1 4.45Å; I572-F576 HydrophobicContact CD1-CE1 3.8Å; I572-F576 HydrophobicContact CD1-CZ 4.46Å; I572-F576 HydrophobicContact CG1-CE1 3.83Å; I572-F576 HydrophobicContact CG1-CZ 4.34Å; I572-F576 WeakPolarHBondContact O-CE1 3.31Å
573	H	86.6	Confident	86.3	Confident	15 Å²	15	31.7 Å²	31.7	7%	0.069	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-53.5	-33.7	-175.6	71.9	-108.5	0	0	0	112.2	F575 F576 I577 L583 Y586 W736	H573-F575 PolarHBondContact O-N 2.86Å; H573-F575 VanDerWaalsContact O-N 3.08Å; H573-F576 HydrophobicContact CB-CE2 4.4Å; H573-F576 HydrophobicContact CB-CZ 4.31Å; H573-F576 PolarHBondContact O-N 3.48Å; H573-I577 HydrophobicContact CB-CD1 4.23Å; H573-I577 PolarHBondContact O-N 3.44Å; H573-L583 HydrophobicContact CB-CD1 4.43Å; H573-L583 VanDerWaalsContact CD2-CD1 3.49Å; H573-L583 WeakPolarHBondContact CD2-CD1 3.33Å; H573-Y586 HydrophobicContact CB-CD1 4.42Å; H573-Y586 HydrophobicContact CB-CE1 4.1Å; H573-W736 AromaticContact CE1-CE2 3.83Å; H573-W736 AromaticContact CE1-CH2 3.55Å; H573-W736 AromaticContact CE1-CZ2 3.5Å; H573-W736 VanDerWaalsContact CE1-CZ2 3.5Å; H573-W736 WeakPolarHBondContact CE1-CZ2 3.46Å; H573-W736 AromaticContact CE1-CZ3 3.9Å; H573-W736 AromaticContact ND1-CH2 3.52Å; H573-W736 AromaticContact ND1-CZ2 3.98Å; H573-W736 AromaticContact ND1-CZ3 3.62Å
574	R	83	Confident	87	Confident	32 Å²	32	32 Å²	32	12%	0.121	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-59.9	-20.7	-179.1	-169.7	172.2	-175.2	156.2	-3.4	114.1	H450 P456 L460 N529 I572	H450-R574 PolarHBondContact O-NH1 3.35Å; P456-R574 VanDerWaalsContact CG-NH1 3.34Å; L460-R574 VanDerWaalsContact CD1-NH1 3.32Å; N529-R574 PolarHBondContact OD1-NH2 3.35Å; I572-R574 PolarHBondContact O-N 2.83Å
575	F	86.8	Confident	87.3	Confident	12 Å²	12	36.8 Å²	36.8	5%	0.053	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-83.2	-14.1	176.6	-61.4	-75.2	0	0	0	113.4	W451 L484 I508 V531 L551 I570 I572 H573 R578	W451-F575 HydrophobicContact CZ3-CZ 4.19Å; L484-F575 HydrophobicContact CD1-CD2 3.93Å; L484-F575 HydrophobicContact CD1-CE2 3.58Å; L484-F575 HydrophobicContact CD1-CZ 4.14Å; L484-F575 HydrophobicContact CD2-CB 4.08Å; L484-F575 HydrophobicContact CD2-CD1 4.44Å; L484-F575 HydrophobicContact CD2-CD2 3.48Å; L484-F575 VanDerWaalsContact CD2-CD2 3.48Å; L484-F575 HydrophobicContact CD2-CE2 4.01Å; L484-F575 HydrophobicContact CD2-CG 3.73Å; L484-F575 HydrophobicContact CG-CD2 4.36Å; L484-F575 HydrophobicContact CG-CE2 4.44Å; I508-F575 HydrophobicContact CD1-CD1 4.19Å; I508-F575 HydrophobicContact CD1-CE1 3.44Å; I508-F575 VanDerWaalsContact CD1-CE1 3.44Å; I508-F575 HydrophobicContact CD1-CZ 3.66Å; I508-F575 HydrophobicContact CG1-CD1 4.26Å; I508-F575 HydrophobicContact CG1-CE1 3.85Å; I508-F575 HydrophobicContact CG2-CE1 4.44Å; V531-F575 HydrophobicContact CG1-CD1 4.33Å; V531-F575 HydrophobicContact CG1-CE1 4.28Å; L551-F575 HydrophobicContact CD2-CZ 4.16Å; I570-F575 HydrophobicContact CD1-CE2 4.05Å; I570-F575 HydrophobicContact CD1-CZ 4.39Å; I572-F575 HydrophobicContact CB-CD2 4.46Å; I572-F575 WeakPolarHBondContact O-CD2 3.3Å; I572-F575 PolarHBondContact O-N 3.12Å; H573-F575 PolarHBondContact O-N 2.86Å; H573-F575 VanDerWaalsContact O-N 3.08Å; F575-R578 VanDerWaalsContact C-NH2 3.31Å; F575-R578 PolarHBondContact O-NH2 2.04Å
576	F	86.3	Confident	87.4	Confident	34 Å²	34	36.5 Å²	36.5	15%	0.149	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-19.7	179.1	52.5	-94.7	0	0	0	115.6	F540 L543 Q544 I572 H573	F540-F576 HydrophobicContact CD2-CB 4.07Å; F540-F576 HydrophobicContact CD2-CD2 4.13Å; F540-F576 HydrophobicContact CD2-CG 4.47Å; F540-F576 HydrophobicContact CE2-CB 4.04Å; F540-F576 AromaticContact CE2-CD2 3.63Å; F540-F576 HydrophobicContact CE2-CD2 3.63Å; F540-F576 HydrophobicContact CE2-CG 4.29Å; F540-F576 HydrophobicContact CZ-CD2 4.13Å; L543-F576 HydrophobicContact CB-CD1 3.95Å; L543-F576 HydrophobicContact CB-CE1 3.86Å; L543-F576 HydrophobicContact CB-CG 4.49Å; L543-F576 HydrophobicContact CB-CZ 4.34Å; L543-F576 HydrophobicContact CD1-CB 4.43Å; L543-F576 HydrophobicContact CD1-CD1 4.2Å; Q544-F576 HydrophobicContact CG-CE2 3.86Å; Q544-F576 HydrophobicContact CG-CZ 4.39Å; I572-F576 HydrophobicContact CB-CE1 4.45Å; I572-F576 HydrophobicContact CD1-CE1 3.8Å; I572-F576 HydrophobicContact CD1-CZ 4.46Å; I572-F576 HydrophobicContact CG1-CE1 3.83Å; I572-F576 HydrophobicContact CG1-CZ 4.34Å; I572-F576 WeakPolarHBondContact O-CE1 3.31Å; H573-F576 HydrophobicContact CB-CE2 4.4Å; H573-F576 HydrophobicContact CB-CZ 4.31Å; H573-F576 PolarHBondContact O-N 3.48Å
577	I	84.3	Confident	87.5	Confident	10 Å²	10	36.4 Å²	36.4	5%	0.051	18%	0.182	C	C	.	.			trans	-104.1	141.4	172.5	-54.8	-173.2	0	0	0	109.2	H573 V582 L583 Y586	H573-I577 HydrophobicContact CB-CD1 4.23Å; H573-I577 PolarHBondContact O-N 3.44Å; I577-V582 HydrophobicContact CG2-CB 4.07Å; I577-V582 HydrophobicContact CG2-CG1 3.9Å; I577-L583 HydrophobicContact CD1-CD1 4.46Å; I577-L583 HydrophobicContact CG2-CB 3.94Å; I577-Y586 HydrophobicContact CD1-CD1 3.34Å; I577-Y586 HydrophobicContact CD1-CE1 4.2Å; I577-Y586 HydrophobicContact CD1-CG 3.53Å
578	R	77.3	Confident	87.4	Confident	112 Å²	112	37.2 Å²	37.2	42%	0.423	19%	0.189	S	C	.	.			trans	-130.1	-32.9	-176.5	-56.5	-62	156.1	142.2	5.5	115.2	N529 V531 F575	N529-R578 PolarHBondContact O-NH1 2.85Å; V531-R578 PolarHBondContact O-NH1 3.04Å; V531-R578 PolarHBondContact O-NH2 3.44Å; F575-R578 VanDerWaalsContact C-NH2 3.31Å; F575-R578 PolarHBondContact O-NH2 2.04Å
579	S	83.5	Confident	87.6	Confident	49 Å²	49	40.5 Å²	40.5	34%	0.343	21%	0.205	S	C	.	.	S	Bend	trans	-98.3	147.5	177.7	97.3	0	0	0	0	110.6	E581 V582 L583	S579-E581 VanDerWaalsContact C-N 3.32Å; S579-E581 WeakPolarHBondContact CB-OE2 3.42Å; S579-E581 PolarHBondContact O-N 2.67Å; S579-E581 PolarHBondContact OG-OE2 2.97Å; S579-V582 PolarHBondContact O-N 2.92Å; S579-V582 WeakPolarHBondContact OG-CG2 3.48Å; S579-V582 PolarHBondContact OG-N 3.45Å; S579-L583 PolarHBondContact O-N 3.44Å; S579-L583 VanDerWaalsContact O-N 3.11Å
580	K	83.2	Confident	87.6	Confident	81 Å²	81	40.5 Å²	40.5	35%	0.352	21%	0.205	S	C	.	.	H	α-helix	trans	-63.4	-38.4	-176.9	167.4	171.7	170.1	-178	0	112.2	E455 V582 L583 E584	E455-K580 HydrophobicContact CG-CD 4.08Å; E455-K580 WeakPolarHBondContact OE1-CD 3.3Å; E455-K580 WeakPolarHBondContact OE1-CE 3.35Å; E455-K580 IonicContact OE1-NZ 3.15Å; E455-K580 PolarHBondContact OE1-NZ 3.29Å; K580-V582 VanDerWaalsContact C-N 3.34Å; K580-V582 PolarHBondContact O-N 3.25Å; K580-L583 WeakPolarHBondContact O-CB 3.29Å; K580-L583 PolarHBondContact O-N 3.29Å; K580-E584 VanDerWaalsContact CE-OE1 3.23Å; K580-E584 WeakPolarHBondContact CE-OE1 3.39Å; K580-E584 HydrophobicContact CG-CG 4.46Å; K580-E584 WeakPolarHBondContact CG-OE1 3.25Å; K580-E584 WeakPolarHBondContact O-CG 3.19Å; K580-E584 PolarHBondContact O-N 3.01Å
581	E	86.8	Confident	87.7	Confident	115 Å²	115	40.5 Å²	40.5	54%	0.537	21%	0.205	S	C	.	.	H	α-helix	trans	-66.5	-38.5	-178.6	-45.3	75.4	-166.8	0	0	110.5	S579 E584 V585	S579-E581 VanDerWaalsContact C-N 3.32Å; S579-E581 WeakPolarHBondContact CB-OE2 3.42Å; S579-E581 PolarHBondContact O-N 2.67Å; S579-E581 PolarHBondContact OG-OE2 2.97Å; E581-E584 PolarHBondContact O-N 3.14Å; E581-V585 WeakPolarHBondContact O-CG2 3.29Å; E581-V585 PolarHBondContact O-N 3.48Å; E581-V585 VanDerWaalsContact O-N 3.07Å
582	V	88.5	Confident	87.8	Confident	75 Å²	75	43.5 Å²	43.5	46%	0.455	22%	0.22	S	C	.	.	H	α-helix	trans	-71.9	-33.4	174.5	178.4	0	0	0	0	111.2	I577 S579 K580 Y586	I577-V582 HydrophobicContact CG2-CB 4.07Å; I577-V582 HydrophobicContact CG2-CG1 3.9Å; S579-V582 PolarHBondContact O-N 2.92Å; S579-V582 WeakPolarHBondContact OG-CG2 3.48Å; S579-V582 PolarHBondContact OG-N 3.45Å; K580-V582 VanDerWaalsContact C-N 3.34Å; K580-V582 PolarHBondContact O-N 3.25Å; V582-Y586 VanDerWaalsContact O-CB 3.25Å; V582-Y586 WeakPolarHBondContact O-CB 3.23Å; V582-Y586 PolarHBondContact O-N 3.21Å
583	L	88.5	Confident	87.8	Confident	8 Å²	8	48 Å²	48	4%	0.042	24%	0.237	C	C	.	.	H	α-helix	trans	-66.8	-41.9	172.6	179.9	57.2	0	0	0	111.8	K454 H573 I577 S579 K580 Y586 A587 W736	K454-L583 HydrophobicContact CG-CD2 4.29Å; H573-L583 HydrophobicContact CB-CD1 4.43Å; H573-L583 VanDerWaalsContact CD2-CD1 3.49Å; H573-L583 WeakPolarHBondContact CD2-CD1 3.33Å; I577-L583 HydrophobicContact CD1-CD1 4.46Å; I577-L583 HydrophobicContact CG2-CB 3.94Å; S579-L583 PolarHBondContact O-N 3.44Å; S579-L583 VanDerWaalsContact O-N 3.11Å; K580-L583 WeakPolarHBondContact O-CB 3.29Å; K580-L583 PolarHBondContact O-N 3.29Å; L583-Y586 HydrophobicContact CD1-CD1 4.4Å; L583-Y586 PolarHBondContact O-N 3.18Å; L583-A587 WeakPolarHBondContact O-CB 3.09Å; L583-A587 PolarHBondContact O-N 2.94Å; L583-W736 HydrophobicContact CD1-CD2 4.5Å; L583-W736 HydrophobicContact CD1-CE3 4.33Å; L583-W736 HydrophobicContact CD2-CG 4.47Å
584	E	89.8	Confident	88.1	Confident	61 Å²	61	47.3 Å²	47.3	29%	0.285	23%	0.234	S	C	.	.	H	α-helix	trans	-60.2	-48.2	175.7	-75.5	167	177.7	0	0	111.7	K454 K580 E581 A587 A588 T737	K454-E584 VanDerWaalsContact CE-CG 3.42Å; K454-E584 WeakPolarHBondContact CE-OE1 3.28Å; K454-E584 VanDerWaalsContact NZ-CG 3.27Å; K454-E584 IonicContact NZ-OE1 3.35Å; K454-E584 PolarHBondContact NZ-OE1 3.11Å; K580-E584 VanDerWaalsContact CE-OE1 3.23Å; K580-E584 WeakPolarHBondContact CE-OE1 3.39Å; K580-E584 HydrophobicContact CG-CG 4.46Å; K580-E584 WeakPolarHBondContact CG-OE1 3.25Å; K580-E584 WeakPolarHBondContact O-CG 3.19Å; K580-E584 PolarHBondContact O-N 3.01Å; E581-E584 PolarHBondContact O-N 3.14Å; E584-A587 PolarHBondContact O-N 2.99Å; E584-A588 WeakPolarHBondContact O-CB 3.36Å; E584-A588 PolarHBondContact O-N 3.19Å; E584-T737 PolarHBondContact O-OG1 2.76Å
585	V	90.9	Very high	88.4	Confident	106 Å²	106	47.3 Å²	47.3	64%	0.642	24%	0.235	S	C	*	.	H	α-helix	trans	-66.7	-41.6	177.9	173.6	0	0	0	0	111.6	E581 A588 D589	E581-V585 WeakPolarHBondContact O-CG2 3.29Å; E581-V585 PolarHBondContact O-N 3.48Å; E581-V585 VanDerWaalsContact O-N 3.07Å; V585-A588 PolarHBondContact O-N 3.42Å; V585-D589 PolarHBondContact O-N 2.79Å; V585-D589 VanDerWaalsContact O-N 3.12Å
586	Y	90.7	Very high	88.6	Confident	18 Å²	18	52.3 Å²	52.3	7%	0.071	26%	0.258	C	S	.	.	H	α-helix	trans	-63.9	-45.6	175.7	169.6	-116.4	0	0	0	112.2	Q544 H573 I577 V582 L583 A588 D589 E590 L732	Q544-Y586 HydrophobicContact CB-CE2 4.32Å; Q544-Y586 HydrophobicContact CG-CD2 4.49Å; Q544-Y586 HydrophobicContact CG-CE2 4Å; Q544-Y586 VanDerWaalsContact NE2-CD2 3.29Å; H573-Y586 HydrophobicContact CB-CD1 4.42Å; H573-Y586 HydrophobicContact CB-CE1 4.1Å; I577-Y586 HydrophobicContact CD1-CD1 3.34Å; I577-Y586 HydrophobicContact CD1-CE1 4.2Å; I577-Y586 HydrophobicContact CD1-CG 3.53Å; V582-Y586 VanDerWaalsContact O-CB 3.25Å; V582-Y586 WeakPolarHBondContact O-CB 3.23Å; V582-Y586 PolarHBondContact O-N 3.21Å; L583-Y586 HydrophobicContact CD1-CD1 4.4Å; L583-Y586 PolarHBondContact O-N 3.18Å; Y586-A588 VanDerWaalsContact C-N 3.29Å; Y586-A588 PolarHBondContact O-N 3.36Å; Y586-D589 PolarHBondContact O-N 2.92Å; Y586-E590 HydrophobicContact CE2-CB 4.12Å; Y586-E590 WeakPolarHBondContact O-CB 3.19Å; Y586-E590 PolarHBondContact O-N 3.41Å; Y586-E590 PolarHBondContact OH-OE2 3.41Å; Y586-E590 VanDerWaalsContact OH-OE2 3.11Å; Y586-L732 HydrophobicContact CE1-CD2 4.44Å
587	A	91.5	Very high	88.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69.9	-26.8	179.7	0	0	0	0	0	112.4	L583 E584 C591 L732 W736 T737	L583-A587 WeakPolarHBondContact O-CB 3.09Å; L583-A587 PolarHBondContact O-N 2.94Å; E584-A587 PolarHBondContact O-N 2.99Å; A587-C591 WeakPolarHBondContact O-CB 3.15Å; A587-C591 PolarHBondContact O-N 3.45Å; A587-L732 HydrophobicContact CB-CD2 3.89Å; A587-W736 HydrophobicContact CB-CB 3.74Å; A587-W736 HydrophobicContact CB-CE3 4.17Å; A587-T737 VanDerWaalsContact CB-OG1 3.3Å; A587-T737 WeakPolarHBondContact CB-OG1 3.43Å
588	A	90.3	Very high	88.9	Confident	18 Å²	18	52.9 Å²	52.9	15%	0.149	26%	0.261	C	S	.	.	H	α-helix	trans	-64.6	-54.6	169.7	0	0	0	0	0	111.7	E584 V585 Y586 C591 I592 T737	E584-A588 WeakPolarHBondContact O-CB 3.36Å; E584-A588 PolarHBondContact O-N 3.19Å; V585-A588 PolarHBondContact O-N 3.42Å; Y586-A588 VanDerWaalsContact C-N 3.29Å; Y586-A588 PolarHBondContact O-N 3.36Å; A588-C591 PolarHBondContact O-N 2.85Å; A588-I592 WeakPolarHBondContact O-CG1 3.49Å; A588-I592 PolarHBondContact O-N 3.32Å; A588-I592 VanDerWaalsContact O-N 3.07Å; A588-T737 HydrophobicContact CB-CG2 3.83Å; A588-T737 PolarHBondContact N-OG1 2.97Å
589	D	92	Very high	89.4	Confident	99 Å²	99	49.2 Å²	49.2	53%	0.529	26%	0.259	S	S	.	.	H	α-helix	trans	-60.7	-46	179.9	-175.3	57.8	0	0	0	111.7	V585 Y586 C591 I592 R593	V585-D589 PolarHBondContact O-N 2.79Å; V585-D589 VanDerWaalsContact O-N 3.12Å; Y586-D589 PolarHBondContact O-N 2.92Å; D589-C591 PolarHBondContact O-N 3.4Å; D589-I592 PolarHBondContact O-N 2.8Å; D589-R593 WeakPolarHBondContact O-CB 3.32Å; D589-R593 PolarHBondContact O-N 3.39Å
590	E	90.6	Very high	89.5	Confident	1 Å²	1	55 Å²	55	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-67.8	-33.7	177.5	-173.9	73.7	-129.1	0	0	112.8	R547 Y586 R593 W594 L732	R547-E590 IonicContact CZ-OE1 2.67Å; R547-E590 IonicContact NE-OE1 3.74Å; R547-E590 PolarHBondContact NE-OE1 3.47Å; R547-E590 IonicContact NH2-OE1 2.76Å; R547-E590 PolarHBondContact NH2-OE1 2.63Å; Y586-E590 HydrophobicContact CE2-CB 4.12Å; Y586-E590 WeakPolarHBondContact O-CB 3.19Å; Y586-E590 PolarHBondContact O-N 3.41Å; Y586-E590 PolarHBondContact OH-OE2 3.41Å; Y586-E590 VanDerWaalsContact OH-OE2 3.11Å; E590-R593 PolarHBondContact O-N 2.88Å; E590-R593 IonicContact OE1-CZ 3.78Å; E590-R593 IonicContact OE1-NE 3.65Å; E590-R593 PolarHBondContact OE1-NE 2.76Å; E590-R593 IonicContact OE1-NH2 2.78Å; E590-R593 PolarHBondContact OE1-NH2 3.18Å; E590-R593 IonicContact OE2-CZ 3.45Å; E590-R593 IonicContact OE2-NE 2.7Å; E590-R593 PolarHBondContact OE2-NE 3Å; E590-R593 IonicContact OE2-NH2 3.08Å; E590-R593 PolarHBondContact OE2-NH2 2.77Å; E590-W594 WeakPolarHBondContact O-CB 3.41Å; E590-W594 PolarHBondContact O-N 3.21Å; E590-L732 HydrophobicContact CB-CD1 4.4Å; E590-L732 HydrophobicContact CB-CD2 3.99Å; E590-L732 HydrophobicContact CG-CD1 3.59Å; E590-L732 HydrophobicContact CG-CD2 3.91Å; E590-L732 HydrophobicContact CG-CG 4.38Å
591	C	91.5	Very high	89.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.2	-43.7	173.1	175.8	0	0	0	0	111.3	A587 A588 D589 W594 F595 C733	A587-C591 WeakPolarHBondContact O-CB 3.15Å; A587-C591 PolarHBondContact O-N 3.45Å; A588-C591 PolarHBondContact O-N 2.85Å; D589-C591 PolarHBondContact O-N 3.4Å; C591-W594 PolarHBondContact O-N 2.8Å; C591-F595 WeakPolarHBondContact O-CB 3.38Å; C591-F595 PolarHBondContact O-N 3Å; C591-C733 HydrophobicContact CB-CB 4.07Å; C591-C733 WeakPolarHBondContact CB-SG 3.46Å; C591-C733 VanDerWaalsContact SG-CA 3.51Å; C591-C733 WeakPolarHBondContact SG-CB 3.39Å; C591-C733 CovalentContact SG-SG 2.03Å; C591-C733 PolarHBondContact SG-SG 2.94Å
592	I	91.6	Very high	89.4	Confident	66 Å²	66	51 Å²	51	34%	0.338	26%	0.259	S	S	.	.	H	α-helix	trans	-64.8	-46.4	175.4	-65.7	165.2	0	0	0	110	A588 D589 W594 F595 E596	A588-I592 WeakPolarHBondContact O-CG1 3.49Å; A588-I592 PolarHBondContact O-N 3.32Å; A588-I592 VanDerWaalsContact O-N 3.07Å; D589-I592 PolarHBondContact O-N 2.8Å; I592-W594 VanDerWaalsContact C-N 3.33Å; I592-W594 PolarHBondContact O-N 3.28Å; I592-F595 WeakPolarHBondContact O-CB 3.38Å; I592-F595 PolarHBondContact O-N 3.18Å; I592-E596 PolarHBondContact O-N 3Å
593	R	90.9	Very high	89.2	Confident	96 Å²	96	52.6 Å²	52.6	36%	0.362	27%	0.266	S	S	.	.	H	α-helix	trans	-57.2	-42.8	176.7	-169.5	172.1	81.3	166	6.5	112.5	Q544 D589 E590 E597	Q544-R593 PolarHBondContact O-NH2 2.84Å; D589-R593 WeakPolarHBondContact O-CB 3.32Å; D589-R593 PolarHBondContact O-N 3.39Å; E590-R593 PolarHBondContact O-N 2.88Å; E590-R593 IonicContact OE1-CZ 3.78Å; E590-R593 IonicContact OE1-NE 3.65Å; E590-R593 PolarHBondContact OE1-NE 2.76Å; E590-R593 IonicContact OE1-NH2 2.78Å; E590-R593 PolarHBondContact OE1-NH2 3.18Å; E590-R593 IonicContact OE2-CZ 3.45Å; E590-R593 IonicContact OE2-NE 2.7Å; E590-R593 PolarHBondContact OE2-NE 3Å; E590-R593 IonicContact OE2-NH2 3.08Å; E590-R593 PolarHBondContact OE2-NH2 2.77Å; R593-E597 WeakPolarHBondContact O-CB 3.27Å; R593-E597 PolarHBondContact O-N 2.95Å
594	W	91.2	Very high	89.2	Confident	1 Å²	1	52.3 Å²	52.3	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-68	-40.1	173.1	167.4	86.9	0	0	0	112.2	E590 C591 I592 E596 E597 D598 H725 P729 F744 R747 R748	E590-W594 WeakPolarHBondContact O-CB 3.41Å; E590-W594 PolarHBondContact O-N 3.21Å; C591-W594 PolarHBondContact O-N 2.8Å; I592-W594 VanDerWaalsContact C-N 3.33Å; I592-W594 PolarHBondContact O-N 3.28Å; W594-E596 VanDerWaalsContact C-N 3.25Å; W594-E596 PolarHBondContact O-N 3.3Å; W594-E597 PolarHBondContact O-N 3.29Å; W594-D598 HydrophobicContact CZ2-CB 4.43Å; W594-D598 VanDerWaalsContact O-CB 3.26Å; W594-D598 WeakPolarHBondContact O-CB 3.16Å; W594-D598 PolarHBondContact O-N 3.3Å; W594-H725 PolarHBondContact NE1-O 3.3Å; W594-P729 HydrophobicContact CD2-CB 3.61Å; W594-P729 HydrophobicContact CD2-CG 4.19Å; W594-P729 VanDerWaalsContact CE2-CB 3.41Å; W594-P729 HydrophobicContact CE3-CB 4.28Å; W594-P729 HydrophobicContact CG-CB 3.79Å; W594-P729 HydrophobicContact CG-CG 3.9Å; W594-P729 HydrophobicContact CZ2-CB 3.89Å; W594-P729 VanDerWaalsContact NE1-CG 3.33Å; W594-F744 HydrophobicContact CH2-CB 4.34Å; W594-F744 AromaticContact CH2-CD2 3.44Å; W594-F744 HydrophobicContact CH2-CD2 3.44Å; W594-F744 VanDerWaalsContact CH2-CD2 3.44Å; W594-F744 HydrophobicContact CH2-CE2 4.01Å; W594-F744 HydrophobicContact CH2-CG 4.15Å; W594-F744 AromaticContact CZ2-CD2 3.95Å; W594-F744 HydrophobicContact CZ2-CD2 3.95Å; W594-F744 HydrophobicContact CZ2-CE2 4.1Å; W594-F744 HydrophobicContact CZ3-CB 4.28Å; W594-F744 AromaticContact CZ3-CD2 3.97Å; W594-F744 HydrophobicContact CZ3-CD2 3.97Å; W594-R747 HydrophobicContact CH2-CB 3.65Å; W594-R747 HydrophobicContact CH2-CG 4.09Å; W594-R747 HydrophobicContact CZ2-CB 4.35Å; W594-R747 HydrophobicContact CZ3-CB 4.21Å; W594-R747 HydrophobicContact CZ3-CG 4.18Å; W594-R748 HydrophobicContact CH2-CG 4.18Å; W594-R748 HydrophobicContact CZ2-CG 4.31Å
595	F	90.8	Very high	89.1	Confident	32 Å²	32	51.1 Å²	51.1	14%	0.14	26%	0.259	C	S	.	.	H	α-helix	trans	-62.6	-33.9	178.5	175.7	-94	0	0	0	112.1	C591 I592 G599 F743 W746 R747	C591-F595 WeakPolarHBondContact O-CB 3.38Å; C591-F595 PolarHBondContact O-N 3Å; I592-F595 WeakPolarHBondContact O-CB 3.38Å; I592-F595 PolarHBondContact O-N 3.18Å; F595-G599 PolarHBondContact O-N 3.24Å; F595-F743 HydrophobicContact CB-CB 4.33Å; F595-F743 HydrophobicContact CD1-CD1 4.37Å; F595-F743 HydrophobicContact CD2-CB 3.73Å; F595-F743 HydrophobicContact CD2-CD1 4.13Å; F595-F743 HydrophobicContact CD2-CG 4.36Å; F595-F743 WeakPolarHBondContact CD2-O 3.46Å; F595-F743 HydrophobicContact CE1-CD1 4.37Å; F595-F743 HydrophobicContact CE2-CB 4.31Å; F595-F743 HydrophobicContact CE2-CD1 4.12Å; F595-F743 HydrophobicContact CG-CB 4.13Å; F595-F743 HydrophobicContact CG-CD1 4.25Å; F595-F743 HydrophobicContact CG-CG 4.49Å; F595-F743 HydrophobicContact CZ-CD1 4.25Å; F595-W746 HydrophobicContact CE2-CB 4.46Å; F595-W746 HydrophobicContact CE2-CD2 4.35Å; F595-W746 AromaticContact CE2-CE3 3.73Å; F595-W746 HydrophobicContact CE2-CE3 3.73Å; F595-W746 HydrophobicContact CE2-CZ3 4.43Å; F595-W746 HydrophobicContact CZ-CD2 4.35Å; F595-W746 AromaticContact CZ-CE3 3.51Å; F595-W746 HydrophobicContact CZ-CE3 3.51Å; F595-W746 AromaticContact CZ-CZ3 3.76Å; F595-W746 HydrophobicContact CZ-CZ3 3.76Å; F595-R747 HydrophobicContact CD2-CG 3.47Å; F595-R747 VanDerWaalsContact CD2-CG 3.47Å; F595-R747 HydrophobicContact CE2-CG 3.71Å; F595-R747 HydrophobicContact CG-CG 4.49Å; F595-R747 VanDerWaalsContact O-CZ 3.29Å; F595-R747 PolarHBondContact O-NE 3.03Å; F595-R747 PolarHBondContact O-NH2 2.92Å
596	E	91.5	Very high	88.8	Confident	116 Å²	116	53.7 Å²	53.7	54%	0.542	26%	0.257	S	S	.	.	H	α-helix	trans	-72.9	-48.5	170.5	-68.2	-174.1	172	0	0	112.3	I592 W594 D598 G599 Q600	I592-E596 PolarHBondContact O-N 3Å; W594-E596 VanDerWaalsContact C-N 3.25Å; W594-E596 PolarHBondContact O-N 3.3Å; E596-D598 PolarHBondContact O-N 2.98Å; E596-G599 WeakPolarHBondContact O-CA 3.36Å; E596-G599 PolarHBondContact O-N 3.05Å; E596-G599 VanDerWaalsContact O-N 3.1Å; E596-Q600 WeakPolarHBondContact O-CG 3.25Å; E596-Q600 PolarHBondContact O-N 3.49Å
597	E	87.8	Confident	88.6	Confident	51 Å²	51	53 Å²	53	24%	0.238	26%	0.255	C	S	.	.	H	α-helix	trans	-55.9	-49.5	178.1	-176.7	-171.5	178	0	0	111.8	R547 R593 W594 G599 Q600 Q601	R547-E597 IonicContact CZ-OE2 2.69Å; R547-E597 IonicContact NH1-OE1 2.81Å; R547-E597 IonicContact NH1-OE2 3.71Å; R547-E597 PolarHBondContact NH1-OE2 3.48Å; R547-E597 IonicContact NH2-OE2 3.46Å; R547-E597 PolarHBondContact NH2-OE2 3.35Å; R593-E597 WeakPolarHBondContact O-CB 3.27Å; R593-E597 PolarHBondContact O-N 2.95Å; W594-E597 PolarHBondContact O-N 3.29Å; E597-G599 PolarHBondContact O-N 3.24Å; E597-Q600 PolarHBondContact O-N 2.75Å; E597-Q601 WeakPolarHBondContact O-CG 3.26Å
598	D	88.6	Confident	88.5	Confident	5 Å²	5	53.1 Å²	53.1	3%	0.027	26%	0.256	C	S	.	.	H	α-helix	trans	-67.6	-27.1	178.7	-161.8	87.6	0	0	0	112	W594 E596 Q601 R702 R748	W594-D598 HydrophobicContact CZ2-CB 4.43Å; W594-D598 VanDerWaalsContact O-CB 3.26Å; W594-D598 WeakPolarHBondContact O-CB 3.16Å; W594-D598 PolarHBondContact O-N 3.3Å; E596-D598 PolarHBondContact O-N 2.98Å; D598-Q601 PolarHBondContact O-N 3.43Å; D598-R702 PolarHBondContact O-NH2 3.49Å; D598-R702 VanDerWaalsContact O-NH2 3.11Å; D598-R702 IonicContact OD1-CZ 3.73Å; D598-R702 IonicContact OD1-NE 3.23Å; D598-R702 PolarHBondContact OD1-NE 3Å; D598-R702 IonicContact OD1-NH2 2.73Å; D598-R702 PolarHBondContact OD1-NH2 2.76Å; D598-R702 IonicContact OD2-CZ 3.31Å; D598-R702 IonicContact OD2-NE 3.4Å; D598-R702 IonicContact OD2-NH2 2.64Å; D598-R702 PolarHBondContact OD2-NH2 3.49Å; D598-R748 IonicContact OD1-CZ 2.73Å; D598-R748 IonicContact OD1-NH1 3.77Å; D598-R748 PolarHBondContact OD1-NH1 3.24Å; D598-R748 VanDerWaalsContact OD1-NH1 3.11Å; D598-R748 IonicContact OD1-NH2 2.7Å; D598-R748 PolarHBondContact OD1-NH2 3.48Å; D598-R748 IonicContact OD2-CZ 3.69Å; D598-R748 IonicContact OD2-NH1 3.59Å; D598-R748 PolarHBondContact OD2-NH1 3.19Å; D598-R748 IonicContact OD2-NH2 3.87Å
599	G	87.3	Confident	88.4	Confident	36 Å²	36	53.7 Å²	53.7	37%	0.371	26%	0.255	S	S	.	.	H	α-helix	trans	-77.2	-25.3	176.2	0	0	0	0	0	115.2	F595 E596 E597 Q601	F595-G599 PolarHBondContact O-N 3.24Å; E596-G599 WeakPolarHBondContact O-CA 3.36Å; E596-G599 PolarHBondContact O-N 3.05Å; E596-G599 VanDerWaalsContact O-N 3.1Å; E597-G599 PolarHBondContact O-N 3.24Å; G599-Q601 VanDerWaalsContact C-N 3.26Å
600	Q	86.4	Confident	88.2	Confident	169 Å²	169	52.7 Å²	52.7	79%	0.79	25%	0.253	S	S	*	.	H	α-helix	trans	-77.3	-16.9	170.5	-67.4	177	31.6	0	0	112.1	E596 E597	E596-Q600 WeakPolarHBondContact O-CG 3.25Å; E596-Q600 PolarHBondContact O-N 3.49Å; E597-Q600 PolarHBondContact O-N 2.75Å
601	Q	83.5	Confident	88.1	Confident	38 Å²	38	56.2 Å²	56.2	18%	0.178	27%	0.272	C	S	.	.	S	Bend	trans	-84.3	154.5	175.7	-61.6	176.7	33.8	0	0	111.3	E597 D598 G599	E597-Q601 WeakPolarHBondContact O-CG 3.26Å; D598-Q601 PolarHBondContact O-N 3.43Å; G599-Q601 VanDerWaalsContact C-N 3.26Å
602	W	82.7	Confident	88	Confident	74 Å²	74	56.7 Å²	56.7	28%	0.28	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-60.3	146.1	177	76.3	-74.4	0	0	0	111.3	F604 Y663 V664 Y667 R702	W602-F604 HydrophobicContact CH2-CB 3.17Å; W602-F604 HydrophobicContact CZ2-CB 3.47Å; W602-F604 VanDerWaalsContact CZ2-CB 3.47Å; W602-F604 HydrophobicContact CZ3-CB 3.95Å; W602-Y663 HydrophobicContact CE3-CD2 4.46Å; W602-V664 HydrophobicContact CZ2-CG2 4.31Å; W602-Y667 AromaticContact CH2-CE1 3.7Å; W602-Y667 HydrophobicContact CH2-CE1 3.7Å; W602-Y667 AromaticContact CH2-CE2 3.69Å; W602-Y667 HydrophobicContact CH2-CE2 3.69Å; W602-Y667 AromaticContact CH2-CZ 3.19Å; W602-Y667 WeakPolarHBondContact CH2-OH 3.29Å; W602-Y667 HydrophobicContact CZ2-CD1 4.22Å; W602-Y667 AromaticContact CZ2-CE1 3.3Å; W602-Y667 HydrophobicContact CZ2-CE1 3.3Å; W602-Y667 HydrophobicContact CZ2-CE2 4.19Å; W602-Y667 AromaticContact CZ2-CZ 3.27Å; W602-Y667 WeakPolarHBondContact CZ2-OH 3.46Å; W602-R702 PolarHBondContact O-NH1 3.12Å
603	N	84.7	Confident	88.1	Confident	110 Å²	110	53.9 Å²	53.9	59%	0.588	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-85.4	116.2	-172.3	-178.6	-8.6	0	0	0	112.1	I605	N603-I605 WeakPolarHBondContact OD1-CB 3.42Å; N603-I605 WeakPolarHBondContact OD1-CG1 3.35Å; N603-I605 PolarHBondContact OD1-N 3.37Å
604	F	88.5	Confident	88.2	Confident	1 Å²	1	49.3 Å²	49.3	0%	0.004	25%	0.245	C	C	.	.			trans	-95.5	-10.3	-176.7	75.3	-78.7	0	0	0	115.2	W602 R606 D607 T608 Y667 P700 Q701 R702	W602-F604 HydrophobicContact CH2-CB 3.17Å; W602-F604 HydrophobicContact CZ2-CB 3.47Å; W602-F604 VanDerWaalsContact CZ2-CB 3.47Å; W602-F604 HydrophobicContact CZ3-CB 3.95Å; F604-R606 PolarHBondContact O-N 3.22Å; F604-D607 PolarHBondContact O-N 3.18Å; F604-T608 WeakPolarHBondContact CD2-OG1 3.45Å; F604-T608 WeakPolarHBondContact O-CB 3.37Å; F604-T608 PolarHBondContact O-N 3.1Å; F604-T608 PolarHBondContact O-OG1 3.37Å; F604-Y667 HydrophobicContact CB-CD1 4.11Å; F604-Y667 HydrophobicContact CB-CD2 4.37Å; F604-Y667 HydrophobicContact CB-CE1 4.31Å; F604-Y667 HydrophobicContact CB-CE2 4.5Å; F604-Y667 HydrophobicContact CB-CG 4.22Å; F604-Y667 HydrophobicContact CD2-CD1 4.12Å; F604-Y667 AromaticContact CD2-CG 3.9Å; F604-Y667 HydrophobicContact CD2-CG 3.9Å; F604-Y667 HydrophobicContact CG-CD1 4.37Å; F604-Y667 HydrophobicContact CG-CG 4.46Å; F604-P700 HydrophobicContact CE2-CB 3.94Å; F604-Q701 VanDerWaalsContact CE2-C 3.44Å; F604-Q701 WeakPolarHBondContact CE2-O 3.38Å; F604-R702 HydrophobicContact CD1-CB 4.33Å; F604-R702 HydrophobicContact CD1-CG 4.3Å; F604-R702 HydrophobicContact CE1-CB 3.75Å; F604-R702 HydrophobicContact CE1-CG 4.17Å; F604-R702 HydrophobicContact CE2-CB 4.33Å; F604-R702 HydrophobicContact CZ-CB 3.75Å
605	I	88	Confident	88.4	Confident	36 Å²	36	49.3 Å²	49.3	19%	0.185	25%	0.245	C	C	.	.	H	α-helix	trans	-67.2	-41.7	-168.1	-55.3	-57.3	0	0	0	111.7	N603 T608 E609 P700 P749	N603-I605 WeakPolarHBondContact OD1-CB 3.42Å; N603-I605 WeakPolarHBondContact OD1-CG1 3.35Å; N603-I605 PolarHBondContact OD1-N 3.37Å; I605-T608 PolarHBondContact O-N 3.07Å; I605-E609 PolarHBondContact O-N 3.16Å; I605-P700 HydrophobicContact CD1-CB 4.23Å; I605-P700 HydrophobicContact CD1-CG 3.61Å; I605-P749 HydrophobicContact CG2-CG 3.72Å
606	R	84.4	Confident	88.5	Confident	160 Å²	160	48 Å²	48	60%	0.604	24%	0.239	S	C	*	.	H	α-helix	trans	-62.6	-50.7	176.6	-175.2	-163	65.1	-171.3	-2.7	111.3	F604 T608 E609 T610	F604-R606 PolarHBondContact O-N 3.22Å; R606-T608 PolarHBondContact O-N 3.15Å; R606-E609 PolarHBondContact O-N 3.28Å; R606-T610 WeakPolarHBondContact O-CB 3.47Å; R606-T610 PolarHBondContact O-N 3.29Å; R606-T610 PolarHBondContact O-OG1 2.66Å; R606-T610 VanDerWaalsContact O-OG1 3.08Å
607	D	86.6	Confident	88.5	Confident	5 Å²	5	43.8 Å²	43.8	3%	0.027	22%	0.219	C	C	.	.	H	α-helix	trans	-62.4	-31.8	-179.6	-70.1	20.1	0	0	0	111.1	F604 N611 G661 N662	F604-D607 PolarHBondContact O-N 3.18Å; D607-N611 VanDerWaalsContact O-CB 3.31Å; D607-N611 WeakPolarHBondContact O-CB 3.2Å; D607-N611 PolarHBondContact O-N 3.02Å; D607-N611 VanDerWaalsContact O-N 3.12Å; D607-G661 WeakPolarHBondContact OD2-CA 3.47Å; D607-N662 PolarHBondContact OD1-ND2 3Å; D607-N662 VanDerWaalsContact OD1-ND2 3.11Å; D607-N662 PolarHBondContact OD2-N 2.81Å; D607-N662 PolarHBondContact OD2-ND2 3.41Å
608	T	90.3	Very high	88.7	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-70.3	-49.5	174.6	-62	0	0	0	0	113	F604 I605 R606 A612 I659 Q669 P700	F604-T608 WeakPolarHBondContact CD2-OG1 3.45Å; F604-T608 WeakPolarHBondContact O-CB 3.37Å; F604-T608 PolarHBondContact O-N 3.1Å; F604-T608 PolarHBondContact O-OG1 3.37Å; I605-T608 PolarHBondContact O-N 3.07Å; R606-T608 PolarHBondContact O-N 3.15Å; T608-A612 CarbonylContact O-C 3.48Å; T608-A612 VanDerWaalsContact O-C 3.3Å; T608-A612 WeakPolarHBondContact O-CA 3.47Å; T608-A612 PolarHBondContact O-N 2.96Å; T608-I659 HydrophobicContact CG2-CD1 3.74Å; T608-Q669 HydrophobicContact CG2-CB 4.28Å; T608-P700 HydrophobicContact CG2-CB 3.67Å
609	E	87.9	Confident	88.8	Confident	31 Å²	31	45.1 Å²	45.1	15%	0.145	22%	0.223	C	C	.	.	H	α-helix	trans	-67	-38.9	177.7	-173.7	72.8	162.8	0	0	111.2	I605 R606 S613 S751 S752	I605-E609 PolarHBondContact O-N 3.16Å; R606-E609 PolarHBondContact O-N 3.28Å; E609-S613 VanDerWaalsContact CD-OG 3.25Å; E609-S613 WeakPolarHBondContact O-CA 3.31Å; E609-S613 WeakPolarHBondContact O-CB 3.1Å; E609-S613 PolarHBondContact O-N 2.97Å; E609-S613 PolarHBondContact OE1-OG 2.8Å; E609-S613 PolarHBondContact OE2-OG 3.35Å; E609-S751 PolarHBondContact OE1-OG 3.04Å; E609-S751 WeakPolarHBondContact OE2-CB 3.49Å; E609-S751 PolarHBondContact OE2-OG 3.25Å; E609-S752 PolarHBondContact OE1-N 2.84Å; E609-S752 PolarHBondContact OE1-OG 2.86Å
610	T	87.2	Confident	89.2	Confident	78 Å²	78	43.4 Å²	43.4	48%	0.479	21%	0.205	S	C	.	.	H	α-helix	trans	-66.2	-42.2	177.7	-59.6	0	0	0	0	112.9	R606	R606-T610 WeakPolarHBondContact O-CB 3.47Å; R606-T610 PolarHBondContact O-N 3.29Å; R606-T610 PolarHBondContact O-OG1 2.66Å; R606-T610 VanDerWaalsContact O-OG1 3.08Å
611	N	87.9	Confident	89.5	Confident	74 Å²	74	35.4 Å²	35.4	40%	0.396	17%	0.168	S	C	.	.	H	α-helix	trans	-96.3	-15.1	-173.2	-66.1	-21.1	0	0	0	114.2	D607 I659 Q660	D607-N611 VanDerWaalsContact O-CB 3.31Å; D607-N611 WeakPolarHBondContact O-CB 3.2Å; D607-N611 PolarHBondContact O-N 3.02Å; D607-N611 VanDerWaalsContact O-N 3.12Å; N611-I659 HydrophobicContact CB-CG2 3.95Å; N611-Q660 PolarHBondContact ND2-O 2.85Å
612	A	90.7	Very high	90	Very high	11 Å²	11	35 Å²	35	9%	0.091	17%	0.168	C	C	.	.	H	α-helix	trans	-153.1	46	-179.4	0	0	0	0	0	113.2	T608 C614 I659 Q669	T608-A612 CarbonylContact O-C 3.48Å; T608-A612 VanDerWaalsContact O-C 3.3Å; T608-A612 WeakPolarHBondContact O-CA 3.47Å; T608-A612 PolarHBondContact O-N 2.96Å; A612-C614 PolarHBondContact O-N 3.28Å; A612-I659 HydrophobicContact CB-CD1 3.59Å; A612-I659 HydrophobicContact CB-CG1 3.88Å; A612-Q669 WeakPolarHBondContact O-CG 3.28Å; A612-Q669 PolarHBondContact O-NE2 3.01Å
613	S	92.8	Very high	90.5	Very high	7 Å²	7	31.5 Å²	31.5	5%	0.049	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-52.9	137.1	167.6	-159.6	0	0	0	0	110.5	E609 F628 S751 C753 L754 Y756	E609-S613 VanDerWaalsContact CD-OG 3.25Å; E609-S613 WeakPolarHBondContact O-CA 3.31Å; E609-S613 WeakPolarHBondContact O-CB 3.1Å; E609-S613 PolarHBondContact O-N 2.97Å; E609-S613 PolarHBondContact OE1-OG 2.8Å; E609-S613 PolarHBondContact OE2-OG 3.35Å; S613-F628 WeakPolarHBondContact O-CZ 3.48Å; S613-S751 PolarHBondContact OG-OG 2.83Å; S613-C753 WeakPolarHBondContact OG-CA 3.43Å; S613-L754 PolarHBondContact OG-N 2.88Å; S613-Y756 WeakPolarHBondContact O-CD2 3.27Å
614	C	94.2	Very high	91	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-67.6	147.5	-179.6	-74.4	0	0	0	0	112	A612 C616 C671 L679 S751 C753 Y756	A612-C614 PolarHBondContact O-N 3.28Å; C614-C616 PolarHBondContact O-N 2.9Å; C614-C671 WeakPolarHBondContact CA-SG 3.45Å; C614-C671 HydrophobicContact CB-CB 3.68Å; C614-C671 WeakPolarHBondContact CB-SG 3.32Å; C614-C671 WeakPolarHBondContact SG-CA 3.42Å; C614-C671 WeakPolarHBondContact SG-CB 3.37Å; C614-C671 CovalentContact SG-SG 2.03Å; C614-C671 PolarHBondContact SG-SG 2.93Å; C614-L679 HydrophobicContact CB-CD1 3.82Å; C614-L679 HydrophobicContact CB-CD2 3.64Å; C614-L679 HydrophobicContact CB-CG 4.43Å; C614-S751 WeakPolarHBondContact CB-OG 3.46Å; C614-S751 PolarHBondContact N-OG 3.44Å; C614-S751 WeakPolarHBondContact SG-CB 3.48Å; C614-C753 WeakPolarHBondContact O-CA 3.3Å; C614-C753 WeakPolarHBondContact O-CB 3.37Å; C614-Y756 WeakPolarHBondContact O-CB 3.39Å
615	P	95	Very high	91.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-57.6	137.3	167.2	-16.5	25.4	0	0	0	111.5	R617 Q620 A621 F628 Y673 Y756	P615-R617 PolarHBondContact O-N 2.72Å; P615-Q620 HydrophobicContact CB-CB 3.68Å; P615-A621 HydrophobicContact CB-CB 4.23Å; P615-A621 HydrophobicContact CG-CB 3.93Å; P615-F628 HydrophobicContact CG-CD2 3.97Å; P615-F628 HydrophobicContact CG-CE2 3.99Å; P615-F628 HydrophobicContact CG-CG 4.48Å; P615-F628 HydrophobicContact CG-CZ 4.49Å; P615-Y673 WeakPolarHBondContact CB-OH 3.04Å; P615-Y673 VanDerWaalsContact CD-OH 3.31Å; P615-Y673 WeakPolarHBondContact CD-OH 3.4Å; P615-Y673 VanDerWaalsContact O-CE1 3.26Å; P615-Y673 WeakPolarHBondContact O-CE1 3.07Å; P615-Y673 PolarHBondContact O-OH 3.3Å; P615-Y756 HydrophobicContact CB-CD1 4.34Å; P615-Y756 HydrophobicContact CB-CD2 4.31Å; P615-Y756 HydrophobicContact CB-CE1 3.86Å; P615-Y756 HydrophobicContact CB-CE2 3.84Å; P615-Y756 HydrophobicContact CG-CD2 4.24Å; P615-Y756 HydrophobicContact CG-CE1 4.49Å; P615-Y756 HydrophobicContact CG-CE2 3.59Å
616	C	92.1	Very high	91.5	Very high	4 Å²	4	24.8 Å²	24.8	3%	0.027	12%	0.119	C	C	.	.	S	Bend	trans	-66.7	-26.2	178.7	-57.2	0	0	0	0	113.2	C614 L679 C753 Y1140 L1165	C614-C616 PolarHBondContact O-N 2.9Å; C616-L679 PolarHBondContact O-N 3.24Å; C616-L679 VanDerWaalsContact O-N 3.13Å; C616-C753 VanDerWaalsContact CA-SG 3.52Å; C616-C753 HydrophobicContact CB-CB 3.87Å; C616-C753 WeakPolarHBondContact CB-SG 3.31Å; C616-C753 WeakPolarHBondContact SG-CB 3.46Å; C616-C753 CovalentContact SG-SG 2.04Å; C616-C753 PolarHBondContact SG-SG 3.39Å; C616-Y1140 HydrophobicContact CB-CD2 4.47Å; C616-L1165 HydrophobicContact CB-CD2 4.14Å
617	R	91.6	Very high	91.9	Very high	28 Å²	28	18.6 Å²	18.6	11%	0.106	10%	0.096	C	C	.	.	B	Isolated β-bridge	trans	-130	146.2	-173.8	-80.9	-66.8	-57.2	-179.9	6.5	112.2	P615 E619 Q620 A621 Y673 D676 G677 Y678 Y1140	P615-R617 PolarHBondContact O-N 2.72Å; R617-E619 VanDerWaalsContact C-N 3.27Å; R617-E619 IonicContact CZ-OE1 2.67Å; R617-E619 IonicContact CZ-OE2 2.72Å; R617-E619 IonicContact NE-OE2 3.07Å; R617-E619 PolarHBondContact NE-OE2 3.48Å; R617-E619 IonicContact NH2-OE1 3.45Å; R617-E619 PolarHBondContact NH2-OE1 2.97Å; R617-E619 IonicContact NH2-OE2 2.72Å; R617-E619 PolarHBondContact NH2-OE2 3.43Å; R617-E619 PolarHBondContact O-N 2.89Å; R617-Q620 HydrophobicContact CB-CG 3.98Å; R617-Q620 WeakPolarHBondContact O-CB 3.44Å; R617-Q620 PolarHBondContact O-N 3.02Å; R617-Q620 VanDerWaalsContact O-N 3.11Å; R617-A621 PolarHBondContact O-N 2.9Å; R617-Y673 VanDerWaalsContact C-CE1 3.46Å; R617-D676 VanDerWaalsContact CZ-O 3.29Å; R617-D676 PolarHBondContact NH1-O 2.83Å; R617-D676 PolarHBondContact NH2-O 2.85Å; R617-G677 CarbonylContact C-O 3.54Å; R617-G677 WeakPolarHBondContact CA-O 3.31Å; R617-G677 WeakPolarHBondContact CD-O 3.45Å; R617-G677 PolarHBondContact NE-O 2.81Å; R617-Y678 VanDerWaalsContact NH1-CZ 3.34Å; R617-Y1140 HydrophobicContact CB-CE2 4.43Å; R617-Y1140 HydrophobicContact CG-CD2 4.47Å; R617-Y1140 HydrophobicContact CG-CE1 4.43Å; R617-Y1140 HydrophobicContact CG-CE2 3.81Å
618	Y	91.9	Very high	92.3	Very high	47 Å²	47	18.5 Å²	18.5	18%	0.184	10%	0.096	C	C	.	.	H	α-helix	trans	-53.2	-41.6	174.7	171.9	-105.6	0	0	0	112.9	Q620 A621 V622 E651 F653 Y673 G677	Y618-Q620 VanDerWaalsContact C-N 3.28Å; Y618-Q620 PolarHBondContact O-N 3.08Å; Y618-A621 PolarHBondContact O-N 3.16Å; Y618-V622 HydrophobicContact CD1-CG2 4.28Å; Y618-V622 HydrophobicContact CD2-CG2 4.31Å; Y618-V622 HydrophobicContact CE1-CG2 3.76Å; Y618-V622 HydrophobicContact CE2-CG2 3.77Å; Y618-V622 VanDerWaalsContact CZ-CG2 3.47Å; Y618-V622 WeakPolarHBondContact O-CG2 3.41Å; Y618-V622 PolarHBondContact O-N 3.22Å; Y618-E651 HydrophobicContact CD2-CB 4.21Å; Y618-E651 HydrophobicContact CE2-CB 3.71Å; Y618-E651 HydrophobicContact CE2-CG 3.81Å; Y618-F653 HydrophobicContact CD2-CE2 4.2Å; Y618-F653 HydrophobicContact CE2-CE2 4.09Å; Y618-F653 HydrophobicContact CE2-CZ 4.42Å; Y618-Y673 HydrophobicContact CD2-CD2 4.34Å; Y618-Y673 HydrophobicContact CD2-CG 4.4Å; Y618-G677 PolarHBondContact N-O 2.77Å
619	E	92.2	Very high	92.4	Very high	37 Å²	37	18.5 Å²	18.5	17%	0.173	10%	0.095	C	C	.	.	H	α-helix	trans	-68.6	-29	-177.7	-58.1	71.3	-146.8	0	0	112	R617 I623 A1135	R617-E619 VanDerWaalsContact C-N 3.27Å; R617-E619 IonicContact CZ-OE1 2.67Å; R617-E619 IonicContact CZ-OE2 2.72Å; R617-E619 IonicContact NE-OE2 3.07Å; R617-E619 PolarHBondContact NE-OE2 3.48Å; R617-E619 IonicContact NH2-OE1 3.45Å; R617-E619 PolarHBondContact NH2-OE1 2.97Å; R617-E619 IonicContact NH2-OE2 2.72Å; R617-E619 PolarHBondContact NH2-OE2 3.43Å; R617-E619 PolarHBondContact O-N 2.89Å; E619-I623 PolarHBondContact O-N 2.93Å; E619-A1135 HydrophobicContact CB-CB 3.83Å; E619-A1135 HydrophobicContact CG-CB 3.92Å
620	Q	94.2	Very high	92.6	Very high	1 Å²	1	17 Å²	17	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-68.7	-46.9	172.1	-58.6	177	-52.1	0	0	110.2	P615 R617 Y618 V622 I623 D624 Y756 G1136 R1138	P615-Q620 HydrophobicContact CB-CB 3.68Å; R617-Q620 HydrophobicContact CB-CG 3.98Å; R617-Q620 WeakPolarHBondContact O-CB 3.44Å; R617-Q620 PolarHBondContact O-N 3.02Å; R617-Q620 VanDerWaalsContact O-N 3.11Å; Y618-Q620 VanDerWaalsContact C-N 3.28Å; Y618-Q620 PolarHBondContact O-N 3.08Å; Q620-V622 VanDerWaalsContact C-N 3.29Å; Q620-V622 PolarHBondContact O-N 2.85Å; Q620-I623 WeakPolarHBondContact O-CG1 3.42Å; Q620-I623 PolarHBondContact O-N 3.05Å; Q620-I623 VanDerWaalsContact O-N 3.17Å; Q620-D624 WeakPolarHBondContact O-CB 3.06Å; Q620-D624 PolarHBondContact O-N 2.03Å; Q620-Y756 HydrophobicContact CB-CE1 4.09Å; Q620-Y756 HydrophobicContact CG-CE1 4.37Å; Q620-G1136 WeakPolarHBondContact CG-O 3.44Å; Q620-R1138 PolarHBondContact NE2-O 3.47Å
621	A	94.1	Very high	92.7	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.008	7%	0.067	C	C	.	.	H	α-helix	trans	-61.4	-35	177	0	0	0	0	0	113.1	P615 R617 Y618 I623 D624 F653 Y673	P615-A621 HydrophobicContact CB-CB 4.23Å; P615-A621 HydrophobicContact CG-CB 3.93Å; R617-A621 PolarHBondContact O-N 2.9Å; Y618-A621 PolarHBondContact O-N 3.16Å; A621-I623 VanDerWaalsContact C-N 3.32Å; A621-I623 PolarHBondContact O-N 3.16Å; A621-D624 PolarHBondContact O-N 2.82Å; A621-F653 HydrophobicContact CB-CD1 4.15Å; A621-F653 HydrophobicContact CB-CD2 3.81Å; A621-F653 HydrophobicContact CB-CE1 4.07Å; A621-F653 HydrophobicContact CB-CE2 3.73Å; A621-F653 HydrophobicContact CB-CG 4.03Å; A621-F653 HydrophobicContact CB-CZ 3.87Å; A621-F653 VanDerWaalsContact O-CE1 3.29Å; A621-F653 WeakPolarHBondContact O-CE1 3.28Å; A621-Y673 HydrophobicContact CB-CE2 3.69Å
622	V	92.4	Very high	92.2	Very high	28 Å²	28	11.1 Å²	11.1	17%	0.17	6%	0.055	C	C	.	.	H	α-helix	trans	-64.2	-32.4	176.3	165.6	0	0	0	0	112.9	Y618 Q620 F653	Y618-V622 HydrophobicContact CD1-CG2 4.28Å; Y618-V622 HydrophobicContact CD2-CG2 4.31Å; Y618-V622 HydrophobicContact CE1-CG2 3.76Å; Y618-V622 HydrophobicContact CE2-CG2 3.77Å; Y618-V622 VanDerWaalsContact CZ-CG2 3.47Å; Y618-V622 WeakPolarHBondContact O-CG2 3.41Å; Y618-V622 PolarHBondContact O-N 3.22Å; Q620-V622 VanDerWaalsContact C-N 3.29Å; Q620-V622 PolarHBondContact O-N 2.85Å; V622-F653 HydrophobicContact CG2-CZ 4.05Å
623	I	93.8	Very high	91.5	Very high	2 Å²	2	12.8 Å²	12.8	1%	0.01	6%	0.059	C	C	.	.	H	α-helix	trans	-92	-21.3	177.7	65	163.1	0	0	0	113.7	E619 Q620 A621 I625 P759 F761 S951 I1132 G1136 M1137	E619-I623 PolarHBondContact O-N 2.93Å; Q620-I623 WeakPolarHBondContact O-CG1 3.42Å; Q620-I623 PolarHBondContact O-N 3.05Å; Q620-I623 VanDerWaalsContact O-N 3.17Å; A621-I623 VanDerWaalsContact C-N 3.32Å; A621-I623 PolarHBondContact O-N 3.16Å; I623-I625 PolarHBondContact O-N 2.88Å; I623-P759 HydrophobicContact CD1-CG 3.85Å; I623-P759 HydrophobicContact CG1-CG 3.94Å; I623-F761 HydrophobicContact CB-CD1 4.29Å; I623-F761 HydrophobicContact CD1-CD1 3.82Å; I623-F761 HydrophobicContact CD1-CE1 4.02Å; I623-F761 HydrophobicContact CG2-CD1 4.25Å; I623-F761 HydrophobicContact CG2-CE1 4.04Å; I623-S951 WeakPolarHBondContact O-CB 3.3Å; I623-S951 PolarHBondContact O-OG 3.47Å; I623-I1132 HydrophobicContact CG2-CG2 3.45Å; I623-I1132 VanDerWaalsContact CG2-CG2 3.45Å; I623-G1136 VanDerWaalsContact CD1-C 3.49Å; I623-M1137 HydrophobicContact CD1-CG 4.19Å
624	D	95.4	Very high	90.8	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.005	6%	0.061	C	C	.	.			trans	-83.1	40.7	-173.6	-155.5	-3.2	0	0	0	114.1	Q620 A621 G626 R627 F628 Y756 P759	Q620-D624 WeakPolarHBondContact O-CB 3.06Å; Q620-D624 PolarHBondContact O-N 2.03Å; A621-D624 PolarHBondContact O-N 2.82Å; D624-G626 PolarHBondContact O-N 3.13Å; D624-R627 VanDerWaalsContact CG-NH2 3.34Å; D624-R627 PolarHBondContact O-N 2.77Å; D624-R627 VanDerWaalsContact O-N 3.07Å; D624-R627 IonicContact OD1-CZ 3.01Å; D624-R627 IonicContact OD1-NE 3.46Å; D624-R627 PolarHBondContact OD1-NE 2.92Å; D624-R627 IonicContact OD1-NH2 2.71Å; D624-R627 PolarHBondContact OD1-NH2 3.09Å; D624-R627 IonicContact OD2-CZ 2.75Å; D624-R627 VanDerWaalsContact OD2-CZ 3.31Å; D624-R627 IonicContact OD2-NE 3.88Å; D624-R627 PolarHBondContact OD2-NE 2.89Å; D624-R627 IonicContact OD2-NH2 3.15Å; D624-R627 PolarHBondContact OD2-NH2 3.11Å; D624-F628 HydrophobicContact CB-CD2 4.09Å; D624-F628 PolarHBondContact O-N 2.81Å; D624-Y756 VanDerWaalsContact OD2-CE2 3.24Å; D624-Y756 WeakPolarHBondContact OD2-CE2 3.42Å; D624-Y756 PolarHBondContact OD2-OH 3.39Å; D624-P759 HydrophobicContact CB-CG 3.97Å
625	I	94.2	Very high	90.2	Very high	3 Å²	3	13.2 Å²	13.2	2%	0.015	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-34.4	-172.2	-62.8	151.7	0	0	0	112.9	I623 F628 F913 V915 R924 L949	I623-I625 PolarHBondContact O-N 2.88Å; I625-F628 CarbonylContact C-O 3.4Å; I625-F628 WeakPolarHBondContact CA-O 3.22Å; I625-F628 VanDerWaalsContact O-O 3.14Å; I625-F913 HydrophobicContact CD1-CD1 4.31Å; I625-F913 HydrophobicContact CD1-CE1 4.4Å; I625-F913 HydrophobicContact CG1-CD1 4.15Å; I625-F913 HydrophobicContact CG1-CE1 4.33Å; I625-F913 HydrophobicContact CG2-CB 4.48Å; I625-F913 HydrophobicContact CG2-CD1 3.98Å; I625-V915 HydrophobicContact CG2-CG2 4.12Å; I625-V915 WeakPolarHBondContact O-CG2 3.04Å; I625-R924 HydrophobicContact CD1-CB 3.8Å; I625-L949 HydrophobicContact CD1-CD2 3.87Å
626	G	93.2	Very high	89.2	Confident	1 Å²	1	20 Å²	20	1%	0.01	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-24.2	-174.3	0	0	0	0	0	114.8	D624 V915 R920	D624-G626 PolarHBondContact O-N 3.13Å; G626-V915 WeakPolarHBondContact O-CG1 3.19Å; G626-R920 CarbonylContact C-O 3.54Å; G626-R920 VanDerWaalsContact CA-O 3.24Å; G626-R920 WeakPolarHBondContact CA-O 3.44Å
627	R	93.4	Very high	88.3	Confident	31 Å²	31	21.5 Å²	21.5	12%	0.117	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-34	175.6	-65.1	-176.3	-65.2	-178.4	2.7	111.9	D624 N655 A656 R757 R920 P953	D624-R627 VanDerWaalsContact CG-NH2 3.34Å; D624-R627 PolarHBondContact O-N 2.77Å; D624-R627 VanDerWaalsContact O-N 3.07Å; D624-R627 IonicContact OD1-CZ 3.01Å; D624-R627 IonicContact OD1-NE 3.46Å; D624-R627 PolarHBondContact OD1-NE 2.92Å; D624-R627 IonicContact OD1-NH2 2.71Å; D624-R627 PolarHBondContact OD1-NH2 3.09Å; D624-R627 IonicContact OD2-CZ 2.75Å; D624-R627 VanDerWaalsContact OD2-CZ 3.31Å; D624-R627 IonicContact OD2-NE 3.88Å; D624-R627 PolarHBondContact OD2-NE 2.89Å; D624-R627 IonicContact OD2-NH2 3.15Å; D624-R627 PolarHBondContact OD2-NH2 3.11Å; R627-N655 CarbonylContact O-C 3.43Å; R627-N655 WeakPolarHBondContact O-CA 3.23Å; R627-A656 PolarHBondContact O-N 3Å; R627-R757 PolarHBondContact NH1-O 3.35Å; R627-R757 PolarHBondContact NH2-O 2.77Å; R627-R920 HydrophobicContact CG-CB 4.01Å; R627-P953 HydrophobicContact CG-CG 4.41Å
628	F	94.7	Very high	87	Confident	3 Å²	3	21.5 Å²	21.5	1%	0.013	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	137.3	-176.6	-60.2	-82.2	0	0	0	111.8	S613 P615 D624 I625 F653 L654 C671 Y756	S613-F628 WeakPolarHBondContact O-CZ 3.48Å; P615-F628 HydrophobicContact CG-CD2 3.97Å; P615-F628 HydrophobicContact CG-CE2 3.99Å; P615-F628 HydrophobicContact CG-CG 4.48Å; P615-F628 HydrophobicContact CG-CZ 4.49Å; D624-F628 HydrophobicContact CB-CD2 4.09Å; D624-F628 PolarHBondContact O-N 2.81Å; I625-F628 CarbonylContact C-O 3.4Å; I625-F628 WeakPolarHBondContact CA-O 3.22Å; I625-F628 VanDerWaalsContact O-O 3.14Å; F628-F653 HydrophobicContact CB-CB 4.35Å; F628-F653 HydrophobicContact CB-CD1 4.31Å; F628-L654 WeakPolarHBondContact CA-O 3.44Å; F628-C671 VanDerWaalsContact CE1-SG 3.6Å; F628-Y756 HydrophobicContact CE2-CE2 4.13Å
629	M	92.7	Very high	85.2	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	159.9	175	54.9	165.6	-86.5	0	0	109.8	F653 L654 A656 F706 T892 Y901	M629-F653 CarbonylContact O-C 3.57Å; M629-F653 WeakPolarHBondContact O-CA 3.24Å; M629-F653 WeakPolarHBondContact O-CB 3.43Å; M629-L654 WeakPolarHBondContact CG-O 3.29Å; M629-L654 PolarHBondContact N-O 2.88Å; M629-L654 PolarHBondContact O-N 2.82Å; M629-L654 VanDerWaalsContact O-O 3.13Å; M629-A656 HydrophobicContact CB-CB 4.38Å; M629-A656 HydrophobicContact CG-CB 3.98Å; M629-A656 HydrophobicContact SD-CB 4.37Å; M629-F706 HydrophobicContact CE-CE2 3.71Å; M629-F706 HydrophobicContact CE-CZ 3.74Å; M629-F706 HydrophobicContact SD-CE2 3.73Å; M629-F706 HydrophobicContact SD-CZ 4.36Å; M629-T892 HydrophobicContact CE-CG2 4.37Å; M629-Y901 HydrophobicContact CB-CE1 3.83Å
630	P	90.7	Very high	83.3	Confident	0 Å²	0	29 Å²	29	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	148.5	179.1	-13.9	27.6	0	0	0	111.4	S635 R637 F638 Y901	P630-S635 VanDerWaalsContact CB-OG 3.23Å; P630-S635 WeakPolarHBondContact CB-OG 3.32Å; P630-R637 HydrophobicContact CB-CB 4.39Å; P630-R637 HydrophobicContact CG-CB 4.41Å; P630-F638 HydrophobicContact CB-CD2 4.22Å; P630-F638 HydrophobicContact CB-CE2 3.78Å; P630-F638 HydrophobicContact CB-CZ 4.49Å; P630-F638 HydrophobicContact CG-CE2 4.2Å; P630-F638 HydrophobicContact CG-CZ 4.44Å; P630-F638 WeakPolarHBondContact O-CE2 3.39Å; P630-Y901 WeakPolarHBondContact CD-OH 3.34Å; P630-Y901 HydrophobicContact CG-CE2 4.07Å
631	H	88.9	Confident	80.8	Confident	6 Å²	6	36.7 Å²	36.7	3%	0.028	17%	0.174	C	C	.	.			trans	-71.5	124.4	-175.5	-171.8	-89.6	0	0	0	111	R633 C634 S635 Y646 C652	H631-R633 PolarHBondContact ND1-N 3.22Å; H631-R633 PolarHBondContact O-N 2.78Å; H631-C634 HydrophobicContact CB-CB 4.15Å; H631-C634 VanDerWaalsContact ND1-CB 3.32Å; H631-C634 WeakPolarHBondContact ND1-CB 3.19Å; H631-C634 PolarHBondContact ND1-N 3.1Å; H631-C634 PolarHBondContact O-N 2.83Å; H631-C634 VanDerWaalsContact O-N 3.08Å; H631-S635 WeakPolarHBondContact O-CB 3.44Å; H631-S635 PolarHBondContact O-N 3.25Å; H631-Y646 AromaticContact CE1-CE2 3.97Å; H631-Y646 AromaticContact NE2-CE2 3.89Å; H631-C652 HydrophobicContact CB-CB 3.89Å; H631-C652 WeakPolarHBondContact CB-O 3.21Å; H631-C652 PolarHBondContact N-O 3.21Å
632	P	79.1	Confident	78.8	Confident	22 Å²	22	41.2 Å²	41.2	14%	0.143	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.2	-166.6	24.2	-35.6	0	0	0	115	L438 E705 F706	L438-P632 HydrophobicContact CD2-CB 4.3Å; P632-E705 HydrophobicContact CG-CG 4.39Å; P632-F706 HydrophobicContact CB-CZ 4.36Å; P632-F706 HydrophobicContact CG-CE1 4Å; P632-F706 HydrophobicContact CG-CZ 3.87Å
633	R	76.2	Confident	77.4	Confident	46 Å²	46	41.3 Å²	41.3	17%	0.174	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-1.2	176.1	-54.7	-165	-161.8	80.2	13	115.2	G437 L438 H631 S640 E705 T719	G437-R633 PolarHBondContact O-NE 3.11Å; G437-R633 PolarHBondContact O-NH2 3.1Å; L438-R633 HydrophobicContact CD2-CG 4.43Å; H631-R633 PolarHBondContact ND1-N 3.22Å; H631-R633 PolarHBondContact O-N 2.78Å; R633-S640 WeakPolarHBondContact O-CB 3.45Å; R633-S640 PolarHBondContact O-OG 3.06Å; R633-E705 IonicContact CZ-OE1 3.56Å; R633-E705 IonicContact CZ-OE2 2.79Å; R633-E705 VanDerWaalsContact NH1-CD 3.3Å; R633-E705 IonicContact NH1-OE1 3.65Å; R633-E705 PolarHBondContact NH1-OE1 2.85Å; R633-E705 IonicContact NH1-OE2 3.62Å; R633-E705 PolarHBondContact NH1-OE2 3.48Å; R633-E705 IonicContact NH2-OE1 3.53Å; R633-E705 PolarHBondContact NH2-OE1 2.83Å; R633-E705 IonicContact NH2-OE2 3.2Å; R633-T719 PolarHBondContact NH2-OG1 2.64Å
634	C	77.8	Confident	75.9	Confident	14 Å²	14	43.2 Å²	43.2	10%	0.095	21%	0.207	C	C	.	.	S	Bend	trans	-141.1	44.3	-172.1	-65.8	0	0	0	0	111.4	H631 C643 Y646 C652	H631-C634 HydrophobicContact CB-CB 4.15Å; H631-C634 VanDerWaalsContact ND1-CB 3.32Å; H631-C634 WeakPolarHBondContact ND1-CB 3.19Å; H631-C634 PolarHBondContact ND1-N 3.1Å; H631-C634 PolarHBondContact O-N 2.83Å; H631-C634 VanDerWaalsContact O-N 3.08Å; C634-C643 HydrophobicContact CB-CB 3.74Å; C634-C643 WeakPolarHBondContact CB-SG 3.42Å; C634-C643 WeakPolarHBondContact SG-CB 3.47Å; C634-C643 CovalentContact SG-SG 2.03Å; C634-C643 PolarHBondContact SG-SG 2.88Å; C634-Y646 HydrophobicContact CB-CD2 3.89Å; C634-C652 HydrophobicContact CB-CB 4.41Å
635	S	81.7	Confident	74.2	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.014	21%	0.212	C	C	.	.			trans	-136	137	179.8	-176.6	0	0	0	0	111.8	P630 H631 R637 F638 R639 E651	P630-S635 VanDerWaalsContact CB-OG 3.23Å; P630-S635 WeakPolarHBondContact CB-OG 3.32Å; H631-S635 WeakPolarHBondContact O-CB 3.44Å; H631-S635 PolarHBondContact O-N 3.25Å; S635-R637 PolarHBondContact O-N 2.92Å; S635-R637 PolarHBondContact OG-N 2.8Å; S635-F638 PolarHBondContact O-N 3.46Å; S635-F638 VanDerWaalsContact O-N 3.12Å; S635-R639 PolarHBondContact O-N 3.44Å; S635-E651 WeakPolarHBondContact CA-OE1 3.38Å; S635-E651 WeakPolarHBondContact CB-OE1 3.3Å; S635-E651 PolarHBondContact OG-OE1 3.49Å; S635-E651 PolarHBondContact OG-OE2 3.47Å; S635-E651 VanDerWaalsContact OG-OE2 3.08Å
636	Q	73.2	Confident	73	Confident	143 Å²	143	44.4 Å²	44.4	67%	0.668	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-63.4	-30	176	-53.3	-166.4	14.8	0	0	110.6	F638 R639 K650 E651	Q636-F638 PolarHBondContact O-N 2.9Å; Q636-R639 PolarHBondContact O-N 2.85Å; Q636-K650 PolarHBondContact NE2-O 3.37Å; Q636-E651 PolarHBondContact N-OE2 2.8Å; Q636-E651 VanDerWaalsContact N-OE2 3.17Å
637	R	73.5	Confident	71.9	Confident	36 Å²	36	47 Å²	47	14%	0.136	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-63.4	-24.1	175.8	-68.4	-175.7	171.6	175	-1.9	114.6	P630 S635 N903 D904	P630-R637 HydrophobicContact CB-CB 4.39Å; P630-R637 HydrophobicContact CG-CB 4.41Å; S635-R637 PolarHBondContact O-N 2.92Å; S635-R637 PolarHBondContact OG-N 2.8Å; R637-N903 VanDerWaalsContact CA-OD1 3.23Å; R637-N903 WeakPolarHBondContact CA-OD1 3.24Å; R637-N903 WeakPolarHBondContact CB-OD1 3.46Å; R637-N903 VanDerWaalsContact CG-OD1 3.29Å; R637-N903 WeakPolarHBondContact CG-OD1 3.03Å; R637-N903 PolarHBondContact O-OD1 2.83Å; R637-D904 WeakPolarHBondContact O-CB 3.34Å; R637-D904 PolarHBondContact O-N 3.19Å
638	F	63.7	Low	70.8	Confident	28 Å²	28	47.3 Å²	47.3	12%	0.123	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-115.1	11.7	179.3	-59.3	-48.5	0	0	0	113.4	P630 S635 Q636 S640 K891 T892 Y901 V902	P630-F638 HydrophobicContact CB-CD2 4.22Å; P630-F638 HydrophobicContact CB-CE2 3.78Å; P630-F638 HydrophobicContact CB-CZ 4.49Å; P630-F638 HydrophobicContact CG-CE2 4.2Å; P630-F638 HydrophobicContact CG-CZ 4.44Å; P630-F638 WeakPolarHBondContact O-CE2 3.39Å; S635-F638 PolarHBondContact O-N 3.46Å; S635-F638 VanDerWaalsContact O-N 3.12Å; Q636-F638 PolarHBondContact O-N 2.9Å; F638-S640 PolarHBondContact O-N 3.22Å; F638-K891 HydrophobicContact CD1-CB 3.61Å; F638-K891 HydrophobicContact CD1-CG 4.1Å; F638-K891 HydrophobicContact CE1-CB 3.72Å; F638-T892 WeakPolarHBondContact CZ-OG1 3.47Å; F638-Y901 HydrophobicContact CE1-CD2 4.21Å; F638-Y901 AromaticContact CZ-CD2 3.77Å; F638-Y901 HydrophobicContact CZ-CD2 3.77Å; F638-Y901 HydrophobicContact CZ-CE2 4.42Å; F638-Y901 HydrophobicContact CZ-CG 4.22Å; F638-V902 WeakPolarHBondContact CE1-O 3.35Å
639	R	54	Low	70.1	Confident	190 Å²	190	48.5 Å²	48.5	72%	0.717	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	14	167.6	-156.8	175.5	175	166.5	0.9	117	S635 Q636 L641 D904	S635-R639 PolarHBondContact O-N 3.44Å; Q636-R639 PolarHBondContact O-N 2.85Å; R639-L641 PolarHBondContact O-N 3.02Å; R639-L641 VanDerWaalsContact O-N 3.08Å; R639-D904 WeakPolarHBondContact CD-OD2 3.39Å
640	S	52.2	Low	69.6	Low	52 Å²	52	51.8 Å²	51.8	36%	0.364	27%	0.266	S	S	.	.			trans	-74	100.3	166.2	-168.3	0	0	0	0	109.1	R633 F638 H642	R633-S640 WeakPolarHBondContact O-CB 3.45Å; R633-S640 PolarHBondContact O-OG 3.06Å; F638-S640 PolarHBondContact O-N 3.22Å; S640-H642 VanDerWaalsContact C-N 3.29Å; S640-H642 PolarHBondContact O-N 3.34Å; S640-H642 PolarHBondContact OG-O 3.32Å
641	L	42.4	Very low	69.4	Low	161 Å²	161	52.2 Å²	52.2	84%	0.843	27%	0.268	S	S	*	.			trans	-78.8	-12	-175.3	-152.5	76.8	0	0	0	113.5	R639	R639-L641 PolarHBondContact O-N 3.02Å; R639-L641 VanDerWaalsContact O-N 3.08Å
642	H	51.8	Low	69.5	Low	97 Å²	97	52 Å²	52	45%	0.449	27%	0.267	S	S	.	.			trans	-112.8	132.8	176.1	-62.4	72.2	0	0	0	108.5	D449 S640	D449-H642 IonicContact OD2-CD2 3.34Å; D449-H642 IonicContact OD2-CG 2.7Å; S640-H642 VanDerWaalsContact C-N 3.29Å; S640-H642 PolarHBondContact O-N 3.34Å; S640-H642 PolarHBondContact OG-O 3.32Å
643	C	63.6	Low	70.2	Confident	29 Å²	29	51 Å²	51	20%	0.196	26%	0.261	C	S	.	.			trans	-153.6	78.9	178.6	176.7	0	0	0	0	109.9	C634 T645 Y646 V647	C634-C643 HydrophobicContact CB-CB 3.74Å; C634-C643 WeakPolarHBondContact CB-SG 3.42Å; C634-C643 WeakPolarHBondContact SG-CB 3.47Å; C634-C643 CovalentContact SG-SG 2.03Å; C634-C643 PolarHBondContact SG-SG 2.88Å; C643-T645 PolarHBondContact O-N 2.91Å; C643-T645 PolarHBondContact SG-OG1 3.42Å; C643-Y646 CarbonylContact O-C 3.59Å; C643-Y646 PolarHBondContact O-N 2.6Å; C643-V647 PolarHBondContact O-N 3.27Å
644	D	61.3	Low	71	Confident	43 Å²	43	48.9 Å²	48.9	23%	0.23	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-18.6	-175.4	-71.5	19.1	0	0	0	113.5	N696 K735	D644-N696 PolarHBondContact O-ND2 3.24Å; D644-K735 WeakPolarHBondContact O-CE 3.39Å; D644-K735 PolarHBondContact O-NZ 2.58Å
645	T	59.7	Low	71.6	Confident	20 Å²	20	48.2 Å²	48.2	12%	0.123	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-36	174.6	52.5	0	0	0	0	112.2	C643 N696 Y730 Y731	C643-T645 PolarHBondContact O-N 2.91Å; C643-T645 PolarHBondContact SG-OG1 3.42Å; T645-N696 WeakPolarHBondContact O-CB 3.12Å; T645-N696 PolarHBondContact O-ND2 3.03Å; T645-Y730 HydrophobicContact CG2-CD1 4.43Å; T645-Y731 HydrophobicContact CG2-CE2 4.12Å
646	Y	70.2	Confident	72.1	Confident	9 Å²	9	48.1 Å²	48.1	4%	0.035	25%	0.248	C	C	.	.	S	Bend	trans	-126.1	45.4	-172.8	-47.6	-56.9	0	0	0	112.7	H631 C634 C643 A649 C652 V670 F699	H631-Y646 AromaticContact CE1-CE2 3.97Å; H631-Y646 AromaticContact NE2-CE2 3.89Å; C634-Y646 HydrophobicContact CB-CD2 3.89Å; C643-Y646 CarbonylContact O-C 3.59Å; C643-Y646 PolarHBondContact O-N 2.6Å; Y646-A649 VanDerWaalsContact O-CB 3.26Å; Y646-A649 WeakPolarHBondContact O-CB 3.2Å; Y646-A649 PolarHBondContact O-N 3.3Å; Y646-C652 VanDerWaalsContact CB-SG 3.59Å; Y646-V670 HydrophobicContact CD2-CG1 4.46Å; Y646-V670 HydrophobicContact CE1-CG1 4.21Å; Y646-V670 HydrophobicContact CE2-CG1 3.87Å; Y646-F699 AromaticContact CE1-CD1 3.92Å; Y646-F699 HydrophobicContact CE1-CD1 3.92Å; Y646-F699 AromaticContact CE1-CE1 3.66Å; Y646-F699 HydrophobicContact CE1-CE1 3.66Å; Y646-F699 HydrophobicContact CE1-CZ 4.45Å
647	V	69.1	Low	72.8	Confident	55 Å²	55	42.3 Å²	42.3	33%	0.333	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	138.4	175.3	-177.8	0	0	0	0	111.2	C643 A649 Y695 N696	C643-V647 PolarHBondContact O-N 3.27Å; V647-A649 PolarHBondContact O-N 3.31Å; V647-Y695 CarbonylContact O-C 3.57Å; V647-Y695 WeakPolarHBondContact O-CA 3.42Å; V647-N696 PolarHBondContact O-N 2.81Å
648	G	71.3	Confident	73.5	Confident	37 Å²	37	42.9 Å²	42.9	38%	0.381	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	-4.3	177	0	0	0	0	0	115.6	P694	G648-P694 WeakPolarHBondContact CA-O 3.47Å
649	A	78.7	Confident	74.5	Confident	29 Å²	29	41.7 Å²	41.7	24%	0.24	22%	0.221	C	C	.	.			trans	-67.6	140.2	169.3	0	0	0	0	0	111.4	Y646 V647 C672 Y673 M680	Y646-A649 VanDerWaalsContact O-CB 3.26Å; Y646-A649 WeakPolarHBondContact O-CB 3.2Å; Y646-A649 PolarHBondContact O-N 3.3Å; V647-A649 PolarHBondContact O-N 3.31Å; A649-C672 HydrophobicContact CB-CB 4Å; A649-Y673 CarbonylContact C-O 3.54Å; A649-Y673 WeakPolarHBondContact CA-O 3.46Å; A649-M680 VanDerWaalsContact CA-SD 3.59Å; A649-M680 HydrophobicContact CB-CE 4.17Å; A649-M680 HydrophobicContact CB-SD 3.57Å; A649-M680 VanDerWaalsContact CB-SD 3.57Å
650	K	82.1	Confident	75.5	Confident	69 Å²	69	38.9 Å²	38.9	30%	0.3	22%	0.216	S	C	.	.	S	Bend	trans	-69.3	-48	166.8	176.3	-172.9	178.4	-176.8	0	110.5	Q636 Y673 D674	Q636-K650 PolarHBondContact NE2-O 3.37Å; K650-Y673 WeakPolarHBondContact CB-O 3.31Å; K650-Y673 PolarHBondContact N-O 3.18Å; K650-D674 VanDerWaalsContact CB-O 3.28Å; K650-D674 WeakPolarHBondContact CB-O 3.41Å; K650-D674 WeakPolarHBondContact CD-O 3Å
651	E	87.4	Confident	76.3	Confident	8 Å²	8	37.3 Å²	37.3	4%	0.037	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	146.4	-175.8	-175.1	54.3	-93.6	0	0	108.7	Y618 S635 Q636 F653 Y673	Y618-E651 HydrophobicContact CD2-CB 4.21Å; Y618-E651 HydrophobicContact CE2-CB 3.71Å; Y618-E651 HydrophobicContact CE2-CG 3.81Å; S635-E651 WeakPolarHBondContact CA-OE1 3.38Å; S635-E651 WeakPolarHBondContact CB-OE1 3.3Å; S635-E651 PolarHBondContact OG-OE1 3.49Å; S635-E651 PolarHBondContact OG-OE2 3.47Å; S635-E651 VanDerWaalsContact OG-OE2 3.08Å; Q636-E651 PolarHBondContact N-OE2 2.8Å; Q636-E651 VanDerWaalsContact N-OE2 3.17Å; E651-F653 HydrophobicContact CG-CD2 4.33Å; E651-F653 HydrophobicContact CG-CE2 3.7Å; E651-F653 HydrophobicContact CG-CZ 4.33Å; E651-Y673 PolarHBondContact O-N 3.47Å
652	C	91.1	Very high	77.5	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.014	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.7	179.5	-67.7	0	0	0	0	111	H631 C634 Y646 C671 C672	H631-C652 HydrophobicContact CB-CB 3.89Å; H631-C652 WeakPolarHBondContact CB-O 3.21Å; H631-C652 PolarHBondContact N-O 3.21Å; C634-C652 HydrophobicContact CB-CB 4.41Å; Y646-C652 VanDerWaalsContact CB-SG 3.59Å; C652-C671 CarbonylContact C-O 3.55Å; C652-C671 WeakPolarHBondContact CA-O 3.29Å; C652-C672 HydrophobicContact CB-CB 4.17Å; C652-C672 WeakPolarHBondContact CB-SG 3.38Å; C652-C672 WeakPolarHBondContact SG-CB 3.47Å; C652-C672 CovalentContact SG-SG 2.05Å; C652-C672 PolarHBondContact SG-SG 2.56Å
653	F	93.4	Very high	78	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.009	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	149.2	177.6	-68.8	-107.6	0	0	0	110.2	Y618 A621 V622 F628 M629 E651 V670 C671 Y673	Y618-F653 HydrophobicContact CD2-CE2 4.2Å; Y618-F653 HydrophobicContact CE2-CE2 4.09Å; Y618-F653 HydrophobicContact CE2-CZ 4.42Å; A621-F653 HydrophobicContact CB-CD1 4.15Å; A621-F653 HydrophobicContact CB-CD2 3.81Å; A621-F653 HydrophobicContact CB-CE1 4.07Å; A621-F653 HydrophobicContact CB-CE2 3.73Å; A621-F653 HydrophobicContact CB-CG 4.03Å; A621-F653 HydrophobicContact CB-CZ 3.87Å; A621-F653 VanDerWaalsContact O-CE1 3.29Å; A621-F653 WeakPolarHBondContact O-CE1 3.28Å; V622-F653 HydrophobicContact CG2-CZ 4.05Å; F628-F653 HydrophobicContact CB-CB 4.35Å; F628-F653 HydrophobicContact CB-CD1 4.31Å; M629-F653 CarbonylContact O-C 3.57Å; M629-F653 WeakPolarHBondContact O-CA 3.24Å; M629-F653 WeakPolarHBondContact O-CB 3.43Å; E651-F653 HydrophobicContact CG-CD2 4.33Å; E651-F653 HydrophobicContact CG-CE2 3.7Å; E651-F653 HydrophobicContact CG-CZ 4.33Å; F653-V670 CarbonylContact O-C 3.48Å; F653-V670 WeakPolarHBondContact O-CA 3.42Å; F653-C671 HydrophobicContact CB-CB 4.47Å; F653-C671 PolarHBondContact N-O 2.97Å; F653-C671 PolarHBondContact O-N 2.85Å; F653-Y673 HydrophobicContact CD2-CD2 4.05Å; F653-Y673 AromaticContact CD2-CE2 3.76Å; F653-Y673 HydrophobicContact CD2-CE2 3.76Å; F653-Y673 HydrophobicContact CE2-CD2 4.3Å; F653-Y673 HydrophobicContact CE2-CE2 4.25Å
654	L	92	Very high	78.3	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	149.4	171.6	-176	72.1	0	0	0	108.1	F628 M629 A656 Q669 V670 F704 E705 F706	F628-L654 WeakPolarHBondContact CA-O 3.44Å; M629-L654 WeakPolarHBondContact CG-O 3.29Å; M629-L654 PolarHBondContact N-O 2.88Å; M629-L654 PolarHBondContact O-N 2.82Å; M629-L654 VanDerWaalsContact O-O 3.13Å; L654-A656 PolarHBondContact O-N 3.35Å; L654-Q669 WeakPolarHBondContact CA-O 3.47Å; L654-V670 HydrophobicContact CD1-CG2 3.69Å; L654-F704 HydrophobicContact CD1-CE2 4.39Å; L654-F704 HydrophobicContact CD2-CE2 3.95Å; L654-F704 HydrophobicContact CG-CE2 4.07Å; L654-E705 HydrophobicContact CD2-CB 4.11Å; L654-F706 HydrophobicContact CD2-CD2 3.96Å; L654-F706 HydrophobicContact CD2-CE2 3.66Å; L654-F706 HydrophobicContact CD2-CZ 4.1Å
655	N	92.3	Very high	78.9	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	134.3	164.5	60.3	-52.7	0	0	0	111.3	R627 H657 Y667 G668 Q669 F704	R627-N655 CarbonylContact O-C 3.43Å; R627-N655 WeakPolarHBondContact O-CA 3.23Å; N655-H657 PolarHBondContact ND2-O 3.21Å; N655-Y667 PolarHBondContact ND2-O 2.79Å; N655-G668 WeakPolarHBondContact OD1-CA 3.33Å; N655-Q669 PolarHBondContact N-O 3.41Å; N655-Q669 VanDerWaalsContact N-O 3.1Å; N655-Q669 PolarHBondContact OD1-N 2.91Å; N655-Q669 PolarHBondContact OD1-O 2.99Å; N655-F704 VanDerWaalsContact ND2-CE2 3.32Å; N655-F704 WeakPolarHBondContact ND2-CE2 3.5Å; N655-F704 VanDerWaalsContact O-CE2 3.25Å; N655-F704 WeakPolarHBondContact O-CE2 3.28Å; N655-F704 WeakPolarHBondContact O-CZ 3.25Å; N655-F704 WeakPolarHBondContact OD1-CE2 3.5Å
656	A	90.9	Very high	80	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.216	C	C	.	.	S	Bend	trans	-75.7	-28.9	-174.6	0	0	0	0	0	113.4	R627 M629 L654 R894 V915	R627-A656 PolarHBondContact O-N 3Å; M629-A656 HydrophobicContact CB-CB 4.38Å; M629-A656 HydrophobicContact CG-CB 3.98Å; M629-A656 HydrophobicContact SD-CB 4.37Å; L654-A656 PolarHBondContact O-N 3.35Å; A656-R894 VanDerWaalsContact O-CZ 3.25Å; A656-R894 PolarHBondContact O-NH1 2.97Å; A656-R894 PolarHBondContact O-NH2 3.37Å; A656-V915 HydrophobicContact CB-CG1 3.78Å
657	H	88.1	Confident	81	Confident	21 Å²	21	40.1 Å²	40.1	10%	0.097	21%	0.214	C	C	.	.	S	Bend	trans	-123.1	155	177.9	61.1	75.6	0	0	0	109.7	N655 R920	N655-H657 PolarHBondContact ND2-O 3.21Å; H657-R920 WeakPolarHBondContact NE2-CD 3.26Å
658	N	87.9	Confident	82.1	Confident	48 Å²	48	37.5 Å²	37.5	26%	0.257	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-57.9	145.6	173	56.3	-40	0	0	0	111.1	T665 F704	N658-T665 PolarHBondContact ND2-O 2.76Å; N658-F704 HydrophobicContact CB-CD1 3.72Å; N658-F704 HydrophobicContact CB-CE1 4.05Å; N658-F704 HydrophobicContact CB-CG 4.44Å; N658-F704 VanDerWaalsContact N-CE1 3.29Å
659	I	85.3	Confident	83.1	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.01	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-82.5	131	-178.7	-58.1	168.2	0	0	0	109.6	T608 N611 A612 T665 Y667 Q669	T608-I659 HydrophobicContact CG2-CD1 3.74Å; N611-I659 HydrophobicContact CB-CG2 3.95Å; A612-I659 HydrophobicContact CB-CD1 3.59Å; A612-I659 HydrophobicContact CB-CG1 3.88Å; I659-T665 CarbonylContact O-C 3.57Å; I659-T665 WeakPolarHBondContact O-CA 3.22Å; I659-Y667 HydrophobicContact CB-CD2 3.98Å; I659-Y667 HydrophobicContact CG2-CD2 4.14Å; I659-Y667 PolarHBondContact N-O 3.4Å; I659-Q669 HydrophobicContact CD1-CB 3.98Å
660	Q	75.2	Confident	83.8	Confident	132 Å²	132	34.5 Å²	34.5	62%	0.617	17%	0.17	S	C	*	.	P	Polyproline II helix	trans	-77	122.6	171.7	-63	-178.5	6.7	0	0	109.3	N611 T665	N611-Q660 PolarHBondContact ND2-O 2.85Å; Q660-T665 HydrophobicContact CB-CG2 4.42Å; Q660-T665 HydrophobicContact CG-CG2 4.42Å
661	G	67.9	Low	84.3	Confident	18 Å²	18	31.2 Å²	31.2	19%	0.186	16%	0.155	C	C	.	.			trans	-107.9	176.8	168.4	0	0	0	0	0	111.8	D607 Y663 V664	D607-G661 WeakPolarHBondContact OD2-CA 3.47Å; G661-Y663 VanDerWaalsContact C-N 3.26Å; G661-Y663 PolarHBondContact O-N 3.42Å; G661-V664 CarbonylContact C-O 3.55Å; G661-V664 WeakPolarHBondContact CA-O 3.42Å; G661-V664 PolarHBondContact N-O 2.84Å
662	N	67.7	Low	84.5	Confident	107 Å²	107	30.8 Å²	30.8	57%	0.572	15%	0.154	S	C	*	.	S	Bend	trans	-67.8	-21.9	-177.8	-72.7	-80.5	0	0	0	114.2	D607	D607-N662 PolarHBondContact OD1-ND2 3Å; D607-N662 VanDerWaalsContact OD1-ND2 3.11Å; D607-N662 PolarHBondContact OD2-N 2.81Å; D607-N662 PolarHBondContact OD2-ND2 3.41Å
663	Y	63.5	Low	84.4	Confident	195 Å²	195	30.7 Å²	30.7	77%	0.765	15%	0.153	S	C	*	.	S	Bend	trans	-130.2	-28	-172.9	-58.8	-72.6	0	0	0	114.7	W602 G661	W602-Y663 HydrophobicContact CE3-CD2 4.46Å; G661-Y663 VanDerWaalsContact C-N 3.26Å; G661-Y663 PolarHBondContact O-N 3.42Å
664	V	69.6	Low	83.9	Confident	43 Å²	43	31.3 Å²	31.3	26%	0.261	16%	0.156	S	C	.	.			trans	-143.7	172.9	-178.4	-142.2	0	0	0	0	108.3	W602 G661 H666 Y667	W602-V664 HydrophobicContact CZ2-CG2 4.31Å; G661-V664 CarbonylContact C-O 3.55Å; G661-V664 WeakPolarHBondContact CA-O 3.42Å; G661-V664 PolarHBondContact N-O 2.84Å; V664-H666 WeakPolarHBondContact CG1-CD2 3.23Å; V664-H666 WeakPolarHBondContact CG1-NE2 3.33Å; V664-Y667 WeakPolarHBondContact CA-OH 3.45Å; V664-Y667 VanDerWaalsContact CB-OH 3.28Å; V664-Y667 WeakPolarHBondContact CB-OH 3.44Å; V664-Y667 PolarHBondContact O-OH 3.27Å
665	T	72.9	Confident	83.4	Confident	56 Å²	56	41.7 Å²	41.7	34%	0.344	20%	0.195	S	C	.	.			trans	-142.8	52.9	-171	54.4	0	0	0	0	112.5	N658 I659 Q660 Y667 T708	N658-T665 PolarHBondContact ND2-O 2.76Å; I659-T665 CarbonylContact O-C 3.57Å; I659-T665 WeakPolarHBondContact O-CA 3.22Å; Q660-T665 HydrophobicContact CB-CG2 4.42Å; Q660-T665 HydrophobicContact CG-CG2 4.42Å; T665-Y667 PolarHBondContact N-OH 2.81Å; T665-T708 PolarHBondContact O-OG1 3.04Å
666	H	84.4	Confident	83	Confident	15 Å²	15	45.8 Å²	45.8	7%	0.069	22%	0.218	C	C	.	.			trans	-120.5	4.3	-166.7	-60.6	-28	0	0	0	116.1	V664 F704 T708 F715 E716	V664-H666 WeakPolarHBondContact CG1-CD2 3.23Å; V664-H666 WeakPolarHBondContact CG1-NE2 3.33Å; H666-F704 VanDerWaalsContact O-CB 3.29Å; H666-F704 WeakPolarHBondContact O-CB 3.18Å; H666-F704 PolarHBondContact O-N 3.39Å; H666-T708 VanDerWaalsContact ND1-CB 3.29Å; H666-T708 WeakPolarHBondContact ND1-CB 3.23Å; H666-T708 WeakPolarHBondContact ND1-CG2 3.42Å; H666-T708 PolarHBondContact ND1-OG1 3.34Å; H666-F715 HydrophobicContact CB-CB 3.94Å; H666-E716 IonicContact CE1-OE1 2.81Å; H666-E716 IonicContact NE2-OE1 2.91Å
667	Y	90.4	Very high	82.9	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.008	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-94	151.8	-162.6	-25.6	-48.5	0	0	0	113.3	W602 F604 N655 I659 V664 T665 Q701	W602-Y667 AromaticContact CH2-CE1 3.7Å; W602-Y667 HydrophobicContact CH2-CE1 3.7Å; W602-Y667 AromaticContact CH2-CE2 3.69Å; W602-Y667 HydrophobicContact CH2-CE2 3.69Å; W602-Y667 AromaticContact CH2-CZ 3.19Å; W602-Y667 WeakPolarHBondContact CH2-OH 3.29Å; W602-Y667 HydrophobicContact CZ2-CD1 4.22Å; W602-Y667 AromaticContact CZ2-CE1 3.3Å; W602-Y667 HydrophobicContact CZ2-CE1 3.3Å; W602-Y667 HydrophobicContact CZ2-CE2 4.19Å; W602-Y667 AromaticContact CZ2-CZ 3.27Å; W602-Y667 WeakPolarHBondContact CZ2-OH 3.46Å; F604-Y667 HydrophobicContact CB-CD1 4.11Å; F604-Y667 HydrophobicContact CB-CD2 4.37Å; F604-Y667 HydrophobicContact CB-CE1 4.31Å; F604-Y667 HydrophobicContact CB-CE2 4.5Å; F604-Y667 HydrophobicContact CB-CG 4.22Å; F604-Y667 HydrophobicContact CD2-CD1 4.12Å; F604-Y667 AromaticContact CD2-CG 3.9Å; F604-Y667 HydrophobicContact CD2-CG 3.9Å; F604-Y667 HydrophobicContact CG-CD1 4.37Å; F604-Y667 HydrophobicContact CG-CG 4.46Å; N655-Y667 PolarHBondContact ND2-O 2.79Å; I659-Y667 HydrophobicContact CB-CD2 3.98Å; I659-Y667 HydrophobicContact CG2-CD2 4.14Å; I659-Y667 PolarHBondContact N-O 3.4Å; V664-Y667 WeakPolarHBondContact CA-OH 3.45Å; V664-Y667 VanDerWaalsContact CB-OH 3.28Å; V664-Y667 WeakPolarHBondContact CB-OH 3.44Å; V664-Y667 PolarHBondContact O-OH 3.27Å; T665-Y667 PolarHBondContact N-OH 2.81Å; Y667-Q701 CarbonylContact C-O 3.57Å; Y667-Q701 VanDerWaalsContact CA-O 3.25Å; Y667-Q701 WeakPolarHBondContact CA-O 3.19Å; Y667-Q701 VanDerWaalsContact CB-O 3.31Å; Y667-Q701 WeakPolarHBondContact CB-O 3.08Å
668	G	92.3	Very high	82.8	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	167.3	165.8	0	0	0	0	0	112.5	N655 Q701	N655-G668 WeakPolarHBondContact OD1-CA 3.33Å; G668-Q701 PolarHBondContact N-O 2.76Å; G668-Q701 PolarHBondContact O-N 2.89Å
669	Q	93.2	Very high	82.8	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.009	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	127.8	169.1	177.8	75.1	-73.3	0	0	108.2	T608 A612 L654 N655 I659	T608-Q669 HydrophobicContact CG2-CB 4.28Å; A612-Q669 WeakPolarHBondContact O-CG 3.28Å; A612-Q669 PolarHBondContact O-NE2 3.01Å; L654-Q669 WeakPolarHBondContact CA-O 3.47Å; N655-Q669 PolarHBondContact N-O 3.41Å; N655-Q669 VanDerWaalsContact N-O 3.1Å; N655-Q669 PolarHBondContact OD1-N 2.91Å; N655-Q669 PolarHBondContact OD1-O 2.99Å; I659-Q669 HydrophobicContact CD1-CB 3.98Å
670	V	93.1	Very high	82.7	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.9	173.8	-177.7	0	0	0	0	110.3	Y646 F653 L654 G698 F699 Q701	Y646-V670 HydrophobicContact CD2-CG1 4.46Å; Y646-V670 HydrophobicContact CE1-CG1 4.21Å; Y646-V670 HydrophobicContact CE2-CG1 3.87Å; F653-V670 CarbonylContact O-C 3.48Å; F653-V670 WeakPolarHBondContact O-CA 3.42Å; L654-V670 HydrophobicContact CD1-CG2 3.69Å; V670-G698 CarbonylContact O-C 3.42Å; V670-G698 VanDerWaalsContact O-C 3.27Å; V670-G698 VanDerWaalsContact O-CA 3.3Å; V670-G698 WeakPolarHBondContact O-CA 3.45Å; V670-F699 PolarHBondContact N-O 2.73Å; V670-F699 PolarHBondContact O-N 2.88Å; V670-Q701 HydrophobicContact CG2-CG 4.28Å; V670-Q701 VanDerWaalsContact CG2-NE2 3.34Å
671	C	92.7	Very high	82.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	104.9	-177.9	-50.3	0	0	0	0	109.1	C614 F628 C652 F653 Y673 L679	C614-C671 WeakPolarHBondContact CA-SG 3.45Å; C614-C671 HydrophobicContact CB-CB 3.68Å; C614-C671 WeakPolarHBondContact CB-SG 3.32Å; C614-C671 WeakPolarHBondContact SG-CA 3.42Å; C614-C671 WeakPolarHBondContact SG-CB 3.37Å; C614-C671 CovalentContact SG-SG 2.03Å; C614-C671 PolarHBondContact SG-SG 2.93Å; F628-C671 VanDerWaalsContact CE1-SG 3.6Å; C652-C671 CarbonylContact C-O 3.55Å; C652-C671 WeakPolarHBondContact CA-O 3.29Å; F653-C671 HydrophobicContact CB-CB 4.47Å; F653-C671 PolarHBondContact N-O 2.97Å; F653-C671 PolarHBondContact O-N 2.85Å; C671-Y673 HydrophobicContact CB-CE2 4.14Å; C671-Y673 WeakPolarHBondContact O-CE2 3.09Å; C671-L679 HydrophobicContact CB-CD1 4.29Å
672	C	90.1	Very high	82.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	143.3	178.8	-67.1	0	0	0	0	111.1	A649 C652 M680	A649-C672 HydrophobicContact CB-CB 4Å; C652-C672 HydrophobicContact CB-CB 4.17Å; C652-C672 WeakPolarHBondContact CB-SG 3.38Å; C652-C672 WeakPolarHBondContact SG-CB 3.47Å; C652-C672 CovalentContact SG-SG 2.05Å; C652-C672 PolarHBondContact SG-SG 2.56Å; C672-M680 HydrophobicContact CB-SD 3.73Å; C672-M680 WeakPolarHBondContact O-CB 3.32Å; C672-M680 WeakPolarHBondContact O-CG 3.32Å; C672-M680 PolarHBondContact O-N 2.77Å
673	Y	88.9	Confident	82.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	141.9	-174.6	-62	-83.4	0	0	0	111.7	P615 R617 Y618 A621 A649 K650 E651 F653 C671 Y678 L679 M680	P615-Y673 WeakPolarHBondContact CB-OH 3.04Å; P615-Y673 VanDerWaalsContact CD-OH 3.31Å; P615-Y673 WeakPolarHBondContact CD-OH 3.4Å; P615-Y673 VanDerWaalsContact O-CE1 3.26Å; P615-Y673 WeakPolarHBondContact O-CE1 3.07Å; P615-Y673 PolarHBondContact O-OH 3.3Å; R617-Y673 VanDerWaalsContact C-CE1 3.46Å; Y618-Y673 HydrophobicContact CD2-CD2 4.34Å; Y618-Y673 HydrophobicContact CD2-CG 4.4Å; A621-Y673 HydrophobicContact CB-CE2 3.69Å; A649-Y673 CarbonylContact C-O 3.54Å; A649-Y673 WeakPolarHBondContact CA-O 3.46Å; K650-Y673 WeakPolarHBondContact CB-O 3.31Å; K650-Y673 PolarHBondContact N-O 3.18Å; E651-Y673 PolarHBondContact O-N 3.47Å; F653-Y673 HydrophobicContact CD2-CD2 4.05Å; F653-Y673 AromaticContact CD2-CE2 3.76Å; F653-Y673 HydrophobicContact CD2-CE2 3.76Å; F653-Y673 HydrophobicContact CE2-CD2 4.3Å; F653-Y673 HydrophobicContact CE2-CE2 4.25Å; C671-Y673 HydrophobicContact CB-CE2 4.14Å; C671-Y673 WeakPolarHBondContact O-CE2 3.09Å; Y673-Y678 CarbonylContact C-O 3.51Å; Y673-Y678 VanDerWaalsContact CA-O 3.27Å; Y673-Y678 WeakPolarHBondContact CA-O 3.3Å; Y673-L679 HydrophobicContact CD1-CB 4.46Å; Y673-L679 HydrophobicContact CE1-CB 4.1Å; Y673-L679 HydrophobicContact CE1-CD1 4.16Å; Y673-M680 VanDerWaalsContact C-SD 3.59Å
674	D	83.2	Confident	81.4	Confident	15 Å²	15	28.8 Å²	28.8	8%	0.08	14%	0.136	C	C	.	.			trans	-73.7	177.5	175	70.9	19.9	0	0	0	112.5	K650 D676 G677 Y678 M680 G1161	K650-D674 VanDerWaalsContact CB-O 3.28Å; K650-D674 WeakPolarHBondContact CB-O 3.41Å; K650-D674 WeakPolarHBondContact CD-O 3Å; D674-D676 VanDerWaalsContact C-N 3.25Å; D674-D676 PolarHBondContact O-N 3.49Å; D674-D676 WeakPolarHBondContact OD1-CA 3.43Å; D674-D676 WeakPolarHBondContact OD1-CB 3.47Å; D674-D676 PolarHBondContact OD1-N 2.71Å; D674-G677 WeakPolarHBondContact O-CA 3.25Å; D674-G677 PolarHBondContact O-N 2.77Å; D674-G677 PolarHBondContact OD1-N 2.91Å; D674-Y678 PolarHBondContact N-O 3.42Å; D674-Y678 PolarHBondContact OD1-N 2.81Å; D674-M680 HydrophobicContact CB-CG 4.12Å; D674-G1161 PolarHBondContact OD2-N 3.12Å
675	R	81.3	Confident	80.1	Confident	217 Å²	217	27.7 Å²	27.7	82%	0.819	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-37.6	179.6	-178.2	178.3	174.7	179.7	-1.8	113.1	G677	R675-G677 VanDerWaalsContact C-N 3.25Å; R675-G677 PolarHBondContact O-N 3.48Å
676	D	84.7	Confident	78.3	Confident	88 Å²	88	25.2 Å²	25.2	47%	0.471	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-14.5	178.7	-79	11.9	0	0	0	112	R617 D674 Y678 K1162	R617-D676 VanDerWaalsContact CZ-O 3.29Å; R617-D676 PolarHBondContact NH1-O 2.83Å; R617-D676 PolarHBondContact NH2-O 2.85Å; D674-D676 VanDerWaalsContact C-N 3.25Å; D674-D676 PolarHBondContact O-N 3.49Å; D674-D676 WeakPolarHBondContact OD1-CA 3.43Å; D674-D676 WeakPolarHBondContact OD1-CB 3.47Å; D674-D676 PolarHBondContact OD1-N 2.71Å; D676-Y678 HydrophobicContact CB-CD2 3.77Å; D676-Y678 HydrophobicContact CB-CE2 4.03Å; D676-K1162 IonicContact OD2-NZ 3.53Å; D676-K1162 PolarHBondContact OD2-NZ 3.33Å
677	G	88.3	Confident	76.2	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	93.1	20.7	179	0	0	0	0	0	114.6	R617 Y618 D674 R675	R617-G677 CarbonylContact C-O 3.54Å; R617-G677 WeakPolarHBondContact CA-O 3.31Å; R617-G677 WeakPolarHBondContact CD-O 3.45Å; R617-G677 PolarHBondContact NE-O 2.81Å; Y618-G677 PolarHBondContact N-O 2.77Å; D674-G677 WeakPolarHBondContact O-CA 3.25Å; D674-G677 PolarHBondContact O-N 2.77Å; D674-G677 PolarHBondContact OD1-N 2.91Å; R675-G677 VanDerWaalsContact C-N 3.25Å; R675-G677 PolarHBondContact O-N 3.48Å
678	Y	87.5	Confident	73.7	Confident	55 Å²	55	28.9 Å²	28.9	22%	0.216	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-92.7	150.4	172.9	-67	-90.4	0	0	0	111.7	R617 Y673 D674 D676 M680 K1162 L1165	R617-Y678 VanDerWaalsContact NH1-CZ 3.34Å; Y673-Y678 CarbonylContact C-O 3.51Å; Y673-Y678 VanDerWaalsContact CA-O 3.27Å; Y673-Y678 WeakPolarHBondContact CA-O 3.3Å; D674-Y678 PolarHBondContact N-O 3.42Å; D674-Y678 PolarHBondContact OD1-N 2.81Å; D676-Y678 HydrophobicContact CB-CD2 3.77Å; D676-Y678 HydrophobicContact CB-CE2 4.03Å; Y678-M680 PolarHBondContact O-N 3.23Å; Y678-K1162 HydrophobicContact CD1-CG 3.82Å; Y678-K1162 HydrophobicContact CD2-CD 4.32Å; Y678-K1162 HydrophobicContact CD2-CG 3.7Å; Y678-K1162 HydrophobicContact CE1-CG 3.82Å; Y678-K1162 HydrophobicContact CE2-CD 4.01Å; Y678-K1162 HydrophobicContact CE2-CG 3.71Å; Y678-K1162 HydrophobicContact CG-CG 3.76Å; Y678-L1165 HydrophobicContact CD1-CD1 4.05Å; Y678-L1165 HydrophobicContact CE1-CD1 3.99Å
679	L	87.6	Confident	71.2	Confident	4 Å²	4	33.1 Å²	33.1	2%	0.021	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-59.3	128.2	176.8	-178.3	59.4	0	0	0	110.5	C614 C616 C671 Y673 H681 C753 G1161	C614-L679 HydrophobicContact CB-CD1 3.82Å; C614-L679 HydrophobicContact CB-CD2 3.64Å; C614-L679 HydrophobicContact CB-CG 4.43Å; C616-L679 PolarHBondContact O-N 3.24Å; C616-L679 VanDerWaalsContact O-N 3.13Å; C671-L679 HydrophobicContact CB-CD1 4.29Å; Y673-L679 HydrophobicContact CD1-CB 4.46Å; Y673-L679 HydrophobicContact CE1-CB 4.1Å; Y673-L679 HydrophobicContact CE1-CD1 4.16Å; L679-H681 PolarHBondContact O-CD2 3.22Å; L679-C753 HydrophobicContact CD2-CB 3.94Å; L679-G1161 WeakPolarHBondContact O-CA 3.43Å
680	M	83.3	Confident	68.6	Low	11 Å²	11	38.1 Å²	38.1	5%	0.054	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-77.5	133.2	177.6	-63.8	166.4	74.5	0	0	109.8	A649 C672 Y673 D674 Y678 Y695 N696 P697	A649-M680 VanDerWaalsContact CA-SD 3.59Å; A649-M680 HydrophobicContact CB-CE 4.17Å; A649-M680 HydrophobicContact CB-SD 3.57Å; A649-M680 VanDerWaalsContact CB-SD 3.57Å; C672-M680 HydrophobicContact CB-SD 3.73Å; C672-M680 WeakPolarHBondContact O-CB 3.32Å; C672-M680 WeakPolarHBondContact O-CG 3.32Å; C672-M680 PolarHBondContact O-N 2.77Å; Y673-M680 VanDerWaalsContact C-SD 3.59Å; D674-M680 HydrophobicContact CB-CG 4.12Å; Y678-M680 PolarHBondContact O-N 3.23Å; M680-Y695 HydrophobicContact CE-CD1 4.2Å; M680-Y695 HydrophobicContact CE-CG 4.49Å; M680-N696 VanDerWaalsContact CE-O 3.27Å; M680-N696 WeakPolarHBondContact CE-O 2.92Å; M680-P697 HydrophobicContact CB-CB 3.94Å; M680-P697 WeakPolarHBondContact O-CB 3.18Å
681	H	77.1	Confident	66.3	Low	24 Å²	24	46.9 Å²	46.9	11%	0.111	22%	0.223	C	C	.	.			trans	-118.2	154.4	-178.5	-60.3	-56.8	0	0	0	111.8	L679 S683 S750 S751 Y1164	L679-H681 PolarHBondContact O-CD2 3.22Å; H681-S683 PolarHBondContact O-N 2.62Å; H681-S750 WeakPolarHBondContact CA-OG 3.46Å; H681-S751 PolarHBondContact CE1-O 2.89Å; H681-S751 VanDerWaalsContact CE1-O 3.3Å; H681-S751 PolarHBondContact ND1-O 3.36Å; H681-Y1164 HydrophobicContact CB-CD2 4.47Å; H681-Y1164 HydrophobicContact CB-CE2 3.66Å; H681-Y1164 AromaticContact CD2-CD2 3.46Å; H681-Y1164 VanDerWaalsContact CD2-CD2 3.46Å; H681-Y1164 WeakPolarHBondContact CD2-CD2 3.24Å; H681-Y1164 AromaticContact CD2-CE2 3.55Å; H681-Y1164 AromaticContact CE1-CD2 3.6Å; H681-Y1164 AromaticContact CE1-CE2 3.96Å; H681-Y1164 AromaticContact CG-CD2 3.69Å; H681-Y1164 AromaticContact CG-CE2 3.35Å; H681-Y1164 AromaticContact ND1-CD2 3.77Å; H681-Y1164 AromaticContact ND1-CE2 3.64Å; H681-Y1164 AromaticContact NE2-CD2 3.39Å; H681-Y1164 WeakPolarHBondContact NE2-CD2 3.27Å; H681-Y1164 AromaticContact NE2-CE2 3.92Å
682	T	69	Low	63.9	Low	12 Å²	12	53.1 Å²	53.1	7%	0.074	26%	0.256	C	S	.	.			trans	-65.8	123.4	171.8	48.8	0	0	0	0	110.8	Y684 P697 Y745 S750	T682-Y684 PolarHBondContact O-N 2.76Å; T682-P697 HydrophobicContact CG2-CG 3.65Å; T682-Y745 HydrophobicContact CG2-CD1 3.25Å; T682-Y745 HydrophobicContact CG2-CD2 4.02Å; T682-Y745 HydrophobicContact CG2-CE1 3.57Å; T682-Y745 HydrophobicContact CG2-CE2 4.27Å; T682-Y745 HydrophobicContact CG2-CG 3.51Å; T682-S750 PolarHBondContact N-OG 3.17Å; T682-S750 PolarHBondContact OG1-OG 3.08Å
683	S	51.7	Low	62	Low	27 Å²	27	56.2 Å²	56.2	19%	0.189	27%	0.268	C	S	.	.			trans	-66.1	-24.6	173.9	50.3	0	0	0	0	113.2	H681 Q685 Y693	H681-S683 PolarHBondContact O-N 2.62Å; S683-Q685 CarbonylContact O-C 3.55Å; S683-Q685 PolarHBondContact O-N 2.89Å; S683-Y693 PolarHBondContact OG-OH 3.32Å
684	Y	49.3	Very low	60.4	Low	33 Å²	33	59.4 Å²	59.4	13%	0.129	29%	0.289	C	S	.	.			trans	-69.7	115.1	-178.4	-70.8	-90.9	0	0	0	110.6	T682 V687 Y693 C741 Q742 Y745	T682-Y684 PolarHBondContact O-N 2.76Å; Y684-V687 WeakPolarHBondContact CE1-O 3.23Å; Y684-V687 PolarHBondContact OH-O 3.44Å; Y684-Y693 HydrophobicContact CE2-CE1 4.45Å; Y684-Y693 HydrophobicContact CE2-CE2 4.26Å; Y684-Y693 AromaticContact CE2-CZ 3.71Å; Y684-Y693 WeakPolarHBondContact CE2-OH 3.31Å; Y684-Y693 VanDerWaalsContact CZ-OH 3.32Å; Y684-Y693 WeakPolarHBondContact OH-CE2 3.37Å; Y684-Y693 PolarHBondContact OH-OH 3.08Å; Y684-C741 HydrophobicContact CE2-CB 4.48Å; Y684-Q742 HydrophobicContact CD1-CB 3.94Å; Y684-Q742 HydrophobicContact CE1-CB 4.38Å; Y684-Y745 AromaticContact CD2-CD2 3.91Å; Y684-Y745 HydrophobicContact CD2-CD2 3.91Å; Y684-Y745 HydrophobicContact CD2-CE2 4.43Å; Y684-Y745 HydrophobicContact CE2-CD2 4.41Å
685	Q	40.9	Very low	59.3	Low	19 Å²	19	64.2 Å²	64.2	9%	0.089	31%	0.307	C	S	.	.	S	Bend	cis	-17.7	96.7	11.5	-73.2	90.6	75	0	0	119	S683 I1146 V1148 P1151 L1154 I1156	S683-Q685 CarbonylContact O-C 3.55Å; S683-Q685 PolarHBondContact O-N 2.89Å; Q685-I1146 PolarHBondContact NE2-O 2.84Å; Q685-I1146 PolarHBondContact OE1-O 2.81Å; Q685-V1148 VanDerWaalsContact CD-CG2 3.43Å; Q685-V1148 HydrophobicContact CG-CB 3.62Å; Q685-V1148 HydrophobicContact CG-CG1 4.35Å; Q685-V1148 HydrophobicContact CG-CG2 3.74Å; Q685-P1151 HydrophobicContact CB-CB 4.17Å; Q685-P1151 HydrophobicContact CG-CB 4.05Å; Q685-L1154 CarbonylContact C-O 3.5Å; Q685-L1154 HydrophobicContact CG-CD2 4.37Å; Q685-I1156 HydrophobicContact CB-CD1 4.32Å
686	T	36	Very low	59	Low	5 Å²	5	54.1 Å²	54.1	3%	0.031	27%	0.269	C	S	.	.			trans	6.6	120.8	173.3	50.3	0	0	0	0	121.2	P1151 F1153 L1154	T686-P1151 HydrophobicContact CG2-CB 3.8Å; T686-P1151 HydrophobicContact CG2-CG 3.97Å; T686-P1151 PolarHBondContact OG1-O 2.8Å; T686-F1153 PolarHBondContact OG1-N 3.31Å; T686-L1154 CarbonylContact O-C 3.53Å; T686-L1154 PolarHBondContact OG1-N 3.3Å; T686-L1154 PolarHBondContact OG1-O 2.81Å
687	V	39.5	Very low	58.8	Low	24 Å²	24	50.3 Å²	50.3	15%	0.145	25%	0.249	C	C	.	.			trans	-123.9	129.4	147.3	-168.6	0	0	0	0	108.9	Y684 F1155 Y1175	Y684-V687 WeakPolarHBondContact CE1-O 3.23Å; Y684-V687 PolarHBondContact OH-O 3.44Å; V687-F1155 HydrophobicContact CG2-CB 3.93Å; V687-Y1175 WeakPolarHBondContact CG1-OH 3.41Å
688	V	39.2	Very low	58.7	Low	69 Å²	69	50.5 Å²	50.5	42%	0.418	25%	0.251	S	S	.	.			trans	-82.7	117.9	171.4	175	0	0	0	0	107.9	Y1175	V688-Y1175 PolarHBondContact N-OH 2.92Å; V688-Y1175 PolarHBondContact O-OH 3.36Å
689	Q	38	Very low	58.8	Low	90 Å²	90	48 Å²	48	42%	0.421	24%	0.241	S	C	.	.			trans	25.5	94.5	168.7	-61.5	-173.9	23.2	0	0	116.2	P738 E739	Q689-P738 HydrophobicContact CG-CB 4.33Å; Q689-P738 HydrophobicContact CG-CG 4.11Å; Q689-E739 HydrophobicContact CG-CG 4.48Å; Q689-E739 PolarHBondContact NE2-OE1 2.87Å
690	I	39.9	Very low	59	Low	106 Å²	106	47.9 Å²	47.9	54%	0.544	24%	0.241	S	C	.	.			trans	-83.9	125.9	139.9	-54.3	-179.6	0	0	0	105.2	N692	I690-N692 VanDerWaalsContact CG2-O 3.31Å; I690-N692 WeakPolarHBondContact CG2-O 3.47Å; I690-N692 CarbonylContact O-C 3.55Å; I690-N692 PolarHBondContact O-N 2.88Å
691	E	44.6	Very low	59.4	Low	186 Å²	186	47.3 Å²	47.3	87%	0.869	24%	0.238	S	C	*	.	S	Bend	trans	-58.7	-19.9	-172.7	-163.3	168.9	-147.8	0	0	113.2
692	N	42.5	Very low	60	Low	130 Å²	130	46.5 Å²	46.5	70%	0.695	23%	0.234	S	C	*	.	S	Bend	trans	-123.3	113.3	160.3	-69.9	-89	0	0	0	109.4	I690 P694	I690-N692 VanDerWaalsContact CG2-O 3.31Å; I690-N692 WeakPolarHBondContact CG2-O 3.47Å; I690-N692 CarbonylContact O-C 3.55Å; I690-N692 PolarHBondContact O-N 2.88Å; N692-P694 VanDerWaalsContact O-CD 3.3Å; N692-P694 WeakPolarHBondContact O-CD 3.37Å
693	Y	50.2	Low	61.1	Low	65 Å²	65	45.9 Å²	45.9	26%	0.255	23%	0.23	S	C	.	.			trans	-71.6	114.9	165.6	-119.2	-90.5	0	0	0	108.4	S683 Y684 Y695	S683-Y693 PolarHBondContact OG-OH 3.32Å; Y684-Y693 HydrophobicContact CE2-CE1 4.45Å; Y684-Y693 HydrophobicContact CE2-CE2 4.26Å; Y684-Y693 AromaticContact CE2-CZ 3.71Å; Y684-Y693 WeakPolarHBondContact CE2-OH 3.31Å; Y684-Y693 VanDerWaalsContact CZ-OH 3.32Å; Y684-Y693 WeakPolarHBondContact OH-CE2 3.37Å; Y684-Y693 PolarHBondContact OH-OH 3.08Å; Y693-Y695 VanDerWaalsContact C-N 3.31Å; Y693-Y695 PolarHBondContact O-N 3.38Å
694	P	54.1	Low	62.9	Low	68 Å²	68	44.8 Å²	44.8	44%	0.442	22%	0.222	S	C	.	.	S	Bend	trans	-76.5	-19.9	-173.3	29.8	-34.6	0	0	0	113.2	G648 N692	G648-P694 WeakPolarHBondContact CA-O 3.47Å; N692-P694 VanDerWaalsContact O-CD 3.3Å; N692-P694 WeakPolarHBondContact O-CD 3.37Å
695	Y	60.9	Low	64.7	Low	116 Å²	116	43.3 Å²	43.3	46%	0.455	22%	0.216	S	C	.	.			trans	-140.4	120.8	-173.7	-59.7	-63.5	0	0	0	110.9	V647 M680 Y693	V647-Y695 CarbonylContact O-C 3.57Å; V647-Y695 WeakPolarHBondContact O-CA 3.42Å; M680-Y695 HydrophobicContact CE-CD1 4.2Å; M680-Y695 HydrophobicContact CE-CG 4.49Å; Y693-Y695 VanDerWaalsContact C-N 3.31Å; Y693-Y695 PolarHBondContact O-N 3.38Å
696	N	75.6	Confident	66.9	Low	5 Å²	5	42.7 Å²	42.7	3%	0.027	21%	0.213	C	C	.	.			trans	-111.4	116.2	173.2	-77	-6.9	0	0	0	110.1	D644 T645 V647 M680 Y730	D644-N696 PolarHBondContact O-ND2 3.24Å; T645-N696 WeakPolarHBondContact O-CB 3.12Å; T645-N696 PolarHBondContact O-ND2 3.03Å; V647-N696 PolarHBondContact O-N 2.81Å; M680-N696 VanDerWaalsContact CE-O 3.27Å; M680-N696 WeakPolarHBondContact CE-O 2.92Å; N696-Y730 PolarHBondContact ND2-OH 2.79Å
697	P	79.5	Confident	69.4	Low	8 Å²	8	42.7 Å²	42.7	5%	0.052	21%	0.214	C	C	.	.			trans	-74.6	159.3	178.6	33.5	-38.6	0	0	0	112.6	M680 T682 Y745	M680-P697 HydrophobicContact CB-CB 3.94Å; M680-P697 WeakPolarHBondContact O-CB 3.18Å; T682-P697 HydrophobicContact CG2-CG 3.65Å; P697-Y745 HydrophobicContact CG-CE1 4.29Å
698	G	86.4	Confident	71.6	Confident	3 Å²	3	42 Å²	42	3%	0.031	21%	0.21	C	C	.	.			trans	-70.1	152.2	167.8	0	0	0	0	0	111.9	V670 S750	V670-G698 CarbonylContact O-C 3.42Å; V670-G698 VanDerWaalsContact O-C 3.27Å; V670-G698 VanDerWaalsContact O-CA 3.3Å; V670-G698 WeakPolarHBondContact O-CA 3.45Å; G698-S750 WeakPolarHBondContact O-CA 3.47Å; G698-S750 WeakPolarHBondContact O-CB 3.27Å
699	F	88.9	Confident	73.4	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.009	22%	0.22	C	C	.	.			trans	-136.9	155.9	-176.4	56.4	-102.1	0	0	0	112.4	Y646 V670 D726 Y730 F744 R748	Y646-F699 AromaticContact CE1-CD1 3.92Å; Y646-F699 HydrophobicContact CE1-CD1 3.92Å; Y646-F699 AromaticContact CE1-CE1 3.66Å; Y646-F699 HydrophobicContact CE1-CE1 3.66Å; Y646-F699 HydrophobicContact CE1-CZ 4.45Å; V670-F699 PolarHBondContact N-O 2.73Å; V670-F699 PolarHBondContact O-N 2.88Å; F699-D726 HydrophobicContact CE2-CB 4.31Å; F699-Y730 HydrophobicContact CE1-CD2 4.22Å; F699-Y730 HydrophobicContact CE1-CG 4.31Å; F699-F744 AromaticContact CD1-CE1 3.97Å; F699-F744 HydrophobicContact CD1-CE1 3.97Å; F699-F744 HydrophobicContact CD1-CZ 4.33Å; F699-F744 HydrophobicContact CD2-CE1 4.22Å; F699-F744 AromaticContact CD2-CZ 3.97Å; F699-F744 HydrophobicContact CD2-CZ 3.97Å; F699-F744 HydrophobicContact CE1-CE1 4.15Å; F699-F744 HydrophobicContact CE1-CZ 4.2Å; F699-F744 HydrophobicContact CE2-CE1 4.42Å; F699-F744 AromaticContact CE2-CZ 3.85Å; F699-F744 HydrophobicContact CE2-CZ 3.85Å; F699-F744 HydrophobicContact CG-CE1 4Å; F699-F744 HydrophobicContact CG-CZ 4.22Å; F699-F744 HydrophobicContact CZ-CE1 4.38Å; F699-F744 AromaticContact CZ-CZ 3.96Å; F699-F744 HydrophobicContact CZ-CZ 3.96Å; F699-R748 HydrophobicContact CB-CB 4.36Å
700	P	92.2	Very high	75.4	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.013	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	138.1	174.8	29.5	-36.3	0	0	0	110.9	F604 I605 T608 R748 P749	F604-P700 HydrophobicContact CE2-CB 3.94Å; I605-P700 HydrophobicContact CD1-CB 4.23Å; I605-P700 HydrophobicContact CD1-CG 3.61Å; T608-P700 HydrophobicContact CG2-CB 3.67Å; P700-R748 WeakPolarHBondContact O-CD 3.48Å; P700-P749 WeakPolarHBondContact CD-O 3.26Å; P700-P749 WeakPolarHBondContact CG-O 3.41Å
701	Q	91.9	Very high	77.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	128.1	-175.4	-46.7	178.6	-29.6	0	0	109.9	F604 Y667 G668 V670 H722	F604-Q701 VanDerWaalsContact CE2-C 3.44Å; F604-Q701 WeakPolarHBondContact CE2-O 3.38Å; Y667-Q701 CarbonylContact C-O 3.57Å; Y667-Q701 VanDerWaalsContact CA-O 3.25Å; Y667-Q701 WeakPolarHBondContact CA-O 3.19Å; Y667-Q701 VanDerWaalsContact CB-O 3.31Å; Y667-Q701 WeakPolarHBondContact CB-O 3.08Å; G668-Q701 PolarHBondContact N-O 2.76Å; G668-Q701 PolarHBondContact O-N 2.89Å; V670-Q701 HydrophobicContact CG2-CG 4.28Å; V670-Q701 VanDerWaalsContact CG2-NE2 3.34Å; Q701-H722 PolarHBondContact NE2-CE1 2.88Å; Q701-H722 PolarHBondContact NE2-NE2 2.78Å
702	R	90.7	Very high	79	Confident	6 Å²	6	34.1 Å²	34.1	2%	0.023	17%	0.174	C	C	.	.	S	Bend	trans	-69.5	-37.3	175.4	-174.7	-179.7	-71.5	-85.9	5.4	111.5	D598 W602 F604 F715 D726	D598-R702 PolarHBondContact O-NH2 3.49Å; D598-R702 VanDerWaalsContact O-NH2 3.11Å; D598-R702 IonicContact OD1-CZ 3.73Å; D598-R702 IonicContact OD1-NE 3.23Å; D598-R702 PolarHBondContact OD1-NE 3Å; D598-R702 IonicContact OD1-NH2 2.73Å; D598-R702 PolarHBondContact OD1-NH2 2.76Å; D598-R702 IonicContact OD2-CZ 3.31Å; D598-R702 IonicContact OD2-NE 3.4Å; D598-R702 IonicContact OD2-NH2 2.64Å; D598-R702 PolarHBondContact OD2-NH2 3.49Å; W602-R702 PolarHBondContact O-NH1 3.12Å; F604-R702 HydrophobicContact CD1-CB 4.33Å; F604-R702 HydrophobicContact CD1-CG 4.3Å; F604-R702 HydrophobicContact CE1-CB 3.75Å; F604-R702 HydrophobicContact CE1-CG 4.17Å; F604-R702 HydrophobicContact CE2-CB 4.33Å; F604-R702 HydrophobicContact CZ-CB 3.75Å; R702-F715 VanDerWaalsContact CD-CE1 3.43Å; R702-F715 HydrophobicContact CG-CD1 3.94Å; R702-F715 HydrophobicContact CG-CE1 3.93Å; R702-D726 VanDerWaalsContact N-CG 3.27Å; R702-D726 PolarHBondContact N-OD1 2.98Å; R702-D726 PolarHBondContact N-OD2 3.46Å
703	A	90.4	Very high	80.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	-111.8	114.6	169.2	0	0	0	0	0	108.6	E705 F715 H722 H725 D726	A703-E705 PolarHBondContact O-N 3.21Å; A703-F715 HydrophobicContact CB-CB 3.99Å; A703-F715 HydrophobicContact CB-CD1 4.33Å; A703-H722 WeakPolarHBondContact O-CB 3.01Å; A703-H722 PolarHBondContact O-ND1 2.83Å; A703-H725 HydrophobicContact CB-CB 4.47Å; A703-D726 PolarHBondContact N-OD2 2.85Å
704	F	91	Very high	82.3	Confident	4 Å²	4	30.5 Å²	30.5	2%	0.018	15%	0.154	C	C	.	.			trans	-52.7	130.7	174.3	-174.1	-148.2	0	0	0	109.4	L654 N655 N658 H666 F706 G707	L654-F704 HydrophobicContact CD1-CE2 4.39Å; L654-F704 HydrophobicContact CD2-CE2 3.95Å; L654-F704 HydrophobicContact CG-CE2 4.07Å; N655-F704 VanDerWaalsContact ND2-CE2 3.32Å; N655-F704 WeakPolarHBondContact ND2-CE2 3.5Å; N655-F704 VanDerWaalsContact O-CE2 3.25Å; N655-F704 WeakPolarHBondContact O-CE2 3.28Å; N655-F704 WeakPolarHBondContact O-CZ 3.25Å; N655-F704 WeakPolarHBondContact OD1-CE2 3.5Å; N658-F704 HydrophobicContact CB-CD1 3.72Å; N658-F704 HydrophobicContact CB-CE1 4.05Å; N658-F704 HydrophobicContact CB-CG 4.44Å; N658-F704 VanDerWaalsContact N-CE1 3.29Å; H666-F704 VanDerWaalsContact O-CB 3.29Å; H666-F704 WeakPolarHBondContact O-CB 3.18Å; H666-F704 PolarHBondContact O-N 3.39Å; F704-F706 HydrophobicContact CD1-CB 3.73Å; F704-F706 HydrophobicContact CD2-CB 4.49Å; F704-F706 HydrophobicContact CE1-CB 3.59Å; F704-F706 HydrophobicContact CE1-CD2 4.09Å; F704-F706 HydrophobicContact CE1-CG 4.37Å; F704-F706 HydrophobicContact CE2-CB 4.37Å; F704-F706 HydrophobicContact CE2-CD2 4.01Å; F704-F706 HydrophobicContact CG-CB 4.2Å; F704-F706 HydrophobicContact CZ-CB 3.95Å; F704-F706 AromaticContact CZ-CD2 3.62Å; F704-F706 HydrophobicContact CZ-CD2 3.62Å; F704-F706 HydrophobicContact CZ-CG 4.26Å; F704-F706 PolarHBondContact O-N 3.48Å; F704-G707 WeakPolarHBondContact CD1-O 3.34Å; F704-G707 PolarHBondContact O-N 3.28Å
705	E	87.2	Confident	83.9	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-39.3	-38.2	174.8	170.1	58.9	-122.3	0	0	113.1	P632 R633 L654 A703 T719 H722	P632-E705 HydrophobicContact CG-CG 4.39Å; R633-E705 IonicContact CZ-OE1 3.56Å; R633-E705 IonicContact CZ-OE2 2.79Å; R633-E705 VanDerWaalsContact NH1-CD 3.3Å; R633-E705 IonicContact NH1-OE1 3.65Å; R633-E705 PolarHBondContact NH1-OE1 2.85Å; R633-E705 IonicContact NH1-OE2 3.62Å; R633-E705 PolarHBondContact NH1-OE2 3.48Å; R633-E705 IonicContact NH2-OE1 3.53Å; R633-E705 PolarHBondContact NH2-OE1 2.83Å; R633-E705 IonicContact NH2-OE2 3.2Å; L654-E705 HydrophobicContact CD2-CB 4.11Å; A703-E705 PolarHBondContact O-N 3.21Å; E705-T719 PolarHBondContact O-N 3.19Å; E705-T719 PolarHBondContact OE1-OG1 2.03Å; E705-H722 IonicContact OE2-CD2 2.76Å; E705-H722 PolarHBondContact OE2-CD2 3.27Å; E705-H722 IonicContact OE2-NE2 3.21Å
706	F	86.7	Confident	85.1	Confident	6 Å²	6	22.8 Å²	22.8	3%	0.026	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	1.3	-171.6	-75	-20.1	0	0	0	115.2	W406 L438 M629 P632 L654 F704	W406-F706 HydrophobicContact CE3-CB 3.97Å; W406-F706 HydrophobicContact CE3-CD1 4.2Å; W406-F706 HydrophobicContact CE3-CG 4.19Å; W406-F706 HydrophobicContact CH2-CB 3.96Å; W406-F706 AromaticContact CH2-CD1 3.08Å; W406-F706 HydrophobicContact CH2-CD1 3.08Å; W406-F706 AromaticContact CH2-CD2 3.67Å; W406-F706 HydrophobicContact CH2-CD2 3.67Å; W406-F706 AromaticContact CH2-CE1 3.32Å; W406-F706 HydrophobicContact CH2-CE1 3.32Å; W406-F706 AromaticContact CH2-CE2 3.87Å; W406-F706 HydrophobicContact CH2-CE2 3.87Å; W406-F706 AromaticContact CH2-CG 3.27Å; W406-F706 HydrophobicContact CH2-CG 3.27Å; W406-F706 AromaticContact CH2-CZ 3.71Å; W406-F706 HydrophobicContact CH2-CZ 3.71Å; W406-F706 AromaticContact CZ2-CD1 3.76Å; W406-F706 HydrophobicContact CZ2-CD1 3.76Å; W406-F706 AromaticContact CZ2-CE1 3.74Å; W406-F706 HydrophobicContact CZ2-CE1 3.74Å; W406-F706 HydrophobicContact CZ2-CG 4.35Å; W406-F706 HydrophobicContact CZ2-CZ 4.32Å; W406-F706 HydrophobicContact CZ3-CB 3.29Å; W406-F706 AromaticContact CZ3-CD1 3.38Å; W406-F706 HydrophobicContact CZ3-CD1 3.38Å; W406-F706 AromaticContact CZ3-CD2 3.82Å; W406-F706 HydrophobicContact CZ3-CD2 3.82Å; W406-F706 HydrophobicContact CZ3-CE1 4.1Å; W406-F706 HydrophobicContact CZ3-CE2 4.47Å; W406-F706 AromaticContact CZ3-CG 3.19Å; W406-F706 HydrophobicContact CZ3-CG 3.19Å; L438-F706 HydrophobicContact CD1-CE1 4.07Å; M629-F706 HydrophobicContact CE-CE2 3.71Å; M629-F706 HydrophobicContact CE-CZ 3.74Å; M629-F706 HydrophobicContact SD-CE2 3.73Å; M629-F706 HydrophobicContact SD-CZ 4.36Å; P632-F706 HydrophobicContact CB-CZ 4.36Å; P632-F706 HydrophobicContact CG-CE1 4Å; P632-F706 HydrophobicContact CG-CZ 3.87Å; L654-F706 HydrophobicContact CD2-CD2 3.96Å; L654-F706 HydrophobicContact CD2-CE2 3.66Å; L654-F706 HydrophobicContact CD2-CZ 4.1Å; F704-F706 HydrophobicContact CD1-CB 3.73Å; F704-F706 HydrophobicContact CD2-CB 4.49Å; F704-F706 HydrophobicContact CE1-CB 3.59Å; F704-F706 HydrophobicContact CE1-CD2 4.09Å; F704-F706 HydrophobicContact CE1-CG 4.37Å; F704-F706 HydrophobicContact CE2-CB 4.37Å; F704-F706 HydrophobicContact CE2-CD2 4.01Å; F704-F706 HydrophobicContact CG-CB 4.2Å; F704-F706 HydrophobicContact CZ-CB 3.95Å; F704-F706 AromaticContact CZ-CD2 3.62Å; F704-F706 HydrophobicContact CZ-CD2 3.62Å; F704-F706 HydrophobicContact CZ-CG 4.26Å; F704-F706 PolarHBondContact O-N 3.48Å
707	G	87.5	Confident	85.7	Confident	5 Å²	5	22.5 Å²	22.5	5%	0.052	11%	0.114	C	C	.	.			trans	68.4	-174.7	-179	0	0	0	0	0	113.5	F704 E716	F704-G707 WeakPolarHBondContact CD1-O 3.34Å; F704-G707 PolarHBondContact O-N 3.28Å; G707-E716 CarbonylContact C-O 3.57Å; G707-E716 WeakPolarHBondContact CA-O 3.38Å
708	T	85.4	Confident	86.1	Confident	11 Å²	11	22.3 Å²	22.3	7%	0.067	11%	0.113	C	C	.	.			trans	-138.6	128.8	174.5	-60.9	0	0	0	0	109.4	T665 H666 F711 E716	T665-T708 PolarHBondContact O-OG1 3.04Å; H666-T708 VanDerWaalsContact ND1-CB 3.29Å; H666-T708 WeakPolarHBondContact ND1-CB 3.23Å; H666-T708 WeakPolarHBondContact ND1-CG2 3.42Å; H666-T708 PolarHBondContact ND1-OG1 3.34Å; T708-F711 PolarHBondContact O-N 3.26Å; T708-E716 PolarHBondContact N-O 3.42Å; T708-E716 WeakPolarHBondContact O-CB 3.44Å
709	Y	78.1	Confident	86.1	Confident	160 Å²	160	22.2 Å²	22.2	63%	0.627	11%	0.112	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	130.2	173.5	-179.9	-87.7	0	0	0	110.1	F711	Y709-F711 HydrophobicContact CD2-CD2 4.12Å; Y709-F711 AromaticContact CD2-CE2 3.79Å; Y709-F711 HydrophobicContact CD2-CE2 3.79Å; Y709-F711 HydrophobicContact CG-CE2 4.37Å
710	P	79.6	Confident	86.1	Confident	46 Å²	46	22.4 Å²	22.4	30%	0.299	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	cis	-94.2	13.1	21.6	37.5	-38.2	0	0	0	117.1	A712	P710-A712 VanDerWaalsContact C-N 3.34Å; P710-A712 HydrophobicContact CG-CB 4.21Å; P710-A712 PolarHBondContact O-N 2.93Å
711	F	82.7	Confident	86	Confident	23 Å²	23	22.3 Å²	22.3	10%	0.101	11%	0.112	C	C	.	.			trans	61	36.3	177.1	-41.2	-77.5	0	0	0	113.9	H405 T708 Y709 E716 P718	H405-F711 HydrophobicContact CB-CD2 3.61Å; H405-F711 HydrophobicContact CB-CE2 3.75Å; H405-F711 AromaticContact CG-CD2 3.6Å; H405-F711 AromaticContact ND1-CD2 3.48Å; H405-F711 WeakPolarHBondContact ND1-CD2 3.3Å; H405-F711 AromaticContact ND1-CE2 3.93Å; T708-F711 PolarHBondContact O-N 3.26Å; Y709-F711 HydrophobicContact CD2-CD2 4.12Å; Y709-F711 AromaticContact CD2-CE2 3.79Å; Y709-F711 HydrophobicContact CD2-CE2 3.79Å; Y709-F711 HydrophobicContact CG-CE2 4.37Å; F711-E716 VanDerWaalsContact CD1-O 3.31Å; F711-E716 WeakPolarHBondContact CD1-O 2.98Å; F711-E716 PolarHBondContact N-OE2 3.28Å; F711-P718 HydrophobicContact CD1-CG 3.53Å; F711-P718 HydrophobicContact CE1-CG 3.69Å; F711-P718 HydrophobicContact CG-CG 4.39Å
712	A	78.6	Confident	85.9	Confident	55 Å²	55	22.5 Å²	22.5	46%	0.455	11%	0.113	S	C	.	.			trans	-123	-16	-167.7	0	0	0	0	0	115.4	P500 P710 E716	P500-A712 WeakPolarHBondContact CD-O 3.1Å; P710-A712 VanDerWaalsContact C-N 3.34Å; P710-A712 HydrophobicContact CG-CB 4.21Å; P710-A712 PolarHBondContact O-N 2.93Å; A712-E716 PolarHBondContact N-OE2 3.06Å
713	K	78.3	Confident	85.9	Confident	92 Å²	92	23.4 Å²	23.4	40%	0.4	12%	0.117	S	C	.	.	S	Bend	trans	-122.1	-174.8	-175.7	-45.5	-170.7	-146.7	84.8	0	113.1	E716 L717	K713-E716 HydrophobicContact CB-CG 4.19Å; K713-E716 PolarHBondContact N-OE2 2.68Å; K713-E716 IonicContact NZ-OE1 2.64Å; K713-E716 PolarHBondContact NZ-OE1 3.03Å; K713-E716 WeakPolarHBondContact O-CB 3.31Å; K713-E716 PolarHBondContact O-N 3.05Å; K713-L717 WeakPolarHBondContact O-CD1 3.41Å
714	Q	82.9	Confident	85.9	Confident	28 Å²	28	24.4 Å²	24.4	13%	0.131	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47	139.7	167.4	-139.3	-179.2	3.3	0	0	111.6	E489 F498 E716	E489-Q714 WeakPolarHBondContact OE2-CA 3.48Å; E489-Q714 WeakPolarHBondContact OE2-CG 3.49Å; F498-Q714 HydrophobicContact CB-CB 3.72Å; F498-Q714 HydrophobicContact CB-CG 3.9Å; F498-Q714 HydrophobicContact CD1-CG 3.95Å; F498-Q714 HydrophobicContact CD2-CB 4.12Å; F498-Q714 HydrophobicContact CD2-CG 4.09Å; F498-Q714 HydrophobicContact CG-CB 3.93Å; F498-Q714 HydrophobicContact CG-CG 3.72Å; Q714-E716 PolarHBondContact O-N 2.72Å
715	F	86.7	Confident	85.9	Confident	18 Å²	18	24.2 Å²	24.2	8%	0.079	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	-9.2	179.2	-36.2	-69.2	0	0	0	116.2	E489 H666 R702 A703 H725	E489-F715 PolarHBondContact OE1-N 2.83Å; E489-F715 PolarHBondContact OE2-N 2.83Å; H666-F715 HydrophobicContact CB-CB 3.94Å; R702-F715 VanDerWaalsContact CD-CE1 3.43Å; R702-F715 HydrophobicContact CG-CD1 3.94Å; R702-F715 HydrophobicContact CG-CE1 3.93Å; A703-F715 HydrophobicContact CB-CB 3.99Å; A703-F715 HydrophobicContact CB-CD1 4.33Å; F715-H725 AromaticContact CD1-CD2 3.49Å; F715-H725 VanDerWaalsContact CD1-CD2 3.49Å; F715-H725 WeakPolarHBondContact CD1-CD2 3.4Å; F715-H725 AromaticContact CD1-CG 3.84Å; F715-H725 AromaticContact CD1-NE2 3.65Å; F715-H725 AromaticContact CE1-CD2 3.69Å; F715-H725 AromaticContact CE1-CE1 3.5Å; F715-H725 VanDerWaalsContact CE1-CE1 3.5Å; F715-H725 WeakPolarHBondContact CE1-CE1 3.5Å; F715-H725 AromaticContact CE1-CG 3.76Å; F715-H725 AromaticContact CE1-ND1 3.65Å; F715-H725 AromaticContact CE1-NE2 3.51Å
716	E	87.1	Confident	86.1	Confident	3 Å²	3	24.2 Å²	24.2	1%	0.014	12%	0.12	C	C	.	.			trans	-84.4	-19.9	-172	-70.9	-176.2	178.7	0	0	113.7	H666 G707 T708 F711 A712 K713 Q714	H666-E716 IonicContact CE1-OE1 2.81Å; H666-E716 IonicContact NE2-OE1 2.91Å; G707-E716 CarbonylContact C-O 3.57Å; G707-E716 WeakPolarHBondContact CA-O 3.38Å; T708-E716 PolarHBondContact N-O 3.42Å; T708-E716 WeakPolarHBondContact O-CB 3.44Å; F711-E716 VanDerWaalsContact CD1-O 3.31Å; F711-E716 WeakPolarHBondContact CD1-O 2.98Å; F711-E716 PolarHBondContact N-OE2 3.28Å; A712-E716 PolarHBondContact N-OE2 3.06Å; K713-E716 HydrophobicContact CB-CG 4.19Å; K713-E716 PolarHBondContact N-OE2 2.68Å; K713-E716 IonicContact NZ-OE1 2.64Å; K713-E716 PolarHBondContact NZ-OE1 3.03Å; K713-E716 WeakPolarHBondContact O-CB 3.31Å; K713-E716 PolarHBondContact O-N 3.05Å; Q714-E716 PolarHBondContact O-N 2.72Å
717	L	88.1	Confident	86.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	-86.3	129.7	-168.3	-79.1	76.7	0	0	0	113.1	Y404 Y487 P500 K713 T719 M720 S721	Y404-L717 HydrophobicContact CD1-CD2 4.25Å; Y404-L717 HydrophobicContact CD2-CD2 3.72Å; Y404-L717 HydrophobicContact CE2-CD2 4.16Å; Y404-L717 HydrophobicContact CG-CD2 3.76Å; Y487-L717 HydrophobicContact CE2-CD2 4.4Å; P500-L717 HydrophobicContact CB-CD1 3.92Å; P500-L717 HydrophobicContact CB-CD2 3.47Å; P500-L717 VanDerWaalsContact CB-CD2 3.47Å; P500-L717 HydrophobicContact CB-CG 4.36Å; P500-L717 HydrophobicContact CG-CD1 3.88Å; P500-L717 HydrophobicContact CG-CD2 3.82Å; P500-L717 HydrophobicContact CG-CG 4.5Å; K713-L717 WeakPolarHBondContact O-CD1 3.41Å; L717-T719 PolarHBondContact O-N 2.81Å; L717-M720 HydrophobicContact CB-CB 4.11Å; L717-M720 HydrophobicContact CD2-SD 3.93Å; L717-S721 WeakPolarHBondContact CB-OG 3.49Å; L717-S721 PolarHBondContact N-OG 3.42Å; L717-S721 WeakPolarHBondContact O-CB 3.32Å; L717-S721 PolarHBondContact O-N 2.85Å; L717-S721 PolarHBondContact O-OG 2.75Å
718	P	88.1	Confident	86.3	Confident	4 Å²	4	24.3 Å²	24.3	3%	0.026	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	134.9	-179	-16.6	31.5	0	0	0	111.3	Y404 W406 P435 F711 M720	Y404-P718 VanDerWaalsContact O-CD 3.31Å; Y404-P718 WeakPolarHBondContact O-CD 3.42Å; W406-P718 HydrophobicContact CB-CB 4.05Å; W406-P718 HydrophobicContact CB-CG 3.74Å; P435-P718 HydrophobicContact CB-CB 4.13Å; P435-P718 HydrophobicContact CG-CB 4.17Å; F711-P718 HydrophobicContact CD1-CG 3.53Å; F711-P718 HydrophobicContact CE1-CG 3.69Å; F711-P718 HydrophobicContact CG-CG 4.39Å; P718-M720 PolarHBondContact O-N 2.8Å
719	T	86.2	Confident	86.6	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.006	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	-47.5	-171.2	-58.3	0	0	0	0	114.6	P569 R633 E705 L717 H722 Y723	P569-T719 HydrophobicContact CG-CG2 3.58Å; R633-T719 PolarHBondContact NH2-OG1 2.64Å; E705-T719 PolarHBondContact O-N 3.19Å; E705-T719 PolarHBondContact OE1-OG1 2.03Å; L717-T719 PolarHBondContact O-N 2.81Å; T719-H722 PolarHBondContact O-N 2.66Å; T719-Y723 HydrophobicContact CG2-CD2 3.64Å; T719-Y723 HydrophobicContact CG2-CE2 3.66Å; T719-Y723 WeakPolarHBondContact O-CB 3.36Å; T719-Y723 VanDerWaalsContact O-CD2 3.29Å; T719-Y723 WeakPolarHBondContact O-CD2 3.1Å; T719-Y723 PolarHBondContact O-N 2.78Å
720	M	88.8	Confident	87	Confident	6 Å²	6	16.4 Å²	16.4	3%	0.03	9%	0.087	C	C	.	.	H	α-helix	trans	-61.7	-54.2	-173.9	-64.2	-175.2	169.5	0	0	113	M358 Y404 Y487 L548 F550 L717 P718 H722 Y723 Y724	M358-M720 HydrophobicContact CG-CE 3.42Å; M358-M720 VanDerWaalsContact CG-CE 3.42Å; M358-M720 HydrophobicContact SD-CE 3.34Å; M358-M720 WeakPolarHBondContact SD-CE 3.44Å; Y404-M720 HydrophobicContact CD1-CE 4.31Å; Y404-M720 HydrophobicContact CD1-SD 4.35Å; Y404-M720 HydrophobicContact CE1-CE 4.02Å; Y404-M720 HydrophobicContact CE1-SD 4.22Å; Y487-M720 HydrophobicContact CD1-CB 4.49Å; Y487-M720 HydrophobicContact CD2-CB 4.49Å; Y487-M720 HydrophobicContact CD2-SD 3.89Å; Y487-M720 HydrophobicContact CE1-CB 3.93Å; Y487-M720 HydrophobicContact CE2-CB 3.93Å; Y487-M720 HydrophobicContact CE2-CG 4.3Å; Y487-M720 HydrophobicContact CE2-SD 3.58Å; Y487-M720 VanDerWaalsContact CE2-SD 3.58Å; L548-M720 WeakPolarHBondContact CD2-O 3.29Å; F550-M720 HydrophobicContact CE2-CE 4.07Å; F550-M720 HydrophobicContact CZ-CE 3.99Å; F550-M720 HydrophobicContact CZ-CG 4.14Å; L717-M720 HydrophobicContact CB-CB 4.11Å; L717-M720 HydrophobicContact CD2-SD 3.93Å; P718-M720 PolarHBondContact O-N 2.8Å; M720-H722 VanDerWaalsContact C-N 3.31Å; M720-H722 PolarHBondContact O-N 3.45Å; M720-Y723 PolarHBondContact O-N 2.88Å; M720-Y724 WeakPolarHBondContact O-CB 3.49Å; M720-Y724 PolarHBondContact O-N 3.22Å; M720-Y724 VanDerWaalsContact O-N 3.08Å
721	S	90	Very high	87.4	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-64.4	-39.1	179.4	-60.6	0	0	0	0	111.4	E489 L717 Y724 H725	E489-S721 WeakPolarHBondContact OE1-CB 3.45Å; E489-S721 PolarHBondContact OE1-OG 3.24Å; L717-S721 WeakPolarHBondContact CB-OG 3.49Å; L717-S721 PolarHBondContact N-OG 3.42Å; L717-S721 WeakPolarHBondContact O-CB 3.32Å; L717-S721 PolarHBondContact O-N 2.85Å; L717-S721 PolarHBondContact O-OG 2.75Å; S721-Y724 PolarHBondContact O-N 2.86Å; S721-H725 WeakPolarHBondContact O-CB 3.47Å; S721-H725 PolarHBondContact O-CD2 3.06Å; S721-H725 VanDerWaalsContact O-CD2 3.31Å; S721-H725 PolarHBondContact O-N 2.93Å
722	H	89.9	Confident	87.7	Confident	4 Å²	4	14 Å²	14	2%	0.019	7%	0.073	C	C	.	.	H	α-helix	trans	-61.5	-46	177	-178	52.5	0	0	0	112.4	Q701 A703 E705 T719 M720 Y724 D726 V727	Q701-H722 PolarHBondContact NE2-CE1 2.88Å; Q701-H722 PolarHBondContact NE2-NE2 2.78Å; A703-H722 WeakPolarHBondContact O-CB 3.01Å; A703-H722 PolarHBondContact O-ND1 2.83Å; E705-H722 IonicContact OE2-CD2 2.76Å; E705-H722 PolarHBondContact OE2-CD2 3.27Å; E705-H722 IonicContact OE2-NE2 3.21Å; T719-H722 PolarHBondContact O-N 2.66Å; M720-H722 VanDerWaalsContact C-N 3.31Å; M720-H722 PolarHBondContact O-N 3.45Å; H722-Y724 VanDerWaalsContact C-N 3.31Å; H722-Y724 PolarHBondContact O-N 2.83Å; H722-D726 IonicContact ND1-OD2 3.81Å; H722-D726 WeakPolarHBondContact O-CB 3.48Å; H722-D726 PolarHBondContact O-N 2.93Å; H722-V727 VanDerWaalsContact CD2-CG2 3.43Å; H722-V727 WeakPolarHBondContact CD2-CG2 3.35Å; H722-V727 WeakPolarHBondContact NE2-CG2 3.5Å; H722-V727 PolarHBondContact O-N 3.17Å; H722-V727 VanDerWaalsContact O-N 3.09Å
723	Y	90.2	Very high	88.1	Confident	25 Å²	25	11.4 Å²	11.4	10%	0.098	5%	0.051	C	C	.	.	I	π-helix	trans	-67.4	-31.7	177.3	-87.8	-114.2	0	0	0	112.8	F452 P569 T719 M720 V727 L728	F452-Y723 HydrophobicContact CE1-CE1 4.48Å; F452-Y723 HydrophobicContact CZ-CE1 4.11Å; P569-Y723 HydrophobicContact CB-CD1 3.6Å; P569-Y723 HydrophobicContact CB-CE1 3.86Å; P569-Y723 HydrophobicContact CB-CG 4.03Å; P569-Y723 HydrophobicContact CG-CD1 3.98Å; P569-Y723 HydrophobicContact CG-CD2 4.22Å; P569-Y723 HydrophobicContact CG-CE1 4.04Å; P569-Y723 HydrophobicContact CG-CE2 4.27Å; P569-Y723 HydrophobicContact CG-CG 4.06Å; T719-Y723 HydrophobicContact CG2-CD2 3.64Å; T719-Y723 HydrophobicContact CG2-CE2 3.66Å; T719-Y723 WeakPolarHBondContact O-CB 3.36Å; T719-Y723 VanDerWaalsContact O-CD2 3.29Å; T719-Y723 WeakPolarHBondContact O-CD2 3.1Å; T719-Y723 PolarHBondContact O-N 2.78Å; M720-Y723 PolarHBondContact O-N 2.88Å; Y723-V727 HydrophobicContact CD1-CB 4.09Å; Y723-V727 HydrophobicContact CD1-CG1 4.12Å; Y723-V727 HydrophobicContact CD1-CG2 4.35Å; Y723-V727 HydrophobicContact CD2-CB 4.44Å; Y723-V727 HydrophobicContact CD2-CG2 3.85Å; Y723-V727 HydrophobicContact CE1-CG1 4.15Å; Y723-V727 HydrophobicContact CE2-CG2 4.17Å; Y723-V727 HydrophobicContact CG-CB 4.06Å; Y723-V727 HydrophobicContact CG-CG2 3.97Å; Y723-L728 WeakPolarHBondContact O-CB 3.47Å; Y723-L728 PolarHBondContact O-N 2.91Å
724	Y	90.8	Very high	88.3	Confident	20 Å²	20	7.7 Å²	7.7	8%	0.078	4%	0.036	C	C	.	.	I	π-helix	trans	-74.5	-40.9	179	-172.3	-83.2	0	0	0	113.3	Y487 K488 R547 M720 S721 H722	Y487-Y724 HydrophobicContact CD1-CD2 4.17Å; Y487-Y724 HydrophobicContact CE1-CD2 4.35Å; Y487-Y724 HydrophobicContact CE1-CG 4.48Å; K488-Y724 HydrophobicContact CB-CE2 4.18Å; R547-Y724 HydrophobicContact CB-CD2 4.08Å; R547-Y724 HydrophobicContact CB-CE2 4.12Å; R547-Y724 HydrophobicContact CG-CD2 4.45Å; R547-Y724 HydrophobicContact CG-CE2 4.08Å; M720-Y724 WeakPolarHBondContact O-CB 3.49Å; M720-Y724 PolarHBondContact O-N 3.22Å; M720-Y724 VanDerWaalsContact O-N 3.08Å; S721-Y724 PolarHBondContact O-N 2.86Å; H722-Y724 VanDerWaalsContact C-N 3.31Å; H722-Y724 PolarHBondContact O-N 2.83Å
725	H	90.2	Very high	88.3	Confident	1 Å²	1	9.4 Å²	9.4	1%	0.005	4%	0.043	C	C	.	.	I	π-helix	trans	-99.2	-19.9	-172	-71	-66.9	0	0	0	115.5	E489 W594 A703 F715 S721 R748	E489-H725 IonicContact OE1-NE2 2.61Å; E489-H725 IonicContact OE2-CD2 3.6Å; E489-H725 IonicContact OE2-CE1 2.66Å; E489-H725 IonicContact OE2-NE2 2.7Å; E489-H725 PolarHBondContact OE2-NE2 2.88Å; W594-H725 PolarHBondContact NE1-O 3.3Å; A703-H725 HydrophobicContact CB-CB 4.47Å; F715-H725 AromaticContact CD1-CD2 3.49Å; F715-H725 VanDerWaalsContact CD1-CD2 3.49Å; F715-H725 WeakPolarHBondContact CD1-CD2 3.4Å; F715-H725 AromaticContact CD1-CG 3.84Å; F715-H725 AromaticContact CD1-NE2 3.65Å; F715-H725 AromaticContact CE1-CD2 3.69Å; F715-H725 AromaticContact CE1-CE1 3.5Å; F715-H725 VanDerWaalsContact CE1-CE1 3.5Å; F715-H725 WeakPolarHBondContact CE1-CE1 3.5Å; F715-H725 AromaticContact CE1-CG 3.76Å; F715-H725 AromaticContact CE1-ND1 3.65Å; F715-H725 AromaticContact CE1-NE2 3.51Å; S721-H725 WeakPolarHBondContact O-CB 3.47Å; S721-H725 PolarHBondContact O-CD2 3.06Å; S721-H725 VanDerWaalsContact O-CD2 3.31Å; S721-H725 PolarHBondContact O-N 2.93Å; H725-R748 PolarHBondContact O-NH2 2.97Å
726	D	91.4	Very high	88.2	Confident	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.04	C	C	.	.	I	π-helix	trans	-130.3	-52	-173.8	-59.8	-61.8	0	0	0	113.1	F699 R702 A703 H722 Y730 R748	F699-D726 HydrophobicContact CE2-CB 4.31Å; R702-D726 VanDerWaalsContact N-CG 3.27Å; R702-D726 PolarHBondContact N-OD1 2.98Å; R702-D726 PolarHBondContact N-OD2 3.46Å; A703-D726 PolarHBondContact N-OD2 2.85Å; H722-D726 IonicContact ND1-OD2 3.81Å; H722-D726 WeakPolarHBondContact O-CB 3.48Å; H722-D726 PolarHBondContact O-N 2.93Å; D726-Y730 PolarHBondContact O-N 3.45Å; D726-R748 IonicContact OD1-CZ 2.7Å; D726-R748 IonicContact OD1-NE 3.21Å; D726-R748 PolarHBondContact OD1-NE 3.11Å; D726-R748 IonicContact OD1-NH2 3.7Å; D726-R748 PolarHBondContact OD1-NH2 3.47Å; D726-R748 VanDerWaalsContact OD1-NH2 3.07Å
727	V	89.1	Confident	88	Confident	11 Å²	11	9.3 Å²	9.3	7%	0.067	4%	0.044	C	C	.	.	I	π-helix	trans	-70	-53.8	-174.5	-169.9	0	0	0	0	112.7	H722 Y723 Y730 Y731	H722-V727 VanDerWaalsContact CD2-CG2 3.43Å; H722-V727 WeakPolarHBondContact CD2-CG2 3.35Å; H722-V727 WeakPolarHBondContact NE2-CG2 3.5Å; H722-V727 PolarHBondContact O-N 3.17Å; H722-V727 VanDerWaalsContact O-N 3.09Å; Y723-V727 HydrophobicContact CD1-CB 4.09Å; Y723-V727 HydrophobicContact CD1-CG1 4.12Å; Y723-V727 HydrophobicContact CD1-CG2 4.35Å; Y723-V727 HydrophobicContact CD2-CB 4.44Å; Y723-V727 HydrophobicContact CD2-CG2 3.85Å; Y723-V727 HydrophobicContact CE1-CG1 4.15Å; Y723-V727 HydrophobicContact CE2-CG2 4.17Å; Y723-V727 HydrophobicContact CG-CB 4.06Å; Y723-V727 HydrophobicContact CG-CG2 3.97Å; V727-Y730 WeakPolarHBondContact O-CB 3.18Å; V727-Y730 PolarHBondContact O-N 3.48Å; V727-Y731 HydrophobicContact CG1-CD2 4Å; V727-Y731 HydrophobicContact CG1-CE2 3.8Å; V727-Y731 WeakPolarHBondContact O-CD2 3.44Å; V727-Y731 PolarHBondContact O-N 3.32Å; V727-Y731 VanDerWaalsContact O-N 3.14Å
728	L	89.8	Confident	87.2	Confident	3 Å²	3	11.1 Å²	11.1	2%	0.016	6%	0.056	C	C	.	.	H	α-helix	trans	-67.5	-38.3	-179.2	-73.3	-171.3	0	0	0	113.6	F452 R547 L548 P571 Y723 Y730 Y731 L732 W736	F452-L728 HydrophobicContact CD1-CD2 4.29Å; F452-L728 HydrophobicContact CE1-CD2 3.84Å; R547-L728 HydrophobicContact CB-CD1 3.92Å; R547-L728 WeakPolarHBondContact O-CD1 3.16Å; L548-L728 HydrophobicContact CB-CD1 3.57Å; P571-L728 HydrophobicContact CB-CD2 4.07Å; Y723-L728 WeakPolarHBondContact O-CB 3.47Å; Y723-L728 PolarHBondContact O-N 2.91Å; L728-Y730 PolarHBondContact O-N 3.49Å; L728-Y731 PolarHBondContact O-N 3.02Å; L728-L732 WeakPolarHBondContact O-CD1 2.95Å; L728-L732 VanDerWaalsContact O-CG 3.27Å; L728-L732 WeakPolarHBondContact O-CG 3.41Å; L728-L732 PolarHBondContact O-N 3.22Å; L728-W736 HydrophobicContact CD2-CH2 4.21Å
729	P	91	Very high	86.4	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-55.8	-36.8	169.4	-30.7	39.4	0	0	0	113.8	W594 C733 F744	W594-P729 HydrophobicContact CD2-CB 3.61Å; W594-P729 HydrophobicContact CD2-CG 4.19Å; W594-P729 VanDerWaalsContact CE2-CB 3.41Å; W594-P729 HydrophobicContact CE3-CB 4.28Å; W594-P729 HydrophobicContact CG-CB 3.79Å; W594-P729 HydrophobicContact CG-CG 3.9Å; W594-P729 HydrophobicContact CZ2-CB 3.89Å; W594-P729 VanDerWaalsContact NE1-CG 3.33Å; P729-C733 WeakPolarHBondContact O-CB 3.26Å; P729-C733 PolarHBondContact O-N 2.92Å; P729-C733 PolarHBondContact O-SG 3.43Å; P729-F744 HydrophobicContact CB-CD2 4.24Å; P729-F744 HydrophobicContact CB-CE2 4.18Å
730	Y	88.4	Confident	86	Confident	4 Å²	4	18.4 Å²	18.4	2%	0.016	9%	0.089	C	C	.	.	H	α-helix	trans	-61.7	-45.8	170.4	175.3	-98.9	0	0	0	112	T645 N696 F699 D726 V727 L728 C734 K735 F744	T645-Y730 HydrophobicContact CG2-CD1 4.43Å; N696-Y730 PolarHBondContact ND2-OH 2.79Å; F699-Y730 HydrophobicContact CE1-CD2 4.22Å; F699-Y730 HydrophobicContact CE1-CG 4.31Å; D726-Y730 PolarHBondContact O-N 3.45Å; V727-Y730 WeakPolarHBondContact O-CB 3.18Å; V727-Y730 PolarHBondContact O-N 3.48Å; L728-Y730 PolarHBondContact O-N 3.49Å; Y730-C734 HydrophobicContact CD2-CB 3.87Å; Y730-C734 HydrophobicContact CE2-CB 3.47Å; Y730-C734 VanDerWaalsContact CE2-CB 3.47Å; Y730-C734 WeakPolarHBondContact O-CA 3.13Å; Y730-C734 VanDerWaalsContact O-CB 3.23Å; Y730-C734 WeakPolarHBondContact O-CB 3.29Å; Y730-C734 PolarHBondContact O-N 2.87Å; Y730-K735 HydrophobicContact CE1-CD 4.43Å; Y730-K735 HydrophobicContact CE1-CG 3.92Å; Y730-K735 WeakPolarHBondContact OH-CE 3.3Å; Y730-F744 AromaticContact CD2-CD1 3.92Å; Y730-F744 HydrophobicContact CD2-CD1 3.92Å; Y730-F744 AromaticContact CD2-CE1 3.73Å; Y730-F744 HydrophobicContact CD2-CE1 3.73Å; Y730-F744 HydrophobicContact CD2-CG 4.48Å; Y730-F744 HydrophobicContact CD2-CZ 4.15Å; Y730-F744 HydrophobicContact CG-CE1 4.41Å; Y730-F744 HydrophobicContact CG-CZ 4.38Å
731	Y	87.2	Confident	85.6	Confident	15 Å²	15	18.5 Å²	18.5	6%	0.059	9%	0.09	C	C	.	.	I	π-helix	trans	-63.7	-44.8	177	-82	-81	0	0	0	113	F452 T645 V727 L728 K735 W736	F452-Y731 HydrophobicContact CB-CD1 4Å; F452-Y731 HydrophobicContact CB-CE1 3.56Å; F452-Y731 HydrophobicContact CD1-CD1 4.25Å; F452-Y731 AromaticContact CD1-CD2 3.81Å; F452-Y731 HydrophobicContact CD1-CD2 3.81Å; F452-Y731 HydrophobicContact CD1-CE1 4.16Å; F452-Y731 AromaticContact CD1-CE2 3.67Å; F452-Y731 HydrophobicContact CD1-CE2 3.67Å; F452-Y731 HydrophobicContact CD1-CG 4.12Å; F452-Y731 AromaticContact CD1-CZ 3.87Å; F452-Y731 HydrophobicContact CE1-CD2 4.37Å; F452-Y731 HydrophobicContact CE1-CE2 4.23Å; F452-Y731 HydrophobicContact CG-CE1 4.21Å; F452-Y731 HydrophobicContact CG-CE2 4.31Å; T645-Y731 HydrophobicContact CG2-CE2 4.12Å; V727-Y731 HydrophobicContact CG1-CD2 4Å; V727-Y731 HydrophobicContact CG1-CE2 3.8Å; V727-Y731 WeakPolarHBondContact O-CD2 3.44Å; V727-Y731 PolarHBondContact O-N 3.32Å; V727-Y731 VanDerWaalsContact O-N 3.14Å; L728-Y731 PolarHBondContact O-N 3.02Å; Y731-K735 HydrophobicContact CD1-CB 3.73Å; Y731-K735 HydrophobicContact CD1-CG 3.65Å; Y731-K735 HydrophobicContact CE1-CB 4.37Å; Y731-K735 HydrophobicContact CE1-CG 3.92Å; Y731-K735 HydrophobicContact CG-CG 4.43Å; Y731-K735 WeakPolarHBondContact O-CA 3.49Å; Y731-K735 WeakPolarHBondContact O-CB 3.4Å; Y731-K735 PolarHBondContact O-N 2.95Å; Y731-W736 HydrophobicContact CD1-CZ2 4.35Å; Y731-W736 HydrophobicContact CG-CZ2 4.26Å; Y731-W736 PolarHBondContact O-N 3.48Å
732	L	88.9	Confident	84.9	Confident	5 Å²	5	21.8 Å²	21.8	3%	0.026	11%	0.105	C	C	.	.	I	π-helix	trans	-56.8	-56.5	177.1	-69.6	157.5	0	0	0	110.9	Y586 A587 E590 L728 W736 T737	Y586-L732 HydrophobicContact CE1-CD2 4.44Å; A587-L732 HydrophobicContact CB-CD2 3.89Å; E590-L732 HydrophobicContact CB-CD1 4.4Å; E590-L732 HydrophobicContact CB-CD2 3.99Å; E590-L732 HydrophobicContact CG-CD1 3.59Å; E590-L732 HydrophobicContact CG-CD2 3.91Å; E590-L732 HydrophobicContact CG-CG 4.38Å; L728-L732 WeakPolarHBondContact O-CD1 2.95Å; L728-L732 VanDerWaalsContact O-CG 3.27Å; L728-L732 WeakPolarHBondContact O-CG 3.41Å; L728-L732 PolarHBondContact O-N 3.22Å; L732-W736 HydrophobicContact CD2-CE3 3.68Å; L732-W736 HydrophobicContact CD2-CZ3 3.61Å; L732-W736 HydrophobicContact CG-CE3 4.04Å; L732-W736 HydrophobicContact CG-CZ3 3.82Å; L732-T737 PolarHBondContact O-N 3.37Å
733	C	87.6	Confident	84.5	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.115	C	C	.	.	I	π-helix	trans	-77.5	-32	-175	-64.3	0	0	0	0	114.8	C591 P729 T737 H740 C741 F744	C591-C733 HydrophobicContact CB-CB 4.07Å; C591-C733 WeakPolarHBondContact CB-SG 3.46Å; C591-C733 VanDerWaalsContact SG-CA 3.51Å; C591-C733 WeakPolarHBondContact SG-CB 3.39Å; C591-C733 CovalentContact SG-SG 2.03Å; C591-C733 PolarHBondContact SG-SG 2.94Å; P729-C733 WeakPolarHBondContact O-CB 3.26Å; P729-C733 PolarHBondContact O-N 2.92Å; P729-C733 PolarHBondContact O-SG 3.43Å; C733-T737 CarbonylContact O-C 3.43Å; C733-H740 CarbonylContact O-C 3.34Å; C733-H740 VanDerWaalsContact O-C 3.23Å; C733-C741 WeakPolarHBondContact O-CA 3.28Å; C733-C741 PolarHBondContact O-N 2.82Å; C733-F744 HydrophobicContact CB-CB 3.73Å
734	C	82	Confident	84.2	Confident	13 Å²	13	22.8 Å²	22.8	9%	0.088	11%	0.11	C	C	.	.	I	π-helix	trans	-115.6	-18.3	-169.6	-66.2	0	0	0	0	115.7	Y730 C741	Y730-C734 HydrophobicContact CD2-CB 3.87Å; Y730-C734 HydrophobicContact CE2-CB 3.47Å; Y730-C734 VanDerWaalsContact CE2-CB 3.47Å; Y730-C734 WeakPolarHBondContact O-CA 3.13Å; Y730-C734 VanDerWaalsContact O-CB 3.23Å; Y730-C734 WeakPolarHBondContact O-CB 3.29Å; Y730-C734 PolarHBondContact O-N 2.87Å; C734-C741 HydrophobicContact CB-CB 3.79Å; C734-C741 WeakPolarHBondContact CB-SG 3.14Å; C734-C741 WeakPolarHBondContact SG-CA 3.46Å; C734-C741 WeakPolarHBondContact SG-CB 3.38Å; C734-C741 CovalentContact SG-SG 2.04Å; C734-C741 PolarHBondContact SG-SG 3.46Å
735	K	82.5	Confident	83.8	Confident	65 Å²	65	22.5 Å²	22.5	28%	0.283	11%	0.109	S	C	.	.	I	π-helix	trans	-113.8	-43	-177.1	-64.7	-75.4	-167.5	164.9	0	112.7	D644 Y730 Y731	D644-K735 WeakPolarHBondContact O-CE 3.39Å; D644-K735 PolarHBondContact O-NZ 2.58Å; Y730-K735 HydrophobicContact CE1-CD 4.43Å; Y730-K735 HydrophobicContact CE1-CG 3.92Å; Y730-K735 WeakPolarHBondContact OH-CE 3.3Å; Y731-K735 HydrophobicContact CD1-CB 3.73Å; Y731-K735 HydrophobicContact CD1-CG 3.65Å; Y731-K735 HydrophobicContact CE1-CB 4.37Å; Y731-K735 HydrophobicContact CE1-CG 3.92Å; Y731-K735 HydrophobicContact CG-CG 4.43Å; Y731-K735 WeakPolarHBondContact O-CA 3.49Å; Y731-K735 WeakPolarHBondContact O-CB 3.4Å; Y731-K735 PolarHBondContact O-N 2.95Å
736	W	85.9	Confident	83.3	Confident	5 Å²	5	31.6 Å²	31.6	2%	0.019	14%	0.144	C	C	.	.	I	π-helix	trans	-85.8	-41.8	178.9	-55.9	-27.2	0	0	0	111.5	F452 K454 P571 H573 L583 A587 L728 Y731 L732 P738	F452-W736 PolarHBondContact O-NE1 3.11Å; K454-W736 VanDerWaalsContact CE-O 3.3Å; K454-W736 WeakPolarHBondContact CE-O 3.15Å; K454-W736 PolarHBondContact NZ-O 2.65Å; P571-W736 HydrophobicContact CB-CH2 3.66Å; P571-W736 HydrophobicContact CB-CZ2 4.14Å; P571-W736 HydrophobicContact CG-CH2 4.25Å; P571-W736 HydrophobicContact CG-CZ2 4.22Å; H573-W736 AromaticContact CE1-CE2 3.83Å; H573-W736 AromaticContact CE1-CH2 3.55Å; H573-W736 AromaticContact CE1-CZ2 3.5Å; H573-W736 VanDerWaalsContact CE1-CZ2 3.5Å; H573-W736 WeakPolarHBondContact CE1-CZ2 3.46Å; H573-W736 AromaticContact CE1-CZ3 3.9Å; H573-W736 AromaticContact ND1-CH2 3.52Å; H573-W736 AromaticContact ND1-CZ2 3.98Å; H573-W736 AromaticContact ND1-CZ3 3.62Å; L583-W736 HydrophobicContact CD1-CD2 4.5Å; L583-W736 HydrophobicContact CD1-CE3 4.33Å; L583-W736 HydrophobicContact CD2-CG 4.47Å; A587-W736 HydrophobicContact CB-CB 3.74Å; A587-W736 HydrophobicContact CB-CE3 4.17Å; L728-W736 HydrophobicContact CD2-CH2 4.21Å; Y731-W736 HydrophobicContact CD1-CZ2 4.35Å; Y731-W736 HydrophobicContact CG-CZ2 4.26Å; Y731-W736 PolarHBondContact O-N 3.48Å; L732-W736 HydrophobicContact CD2-CE3 3.68Å; L732-W736 HydrophobicContact CD2-CZ3 3.61Å; L732-W736 HydrophobicContact CG-CE3 4.04Å; L732-W736 HydrophobicContact CG-CZ3 3.82Å; W736-P738 WeakPolarHBondContact O-CD 3.43Å
737	T	82.5	Confident	83.1	Confident	14 Å²	14	34.9 Å²	34.9	9%	0.086	16%	0.156	C	C	.	.	S	Bend	trans	-123.6	68.4	177.1	-48.8	0	0	0	0	111.8	E584 A587 A588 L732 C733 E739 H740	E584-T737 PolarHBondContact O-OG1 2.76Å; A587-T737 VanDerWaalsContact CB-OG1 3.3Å; A587-T737 WeakPolarHBondContact CB-OG1 3.43Å; A588-T737 HydrophobicContact CB-CG2 3.83Å; A588-T737 PolarHBondContact N-OG1 2.97Å; L732-T737 PolarHBondContact O-N 3.37Å; C733-T737 CarbonylContact O-C 3.43Å; T737-E739 PolarHBondContact O-N 3.04Å; T737-H740 HydrophobicContact CG2-CB 4.4Å; T737-H740 PolarHBondContact O-N 2.82Å
738	P	69.9	Low	83	Confident	38 Å²	38	34.4 Å²	34.4	25%	0.247	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-60.1	-15.2	-169.6	22.6	-34	0	0	0	115.9	Q689 W736 H740 C741	Q689-P738 HydrophobicContact CG-CB 4.33Å; Q689-P738 HydrophobicContact CG-CG 4.11Å; W736-P738 WeakPolarHBondContact O-CD 3.43Å; P738-H740 PolarHBondContact O-N 3.1Å; P738-C741 PolarHBondContact O-N 3.46Å
739	E	71.8	Confident	82.7	Confident	118 Å²	118	36.4 Å²	36.4	55%	0.551	17%	0.166	S	C	*	.	G	3₁₀ helix	trans	-65.2	-13.1	170.1	-54.5	-172.4	-176.4	0	0	113.6	Q689 T737	Q689-E739 HydrophobicContact CG-CG 4.48Å; Q689-E739 PolarHBondContact NE2-OE1 2.87Å; T737-E739 PolarHBondContact O-N 3.04Å
740	H	78.6	Confident	82.4	Confident	40 Å²	40	36.8 Å²	36.8	19%	0.185	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-112.6	6.3	-175.5	-71.5	4.9	0	0	0	112.9	C733 T737 P738 Q742 F743	C733-H740 CarbonylContact O-C 3.34Å; C733-H740 VanDerWaalsContact O-C 3.23Å; T737-H740 HydrophobicContact CG2-CB 4.4Å; T737-H740 PolarHBondContact O-N 2.82Å; P738-H740 PolarHBondContact O-N 3.1Å; H740-Q742 PolarHBondContact O-N 3.12Å; H740-Q742 VanDerWaalsContact O-N 3.13Å; H740-F743 HydrophobicContact CB-CD2 3.83Å; H740-F743 HydrophobicContact CB-CE2 4.26Å; H740-F743 AromaticContact CG-CE2 3.95Å; H740-F743 AromaticContact ND1-CE2 3.97Å; H740-F743 WeakPolarHBondContact O-CB 3.49Å; H740-F743 PolarHBondContact O-N 2.97Å
741	C	78.9	Confident	82.4	Confident	8 Å²	8	36.8 Å²	36.8	5%	0.054	17%	0.169	C	C	.	.	H	α-helix	trans	-61.8	-27.4	-177.8	-169.1	0	0	0	0	112.9	Y684 C733 C734 P738 F743 F744 Y745	Y684-C741 HydrophobicContact CE2-CB 4.48Å; C733-C741 WeakPolarHBondContact O-CA 3.28Å; C733-C741 PolarHBondContact O-N 2.82Å; C734-C741 HydrophobicContact CB-CB 3.79Å; C734-C741 WeakPolarHBondContact CB-SG 3.14Å; C734-C741 WeakPolarHBondContact SG-CA 3.46Å; C734-C741 WeakPolarHBondContact SG-CB 3.38Å; C734-C741 CovalentContact SG-SG 2.04Å; C734-C741 PolarHBondContact SG-SG 3.46Å; P738-C741 PolarHBondContact O-N 3.46Å; C741-F743 VanDerWaalsContact C-N 3.3Å; C741-F743 PolarHBondContact O-N 2.92Å; C741-F744 WeakPolarHBondContact O-CB 3.47Å; C741-F744 PolarHBondContact O-N 2.86Å; C741-F744 VanDerWaalsContact O-N 3.16Å; C741-Y745 PolarHBondContact O-N 2.9Å; C741-Y745 WeakPolarHBondContact SG-CE2 3.39Å
742	Q	75.3	Confident	82.2	Confident	68 Å²	68	36.6 Å²	36.6	32%	0.318	17%	0.171	S	C	.	.	H	α-helix	trans	-55.6	-37.9	170.8	62.2	-161.9	30.6	0	0	113.6	Y684 H740 W746	Y684-Q742 HydrophobicContact CD1-CB 3.94Å; Y684-Q742 HydrophobicContact CE1-CB 4.38Å; H740-Q742 PolarHBondContact O-N 3.12Å; H740-Q742 VanDerWaalsContact O-N 3.13Å; Q742-W746 VanDerWaalsContact O-CB 3.25Å; Q742-W746 WeakPolarHBondContact O-CB 3.3Å; Q742-W746 PolarHBondContact O-N 2.92Å
743	F	81.6	Confident	82.2	Confident	50 Å²	50	36.5 Å²	36.5	22%	0.219	17%	0.17	C	C	.	.	H	α-helix	trans	-66.8	-38	176.9	-63.4	-63	0	0	0	111.6	F595 H740 C741 R747	F595-F743 HydrophobicContact CB-CB 4.33Å; F595-F743 HydrophobicContact CD1-CD1 4.37Å; F595-F743 HydrophobicContact CD2-CB 3.73Å; F595-F743 HydrophobicContact CD2-CD1 4.13Å; F595-F743 HydrophobicContact CD2-CG 4.36Å; F595-F743 WeakPolarHBondContact CD2-O 3.46Å; F595-F743 HydrophobicContact CE1-CD1 4.37Å; F595-F743 HydrophobicContact CE2-CB 4.31Å; F595-F743 HydrophobicContact CE2-CD1 4.12Å; F595-F743 HydrophobicContact CG-CB 4.13Å; F595-F743 HydrophobicContact CG-CD1 4.25Å; F595-F743 HydrophobicContact CG-CG 4.49Å; F595-F743 HydrophobicContact CZ-CD1 4.25Å; H740-F743 HydrophobicContact CB-CD2 3.83Å; H740-F743 HydrophobicContact CB-CE2 4.26Å; H740-F743 AromaticContact CG-CE2 3.95Å; H740-F743 AromaticContact ND1-CE2 3.97Å; H740-F743 WeakPolarHBondContact O-CB 3.49Å; H740-F743 PolarHBondContact O-N 2.97Å; C741-F743 VanDerWaalsContact C-N 3.3Å; C741-F743 PolarHBondContact O-N 2.92Å; F743-R747 PolarHBondContact O-N 3.05Å
744	F	85.4	Confident	82.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.5	-57.3	173.8	-175.9	-91.9	0	0	0	111.2	W594 F699 P729 Y730 C733 C741 W746 R747 R748	W594-F744 HydrophobicContact CH2-CB 4.34Å; W594-F744 AromaticContact CH2-CD2 3.44Å; W594-F744 HydrophobicContact CH2-CD2 3.44Å; W594-F744 VanDerWaalsContact CH2-CD2 3.44Å; W594-F744 HydrophobicContact CH2-CE2 4.01Å; W594-F744 HydrophobicContact CH2-CG 4.15Å; W594-F744 AromaticContact CZ2-CD2 3.95Å; W594-F744 HydrophobicContact CZ2-CD2 3.95Å; W594-F744 HydrophobicContact CZ2-CE2 4.1Å; W594-F744 HydrophobicContact CZ3-CB 4.28Å; W594-F744 AromaticContact CZ3-CD2 3.97Å; W594-F744 HydrophobicContact CZ3-CD2 3.97Å; F699-F744 AromaticContact CD1-CE1 3.97Å; F699-F744 HydrophobicContact CD1-CE1 3.97Å; F699-F744 HydrophobicContact CD1-CZ 4.33Å; F699-F744 HydrophobicContact CD2-CE1 4.22Å; F699-F744 AromaticContact CD2-CZ 3.97Å; F699-F744 HydrophobicContact CD2-CZ 3.97Å; F699-F744 HydrophobicContact CE1-CE1 4.15Å; F699-F744 HydrophobicContact CE1-CZ 4.2Å; F699-F744 HydrophobicContact CE2-CE1 4.42Å; F699-F744 AromaticContact CE2-CZ 3.85Å; F699-F744 HydrophobicContact CE2-CZ 3.85Å; F699-F744 HydrophobicContact CG-CE1 4Å; F699-F744 HydrophobicContact CG-CZ 4.22Å; F699-F744 HydrophobicContact CZ-CE1 4.38Å; F699-F744 AromaticContact CZ-CZ 3.96Å; F699-F744 HydrophobicContact CZ-CZ 3.96Å; P729-F744 HydrophobicContact CB-CD2 4.24Å; P729-F744 HydrophobicContact CB-CE2 4.18Å; Y730-F744 AromaticContact CD2-CD1 3.92Å; Y730-F744 HydrophobicContact CD2-CD1 3.92Å; Y730-F744 AromaticContact CD2-CE1 3.73Å; Y730-F744 HydrophobicContact CD2-CE1 3.73Å; Y730-F744 HydrophobicContact CD2-CG 4.48Å; Y730-F744 HydrophobicContact CD2-CZ 4.15Å; Y730-F744 HydrophobicContact CG-CE1 4.41Å; Y730-F744 HydrophobicContact CG-CZ 4.38Å; C733-F744 HydrophobicContact CB-CB 3.73Å; C741-F744 WeakPolarHBondContact O-CB 3.47Å; C741-F744 PolarHBondContact O-N 2.86Å; C741-F744 VanDerWaalsContact O-N 3.16Å; F744-W746 PolarHBondContact O-N 3.38Å; F744-R747 CarbonylContact O-C 3.55Å; F744-R747 WeakPolarHBondContact O-CA 3.34Å; F744-R747 PolarHBondContact O-N 2.82Å; F744-R748 HydrophobicContact CD1-CB 3.99Å; F744-R748 HydrophobicContact CD1-CG 4.34Å; F744-R748 HydrophobicContact CD2-CG 4.28Å; F744-R748 HydrophobicContact CE1-CB 3.61Å; F744-R748 HydrophobicContact CE1-CG 3.91Å; F744-R748 HydrophobicContact CE2-CB 4.46Å; F744-R748 HydrophobicContact CE2-CG 3.84Å; F744-R748 HydrophobicContact CZ-CB 3.88Å; F744-R748 HydrophobicContact CZ-CG 3.65Å; F744-R748 VanDerWaalsContact O-CB 3.29Å; F744-R748 WeakPolarHBondContact O-CB 3.19Å; F744-R748 PolarHBondContact O-N 2.65Å
745	Y	81.3	Confident	82.5	Confident	14 Å²	14	44.4 Å²	44.4	6%	0.055	21%	0.208	C	C	.	.	H	α-helix	trans	-67.9	-20.4	-177.1	-72.1	-52.7	0	0	0	113.9	T682 Y684 P697 C741 R748 P749	T682-Y745 HydrophobicContact CG2-CD1 3.25Å; T682-Y745 HydrophobicContact CG2-CD2 4.02Å; T682-Y745 HydrophobicContact CG2-CE1 3.57Å; T682-Y745 HydrophobicContact CG2-CE2 4.27Å; T682-Y745 HydrophobicContact CG2-CG 3.51Å; Y684-Y745 AromaticContact CD2-CD2 3.91Å; Y684-Y745 HydrophobicContact CD2-CD2 3.91Å; Y684-Y745 HydrophobicContact CD2-CE2 4.43Å; Y684-Y745 HydrophobicContact CE2-CD2 4.41Å; P697-Y745 HydrophobicContact CG-CE1 4.29Å; C741-Y745 PolarHBondContact O-N 2.9Å; C741-Y745 WeakPolarHBondContact SG-CE2 3.39Å; Y745-R748 CarbonylContact O-C 3.42Å; Y745-R748 PolarHBondContact O-N 3.29Å; Y745-P749 VanDerWaalsContact O-CA 3.26Å; Y745-P749 WeakPolarHBondContact O-CA 3.31Å; Y745-P749 WeakPolarHBondContact O-CD 3.26Å
746	W	80.8	Confident	82.9	Confident	193 Å²	193	42.3 Å²	42.3	73%	0.731	20%	0.198	S	C	*	.	H	α-helix	trans	-70.9	-29.1	169.9	-162.1	18.4	0	0	0	112.9	F595 Q742 F744	F595-W746 HydrophobicContact CE2-CB 4.46Å; F595-W746 HydrophobicContact CE2-CD2 4.35Å; F595-W746 AromaticContact CE2-CE3 3.73Å; F595-W746 HydrophobicContact CE2-CE3 3.73Å; F595-W746 HydrophobicContact CE2-CZ3 4.43Å; F595-W746 HydrophobicContact CZ-CD2 4.35Å; F595-W746 AromaticContact CZ-CE3 3.51Å; F595-W746 HydrophobicContact CZ-CE3 3.51Å; F595-W746 AromaticContact CZ-CZ3 3.76Å; F595-W746 HydrophobicContact CZ-CZ3 3.76Å; Q742-W746 VanDerWaalsContact O-CB 3.25Å; Q742-W746 WeakPolarHBondContact O-CB 3.3Å; Q742-W746 PolarHBondContact O-N 2.92Å; F744-W746 PolarHBondContact O-N 3.38Å
747	R	86.4	Confident	83.2	Confident	69 Å²	69	49.5 Å²	49.5	26%	0.26	23%	0.226	S	C	.	.	H	α-helix	trans	-90.9	-12.4	170.8	-66.4	-71.1	-173.4	-136.6	-6	113.7	W594 F595 F743 F744	W594-R747 HydrophobicContact CH2-CB 3.65Å; W594-R747 HydrophobicContact CH2-CG 4.09Å; W594-R747 HydrophobicContact CZ2-CB 4.35Å; W594-R747 HydrophobicContact CZ3-CB 4.21Å; W594-R747 HydrophobicContact CZ3-CG 4.18Å; F595-R747 HydrophobicContact CD2-CG 3.47Å; F595-R747 VanDerWaalsContact CD2-CG 3.47Å; F595-R747 HydrophobicContact CE2-CG 3.71Å; F595-R747 HydrophobicContact CG-CG 4.49Å; F595-R747 VanDerWaalsContact O-CZ 3.29Å; F595-R747 PolarHBondContact O-NE 3.03Å; F595-R747 PolarHBondContact O-NH2 2.92Å; F743-R747 PolarHBondContact O-N 3.05Å; F744-R747 CarbonylContact O-C 3.55Å; F744-R747 WeakPolarHBondContact O-CA 3.34Å; F744-R747 PolarHBondContact O-N 2.82Å
748	R	87.6	Confident	83.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.225	C	C	.	.	S	Bend	trans	-144	50.4	-170	-61.6	-71.7	-175.1	-70.3	-5.7	112.4	W594 D598 F699 P700 H725 D726 F744 Y745	W594-R748 HydrophobicContact CH2-CG 4.18Å; W594-R748 HydrophobicContact CZ2-CG 4.31Å; D598-R748 IonicContact OD1-CZ 2.73Å; D598-R748 IonicContact OD1-NH1 3.77Å; D598-R748 PolarHBondContact OD1-NH1 3.24Å; D598-R748 VanDerWaalsContact OD1-NH1 3.11Å; D598-R748 IonicContact OD1-NH2 2.7Å; D598-R748 PolarHBondContact OD1-NH2 3.48Å; D598-R748 IonicContact OD2-CZ 3.69Å; D598-R748 IonicContact OD2-NH1 3.59Å; D598-R748 PolarHBondContact OD2-NH1 3.19Å; D598-R748 IonicContact OD2-NH2 3.87Å; F699-R748 HydrophobicContact CB-CB 4.36Å; P700-R748 WeakPolarHBondContact O-CD 3.48Å; H725-R748 PolarHBondContact O-NH2 2.97Å; D726-R748 IonicContact OD1-CZ 2.7Å; D726-R748 IonicContact OD1-NE 3.21Å; D726-R748 PolarHBondContact OD1-NE 3.11Å; D726-R748 IonicContact OD1-NH2 3.7Å; D726-R748 PolarHBondContact OD1-NH2 3.47Å; D726-R748 VanDerWaalsContact OD1-NH2 3.07Å; F744-R748 HydrophobicContact CD1-CB 3.99Å; F744-R748 HydrophobicContact CD1-CG 4.34Å; F744-R748 HydrophobicContact CD2-CG 4.28Å; F744-R748 HydrophobicContact CE1-CB 3.61Å; F744-R748 HydrophobicContact CE1-CG 3.91Å; F744-R748 HydrophobicContact CE2-CB 4.46Å; F744-R748 HydrophobicContact CE2-CG 3.84Å; F744-R748 HydrophobicContact CZ-CB 3.88Å; F744-R748 HydrophobicContact CZ-CG 3.65Å; F744-R748 VanDerWaalsContact O-CB 3.29Å; F744-R748 WeakPolarHBondContact O-CB 3.19Å; F744-R748 PolarHBondContact O-N 2.65Å; Y745-R748 CarbonylContact O-C 3.42Å; Y745-R748 PolarHBondContact O-N 3.29Å
749	P	83.6	Confident	84.9	Confident	45 Å²	45	47.8 Å²	47.8	29%	0.292	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-66.6	141.6	-175.1	28.6	-35.9	0	0	0	111.1	I605 P700 Y745	I605-P749 HydrophobicContact CG2-CG 3.72Å; P700-P749 WeakPolarHBondContact CD-O 3.26Å; P700-P749 WeakPolarHBondContact CG-O 3.41Å; Y745-P749 VanDerWaalsContact O-CA 3.26Å; Y745-P749 WeakPolarHBondContact O-CA 3.31Å; Y745-P749 WeakPolarHBondContact O-CD 3.26Å
750	S	84.5	Confident	85.9	Confident	8 Å²	8	42.2 Å²	42.2	6%	0.056	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-60.2	145.1	175.1	57.7	0	0	0	0	111.2	H681 T682 G698	H681-S750 WeakPolarHBondContact CA-OG 3.46Å; T682-S750 PolarHBondContact N-OG 3.17Å; T682-S750 PolarHBondContact OG1-OG 3.08Å; G698-S750 WeakPolarHBondContact O-CA 3.47Å; G698-S750 WeakPolarHBondContact O-CB 3.27Å
751	S	87.9	Confident	86.7	Confident	4 Å²	4	40.4 Å²	40.4	3%	0.028	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-54.7	150.2	172	-174.4	0	0	0	0	112.3	E609 S613 C614 H681	E609-S751 PolarHBondContact OE1-OG 3.04Å; E609-S751 WeakPolarHBondContact OE2-CB 3.49Å; E609-S751 PolarHBondContact OE2-OG 3.25Å; S613-S751 PolarHBondContact OG-OG 2.83Å; C614-S751 WeakPolarHBondContact CB-OG 3.46Å; C614-S751 PolarHBondContact N-OG 3.44Å; C614-S751 WeakPolarHBondContact SG-CB 3.48Å; H681-S751 PolarHBondContact CE1-O 2.89Å; H681-S751 VanDerWaalsContact CE1-O 3.3Å; H681-S751 PolarHBondContact ND1-O 3.36Å
752	S	82.6	Confident	87.4	Confident	12 Å²	12	40.1 Å²	40.1	8%	0.084	18%	0.178	C	C	.	.			trans	-111.4	3.5	-176.3	70	0	0	0	0	113.7	E609 L754 S1142	E609-S752 PolarHBondContact OE1-N 2.84Å; E609-S752 PolarHBondContact OE1-OG 2.86Å; S752-L754 PolarHBondContact O-N 2.97Å; S752-L754 VanDerWaalsContact O-N 3.11Å; S752-L754 WeakPolarHBondContact OG-CB 3.39Å; S752-S1142 WeakPolarHBondContact O-CB 3.33Å; S752-S1142 PolarHBondContact O-OG 2.73Å
753	C	89.9	Confident	88.3	Confident	2 Å²	2	37 Å²	37	1%	0.014	16%	0.164	C	C	.	.			trans	52.7	17.7	-170.6	83.2	0	0	0	0	115.8	S613 C614 C616 L679 E755 Y756	S613-C753 WeakPolarHBondContact OG-CA 3.43Å; C614-C753 WeakPolarHBondContact O-CA 3.3Å; C614-C753 WeakPolarHBondContact O-CB 3.37Å; C616-C753 VanDerWaalsContact CA-SG 3.52Å; C616-C753 HydrophobicContact CB-CB 3.87Å; C616-C753 WeakPolarHBondContact CB-SG 3.31Å; C616-C753 WeakPolarHBondContact SG-CB 3.46Å; C616-C753 CovalentContact SG-SG 2.04Å; C616-C753 PolarHBondContact SG-SG 3.39Å; L679-C753 HydrophobicContact CD2-CB 3.94Å; C753-E755 PolarHBondContact O-N 3.01Å; C753-Y756 WeakPolarHBondContact O-CB 3.4Å; C753-Y756 PolarHBondContact O-N 3.07Å
754	L	86.3	Confident	88.8	Confident	82 Å²	82	34.7 Å²	34.7	43%	0.429	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-41.6	-171.2	-179.6	63.3	0	0	0	113.7	S613 S752 S1142	S613-L754 PolarHBondContact OG-N 2.88Å; S752-L754 PolarHBondContact O-N 2.97Å; S752-L754 VanDerWaalsContact O-N 3.11Å; S752-L754 WeakPolarHBondContact OG-CB 3.39Å; L754-S1142 VanDerWaalsContact CD1-O 3.29Å; L754-S1142 WeakPolarHBondContact CD1-O 2.95Å
755	E	89	Confident	89.1	Confident	98 Å²	98	34.9 Å²	34.9	46%	0.458	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	4	177.3	-66.2	-67.7	173.1	0	0	112.2	C753 R757	C753-E755 PolarHBondContact O-N 3.01Å; E755-R757 PolarHBondContact O-N 3.43Å
756	Y	92.3	Very high	89.4	Confident	20 Å²	20	34.3 Å²	34.3	8%	0.078	15%	0.153	C	C	.	.			trans	-69.5	127.8	-176.8	-176.1	-100.9	0	0	0	112	S613 C614 P615 Q620 D624 F628 C753 P758 P759	S613-Y756 WeakPolarHBondContact O-CD2 3.27Å; C614-Y756 WeakPolarHBondContact O-CB 3.39Å; P615-Y756 HydrophobicContact CB-CD1 4.34Å; P615-Y756 HydrophobicContact CB-CD2 4.31Å; P615-Y756 HydrophobicContact CB-CE1 3.86Å; P615-Y756 HydrophobicContact CB-CE2 3.84Å; P615-Y756 HydrophobicContact CG-CD2 4.24Å; P615-Y756 HydrophobicContact CG-CE1 4.49Å; P615-Y756 HydrophobicContact CG-CE2 3.59Å; Q620-Y756 HydrophobicContact CB-CE1 4.09Å; Q620-Y756 HydrophobicContact CG-CE1 4.37Å; D624-Y756 VanDerWaalsContact OD2-CE2 3.24Å; D624-Y756 WeakPolarHBondContact OD2-CE2 3.42Å; D624-Y756 PolarHBondContact OD2-OH 3.39Å; F628-Y756 HydrophobicContact CE2-CE2 4.13Å; C753-Y756 WeakPolarHBondContact O-CB 3.4Å; C753-Y756 PolarHBondContact O-N 3.07Å; Y756-P758 HydrophobicContact CE1-CB 4.06Å; Y756-P759 WeakPolarHBondContact OH-CD 3.47Å
757	R	92.1	Very high	89.8	Confident	157 Å²	157	25.1 Å²	25.1	59%	0.592	12%	0.118	S	C	*	.			trans	-122.9	126.2	171	-61.6	-179	-168.5	-167.9	3.6	108.3	R627 E755 P954	R627-R757 PolarHBondContact NH1-O 3.35Å; R627-R757 PolarHBondContact NH2-O 2.77Å; E755-R757 PolarHBondContact O-N 3.43Å; R757-P954 HydrophobicContact CB-CB 4.26Å; R757-P954 HydrophobicContact CB-CG 3.67Å
758	P	93.8	Very high	89.8	Confident	12 Å²	12	21.8 Å²	21.8	8%	0.078	11%	0.106	C	C	.	.	P	Polyproline II helix	trans	-65.2	153	-178.3	27.5	-34.6	0	0	0	111.8	Y756 G1136 N1139	Y756-P758 HydrophobicContact CE1-CB 4.06Å; P758-G1136 WeakPolarHBondContact CB-O 3.39Å; P758-N1139 WeakPolarHBondContact CD-OD1 3.41Å; P758-N1139 WeakPolarHBondContact CG-OD1 3.26Å
759	P	94.1	Very high	89.9	Confident	4 Å²	4	21.8 Å²	21.8	3%	0.026	11%	0.106	C	C	.	.	P	Polyproline II helix	trans	-71.8	165.7	171	35.3	-38.7	0	0	0	110.7	I623 D624 Y756 S951 V952	I623-P759 HydrophobicContact CD1-CG 3.85Å; I623-P759 HydrophobicContact CG1-CG 3.94Å; D624-P759 HydrophobicContact CB-CG 3.97Å; Y756-P759 WeakPolarHBondContact OH-CD 3.47Å; P759-S951 WeakPolarHBondContact CB-OG 3.26Å; P759-V952 WeakPolarHBondContact CA-O 3.4Å; P759-V952 VanDerWaalsContact CB-O 3.26Å; P759-V952 WeakPolarHBondContact CB-O 3.24Å
760	A	92.4	Very high	90.2	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.008	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	145.2	157.8	0	0	0	0	0	109.5	F773 V952 F979 M1137	A760-F773 HydrophobicContact CB-CB 4.34Å; A760-F773 HydrophobicContact CB-CD1 4.12Å; A760-V952 PolarHBondContact N-O 2.89Å; A760-V952 VanDerWaalsContact N-O 3.08Å; A760-V952 PolarHBondContact O-N 3.24Å; A760-F979 HydrophobicContact CB-CD1 4.29Å; A760-F979 HydrophobicContact CB-CD2 3.82Å; A760-F979 HydrophobicContact CB-CE1 3.87Å; A760-F979 HydrophobicContact CB-CE2 3.37Å; A760-F979 HydrophobicContact CB-CG 4.28Å; A760-F979 HydrophobicContact CB-CZ 3.39Å; A760-M1137 HydrophobicContact CB-CE 3.9Å
761	F	94.3	Very high	90.5	Very high	1 Å²	1	20 Å²	20	0%	0.004	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149	171.5	72.9	-94.3	0	0	0	112.6	I623 L949 V950 R1133 M1137	I623-F761 HydrophobicContact CB-CD1 4.29Å; I623-F761 HydrophobicContact CD1-CD1 3.82Å; I623-F761 HydrophobicContact CD1-CE1 4.02Å; I623-F761 HydrophobicContact CG2-CD1 4.25Å; I623-F761 HydrophobicContact CG2-CE1 4.04Å; F761-L949 HydrophobicContact CB-CD2 3.96Å; F761-L949 HydrophobicContact CB-CG 4.2Å; F761-L949 HydrophobicContact CD2-CD1 3.62Å; F761-L949 HydrophobicContact CD2-CD2 4.39Å; F761-L949 HydrophobicContact CD2-CG 3.77Å; F761-L949 HydrophobicContact CE2-CD1 3.8Å; F761-L949 HydrophobicContact CE2-CG 4.42Å; F761-L949 HydrophobicContact CG-CD1 4.14Å; F761-L949 HydrophobicContact CG-CD2 4.31Å; F761-L949 HydrophobicContact CG-CG 4.19Å; F761-L949 HydrophobicContact CZ-CD1 4.43Å; F761-V950 CarbonylContact C-O 3.23Å; F761-V950 WeakPolarHBondContact CA-O 3.49Å; F761-V950 VanDerWaalsContact CB-O 3.31Å; F761-V950 WeakPolarHBondContact CB-O 3.25Å; F761-R1133 HydrophobicContact CE1-CB 4.12Å; F761-R1133 HydrophobicContact CE1-CG 4.01Å; F761-R1133 HydrophobicContact CZ-CB 3.64Å; F761-R1133 HydrophobicContact CZ-CG 3.75Å; F761-R1133 PolarHBondContact O-NH1 3.17Å; F761-R1133 PolarHBondContact O-NH2 3.34Å; F761-M1137 HydrophobicContact CD1-CG 4.12Å; F761-M1137 HydrophobicContact CD1-SD 4.01Å; F761-M1137 HydrophobicContact CE1-CG 4.1Å; F761-M1137 HydrophobicContact CE1-SD 4.1Å
762	A	93.5	Very high	90.6	Very high	2 Å²	2	19.9 Å²	19.9	2%	0.017	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	160.9	166.4	0	0	0	0	0	108.9	T771 F773 L949 V950 A976	A762-T771 CarbonylContact C-O 3.5Å; A762-T771 VanDerWaalsContact CA-O 3.22Å; A762-T771 WeakPolarHBondContact CA-O 3.35Å; A762-T771 WeakPolarHBondContact CB-O 3.47Å; A762-F773 HydrophobicContact CB-CD1 3.82Å; A762-F773 HydrophobicContact CB-CD2 4.43Å; A762-F773 HydrophobicContact CB-CE1 3.75Å; A762-F773 HydrophobicContact CB-CE2 4.39Å; A762-F773 HydrophobicContact CB-CG 4.15Å; A762-F773 HydrophobicContact CB-CZ 4.04Å; A762-L949 WeakPolarHBondContact O-CA 3.29Å; A762-V950 PolarHBondContact N-O 3.42Å; A762-V950 PolarHBondContact O-N 3.27Å; A762-A976 HydrophobicContact CB-CB 3.54Å
763	S	94.2	Very high	90.9	Very high	3 Å²	3	19.4 Å²	19.4	2%	0.021	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	155.1	179.9	45	0	0	0	0	113.1	F770 T771 V948 Q1129	S763-F770 CarbonylContact O-C 3.33Å; S763-F770 WeakPolarHBondContact O-CA 3.47Å; S763-T771 PolarHBondContact N-O 2.97Å; S763-T771 PolarHBondContact O-N 2.86Å; S763-V948 CarbonylContact C-O 3.23Å; S763-V948 WeakPolarHBondContact CA-O 3.34Å; S763-V948 WeakPolarHBondContact CB-O 3.41Å; S763-Q1129 PolarHBondContact OG-NE2 3Å
764	V	92.9	Very high	90.8	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.006	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.1	163	54.5	0	0	0	0	110	H769 F770 V845 N947 V948	V764-H769 CarbonylContact C-O 3.34Å; V764-H769 WeakPolarHBondContact CA-O 3.41Å; V764-F770 HydrophobicContact CB-CD1 3.78Å; V764-F770 HydrophobicContact CB-CE1 3.71Å; V764-F770 HydrophobicContact CB-CG 4.25Å; V764-F770 HydrophobicContact CB-CZ 4.1Å; V764-F770 HydrophobicContact CG1-CE1 4.21Å; V764-F770 HydrophobicContact CG2-CD1 4.1Å; V764-F770 HydrophobicContact CG2-CD2 4.13Å; V764-F770 HydrophobicContact CG2-CE1 3.8Å; V764-F770 HydrophobicContact CG2-CE2 3.8Å; V764-F770 HydrophobicContact CG2-CG 4.25Å; V764-F770 HydrophobicContact CG2-CZ 3.63Å; V764-V845 HydrophobicContact CG1-CG2 3.97Å; V764-V845 HydrophobicContact CG2-CG2 3.74Å; V764-N947 CarbonylContact O-C 3.23Å; V764-N947 WeakPolarHBondContact O-CA 3.39Å; V764-V948 HydrophobicContact CG1-CB 3.78Å; V764-V948 HydrophobicContact CG1-CG2 4.12Å; V764-V948 PolarHBondContact N-O 2.87Å; V764-V948 PolarHBondContact O-N 2.92Å
765	F	90.7	Very high	90.8	Very high	5 Å²	5	17.7 Å²	17.7	2%	0.022	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	166.1	-178.2	60	-81.5	0	0	0	111.4	G768 H769 N947 H1105 L1122	F765-G768 PolarHBondContact O-N 3.05Å; F765-H769 HydrophobicContact CD1-CB 4.5Å; F765-H769 HydrophobicContact CD2-CB 4.34Å; F765-H769 HydrophobicContact CE1-CB 4.26Å; F765-H769 HydrophobicContact CE2-CB 4.1Å; F765-H769 HydrophobicContact CZ-CB 4.05Å; F765-H769 PolarHBondContact N-O 3.33Å; F765-H769 WeakPolarHBondContact O-CB 3.18Å; F765-H769 PolarHBondContact O-N 3.25Å; F765-N947 VanDerWaalsContact CA-OD1 3.29Å; F765-N947 WeakPolarHBondContact CA-OD1 3.45Å; F765-N947 HydrophobicContact CB-CB 4.27Å; F765-N947 WeakPolarHBondContact CB-OD1 3.1Å; F765-H1105 HydrophobicContact CE2-CB 4.47Å; F765-H1105 AromaticContact CZ-ND1 3.94Å; F765-L1122 HydrophobicContact CD2-CD1 3.93Å; F765-L1122 HydrophobicContact CD2-CG 4.15Å; F765-L1122 HydrophobicContact CE2-CD1 4.33Å; F765-L1122 HydrophobicContact CE2-CD2 4.2Å; F765-L1122 HydrophobicContact CE2-CG 4.31Å
766	G	88.3	Confident	90.5	Very high	1 Å²	1	16 Å²	16	1%	0.01	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	-140.9	178.5	0	0	0	0	0	113.7	G768 N947 D1109	G766-G768 PolarHBondContact O-N 2.91Å; G766-N947 PolarHBondContact N-OD1 2.97Å; G766-D1109 WeakPolarHBondContact CA-OD2 3.49Å
767	A	88.6	Confident	90.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	44.5	175.6	0	0	0	0	0	114.8	V842 S843 Y1108 D1109 L1113	A767-V842 HydrophobicContact CB-CG2 3.46Å; A767-V842 VanDerWaalsContact CB-CG2 3.46Å; A767-S843 CarbonylContact C-O 3.56Å; A767-Y1108 HydrophobicContact CB-CD1 3.89Å; A767-Y1108 HydrophobicContact CB-CE1 3.58Å; A767-D1109 WeakPolarHBondContact CB-OD1 3.26Å; A767-D1109 PolarHBondContact N-OD1 2.92Å; A767-D1109 PolarHBondContact N-OD2 2.82Å; A767-L1113 HydrophobicContact CB-CD1 4Å; A767-L1113 HydrophobicContact CB-CG 4.5Å
768	G	87.1	Confident	89.7	Confident	0 Å²	0	11 Å²	11	0%	0	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	41.7	179.3	0	0	0	0	0	113.1	F765 G766 F770 S779 I780	F765-G768 PolarHBondContact O-N 3.05Å; G766-G768 PolarHBondContact O-N 2.91Å; G768-F770 WeakPolarHBondContact O-CD2 3.08Å; G768-F770 VanDerWaalsContact O-CE2 3.3Å; G768-F770 WeakPolarHBondContact O-CE2 3.06Å; G768-S779 WeakPolarHBondContact O-CA 3.23Å; G768-I780 PolarHBondContact O-N 3.29Å
769	H	90.2	Very high	89.3	Confident	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	122.1	170	-62.6	-44.1	0	0	0	110.1	V764 F765 S779 H1105 Y1108 D1109	V764-H769 CarbonylContact C-O 3.34Å; V764-H769 WeakPolarHBondContact CA-O 3.41Å; F765-H769 HydrophobicContact CD1-CB 4.5Å; F765-H769 HydrophobicContact CD2-CB 4.34Å; F765-H769 HydrophobicContact CE1-CB 4.26Å; F765-H769 HydrophobicContact CE2-CB 4.1Å; F765-H769 HydrophobicContact CZ-CB 4.05Å; F765-H769 PolarHBondContact N-O 3.33Å; F765-H769 WeakPolarHBondContact O-CB 3.18Å; F765-H769 PolarHBondContact O-N 3.25Å; H769-S779 PolarHBondContact ND1-OG 3.05Å; H769-H1105 AromaticContact CD2-CD2 3.56Å; H769-H1105 AromaticContact CD2-CG 3.76Å; H769-H1105 AromaticContact CE1-CD2 3.66Å; H769-H1105 AromaticContact CG-CD2 3.34Å; H769-H1105 AromaticContact CG-CG 3.97Å; H769-H1105 AromaticContact ND1-CD2 3.44Å; H769-H1105 PolarHBondContact ND1-CD2 2.81Å; H769-H1105 WeakPolarHBondContact NE2-CA 3.47Å; H769-H1105 AromaticContact NE2-CD2 3.71Å; H769-H1105 AromaticContact NE2-CG 3.97Å; H769-Y1108 AromaticContact CE1-CD1 3.2Å; H769-Y1108 WeakPolarHBondContact CE1-CD1 3.43Å; H769-Y1108 AromaticContact CE1-CE1 3.75Å; H769-Y1108 AromaticContact CE1-CG 3.43Å; H769-Y1108 VanDerWaalsContact CE1-CG 3.43Å; H769-Y1108 AromaticContact NE2-CD1 3.54Å; H769-Y1108 AromaticContact NE2-CG 3.91Å; H769-D1109 IonicContact CD2-OD1 3.68Å; H769-D1109 IonicContact NE2-OD1 3.8Å; H769-D1109 PolarHBondContact NE2-OD1 3.41Å
770	F	89.5	Confident	88.7	Confident	2 Å²	2	10.5 Å²	10.5	1%	0.009	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	137	-175.9	-69.8	-100	0	0	0	111.1	S763 V764 G768 N777 Y778 I780 L788 I814 M816 L975	S763-F770 CarbonylContact O-C 3.33Å; S763-F770 WeakPolarHBondContact O-CA 3.47Å; V764-F770 HydrophobicContact CB-CD1 3.78Å; V764-F770 HydrophobicContact CB-CE1 3.71Å; V764-F770 HydrophobicContact CB-CG 4.25Å; V764-F770 HydrophobicContact CB-CZ 4.1Å; V764-F770 HydrophobicContact CG1-CE1 4.21Å; V764-F770 HydrophobicContact CG2-CD1 4.1Å; V764-F770 HydrophobicContact CG2-CD2 4.13Å; V764-F770 HydrophobicContact CG2-CE1 3.8Å; V764-F770 HydrophobicContact CG2-CE2 3.8Å; V764-F770 HydrophobicContact CG2-CG 4.25Å; V764-F770 HydrophobicContact CG2-CZ 3.63Å; G768-F770 WeakPolarHBondContact O-CD2 3.08Å; G768-F770 VanDerWaalsContact O-CE2 3.3Å; G768-F770 WeakPolarHBondContact O-CE2 3.06Å; F770-N777 CarbonylContact O-C 3.56Å; F770-N777 VanDerWaalsContact O-CA 3.27Å; F770-N777 WeakPolarHBondContact O-CA 3.09Å; F770-Y778 HydrophobicContact CB-CD1 3.94Å; F770-Y778 HydrophobicContact CB-CD2 4.38Å; F770-Y778 HydrophobicContact CB-CE1 3.51Å; F770-Y778 HydrophobicContact CB-CE2 3.99Å; F770-Y778 HydrophobicContact CB-CG 4.36Å; F770-Y778 HydrophobicContact CD2-CE2 4.13Å; F770-Y778 HydrophobicContact CG-CE1 4.33Å; F770-Y778 HydrophobicContact CG-CE2 4.1Å; F770-Y778 AromaticContact CG-CZ 3.85Å; F770-Y778 PolarHBondContact N-O 2.88Å; F770-Y778 PolarHBondContact O-N 2.83Å; F770-I780 HydrophobicContact CD2-CD1 4.4Å; F770-I780 HydrophobicContact CD2-CG1 4.32Å; F770-I780 HydrophobicContact CE2-CB 3.93Å; F770-I780 HydrophobicContact CE2-CD1 3.97Å; F770-I780 HydrophobicContact CE2-CG1 4.04Å; F770-I780 HydrophobicContact CZ-CD1 4.28Å; F770-L788 HydrophobicContact CD1-CD1 4.33Å; F770-L788 HydrophobicContact CE1-CD1 4.14Å; F770-I814 HydrophobicContact CE1-CD1 3.66Å; F770-I814 HydrophobicContact CZ-CD1 3.66Å; F770-M816 HydrophobicContact CE2-CE 4.25Å; F770-M816 HydrophobicContact CE2-SD 4.28Å; F770-M816 HydrophobicContact CZ-CE 4.45Å; F770-M816 HydrophobicContact CZ-SD 3.98Å; F770-L975 HydrophobicContact CD1-CB 4.12Å; F770-L975 HydrophobicContact CE1-CB 3.96Å; F770-L975 HydrophobicContact CE1-CD1 3.75Å; F770-L975 HydrophobicContact CZ-CD1 3.86Å
771	T	90.3	Very high	88.1	Confident	14 Å²	14	11.4 Å²	11.4	9%	0.086	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.7	166.7	-58	0	0	0	0	108.9	A762 S763 R776 N777	A762-T771 CarbonylContact C-O 3.5Å; A762-T771 VanDerWaalsContact CA-O 3.22Å; A762-T771 WeakPolarHBondContact CA-O 3.35Å; A762-T771 WeakPolarHBondContact CB-O 3.47Å; S763-T771 PolarHBondContact N-O 2.97Å; S763-T771 PolarHBondContact O-N 2.86Å; T771-R776 WeakPolarHBondContact CA-O 3.33Å; T771-N777 WeakPolarHBondContact CB-OD1 3.42Å; T771-N777 WeakPolarHBondContact CG2-OD1 3.46Å; T771-N777 PolarHBondContact OG1-OD1 2.84Å
772	T	90.2	Very high	87.3	Confident	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.072	C	C	.	.			trans	-75.4	170.3	-178.4	68.9	0	0	0	0	113.7	D774 G775 R776 Y778 A976 D986 R1133	T772-D774 PolarHBondContact O-N 3.49Å; T772-D774 PolarHBondContact OG1-N 2.97Å; T772-G775 WeakPolarHBondContact O-CA 3.4Å; T772-G775 PolarHBondContact O-N 2.76Å; T772-G775 PolarHBondContact OG1-N 2.9Å; T772-R776 HydrophobicContact CG2-CB 4.14Å; T772-R776 PolarHBondContact N-O 3.28Å; T772-R776 WeakPolarHBondContact OG1-CB 3.45Å; T772-R776 PolarHBondContact OG1-N 2.77Å; T772-Y778 HydrophobicContact CG2-CD1 4.4Å; T772-Y778 HydrophobicContact CG2-CE1 3.84Å; T772-A976 CarbonylContact C-O 3.58Å; T772-A976 VanDerWaalsContact CA-O 3.26Å; T772-A976 WeakPolarHBondContact CA-O 3.49Å; T772-A976 VanDerWaalsContact CB-O 3.24Å; T772-A976 WeakPolarHBondContact CB-O 3.33Å; T772-D986 WeakPolarHBondContact CB-OD2 3.36Å; T772-D986 HydrophobicContact CG2-CB 4.04Å; T772-D986 PolarHBondContact OG1-OD2 2.83Å; T772-R1133 PolarHBondContact O-NH2 3.01Å
773	F	89.7	Confident	86.7	Confident	2 Å²	2	16.7 Å²	16.7	1%	0.009	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-38.7	170.7	-66	-60.8	0	0	0	112.6	A760 A762 G775 V789 V952 L972 A976 F979 R1133	A760-F773 HydrophobicContact CB-CB 4.34Å; A760-F773 HydrophobicContact CB-CD1 4.12Å; A762-F773 HydrophobicContact CB-CD1 3.82Å; A762-F773 HydrophobicContact CB-CD2 4.43Å; A762-F773 HydrophobicContact CB-CE1 3.75Å; A762-F773 HydrophobicContact CB-CE2 4.39Å; A762-F773 HydrophobicContact CB-CG 4.15Å; A762-F773 HydrophobicContact CB-CZ 4.04Å; F773-G775 VanDerWaalsContact C-N 3.26Å; F773-G775 PolarHBondContact O-N 2.78Å; F773-V789 HydrophobicContact CE2-CG2 4.24Å; F773-V789 HydrophobicContact CZ-CG2 4.03Å; F773-V952 HydrophobicContact CE1-CB 4.1Å; F773-V952 HydrophobicContact CE1-CG2 3.57Å; F773-V952 HydrophobicContact CE2-CG2 4.47Å; F773-V952 HydrophobicContact CZ-CB 4.33Å; F773-V952 HydrophobicContact CZ-CG2 3.46Å; F773-V952 VanDerWaalsContact CZ-CG2 3.46Å; F773-L972 HydrophobicContact CD2-CD1 4.46Å; F773-L972 HydrophobicContact CE2-CD1 4.13Å; F773-A976 HydrophobicContact CD2-CB 3.92Å; F773-A976 WeakPolarHBondContact CD2-O 3.44Å; F773-A976 HydrophobicContact CE2-CB 3.36Å; F773-A976 HydrophobicContact CZ-CB 3.78Å; F773-A976 PolarHBondContact N-O 2.85Å; F773-F979 HydrophobicContact CB-CB 3.8Å; F773-F979 HydrophobicContact CB-CD2 4.16Å; F773-F979 HydrophobicContact CB-CG 4.12Å; F773-F979 HydrophobicContact CD2-CB 4.09Å; F773-F979 HydrophobicContact CG-CB 4.1Å; F773-R1133 PolarHBondContact O-NH2 2.81Å
774	D	86.9	Confident	86.1	Confident	25 Å²	25	17.8 Å²	17.8	13%	0.134	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	6.9	176.3	-60.9	-24.6	0	0	0	113.2	T772 S980 S981 K982 Q983 D986	T772-D774 PolarHBondContact O-N 3.49Å; T772-D774 PolarHBondContact OG1-N 2.97Å; D774-S980 PolarHBondContact OD1-N 3.46Å; D774-S980 PolarHBondContact OD2-N 2.73Å; D774-S980 VanDerWaalsContact OD2-N 3.09Å; D774-S981 VanDerWaalsContact CG-CA 3.44Å; D774-S981 VanDerWaalsContact OD1-CA 3.29Å; D774-S981 WeakPolarHBondContact OD1-CA 3.41Å; D774-S981 PolarHBondContact OD1-N 2.87Å; D774-S981 WeakPolarHBondContact OD2-CA 3.46Å; D774-S981 PolarHBondContact OD2-N 2.96Å; D774-K982 PolarHBondContact OD2-N 3.44Å; D774-Q983 HydrophobicContact CB-CG 4.04Å; D774-Q983 VanDerWaalsContact O-CG 3.29Å; D774-Q983 WeakPolarHBondContact O-CG 3.49Å; D774-Q983 PolarHBondContact O-NE2 3.35Å; D774-D986 WeakPolarHBondContact CB-OD2 3.4Å
775	G	87.2	Confident	85.7	Confident	23 Å²	23	19.5 Å²	19.5	24%	0.237	11%	0.114	C	C	.	.			trans	81.4	25.8	171.5	0	0	0	0	0	115.5	T772 F773 Q983	T772-G775 WeakPolarHBondContact O-CA 3.4Å; T772-G775 PolarHBondContact O-N 2.76Å; T772-G775 PolarHBondContact OG1-N 2.9Å; F773-G775 VanDerWaalsContact C-N 3.26Å; F773-G775 PolarHBondContact O-N 2.78Å; G775-Q983 PolarHBondContact O-NE2 3.06Å
776	R	83.1	Confident	85.4	Confident	63 Å²	63	20.9 Å²	20.9	24%	0.238	12%	0.119	C	C	.	.			trans	-86.5	127.2	174.6	-171	174.7	-171.7	165.1	0.3	110.5	T771 T772 Q983	T771-R776 WeakPolarHBondContact CA-O 3.33Å; T772-R776 HydrophobicContact CG2-CB 4.14Å; T772-R776 PolarHBondContact N-O 3.28Å; T772-R776 WeakPolarHBondContact OG1-CB 3.45Å; T772-R776 PolarHBondContact OG1-N 2.77Å; R776-Q983 HydrophobicContact CB-CB 4.16Å; R776-Q983 HydrophobicContact CB-CG 4.11Å; R776-Q983 VanDerWaalsContact CD-O 3.31Å; R776-Q983 WeakPolarHBondContact CD-O 3.29Å; R776-Q983 PolarHBondContact NH1-O 2.85Å
777	N	83.6	Confident	85.3	Confident	65 Å²	65	21.9 Å²	21.9	35%	0.348	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	138.3	175.4	-69.2	-5.2	0	0	0	111.6	F770 T771	F770-N777 CarbonylContact O-C 3.56Å; F770-N777 VanDerWaalsContact O-CA 3.27Å; F770-N777 WeakPolarHBondContact O-CA 3.09Å; T771-N777 WeakPolarHBondContact CB-OD1 3.42Å; T771-N777 WeakPolarHBondContact CG2-OD1 3.46Å; T771-N777 PolarHBondContact OG1-OD1 2.84Å
778	Y	83.6	Confident	85.4	Confident	6 Å²	6	22 Å²	22	2%	0.024	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	178	172.5	70	-82	0	0	0	111	F770 T772 I780 L975 L987	F770-Y778 HydrophobicContact CB-CD1 3.94Å; F770-Y778 HydrophobicContact CB-CD2 4.38Å; F770-Y778 HydrophobicContact CB-CE1 3.51Å; F770-Y778 HydrophobicContact CB-CE2 3.99Å; F770-Y778 HydrophobicContact CB-CG 4.36Å; F770-Y778 HydrophobicContact CD2-CE2 4.13Å; F770-Y778 HydrophobicContact CG-CE1 4.33Å; F770-Y778 HydrophobicContact CG-CE2 4.1Å; F770-Y778 AromaticContact CG-CZ 3.85Å; F770-Y778 PolarHBondContact N-O 2.88Å; F770-Y778 PolarHBondContact O-N 2.83Å; T772-Y778 HydrophobicContact CG2-CD1 4.4Å; T772-Y778 HydrophobicContact CG2-CE1 3.84Å; Y778-I780 HydrophobicContact CD2-CG1 4.36Å; Y778-I780 HydrophobicContact CE2-CD1 3.94Å; Y778-I780 HydrophobicContact CE2-CG1 3.94Å; Y778-L975 WeakPolarHBondContact OH-CA 3.48Å; Y778-L975 WeakPolarHBondContact OH-CB 3.33Å; Y778-L975 PolarHBondContact OH-O 2.91Å; Y778-L987 HydrophobicContact CD1-CD2 4.39Å; Y778-L987 HydrophobicContact CE1-CD2 4.35Å
779	S	85	Confident	85.5	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	144.8	-177.3	-51.5	0	0	0	0	113.3	G768 H769 I1065 Y1104	G768-S779 WeakPolarHBondContact O-CA 3.23Å; H769-S779 PolarHBondContact ND1-OG 3.05Å; S779-I1065 PolarHBondContact O-N 2.94Å; S779-I1065 VanDerWaalsContact O-N 3.14Å; S779-Y1104 WeakPolarHBondContact CB-OH 3.29Å; S779-Y1104 PolarHBondContact OG-OH 3.49Å
780	I	82.5	Confident	85.4	Confident	7 Å²	7	23 Å²	23	4%	0.036	13%	0.129	C	C	.	.			trans	-120.4	124.3	175.6	-65.1	176.9	0	0	0	110.1	G768 F770 Y778 M816 S843 L975 P1062	G768-I780 PolarHBondContact O-N 3.29Å; F770-I780 HydrophobicContact CD2-CD1 4.4Å; F770-I780 HydrophobicContact CD2-CG1 4.32Å; F770-I780 HydrophobicContact CE2-CB 3.93Å; F770-I780 HydrophobicContact CE2-CD1 3.97Å; F770-I780 HydrophobicContact CE2-CG1 4.04Å; F770-I780 HydrophobicContact CZ-CD1 4.28Å; Y778-I780 HydrophobicContact CD2-CG1 4.36Å; Y778-I780 HydrophobicContact CE2-CD1 3.94Å; Y778-I780 HydrophobicContact CE2-CG1 3.94Å; I780-M816 HydrophobicContact CB-CE 4.39Å; I780-M816 HydrophobicContact CG2-CE 4.39Å; I780-M816 HydrophobicContact CG2-SD 4.27Å; I780-S843 PolarHBondContact O-OG 3.45Å; I780-L975 HydrophobicContact CD1-CD1 3.75Å; I780-L975 HydrophobicContact CD1-CD2 3.67Å; I780-L975 HydrophobicContact CD1-CG 4.34Å; I780-P1062 HydrophobicContact CG2-CB 4.2Å
781	N	79	Confident	85.2	Confident	20 Å²	20	23.3 Å²	23.3	11%	0.107	13%	0.13	C	C	.	.			trans	-118.7	63.5	178.1	-166.5	-21.9	0	0	0	110.8	N841 V842 S843 I1065 Y1108	N781-N841 PolarHBondContact ND2-O 3.07Å; N781-N841 PolarHBondContact OD1-O 3.48Å; N781-V842 WeakPolarHBondContact OD1-CA 3.46Å; N781-V842 PolarHBondContact OD1-N 2.93Å; N781-S843 WeakPolarHBondContact CA-OG 3.41Å; N781-I1065 HydrophobicContact CB-CD1 3.59Å; N781-I1065 HydrophobicContact CB-CG1 4.48Å; N781-Y1108 WeakPolarHBondContact CB-OH 3.43Å; N781-Y1108 PolarHBondContact ND2-OH 3.5Å
782	K	78.1	Confident	84.7	Confident	49 Å²	49	24.2 Å²	24.2	21%	0.213	14%	0.136	C	C	.	.			trans	-148.6	139.2	172.5	-68.3	-59.1	161.5	-149.5	0	111.3	Y786 S843 Y1056 P1062	K782-Y786 WeakPolarHBondContact CB-OH 3.43Å; K782-Y786 PolarHBondContact O-OH 3.06Å; K782-S843 PolarHBondContact N-OG 2.84Å; K782-S843 PolarHBondContact O-OG 3.31Å; K782-Y1056 VanDerWaalsContact NZ-CZ 3.32Å; K782-Y1056 PolarHBondContact NZ-OH 3.42Å; K782-P1062 HydrophobicContact CB-CB 4.14Å; K782-P1062 HydrophobicContact CB-CG 3.99Å; K782-P1062 HydrophobicContact CG-CB 3.8Å; K782-P1062 HydrophobicContact CG-CG 4Å
783	P	80	Confident	84.3	Confident	65 Å²	65	28.3 Å²	28.3	42%	0.422	15%	0.154	S	C	.	.			trans	-77.2	146.8	172	34	-33.9	0	0	0	110.5	Y786 M816 N818	P783-Y786 PolarHBondContact O-OH 2.86Å; P783-M816 CarbonylContact C-O 3.56Å; P783-M816 VanDerWaalsContact CA-O 3.26Å; P783-M816 WeakPolarHBondContact CA-O 3.21Å; P783-N818 WeakPolarHBondContact CB-OD1 3.46Å; P783-N818 VanDerWaalsContact CD-OD1 3.23Å; P783-N818 WeakPolarHBondContact CD-OD1 3.33Å; P783-N818 WeakPolarHBondContact CG-OD1 3.36Å
784	G	81.6	Confident	83.5	Confident	26 Å²	26	29.6 Å²	29.6	27%	0.268	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	158.2	175.9	-179.9	0	0	0	0	0	113.3	M816	G784-M816 PolarHBondContact N-O 2.9Å; G784-M816 PolarHBondContact O-N 3.36Å
785	T	84.2	Confident	82.5	Confident	37 Å²	37	36 Å²	36	23%	0.227	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	133.7	166.1	-57.9	0	0	0	0	109	Q813 I814 N1018 F1025	T785-Q813 HydrophobicContact CG2-CB 4.19Å; T785-Q813 HydrophobicContact CG2-CG 4.44Å; T785-I814 WeakPolarHBondContact CA-O 3.29Å; T785-N1018 PolarHBondContact O-ND2 2.94Å; T785-F1025 HydrophobicContact CG2-CD2 3.76Å; T785-F1025 HydrophobicContact CG2-CE2 3.88Å
786	Y	85.2	Confident	81.4	Confident	33 Å²	33	37.3 Å²	37.3	13%	0.129	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	146	-178.4	-58	-72.6	0	0	0	111.6	K782 P783 L788 Q813 I814 M816 L975 P1062	K782-Y786 WeakPolarHBondContact CB-OH 3.43Å; K782-Y786 PolarHBondContact O-OH 3.06Å; P783-Y786 PolarHBondContact O-OH 2.86Å; Y786-L788 PolarHBondContact O-N 2.96Å; Y786-Q813 CarbonylContact O-C 3.56Å; Y786-Q813 VanDerWaalsContact O-CA 3.3Å; Y786-Q813 WeakPolarHBondContact O-CA 3.43Å; Y786-I814 PolarHBondContact N-O 3.46Å; Y786-I814 PolarHBondContact O-N 2.92Å; Y786-M816 HydrophobicContact CD2-CG 4.26Å; Y786-M816 HydrophobicContact CD2-SD 3.96Å; Y786-M816 HydrophobicContact CE2-CB 4.33Å; Y786-M816 HydrophobicContact CE2-CG 4.4Å; Y786-M816 HydrophobicContact CE2-SD 4.03Å; Y786-L975 HydrophobicContact CG-CD1 4.13Å; Y786-P1062 HydrophobicContact CE1-CG 3.96Å; Y786-P1062 WeakPolarHBondContact OH-CG 3.28Å
787	M	86.4	Confident	80.3	Confident	23 Å²	23	39 Å²	39	11%	0.113	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	109.6	168.9	-63.5	-60	-64.9	0	0	109.3	H790 Q811 Q813 G974 L975 F1021	M787-H790 HydrophobicContact CE-CB 3.75Å; M787-Q811 HydrophobicContact CE-CB 4Å; M787-Q811 HydrophobicContact CE-CG 4Å; M787-Q813 HydrophobicContact CE-CG 4.37Å; M787-Q813 HydrophobicContact SD-CG 3.38Å; M787-Q813 WeakPolarHBondContact SD-CG 3.27Å; M787-G974 WeakPolarHBondContact O-CA 3.22Å; M787-L975 PolarHBondContact O-N 2.88Å; M787-F1021 HydrophobicContact SD-CB 4.49Å
788	L	90	Very high	78.8	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	-47.3	172.7	177.1	59.3	0	0	0	110.3	F770 Y786 I812 I814 V948 V950 G974 L975 A976	F770-L788 HydrophobicContact CD1-CD1 4.33Å; F770-L788 HydrophobicContact CE1-CD1 4.14Å; Y786-L788 PolarHBondContact O-N 2.96Å; L788-I812 HydrophobicContact CB-CG2 4.21Å; L788-I812 HydrophobicContact CD2-CG2 4.26Å; L788-I812 PolarHBondContact N-O 3.19Å; L788-I814 HydrophobicContact CB-CG1 4.32Å; L788-I814 HydrophobicContact CB-CG2 4.01Å; L788-I814 HydrophobicContact CD2-CG2 3.76Å; L788-I814 HydrophobicContact CG-CG2 4.48Å; L788-V948 HydrophobicContact CD2-CG1 4.23Å; L788-V950 HydrophobicContact CD2-CG2 3.67Å; L788-V950 HydrophobicContact CG-CG2 4.4Å; L788-G974 CarbonylContact O-C 3.46Å; L788-L975 HydrophobicContact CD1-CB 4.05Å; L788-L975 PolarHBondContact O-N 2.99Å; L788-L975 VanDerWaalsContact O-N 3.15Å; L788-A976 HydrophobicContact CD1-CB 4.12Å; L788-A976 VanDerWaalsContact O-CB 3.22Å; L788-A976 WeakPolarHBondContact O-CB 3.45Å; L788-A976 PolarHBondContact O-N 3.31Å
789	V	90.2	Very high	77.2	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	133.2	169.9	-177.5	0	0	0	0	109.6	F773 I812 V950 L972 S973 A976	F773-V789 HydrophobicContact CE2-CG2 4.24Å; F773-V789 HydrophobicContact CZ-CG2 4.03Å; V789-I812 HydrophobicContact CB-CB 4.13Å; V789-I812 HydrophobicContact CB-CD1 4.1Å; V789-I812 HydrophobicContact CB-CG1 4.42Å; V789-I812 HydrophobicContact CG2-CD1 4.34Å; V789-I812 PolarHBondContact N-O 2.97Å; V789-I812 PolarHBondContact O-N 2.67Å; V789-V950 HydrophobicContact CG2-CG1 4.05Å; V789-L972 HydrophobicContact CG1-CD2 3.87Å; V789-S973 CarbonylContact C-O 3.56Å; V789-S973 WeakPolarHBondContact CA-O 3.39Å; V789-A976 HydrophobicContact CG2-CB 3.71Å
790	H	88.1	Confident	75.4	Confident	19 Å²	19	54.9 Å²	54.9	9%	0.088	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	129.8	162.9	-175.1	-131	0	0	0	109.6	M787 E809 V810 S973 F1021	M787-H790 HydrophobicContact CE-CB 3.75Å; H790-E809 IonicContact CD2-OE1 2.81Å; H790-E809 IonicContact CE1-OE1 4Å; H790-E809 IonicContact NE2-OE1 2.64Å; H790-E809 PolarHBondContact NE2-OE1 3.34Å; H790-V810 WeakPolarHBondContact CA-O 3.42Å; H790-V810 PolarHBondContact CD2-O 2.86Å; H790-S973 PolarHBondContact N-O 3.32Å; H790-S973 PolarHBondContact O-N 2.61Å; H790-F1021 AromaticContact CE1-CE1 3.75Å; H790-F1021 AromaticContact NE2-CE1 3.89Å
791	K	84.5	Confident	73.7	Confident	10 Å²	10	61.8 Å²	61.8	4%	0.043	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	114.5	164.3	179.1	70.6	-173.5	79.6	0	107.5	T794 E809 V810 Y956 D970 L972	K791-T794 VanDerWaalsContact NZ-CG2 3.32Å; K791-E809 CarbonylContact O-C 3.3Å; K791-E809 VanDerWaalsContact O-CA 3.27Å; K791-E809 WeakPolarHBondContact O-CA 3.3Å; K791-E809 VanDerWaalsContact O-CG 3.24Å; K791-E809 WeakPolarHBondContact O-CG 3.34Å; K791-V810 HydrophobicContact CB-CB 4.03Å; K791-V810 HydrophobicContact CB-CG2 4.46Å; K791-V810 PolarHBondContact N-O 2.81Å; K791-V810 PolarHBondContact O-N 2.8Å; K791-Y956 HydrophobicContact CD-CD1 3.94Å; K791-Y956 HydrophobicContact CD-CE1 3.84Å; K791-Y956 HydrophobicContact CG-CE1 4.02Å; K791-D970 WeakPolarHBondContact CE-O 3.41Å; K791-D970 PolarHBondContact NZ-O 2.64Å; K791-L972 HydrophobicContact CB-CD2 4.05Å; K791-L972 HydrophobicContact CD-CD2 4.03Å
792	P	80.7	Confident	72.2	Confident	33 Å²	33	66.4 Å²	66.4	21%	0.214	33%	0.331	C	S	.	.			trans	-68.6	146.6	172.9	25.8	-30.3	0	0	0	111.1	T794 S969 A971	P792-T794 PolarHBondContact O-N 2.84Å; P792-S969 WeakPolarHBondContact CG-O 3.3Å; P792-A971 VanDerWaalsContact CD-O 3.28Å; P792-A971 WeakPolarHBondContact CD-O 3.19Å
793	K	79.9	Confident	71	Confident	86 Å²	86	70 Å²	70	37%	0.374	34%	0.344	S	S	.	.			trans	-61.3	128.7	176.1	-168.1	165	-164.4	159	0	110.1	M806 L807 E809 E857	K793-M806 HydrophobicContact CG-SD 4.43Å; K793-L807 WeakPolarHBondContact CG-O 3.18Å; K793-E809 HydrophobicContact CB-CB 4.13Å; K793-E857 IonicContact NZ-OE1 3.17Å; K793-E857 PolarHBondContact NZ-OE1 2.85Å; K793-E857 IonicContact NZ-OE2 3.97Å; K793-E857 PolarHBondContact NZ-OE2 2.79Å
794	T	72.9	Confident	69.9	Low	28 Å²	28	71.3 Å²	71.3	17%	0.172	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-104.4	122.1	179.4	48.2	0	0	0	0	110.5	K791 P792 L807 D970	K791-T794 VanDerWaalsContact NZ-CG2 3.32Å; P792-T794 PolarHBondContact O-N 2.84Å; T794-L807 PolarHBondContact N-O 2.98Å; T794-D970 HydrophobicContact CG2-CB 4.33Å
795	E	67	Low	68.8	Low	160 Å²	160	74.7 Å²	74.7	75%	0.748	36%	0.359	S	S	*	.			trans	-62.3	150	171.4	-69	-165.5	154.4	0	0	111.4	Q797	E795-Q797 PolarHBondContact O-N 2.94Å; E795-Q797 VanDerWaalsContact O-N 3.14Å
796	P	62.8	Low	67.9	Low	51 Å²	51	77.1 Å²	77.1	33%	0.331	37%	0.369	S	S	.	.			trans	-76.4	108.7	-172	30.3	-29.9	0	0	0	109.9	Y803 M806	P796-Y803 HydrophobicContact CB-CE2 4.31Å; P796-M806 HydrophobicContact CB-CG 4.08Å; P796-M806 HydrophobicContact CG-CG 3.92Å
797	Q	60.6	Low	67.4	Low	98 Å²	98	77.9 Å²	77.9	46%	0.458	38%	0.375	S	S	.	.			trans	-105.4	144.3	177.4	-72.8	-174.5	-13.5	0	0	111.8	E795 R799 Q804	E795-Q797 PolarHBondContact O-N 2.94Å; E795-Q797 VanDerWaalsContact O-N 3.14Å; Q797-R799 PolarHBondContact O-N 2.93Å; Q797-Q804 PolarHBondContact O-N 3.09Å; Q797-Q804 VanDerWaalsContact O-N 3.11Å
798	W	51.6	Low	67.2	Low	180 Å²	180	77 Å²	77	68%	0.682	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	115	157.7	-74.9	96.3	0	0	0	108.6	D801 Y803	W798-D801 WeakPolarHBondContact CZ3-O 3.34Å; W798-Y803 HydrophobicContact CD2-CD2 4.15Å; W798-Y803 AromaticContact CE2-CD2 3.68Å; W798-Y803 AromaticContact CZ2-CD2 3.9Å; W798-Y803 HydrophobicContact CZ2-CD2 3.9Å; W798-Y803 HydrophobicContact CZ2-CG 4.4Å; W798-Y803 AromaticContact NE1-CD2 3.76Å
799	R	51.7	Low	67.1	Low	107 Å²	107	79.6 Å²	79.6	40%	0.404	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	109.5	-179.6	-155.1	175.9	-78.6	-168.1	1.9	107.8	Q797 I802 Q804 D970	Q797-R799 PolarHBondContact O-N 2.93Å; R799-I802 PolarHBondContact N-O 2.81Å; R799-I802 PolarHBondContact O-N 2.81Å; R799-Q804 HydrophobicContact CB-CG 4.5Å; R799-D970 IonicContact CZ-OD2 3.86Å; R799-D970 IonicContact NH1-OD2 3.65Å; R799-D970 IonicContact NH2-OD2 3.08Å; R799-D970 PolarHBondContact NH2-OD2 2.8Å; R799-D970 VanDerWaalsContact NH2-OD2 3.08Å
800	N	46.4	Very low	67.2	Low	117 Å²	117	79.6 Å²	79.6	63%	0.626	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	51.6	-173.5	-51.3	-19.4	0	0	0	113.8	I802	N800-I802 PolarHBondContact O-N 3.49Å
801	D	46.3	Very low	67.4	Low	153 Å²	153	80.1 Å²	80.1	82%	0.818	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	13.6	-178.8	-55.6	-30.5	0	0	0	115.8	W798	W798-D801 WeakPolarHBondContact CZ3-O 3.34Å
802	I	48.8	Very low	67.9	Low	117 Å²	117	79.6 Å²	79.6	60%	0.6	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.4	169.8	-61.1	169.8	0	0	0	108.2	R799 N800 Q804	R799-I802 PolarHBondContact N-O 2.81Å; R799-I802 PolarHBondContact O-N 2.81Å; N800-I802 PolarHBondContact O-N 3.49Å; I802-Q804 PolarHBondContact O-N 2.05Å
803	Y	52.5	Low	68.4	Low	124 Å²	124	78.2 Å²	78.2	49%	0.486	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	109.3	174.8	-175.2	-102.5	0	0	0	109.7	P796 W798	P796-Y803 HydrophobicContact CB-CE2 4.31Å; W798-Y803 HydrophobicContact CD2-CD2 4.15Å; W798-Y803 AromaticContact CE2-CD2 3.68Å; W798-Y803 AromaticContact CZ2-CD2 3.9Å; W798-Y803 HydrophobicContact CZ2-CD2 3.9Å; W798-Y803 HydrophobicContact CZ2-CG 4.4Å; W798-Y803 AromaticContact NE1-CD2 3.76Å
804	Q	55.6	Low	69	Low	93 Å²	93	74.1 Å²	74.1	44%	0.435	36%	0.356	S	S	.	.			trans	-82.2	123.9	175.3	-63.1	-167	-77.8	0	0	110.1	Q797 R799 I802	Q797-Q804 PolarHBondContact O-N 3.09Å; Q797-Q804 VanDerWaalsContact O-N 3.11Å; R799-Q804 HydrophobicContact CB-CG 4.5Å; I802-Q804 PolarHBondContact O-N 2.05Å
805	V	58.6	Low	69.9	Low	96 Å²	96	73.9 Å²	73.9	58%	0.582	35%	0.352	S	S	*	.			trans	-65	144.9	178.4	-175.3	0	0	0	0	110.1	L807	V805-L807 PolarHBondContact O-N 2.8Å
806	M	67.1	Low	70.9	Confident	89 Å²	89	66.4 Å²	66.4	44%	0.438	32%	0.317	S	S	.	.			trans	-54.6	110	168.5	-93.8	-100.7	-141.9	0	0	110.4	K793 P796	K793-M806 HydrophobicContact CG-SD 4.43Å; P796-M806 HydrophobicContact CB-CG 4.08Å; P796-M806 HydrophobicContact CG-CG 3.92Å
807	L	73.9	Confident	72.1	Confident	49 Å²	49	64.6 Å²	64.6	26%	0.257	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-85.2	133.2	165.1	-67.5	173.6	0	0	0	109	K793 T794 V805 Y956	K793-L807 WeakPolarHBondContact CG-O 3.18Å; T794-L807 PolarHBondContact N-O 2.98Å; V805-L807 PolarHBondContact O-N 2.8Å; L807-Y956 HydrophobicContact CD1-CE1 4.23Å
808	P	82.8	Confident	73.4	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.019	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-64.3	165.5	175.4	29.1	-36	0	0	0	111.6	E852 Q918	P808-E852 HydrophobicContact CB-CG 3.91Å; P808-E852 HydrophobicContact CG-CG 3.44Å; P808-E852 VanDerWaalsContact CG-CG 3.44Å; P808-Q918 HydrophobicContact CG-CB 3.99Å
809	E	87.4	Confident	75.1	Confident	58 Å²	58	53.4 Å²	53.4	27%	0.271	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-64.8	144.4	163.6	-162.4	177.5	166.3	0	0	109.3	H790 K791 K793 Q811 E852 G853	H790-E809 IonicContact CD2-OE1 2.81Å; H790-E809 IonicContact CE1-OE1 4Å; H790-E809 IonicContact NE2-OE1 2.64Å; H790-E809 PolarHBondContact NE2-OE1 3.34Å; K791-E809 CarbonylContact O-C 3.3Å; K791-E809 VanDerWaalsContact O-CA 3.27Å; K791-E809 WeakPolarHBondContact O-CA 3.3Å; K791-E809 VanDerWaalsContact O-CG 3.24Å; K791-E809 WeakPolarHBondContact O-CG 3.34Å; K793-E809 HydrophobicContact CB-CB 4.13Å; E809-Q811 HydrophobicContact CG-CG 4.43Å; E809-Q811 PolarHBondContact OE1-NE2 2.9Å; E809-E852 CarbonylContact O-C 3.58Å; E809-G853 PolarHBondContact O-N 2.79Å
810	V	92	Very high	76.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126.3	169.6	-178.4	0	0	0	0	109	H790 K791 I812 L916 I921	H790-V810 WeakPolarHBondContact CA-O 3.42Å; H790-V810 PolarHBondContact CD2-O 2.86Å; K791-V810 HydrophobicContact CB-CB 4.03Å; K791-V810 HydrophobicContact CB-CG2 4.46Å; K791-V810 PolarHBondContact N-O 2.81Å; K791-V810 PolarHBondContact O-N 2.8Å; V810-I812 HydrophobicContact CG1-CD1 4.38Å; V810-I812 HydrophobicContact CG1-CG1 4.19Å; V810-L916 HydrophobicContact CG1-CD1 3.61Å; V810-I921 HydrophobicContact CG1-CD1 4.32Å; V810-I921 HydrophobicContact CG2-CD1 4.38Å
811	Q	91.9	Very high	78.4	Confident	30 Å²	30	43.5 Å²	43.5	14%	0.14	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	114.8	175.9	-66.8	-174.6	8.7	0	0	109.3	M787 E809 V850 Q851 L1024	M787-Q811 HydrophobicContact CE-CB 4Å; M787-Q811 HydrophobicContact CE-CG 4Å; E809-Q811 HydrophobicContact CG-CG 4.43Å; E809-Q811 PolarHBondContact OE1-NE2 2.9Å; Q811-V850 WeakPolarHBondContact O-CA 3.27Å; Q811-Q851 PolarHBondContact N-O 2.91Å; Q811-Q851 PolarHBondContact O-N 3.11Å; Q811-L1024 HydrophobicContact CB-CD1 3.94Å
812	I	94.9	Very high	80	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	108.3	170.3	-60.2	171.6	0	0	0	107.2	L788 V789 V810 V848 V850 I921 L923 V950	L788-I812 HydrophobicContact CB-CG2 4.21Å; L788-I812 HydrophobicContact CD2-CG2 4.26Å; L788-I812 PolarHBondContact N-O 3.19Å; V789-I812 HydrophobicContact CB-CB 4.13Å; V789-I812 HydrophobicContact CB-CD1 4.1Å; V789-I812 HydrophobicContact CB-CG1 4.42Å; V789-I812 HydrophobicContact CG2-CD1 4.34Å; V789-I812 PolarHBondContact N-O 2.97Å; V789-I812 PolarHBondContact O-N 2.67Å; V810-I812 HydrophobicContact CG1-CD1 4.38Å; V810-I812 HydrophobicContact CG1-CG1 4.19Å; I812-V848 HydrophobicContact CG2-CG1 4.2Å; I812-V850 HydrophobicContact CG1-CG1 4.22Å; I812-V850 HydrophobicContact CG1-CG2 4.47Å; I812-V850 HydrophobicContact CG2-CG2 4.47Å; I812-I921 HydrophobicContact CD1-CG2 4.06Å; I812-L923 HydrophobicContact CD1-CD1 3.99Å; I812-L923 HydrophobicContact CD1-CD2 3.98Å; I812-L923 HydrophobicContact CD1-CG 4.16Å; I812-L923 HydrophobicContact CG1-CD2 4.31Å; I812-L923 HydrophobicContact CG2-CD2 3.77Å; I812-V950 HydrophobicContact CD1-CG1 3.76Å
813	Q	92.3	Very high	81.3	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.019	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	143.9	175.9	-70.8	178.6	10.9	0	0	110.5	T785 Y786 M787 V848 A849 H1022 L1024 F1025	T785-Q813 HydrophobicContact CG2-CB 4.19Å; T785-Q813 HydrophobicContact CG2-CG 4.44Å; Y786-Q813 CarbonylContact O-C 3.56Å; Y786-Q813 VanDerWaalsContact O-CA 3.3Å; Y786-Q813 WeakPolarHBondContact O-CA 3.43Å; M787-Q813 HydrophobicContact CE-CG 4.37Å; M787-Q813 HydrophobicContact SD-CG 3.38Å; M787-Q813 WeakPolarHBondContact SD-CG 3.27Å; Q813-V848 CarbonylContact O-C 3.47Å; Q813-V848 WeakPolarHBondContact O-CA 3.42Å; Q813-A849 PolarHBondContact N-O 2.73Å; Q813-A849 PolarHBondContact O-N 3.04Å; Q813-H1022 PolarHBondContact NE2-O 2.79Å; Q813-L1024 HydrophobicContact CG-CD1 4.31Å; Q813-L1024 HydrophobicContact CG-CG 4.46Å; Q813-F1025 HydrophobicContact CB-CE2 3.84Å
814	I	92.6	Very high	82.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	148.9	167.7	57.7	173.3	0	0	0	110.2	F770 T785 Y786 L788 M816 V845 G847 V848 L975	F770-I814 HydrophobicContact CE1-CD1 3.66Å; F770-I814 HydrophobicContact CZ-CD1 3.66Å; T785-I814 WeakPolarHBondContact CA-O 3.29Å; Y786-I814 PolarHBondContact N-O 3.46Å; Y786-I814 PolarHBondContact O-N 2.92Å; L788-I814 HydrophobicContact CB-CG1 4.32Å; L788-I814 HydrophobicContact CB-CG2 4.01Å; L788-I814 HydrophobicContact CD2-CG2 3.76Å; L788-I814 HydrophobicContact CG-CG2 4.48Å; I814-M816 HydrophobicContact CD1-CG 4.45Å; I814-M816 HydrophobicContact CD1-SD 4.31Å; I814-V845 HydrophobicContact CB-CG1 4.37Å; I814-V845 HydrophobicContact CD1-CG2 4.46Å; I814-G847 WeakPolarHBondContact CA-O 3.38Å; I814-V848 HydrophobicContact CG2-CG1 4.37Å; I814-V848 HydrophobicContact CG2-CG2 4.27Å; I814-L975 HydrophobicContact CD1-CD1 4.14Å
815	R	90.8	Very high	83	Confident	23 Å²	23	32.3 Å²	32.3	9%	0.087	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.7	169.9	-172	172	75.9	-165.5	12.7	109.2	E817 V845 T846 G847 F1025 I1041 G1042	R815-E817 HydrophobicContact CG-CG 4.26Å; R815-E817 IonicContact CZ-OE1 3.28Å; R815-E817 VanDerWaalsContact CZ-OE1 3.23Å; R815-E817 IonicContact NE-OE1 2.68Å; R815-E817 PolarHBondContact NE-OE1 3.21Å; R815-E817 IonicContact NH2-OE1 3.96Å; R815-E817 PolarHBondContact NH2-OE1 2.94Å; R815-V845 WeakPolarHBondContact O-CA 3.27Å; R815-T846 PolarHBondContact NE-OG1 2.91Å; R815-T846 PolarHBondContact O-N 3.21Å; R815-T846 PolarHBondContact O-OG1 2.93Å; R815-G847 PolarHBondContact N-O 2.83Å; R815-G847 PolarHBondContact O-N 2.8Å; R815-F1025 HydrophobicContact CB-CD1 4.47Å; R815-F1025 HydrophobicContact CB-CD2 4.44Å; R815-F1025 HydrophobicContact CB-CE1 4.01Å; R815-F1025 HydrophobicContact CB-CE2 3.96Å; R815-F1025 HydrophobicContact CB-CZ 3.73Å; R815-I1041 PolarHBondContact NH1-O 2.85Å; R815-G1042 PolarHBondContact NH1-O 2.93Å; R815-G1042 PolarHBondContact NH2-O 2.93Å
816	M	88.8	Confident	83.7	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	136.5	173.5	-60.7	-179.4	74.2	0	0	109.4	F770 I780 P783 G784 Y786 I814 V844 V845	F770-M816 HydrophobicContact CE2-CE 4.25Å; F770-M816 HydrophobicContact CE2-SD 4.28Å; F770-M816 HydrophobicContact CZ-CE 4.45Å; F770-M816 HydrophobicContact CZ-SD 3.98Å; I780-M816 HydrophobicContact CB-CE 4.39Å; I780-M816 HydrophobicContact CG2-CE 4.39Å; I780-M816 HydrophobicContact CG2-SD 4.27Å; P783-M816 CarbonylContact C-O 3.56Å; P783-M816 VanDerWaalsContact CA-O 3.26Å; P783-M816 WeakPolarHBondContact CA-O 3.21Å; G784-M816 PolarHBondContact N-O 2.9Å; G784-M816 PolarHBondContact O-N 3.36Å; Y786-M816 HydrophobicContact CD2-CG 4.26Å; Y786-M816 HydrophobicContact CD2-SD 3.96Å; Y786-M816 HydrophobicContact CE2-CB 4.33Å; Y786-M816 HydrophobicContact CE2-CG 4.4Å; Y786-M816 HydrophobicContact CE2-SD 4.03Å; I814-M816 HydrophobicContact CD1-CG 4.45Å; I814-M816 HydrophobicContact CD1-SD 4.31Å; M816-V844 VanDerWaalsContact CA-O 3.23Å; M816-V844 WeakPolarHBondContact CA-O 3.43Å; M816-V845 HydrophobicContact CG-CG2 4.14Å
817	E	88.7	Confident	83.6	Confident	13 Å²	13	31.4 Å²	31.4	6%	0.061	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	155.8	-179.9	-61.2	176.9	-126.4	0	0	109.8	R815 S843 V844 T846 P1043 V1044 Y1045	R815-E817 HydrophobicContact CG-CG 4.26Å; R815-E817 IonicContact CZ-OE1 3.28Å; R815-E817 VanDerWaalsContact CZ-OE1 3.23Å; R815-E817 IonicContact NE-OE1 2.68Å; R815-E817 PolarHBondContact NE-OE1 3.21Å; R815-E817 IonicContact NH2-OE1 3.96Å; R815-E817 PolarHBondContact NH2-OE1 2.94Å; E817-S843 CarbonylContact O-C 3.55Å; E817-S843 VanDerWaalsContact O-CA 3.26Å; E817-S843 WeakPolarHBondContact O-CA 3.37Å; E817-V844 PolarHBondContact N-O 2.85Å; E817-V844 PolarHBondContact O-N 2.87Å; E817-T846 HydrophobicContact CB-CG2 3.78Å; E817-T846 VanDerWaalsContact CD-OG1 3.28Å; E817-T846 HydrophobicContact CG-CG2 4Å; E817-T846 WeakPolarHBondContact CG-OG1 3.38Å; E817-T846 WeakPolarHBondContact OE1-CB 3.49Å; E817-T846 PolarHBondContact OE1-OG1 2.86Å; E817-P1043 VanDerWaalsContact OE2-CA 3.31Å; E817-P1043 WeakPolarHBondContact OE2-CA 3.49Å; E817-P1043 WeakPolarHBondContact OE2-CB 3.46Å; E817-V1044 PolarHBondContact OE1-N 3.22Å; E817-V1044 VanDerWaalsContact OE1-N 3.12Å; E817-V1044 PolarHBondContact OE2-N 3.27Å; E817-Y1045 PolarHBondContact OE2-N 3.49Å
818	N	87.2	Confident	83.3	Confident	38 Å²	38	34 Å²	34	20%	0.203	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	139.2	-177.2	-77.4	8.9	0	0	0	111.8	P783 P820 P839 V842 Y1045	P783-N818 WeakPolarHBondContact CB-OD1 3.46Å; P783-N818 VanDerWaalsContact CD-OD1 3.23Å; P783-N818 WeakPolarHBondContact CD-OD1 3.33Å; P783-N818 WeakPolarHBondContact CG-OD1 3.36Å; N818-P820 WeakPolarHBondContact O-CD 3.46Å; N818-P839 HydrophobicContact CB-CB 3.9Å; N818-V842 CarbonylContact C-O 3.58Å; N818-V842 VanDerWaalsContact CA-O 3.3Å; N818-V842 WeakPolarHBondContact CA-O 3.49Å; N818-Y1045 WeakPolarHBondContact O-CB 3.18Å
819	Y	87.7	Confident	82.3	Confident	6 Å²	6	44.4 Å²	44.4	2%	0.024	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	117	179.6	173.9	-18.3	0	0	0	112.1	R822 L840 V842 V844 L943 G944 Y1045 L1113	Y819-R822 HydrophobicContact CE1-CG 3.64Å; Y819-R822 WeakPolarHBondContact OH-CG 3.34Å; Y819-R822 PolarHBondContact OH-NE 2.83Å; Y819-R822 VanDerWaalsContact OH-NE 3.17Å; Y819-L840 WeakPolarHBondContact O-CB 3.39Å; Y819-L840 PolarHBondContact O-N 2.83Å; Y819-V842 PolarHBondContact N-O 3.5Å; Y819-V844 HydrophobicContact CD2-CG1 4.23Å; Y819-V844 HydrophobicContact CD2-CG2 3.71Å; Y819-V844 HydrophobicContact CG-CG1 4.3Å; Y819-V844 HydrophobicContact CG-CG2 4.22Å; Y819-L943 WeakPolarHBondContact CE2-O 3.19Å; Y819-L943 PolarHBondContact OH-O 3.28Å; Y819-G944 WeakPolarHBondContact CE2-O 3.09Å; Y819-Y1045 HydrophobicContact CD2-CD2 4.05Å; Y819-Y1045 AromaticContact CD2-CE2 3.61Å; Y819-Y1045 HydrophobicContact CD2-CE2 3.61Å; Y819-Y1045 HydrophobicContact CE2-CE2 4.05Å; Y819-L1113 HydrophobicContact CD1-CD2 3.46Å; Y819-L1113 VanDerWaalsContact CD1-CD2 3.46Å; Y819-L1113 HydrophobicContact CE1-CD2 3.91Å; Y819-L1113 HydrophobicContact CG-CD2 4.01Å
820	P	85.4	Confident	81.3	Confident	9 Å²	9	47 Å²	47	6%	0.058	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	145.6	167.9	26.1	-37.3	0	0	0	111.7	N818 R822 Q838 Y1045	N818-P820 WeakPolarHBondContact O-CD 3.46Å; P820-R822 PolarHBondContact O-N 3.01Å; P820-Q838 CarbonylContact C-O 3.57Å; P820-Q838 WeakPolarHBondContact CA-O 3.35Å; P820-Y1045 HydrophobicContact CG-CD1 3.54Å; P820-Y1045 HydrophobicContact CG-CE1 3.74Å; P820-Y1045 HydrophobicContact CG-CG 4.06Å
821	D	81.4	Confident	80.3	Confident	7 Å²	7	48.5 Å²	48.5	4%	0.037	25%	0.249	C	C	.	.			trans	-72.7	94.7	179.4	-165.4	-27.1	0	0	0	111.8	T823 V824 Q838 L840 K1114	D821-T823 PolarHBondContact O-N 3.1Å; D821-T823 VanDerWaalsContact O-N 3.08Å; D821-T823 WeakPolarHBondContact OD1-CB 3.29Å; D821-T823 PolarHBondContact OD1-N 3.44Å; D821-T823 PolarHBondContact OD1-OG1 2.87Å; D821-V824 PolarHBondContact O-N 3.06Å; D821-Q838 PolarHBondContact N-O 3.03Å; D821-L840 HydrophobicContact CB-CD1 4.48Å; D821-L840 HydrophobicContact CB-CD2 3.96Å; D821-L840 HydrophobicContact CB-CG 3.94Å; D821-L840 WeakPolarHBondContact OD2-CD2 3.36Å; D821-K1114 IonicContact OD1-NZ 2.7Å; D821-K1114 IonicContact OD2-NZ 3.16Å; D821-K1114 PolarHBondContact OD2-NZ 3.43Å
822	R	79.9	Confident	79.6	Confident	42 Å²	42	54.3 Å²	54.3	16%	0.158	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	1.6	178.7	-60.5	-62.6	-172.9	-176.5	-4.4	114.9	Y819 P820 V824 D868 Y1045	Y819-R822 HydrophobicContact CE1-CG 3.64Å; Y819-R822 WeakPolarHBondContact OH-CG 3.34Å; Y819-R822 PolarHBondContact OH-NE 2.83Å; Y819-R822 VanDerWaalsContact OH-NE 3.17Å; P820-R822 PolarHBondContact O-N 3.01Å; R822-V824 VanDerWaalsContact C-N 3.31Å; R822-D868 IonicContact CZ-OD1 3.84Å; R822-D868 IonicContact CZ-OD2 2.75Å; R822-D868 VanDerWaalsContact CZ-OD2 3.22Å; R822-D868 IonicContact NH1-OD2 2.87Å; R822-D868 PolarHBondContact NH1-OD2 2.67Å; R822-D868 IonicContact NH2-OD1 2.89Å; R822-D868 PolarHBondContact NH2-OD1 3.37Å; R822-D868 IonicContact NH2-OD2 3.02Å; R822-D868 PolarHBondContact NH2-OD2 3.47Å; R822-Y1045 PolarHBondContact NH2-OH 2.85Å
823	T	75.1	Confident	78.8	Confident	84 Å²	84	56.6 Å²	56.6	52%	0.515	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-5.8	171.8	69.2	0	0	0	0	113.5	D821 K1114	D821-T823 PolarHBondContact O-N 3.1Å; D821-T823 VanDerWaalsContact O-N 3.08Å; D821-T823 WeakPolarHBondContact OD1-CB 3.29Å; D821-T823 PolarHBondContact OD1-N 3.44Å; D821-T823 PolarHBondContact OD1-OG1 2.87Å; T823-K1114 HydrophobicContact CG2-CB 3.97Å; T823-K1114 HydrophobicContact CG2-CD 3.88Å
824	V	74.1	Confident	78.2	Confident	32 Å²	32	58 Å²	58	19%	0.194	29%	0.288	C	S	.	.	S	Bend	trans	-76.1	134	172.2	-178.8	0	0	0	0	110.1	D821 R822 F826 T831 R835 L836	D821-V824 PolarHBondContact O-N 3.06Å; R822-V824 VanDerWaalsContact C-N 3.31Å; V824-F826 WeakPolarHBondContact O-CD2 3.5Å; V824-F826 PolarHBondContact O-N 2.82Å; V824-T831 HydrophobicContact CG1-CG2 3.83Å; V824-R835 HydrophobicContact CG1-CB 4.38Å; V824-L836 HydrophobicContact CG1-CD2 4.08Å
825	D	71.6	Confident	77.6	Confident	94 Å²	94	63.8 Å²	63.8	50%	0.503	31%	0.31	S	S	.	.			trans	-71.7	113.9	175.5	-177.3	-0.4	0	0	0	111.4	G827 H828 T831	D825-G827 WeakPolarHBondContact OD1-CA 3.35Å; D825-G827 PolarHBondContact OD1-N 2.76Å; D825-H828 HydrophobicContact CB-CB 4.4Å; D825-H828 PolarHBondContact OD1-N 3.31Å; D825-T831 PolarHBondContact O-OG1 3.33Å
826	F	71.6	Confident	77.1	Confident	100 Å²	100	64.1 Å²	64.1	44%	0.439	31%	0.313	S	S	.	.	S	Bend	trans	-76.1	-22	177.1	-76.5	-106.2	0	0	0	113	V824 L836	V824-F826 WeakPolarHBondContact O-CD2 3.5Å; V824-F826 PolarHBondContact O-N 2.82Å; F826-L836 HydrophobicContact CB-CD2 4.49Å; F826-L836 HydrophobicContact CD1-CD1 4.33Å; F826-L836 HydrophobicContact CD1-CD2 3.76Å; F826-L836 HydrophobicContact CD2-CD2 4.25Å; F826-L836 HydrophobicContact CE1-CB 4.25Å; F826-L836 HydrophobicContact CE1-CD2 3.94Å; F826-L836 HydrophobicContact CE1-CG 4.46Å; F826-L836 HydrophobicContact CE2-CD2 4.39Å; F826-L836 HydrophobicContact CG-CD2 3.91Å; F826-L836 HydrophobicContact CZ-CD2 4.23Å
827	G	65.7	Low	76.8	Confident	65 Å²	65	65 Å²	65	67%	0.67	32%	0.318	S	S	*	.	S	Bend	trans	-86.8	-18.8	-177.2	0	0	0	0	0	114.6	D825 R829	D825-G827 WeakPolarHBondContact OD1-CA 3.35Å; D825-G827 PolarHBondContact OD1-N 2.76Å; G827-R829 PolarHBondContact O-N 2.89Å
828	H	68.5	Low	76.5	Confident	103 Å²	103	67.3 Å²	67.3	48%	0.477	33%	0.329	S	S	.	.			trans	-71.5	123	-177.5	-154.7	-53.5	0	0	0	111.9	D825 D830 T831	D825-H828 HydrophobicContact CB-CB 4.4Å; D825-H828 PolarHBondContact OD1-N 3.31Å; H828-D830 IonicContact CE1-OD2 3.79Å; H828-D830 PolarHBondContact CE1-OD2 3.03Å; H828-D830 VanDerWaalsContact CE1-OD2 3.22Å; H828-D830 IonicContact ND1-OD2 3.76Å; H828-D830 PolarHBondContact ND1-OD2 2.85Å; H828-D830 PolarHBondContact O-N 2.9Å; H828-T831 WeakPolarHBondContact O-CB 3.33Å; H828-T831 PolarHBondContact O-N 3.21Å; H828-T831 PolarHBondContact O-OG1 2.87Å
829	R	60.4	Low	76.4	Confident	223 Å²	223	67 Å²	67	84%	0.842	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.5	-174.3	-70.4	-177.5	170.6	-168.3	-5.4	116.1	G827	G827-R829 PolarHBondContact O-N 2.89Å
830	D	67.1	Low	76.1	Confident	112 Å²	112	67.3 Å²	67.3	60%	0.599	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	3	-176.5	-52.6	-66.3	0	0	0	112.4	H828 Y832	H828-D830 IonicContact CE1-OD2 3.79Å; H828-D830 PolarHBondContact CE1-OD2 3.03Å; H828-D830 VanDerWaalsContact CE1-OD2 3.22Å; H828-D830 IonicContact ND1-OD2 3.76Å; H828-D830 PolarHBondContact ND1-OD2 2.85Å; H828-D830 PolarHBondContact O-N 2.9Å; D830-Y832 PolarHBondContact O-N 3.14Å
831	T	71.1	Confident	75.7	Confident	31 Å²	31	72 Å²	72	19%	0.19	36%	0.356	C	S	.	.			trans	-73	96.2	176.4	-62.4	0	0	0	0	110.2	V824 D825 H828 R835 L836	V824-T831 HydrophobicContact CG1-CG2 3.83Å; D825-T831 PolarHBondContact O-OG1 3.33Å; H828-T831 WeakPolarHBondContact O-CB 3.33Å; H828-T831 PolarHBondContact O-N 3.21Å; H828-T831 PolarHBondContact O-OG1 2.87Å; T831-R835 HydrophobicContact CG2-CB 4.15Å; T831-L836 HydrophobicContact CG2-CD2 3.47Å; T831-L836 VanDerWaalsContact CG2-CD2 3.47Å; T831-L836 HydrophobicContact CG2-CG 3.89Å
832	Y	76.8	Confident	75.9	Confident	152 Å²	152	71.7 Å²	71.7	60%	0.596	35%	0.354	S	S	*	.			trans	-53.6	137.7	171.7	-60.3	-80.9	0	0	0	112.1	D830 H834 R835	D830-Y832 PolarHBondContact O-N 3.14Å; Y832-H834 AromaticContact CG-CE1 3.98Å; Y832-H834 PolarHBondContact O-N 3.21Å; Y832-R835 WeakPolarHBondContact O-CB 3.15Å; Y832-R835 PolarHBondContact O-N 2.98Å
833	Q	78.5	Confident	76.2	Confident	49 Å²	49	69.7 Å²	69.7	23%	0.229	35%	0.347	C	S	.	.	H	α-helix	trans	-44.8	-45.1	-178.6	-170.9	67.6	28.8	0	0	113.6	P120 N293 R835 L836	P120-Q833 HydrophobicContact CB-CB 4.13Å; P120-Q833 HydrophobicContact CB-CG 4.38Å; N293-Q833 PolarHBondContact OD1-NE2 2.89Å; Q833-R835 PolarHBondContact O-N 3.41Å; Q833-L836 WeakPolarHBondContact O-CB 3.4Å; Q833-L836 PolarHBondContact O-N 3.46Å
834	H	78.6	Confident	77	Confident	32 Å²	32	65.7 Å²	65.7	15%	0.148	32%	0.322	C	S	.	.	H	α-helix	trans	-61.3	-14.2	-178.7	71.4	-109.3	0	0	0	115	Y832 A1048 R1050 W1051	Y832-H834 AromaticContact CG-CE1 3.98Å; Y832-H834 PolarHBondContact O-N 3.21Å; H834-A1048 HydrophobicContact CB-CB 4.04Å; H834-R1050 PolarHBondContact NE2-NH1 2.94Å; H834-R1050 VanDerWaalsContact NE2-NH1 3.14Å; H834-W1051 PolarHBondContact O-NE1 2.8Å
835	R	81.5	Confident	78	Confident	123 Å²	123	64.2 Å²	64.2	46%	0.464	31%	0.313	S	S	.	.	H	α-helix	trans	-84.5	-37.1	173.9	-64.5	-174.5	175.4	-170.6	-1.4	112.3	V824 T831 Y832 Q833 V837 Q838	V824-R835 HydrophobicContact CG1-CB 4.38Å; T831-R835 HydrophobicContact CG2-CB 4.15Å; Y832-R835 WeakPolarHBondContact O-CB 3.15Å; Y832-R835 PolarHBondContact O-N 2.98Å; Q833-R835 PolarHBondContact O-N 3.41Å; R835-V837 PolarHBondContact O-N 3.4Å; R835-Q838 VanDerWaalsContact O-CB 3.31Å; R835-Q838 WeakPolarHBondContact O-CB 3.28Å; R835-Q838 PolarHBondContact O-N 2.77Å; R835-Q838 VanDerWaalsContact O-N 3.08Å
836	L	79.9	Confident	79	Confident	30 Å²	30	59.8 Å²	59.8	16%	0.157	29%	0.289	C	S	.	.	H	α-helix	trans	-63.1	-23	176.3	-57	178	0	0	0	112.4	V824 F826 T831 Q833	V824-L836 HydrophobicContact CG1-CD2 4.08Å; F826-L836 HydrophobicContact CB-CD2 4.49Å; F826-L836 HydrophobicContact CD1-CD1 4.33Å; F826-L836 HydrophobicContact CD1-CD2 3.76Å; F826-L836 HydrophobicContact CD2-CD2 4.25Å; F826-L836 HydrophobicContact CE1-CB 4.25Å; F826-L836 HydrophobicContact CE1-CD2 3.94Å; F826-L836 HydrophobicContact CE1-CG 4.46Å; F826-L836 HydrophobicContact CE2-CD2 4.39Å; F826-L836 HydrophobicContact CG-CD2 3.91Å; F826-L836 HydrophobicContact CZ-CD2 4.23Å; T831-L836 HydrophobicContact CG2-CD2 3.47Å; T831-L836 VanDerWaalsContact CG2-CD2 3.47Å; T831-L836 HydrophobicContact CG2-CG 3.89Å; Q833-L836 WeakPolarHBondContact O-CB 3.4Å; Q833-L836 PolarHBondContact O-N 3.46Å
837	V	81.8	Confident	80.1	Confident	19 Å²	19	55 Å²	55	12%	0.115	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	25.8	176.9	-62.6	0	0	0	0	112.8	P117 R835 P839 P1046 A1048	P117-V837 HydrophobicContact CB-CG1 4.25Å; P117-V837 HydrophobicContact CB-CG2 3.97Å; P117-V837 HydrophobicContact CG-CB 4.4Å; P117-V837 HydrophobicContact CG-CG1 4.48Å; P117-V837 HydrophobicContact CG-CG2 3.84Å; R835-V837 PolarHBondContact O-N 3.4Å; V837-P839 WeakPolarHBondContact O-CD 3.38Å; V837-P1046 WeakPolarHBondContact CB-O 3.25Å; V837-P1046 HydrophobicContact CG1-CG 4.27Å; V837-A1048 HydrophobicContact CG2-CB 3.94Å
838	Q	82.8	Confident	81.6	Confident	62 Å²	62	51.9 Å²	51.9	29%	0.29	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-69.2	122.4	169.1	-179.8	174.7	-26.8	0	0	109.2	P820 D821 R835 W1051	P820-Q838 CarbonylContact C-O 3.57Å; P820-Q838 WeakPolarHBondContact CA-O 3.35Å; D821-Q838 PolarHBondContact N-O 3.03Å; R835-Q838 VanDerWaalsContact O-CB 3.31Å; R835-Q838 WeakPolarHBondContact O-CB 3.28Å; R835-Q838 PolarHBondContact O-N 2.77Å; R835-Q838 VanDerWaalsContact O-N 3.08Å; Q838-W1051 HydrophobicContact CB-CZ2 3.94Å; Q838-W1051 HydrophobicContact CG-CD2 4.24Å; Q838-W1051 HydrophobicContact CG-CH2 4.14Å; Q838-W1051 HydrophobicContact CG-CZ2 3.8Å
839	P	84.9	Confident	82.9	Confident	32 Å²	32	47 Å²	47	21%	0.208	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	141	-179	32.8	-34.9	0	0	0	111.6	N818 V837 V1047 W1051	N818-P839 HydrophobicContact CB-CB 3.9Å; V837-P839 WeakPolarHBondContact O-CD 3.38Å; P839-V1047 HydrophobicContact CB-CG1 4.4Å; P839-V1047 HydrophobicContact CB-CG2 4.1Å; P839-V1047 HydrophobicContact CG-CG1 3.78Å; P839-V1047 HydrophobicContact CG-CG2 4.38Å; P839-W1051 HydrophobicContact CG-CB 4.06Å
840	L	80.9	Confident	84.6	Confident	12 Å²	12	36.4 Å²	36.4	6%	0.063	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	160.2	160.7	-68.3	170.7	0	0	0	110.4	Y819 D821 V842 K1114	Y819-L840 WeakPolarHBondContact O-CB 3.39Å; Y819-L840 PolarHBondContact O-N 2.83Å; D821-L840 HydrophobicContact CB-CD1 4.48Å; D821-L840 HydrophobicContact CB-CD2 3.96Å; D821-L840 HydrophobicContact CB-CG 3.94Å; D821-L840 WeakPolarHBondContact OD2-CD2 3.36Å; L840-V842 HydrophobicContact CB-CG1 3.66Å; L840-V842 HydrophobicContact CD1-CG1 4.37Å; L840-V842 PolarHBondContact O-N 2.76Å; L840-K1114 HydrophobicContact CD2-CD 3.92Å; L840-K1114 VanDerWaalsContact CD2-CE 3.49Å; L840-K1114 HydrophobicContact CD2-CG 4.34Å
841	N	78.4	Confident	85.9	Confident	109 Å²	109	32.6 Å²	32.6	58%	0.583	15%	0.152	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79	57.5	172.7	-74.8	-15.9	0	0	0	110.9	N781	N781-N841 PolarHBondContact ND2-O 3.07Å; N781-N841 PolarHBondContact OD1-O 3.48Å
842	V	84.3	Confident	86.9	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	144.2	-176.8	70.7	0	0	0	0	109.9	A767 N781 N818 Y819 L840 Y1108 L1113	A767-V842 HydrophobicContact CB-CG2 3.46Å; A767-V842 VanDerWaalsContact CB-CG2 3.46Å; N781-V842 WeakPolarHBondContact OD1-CA 3.46Å; N781-V842 PolarHBondContact OD1-N 2.93Å; N818-V842 CarbonylContact C-O 3.58Å; N818-V842 VanDerWaalsContact CA-O 3.3Å; N818-V842 WeakPolarHBondContact CA-O 3.49Å; Y819-V842 PolarHBondContact N-O 3.5Å; L840-V842 HydrophobicContact CB-CG1 3.66Å; L840-V842 HydrophobicContact CD1-CG1 4.37Å; L840-V842 PolarHBondContact O-N 2.76Å; V842-Y1108 HydrophobicContact CG2-CE1 4.45Å; V842-L1113 HydrophobicContact CB-CD2 4.45Å; V842-L1113 HydrophobicContact CG1-CD2 3.43Å; V842-L1113 VanDerWaalsContact CG1-CD2 3.43Å; V842-L1113 HydrophobicContact CG1-CG 4.08Å; V842-L1113 HydrophobicContact CG2-CD2 4.19Å; V842-L1113 HydrophobicContact CG2-CG 4.19Å
843	S	87.3	Confident	87.5	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	127.3	-179.2	57.8	0	0	0	0	112.2	A767 I780 N781 K782 E817	A767-S843 CarbonylContact C-O 3.56Å; I780-S843 PolarHBondContact O-OG 3.45Å; N781-S843 WeakPolarHBondContact CA-OG 3.41Å; K782-S843 PolarHBondContact N-OG 2.84Å; K782-S843 PolarHBondContact O-OG 3.31Å; E817-S843 CarbonylContact O-C 3.55Å; E817-S843 VanDerWaalsContact O-CA 3.26Å; E817-S843 WeakPolarHBondContact O-CA 3.37Å
844	V	91.6	Very high	87.8	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	158.2	176.7	-58.4	0	0	0	0	110.9	M816 E817 Y819 T846 L945 L1113	M816-V844 VanDerWaalsContact CA-O 3.23Å; M816-V844 WeakPolarHBondContact CA-O 3.43Å; E817-V844 PolarHBondContact N-O 2.85Å; E817-V844 PolarHBondContact O-N 2.87Å; Y819-V844 HydrophobicContact CD2-CG1 4.23Å; Y819-V844 HydrophobicContact CD2-CG2 3.71Å; Y819-V844 HydrophobicContact CG-CG1 4.3Å; Y819-V844 HydrophobicContact CG-CG2 4.22Å; V844-T846 HydrophobicContact CG2-CG2 4.14Å; V844-L945 HydrophobicContact CB-CB 3.86Å; V844-L945 HydrophobicContact CG1-CB 4.1Å; V844-L945 HydrophobicContact CG2-CB 4.14Å; V844-L1113 HydrophobicContact CG1-CD2 4.24Å
845	V	94	Very high	87.9	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.006	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	124.8	171.3	-176.9	0	0	0	0	109.6	V764 I814 R815 M816 L946 V948	V764-V845 HydrophobicContact CG1-CG2 3.97Å; V764-V845 HydrophobicContact CG2-CG2 3.74Å; I814-V845 HydrophobicContact CB-CG1 4.37Å; I814-V845 HydrophobicContact CD1-CG2 4.46Å; R815-V845 WeakPolarHBondContact O-CA 3.27Å; M816-V845 HydrophobicContact CG-CG2 4.14Å; V845-L946 HydrophobicContact CB-CB 4.37Å; V845-L946 HydrophobicContact CG1-CB 4.19Å; V845-L946 PolarHBondContact O-N 3.44Å; V845-V948 HydrophobicContact CG1-CG2 4.21Å
846	T	93.8	Very high	87.7	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	-10.7	179.3	60.1	0	0	0	0	113.5	R815 E817 V844 L865 V1044 Y1045	R815-T846 PolarHBondContact NE-OG1 2.91Å; R815-T846 PolarHBondContact O-N 3.21Å; R815-T846 PolarHBondContact O-OG1 2.93Å; E817-T846 HydrophobicContact CB-CG2 3.78Å; E817-T846 VanDerWaalsContact CD-OG1 3.28Å; E817-T846 HydrophobicContact CG-CG2 4Å; E817-T846 WeakPolarHBondContact CG-OG1 3.38Å; E817-T846 WeakPolarHBondContact OE1-CB 3.49Å; E817-T846 PolarHBondContact OE1-OG1 2.86Å; V844-T846 HydrophobicContact CG2-CG2 4.14Å; T846-L865 VanDerWaalsContact O-CB 3.29Å; T846-L865 WeakPolarHBondContact O-CB 3.18Å; T846-L865 PolarHBondContact O-N 3Å; T846-V1044 HydrophobicContact CG2-CB 4.28Å; T846-V1044 HydrophobicContact CG2-CG2 4.46Å; T846-Y1045 HydrophobicContact CG2-CD2 3.84Å; T846-Y1045 HydrophobicContact CG2-CE2 4.23Å
847	G	95.3	Very high	87.8	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	155.6	176.9	0	0	0	0	0	113.9	I814 R815 V863	I814-G847 WeakPolarHBondContact CA-O 3.38Å; R815-G847 PolarHBondContact N-O 2.83Å; R815-G847 PolarHBondContact O-N 2.8Å; G847-V863 CarbonylContact C-O 3.51Å; G847-V863 VanDerWaalsContact CA-O 3.29Å; G847-V863 WeakPolarHBondContact CA-O 3.45Å
848	V	97.1	Very high	88.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.4	174.4	-169.3	0	0	0	0	108.2	I812 Q813 I814 V850 L862 V863 L923 I925 V948	I812-V848 HydrophobicContact CG2-CG1 4.2Å; Q813-V848 CarbonylContact O-C 3.47Å; Q813-V848 WeakPolarHBondContact O-CA 3.42Å; I814-V848 HydrophobicContact CG2-CG1 4.37Å; I814-V848 HydrophobicContact CG2-CG2 4.27Å; V848-V850 HydrophobicContact CG1-CG2 4.11Å; V848-L862 CarbonylContact O-C 3.59Å; V848-L862 WeakPolarHBondContact O-CA 3.4Å; V848-V863 PolarHBondContact N-O 2.76Å; V848-V863 PolarHBondContact O-N 3.09Å; V848-L923 HydrophobicContact CG1-CD2 4.15Å; V848-I925 HydrophobicContact CB-CD1 3.79Å; V848-I925 HydrophobicContact CB-CG1 4.41Å; V848-I925 HydrophobicContact CG1-CD1 4.01Å; V848-I925 HydrophobicContact CG2-CD1 3.95Å; V848-I925 HydrophobicContact CG2-CG1 4.02Å; V848-I925 HydrophobicContact CG2-CG2 4.13Å; V848-V948 HydrophobicContact CG2-CG1 4.26Å; V848-V948 HydrophobicContact CG2-CG2 3.54Å
849	A	95.8	Very high	88.7	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.5	175.2	0	0	0	0	0	109.9	Q813 V861 L862 L1024 F1025	Q813-A849 PolarHBondContact N-O 2.73Å; Q813-A849 PolarHBondContact O-N 3.04Å; A849-V861 CarbonylContact C-O 3.26Å; A849-V861 WeakPolarHBondContact CA-O 3.37Å; A849-L862 HydrophobicContact CB-CG 4.01Å; A849-L1024 HydrophobicContact CB-CB 3.52Å; A849-L1024 HydrophobicContact CB-CD1 4.38Å; A849-F1025 HydrophobicContact CB-CD1 4.14Å; A849-F1025 HydrophobicContact CB-CD2 4.12Å; A849-F1025 HydrophobicContact CB-CE1 3.78Å; A849-F1025 HydrophobicContact CB-CE2 3.77Å; A849-F1025 HydrophobicContact CB-CG 4.3Å; A849-F1025 HydrophobicContact CB-CZ 3.6Å
850	V	96.3	Very high	89.1	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.006	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	134.9	-168.2	-175	0	0	0	0	110	Q811 I812 V848 V861 I914 L916 L923	Q811-V850 WeakPolarHBondContact O-CA 3.27Å; I812-V850 HydrophobicContact CG1-CG1 4.22Å; I812-V850 HydrophobicContact CG1-CG2 4.47Å; I812-V850 HydrophobicContact CG2-CG2 4.47Å; V848-V850 HydrophobicContact CG1-CG2 4.11Å; V850-V861 PolarHBondContact N-O 3.27Å; V850-V861 PolarHBondContact O-N 2.94Å; V850-I914 HydrophobicContact CG2-CD1 3.97Å; V850-L916 HydrophobicContact CG1-CD1 3.84Å; V850-L916 HydrophobicContact CG1-CD2 3.61Å; V850-L916 HydrophobicContact CG1-CG 4.13Å; V850-L923 HydrophobicContact CG1-CD1 4.27Å; V850-L923 HydrophobicContact CG2-CD1 4.3Å; V850-L923 HydrophobicContact CG2-CD2 3.65Å
851	Q	93.3	Very high	89.9	Confident	31 Å²	31	22 Å²	22	15%	0.145	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	136.2	170.3	-162.6	176.7	-57.3	0	0	111.4	Q811 G853 R860 L1024	Q811-Q851 PolarHBondContact N-O 2.91Å; Q811-Q851 PolarHBondContact O-N 3.11Å; Q851-G853 PolarHBondContact NE2-O 2.89Å; Q851-R860 HydrophobicContact CB-CG 4.31Å; Q851-R860 HydrophobicContact CG-CB 4.35Å; Q851-R860 HydrophobicContact CG-CG 4.49Å; Q851-L1024 HydrophobicContact CB-CD1 4.12Å; Q851-L1024 HydrophobicContact CB-CD2 4.3Å
852	E	92.6	Very high	90.8	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	113.1	170.3	176.4	166.2	-94.8	0	0	109.9	P808 E809 S858 L916 E917 Q918 S919	P808-E852 HydrophobicContact CB-CG 3.91Å; P808-E852 HydrophobicContact CG-CG 3.44Å; P808-E852 VanDerWaalsContact CG-CG 3.44Å; E809-E852 CarbonylContact O-C 3.58Å; E852-S858 WeakPolarHBondContact O-CB 3.39Å; E852-S858 PolarHBondContact O-N 2.93Å; E852-L916 HydrophobicContact CB-CB 4.46Å; E852-L916 HydrophobicContact CB-CD1 4.43Å; E852-L916 HydrophobicContact CB-CD2 3.98Å; E852-L916 WeakPolarHBondContact OE1-CB 3.04Å; E852-E917 PolarHBondContact OE2-N 2.81Å; E852-Q918 VanDerWaalsContact OE2-CB 3.27Å; E852-Q918 WeakPolarHBondContact OE2-CB 3.48Å; E852-Q918 WeakPolarHBondContact OE2-CG 3.46Å; E852-Q918 PolarHBondContact OE2-N 2.96Å; E852-S919 WeakPolarHBondContact OE1-CB 3.33Å; E852-S919 PolarHBondContact OE1-N 3.41Å; E852-S919 PolarHBondContact OE1-OG 2.91Å
853	G	88.3	Confident	91.4	Very high	11 Å²	11	16.9 Å²	16.9	11%	0.113	9%	0.094	C	C	.	.	S	Bend	trans	64.7	-150.4	-179.1	0	0	0	0	0	113.5	E809 Q851	E809-G853 PolarHBondContact O-N 2.79Å; Q851-G853 PolarHBondContact NE2-O 2.89Å
854	T	85.9	Confident	91.7	Very high	70 Å²	70	16.9 Å²	16.9	43%	0.429	9%	0.094	S	C	.	.	S	Bend	trans	-77	163.2	175.9	60.8	0	0	0	0	111.8	M856 E857 S858	T854-M856 PolarHBondContact O-N 3.04Å; T854-M856 PolarHBondContact OG1-N 3.21Å; T854-E857 WeakPolarHBondContact CB-OE2 3.37Å; T854-E857 WeakPolarHBondContact CG2-OE2 3.22Å; T854-E857 PolarHBondContact N-OE2 3.12Å; T854-E857 PolarHBondContact O-N 2.98Å; T854-E857 WeakPolarHBondContact OG1-CG 3.41Å; T854-E857 PolarHBondContact OG1-N 3.34Å; T854-E857 PolarHBondContact OG1-OE2 2.82Å; T854-S858 PolarHBondContact O-N 3.29Å; T854-S858 VanDerWaalsContact O-N 3.09Å
855	S	79.6	Confident	91.8	Very high	51 Å²	51	17 Å²	17	36%	0.357	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	7.1	168.5	56.8	0	0	0	0	114.6	R896	S855-R896 VanDerWaalsContact O-CZ 3.23Å; S855-R896 PolarHBondContact O-NH1 3.39Å; S855-R896 PolarHBondContact O-NH2 3.08Å
856	M	78.2	Confident	91.5	Very high	120 Å²	120	17 Å²	17	59%	0.591	9%	0.094	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-27	163.9	-65.8	-168.5	-142	0	0	112.8	T854 R896	T854-M856 PolarHBondContact O-N 3.04Å; T854-M856 PolarHBondContact OG1-N 3.21Å; M856-R896 VanDerWaalsContact C-NH1 3.26Å; M856-R896 PolarHBondContact O-NH1 3.02Å
857	E	82.6	Confident	91.1	Very high	55 Å²	55	18.1 Å²	18.1	26%	0.257	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-43.4	-174.3	-69.3	160.1	137.4	0	0	111.9	K793 T854 R896	K793-E857 IonicContact NZ-OE1 3.17Å; K793-E857 PolarHBondContact NZ-OE1 2.85Å; K793-E857 IonicContact NZ-OE2 3.97Å; K793-E857 PolarHBondContact NZ-OE2 2.79Å; T854-E857 WeakPolarHBondContact CB-OE2 3.37Å; T854-E857 WeakPolarHBondContact CG2-OE2 3.22Å; T854-E857 PolarHBondContact N-OE2 3.12Å; T854-E857 PolarHBondContact O-N 2.98Å; T854-E857 WeakPolarHBondContact OG1-CG 3.41Å; T854-E857 PolarHBondContact OG1-N 3.34Å; T854-E857 PolarHBondContact OG1-OE2 2.82Å; E857-R896 WeakPolarHBondContact O-CG 3.32Å
858	S	90.4	Very high	90.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	-135.9	161.8	171.4	-167.3	0	0	0	0	112.8	E852 T854 R896	E852-S858 WeakPolarHBondContact O-CB 3.39Å; E852-S858 PolarHBondContact O-N 2.93Å; T854-S858 PolarHBondContact O-N 3.29Å; T854-S858 VanDerWaalsContact O-N 3.09Å; S858-R896 CarbonylContact C-O 3.54Å; S858-R896 VanDerWaalsContact CA-O 3.24Å; S858-R896 WeakPolarHBondContact CA-O 3.49Å; S858-R896 PolarHBondContact OG-O 3.05Å
859	D	91.9	Very high	89.2	Confident	8 Å²	8	22.1 Å²	22.1	4%	0.043	12%	0.123	C	C	.	.			trans	-84.1	146.8	166.2	-64.4	-38.7	0	0	0	111	V880 N881 F895 R896 V898	D859-V880 HydrophobicContact CB-CG1 3.91Å; D859-N881 VanDerWaalsContact CG-ND2 3.29Å; D859-N881 PolarHBondContact OD1-ND2 2.64Å; D859-F895 HydrophobicContact CB-CB 4.13Å; D859-F895 WeakPolarHBondContact OD2-CB 3.3Å; D859-R896 PolarHBondContact N-O 3.09Å; D859-R896 IonicContact OD1-CZ 3.83Å; D859-R896 IonicContact OD1-NE 2.73Å; D859-R896 PolarHBondContact OD1-NE 2.85Å; D859-R896 IonicContact OD1-NH2 3.95Å; D859-R896 PolarHBondContact OD1-NH2 2.64Å; D859-R896 WeakPolarHBondContact OD2-CB 3.15Å; D859-R896 PolarHBondContact OD2-N 2.82Å; D859-V898 HydrophobicContact CB-CG1 4.29Å
860	R	94.3	Very high	88.5	Confident	6 Å²	6	22.2 Å²	22.2	2%	0.023	12%	0.123	C	C	.	.			trans	-87.9	129.4	-178.7	-173.8	-178	73.6	168.7	9.2	110.8	Q851 L862 V880 N881 D882 L1024 S1026	Q851-R860 HydrophobicContact CB-CG 4.31Å; Q851-R860 HydrophobicContact CG-CB 4.35Å; Q851-R860 HydrophobicContact CG-CG 4.49Å; R860-L862 HydrophobicContact CG-CD1 4.08Å; R860-V880 CarbonylContact O-C 3.52Å; R860-V880 WeakPolarHBondContact O-CA 3.35Å; R860-N881 PolarHBondContact N-OD1 3.13Å; R860-N881 PolarHBondContact O-N 3.23Å; R860-D882 IonicContact CZ-OD1 2.73Å; R860-D882 IonicContact NH2-OD1 3.92Å; R860-D882 PolarHBondContact NH2-OD1 2.94Å; R860-D882 IonicContact NH2-OD2 3.34Å; R860-L1024 PolarHBondContact NH1-O 2.03Å; R860-L1024 VanDerWaalsContact NH1-O 3.09Å; R860-S1026 VanDerWaalsContact CZ-O 3.24Å; R860-S1026 PolarHBondContact NH1-O 2.82Å; R860-S1026 PolarHBondContact NH2-O 3.14Å
861	V	96.9	Very high	87.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	131.3	179.2	-171.2	0	0	0	0	110.6	A849 V850 V863 I878 L879 V880 V898 V900 I914	A849-V861 CarbonylContact C-O 3.26Å; A849-V861 WeakPolarHBondContact CA-O 3.37Å; V850-V861 PolarHBondContact N-O 3.27Å; V850-V861 PolarHBondContact O-N 2.94Å; V861-V863 HydrophobicContact CG1-CG2 4.34Å; V861-I878 HydrophobicContact CG1-CG2 4.48Å; V861-L879 CarbonylContact C-O 3.43Å; V861-L879 WeakPolarHBondContact CA-O 3.44Å; V861-V880 HydrophobicContact CG1-CG2 4.28Å; V861-V880 HydrophobicContact CG2-CG1 4.5Å; V861-V880 HydrophobicContact CG2-CG2 4.24Å; V861-V898 HydrophobicContact CG2-CB 4.44Å; V861-V898 HydrophobicContact CG2-CG1 3.79Å; V861-V898 HydrophobicContact CG2-CG2 3.82Å; V861-V900 HydrophobicContact CG1-CG2 4.16Å; V861-V900 HydrophobicContact CG2-CG2 4.1Å; V861-I914 HydrophobicContact CB-CD1 4.31Å; V861-I914 HydrophobicContact CG1-CD1 3.8Å; V861-I914 HydrophobicContact CG1-CG1 4.42Å
862	L	96.9	Very high	86.8	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131.2	167.4	-71.5	74.8	0	0	0	108.4	V848 A849 R860 L864 I878 L879 F1025 I1041	V848-L862 CarbonylContact O-C 3.59Å; V848-L862 WeakPolarHBondContact O-CA 3.4Å; A849-L862 HydrophobicContact CB-CG 4.01Å; R860-L862 HydrophobicContact CG-CD1 4.08Å; L862-L864 HydrophobicContact CB-CD2 4.47Å; L862-L864 HydrophobicContact CB-CG 4.4Å; L862-I878 CarbonylContact O-C 3.58Å; L862-I878 WeakPolarHBondContact O-CA 3.41Å; L862-L879 HydrophobicContact CB-CB 4.36Å; L862-L879 HydrophobicContact CB-CD1 4.44Å; L862-L879 PolarHBondContact N-O 3.2Å; L862-L879 PolarHBondContact O-N 3.05Å; L862-F1025 HydrophobicContact CD2-CD1 4.2Å; L862-I1041 HydrophobicContact CD2-CD1 4.47Å; L862-I1041 HydrophobicContact CD2-CG2 4Å
863	V	96.7	Very high	86.2	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	113.2	167.4	-179.5	0	0	0	0	107.3	G847 V848 V861 T876 H877 I878 V912 I914 I925	G847-V863 CarbonylContact C-O 3.51Å; G847-V863 VanDerWaalsContact CA-O 3.29Å; G847-V863 WeakPolarHBondContact CA-O 3.45Å; V848-V863 PolarHBondContact N-O 2.76Å; V848-V863 PolarHBondContact O-N 3.09Å; V861-V863 HydrophobicContact CG1-CG2 4.34Å; V863-T876 HydrophobicContact CG1-CG2 4.08Å; V863-H877 WeakPolarHBondContact CA-O 3.4Å; V863-I878 HydrophobicContact CG2-CG1 4.41Å; V863-I878 HydrophobicContact CG2-CG2 4.47Å; V863-V912 HydrophobicContact CG1-CB 4.46Å; V863-V912 HydrophobicContact CG1-CG2 4.23Å; V863-V912 HydrophobicContact CG2-CG1 4.04Å; V863-I914 HydrophobicContact CG2-CD1 3.95Å; V863-I925 HydrophobicContact CB-CD1 3.96Å; V863-I925 HydrophobicContact CB-CG2 4.33Å; V863-I925 HydrophobicContact CG1-CB 4.42Å; V863-I925 HydrophobicContact CG1-CD1 4.47Å; V863-I925 HydrophobicContact CG1-CG2 3.79Å; V863-I925 HydrophobicContact CG2-CD1 3.97Å
864	L	94.5	Very high	86.1	Confident	1 Å²	1	26 Å²	26	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	141.5	-175.9	-52.3	178.6	0	0	0	109.4	L862 T876 H877 L879 F1025 L1040 I1041	L862-L864 HydrophobicContact CB-CD2 4.47Å; L862-L864 HydrophobicContact CB-CG 4.4Å; L864-T876 CarbonylContact O-C 3.59Å; L864-T876 WeakPolarHBondContact O-CA 3.4Å; L864-T876 WeakPolarHBondContact O-CB 3.39Å; L864-H877 HydrophobicContact CB-CB 4.45Å; L864-H877 PolarHBondContact N-O 3.36Å; L864-H877 PolarHBondContact O-N 2.83Å; L864-L879 HydrophobicContact CD1-CD1 3.85Å; L864-L879 HydrophobicContact CG-CD1 4.22Å; L864-F1025 HydrophobicContact CD2-CD1 3.84Å; L864-F1025 HydrophobicContact CD2-CE1 3.63Å; L864-L1040 VanDerWaalsContact CD1-O 3.28Å; L864-L1040 WeakPolarHBondContact CD1-O 3.47Å; L864-I1041 HydrophobicContact CD1-CG1 4.49Å
865	L	92.3	Very high	86.1	Confident	2 Å²	2	24.5 Å²	24.5	1%	0.01	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	137.3	168.2	178.9	68.5	0	0	0	109.4	T846 E927 G944 L946 V1044 Y1045	T846-L865 VanDerWaalsContact O-CB 3.29Å; T846-L865 WeakPolarHBondContact O-CB 3.18Å; T846-L865 PolarHBondContact O-N 3Å; L865-E927 HydrophobicContact CD1-CG 4.07Å; L865-G944 WeakPolarHBondContact CD2-O 3.01Å; L865-L946 HydrophobicContact CB-CD1 4.26Å; L865-L946 HydrophobicContact CB-CD2 4.16Å; L865-L946 HydrophobicContact CB-CG 4.12Å; L865-L946 HydrophobicContact CD1-CD2 4.04Å; L865-V1044 HydrophobicContact CB-CG2 4.33Å; L865-V1044 HydrophobicContact CD2-CG1 4.21Å; L865-V1044 HydrophobicContact CG-CG1 4.35Å; L865-V1044 VanDerWaalsContact O-CG2 3.3Å; L865-V1044 WeakPolarHBondContact O-CG2 3.31Å; L865-Y1045 HydrophobicContact CD2-CE2 4.06Å
866	R	89.1	Confident	86.6	Confident	1 Å²	1	22.1 Å²	22.1	0%	0.004	10%	0.104	C	C	.	.	P	Polyproline II helix	trans	-68.8	144	174.6	-68.5	-137.2	175.3	-166.1	-8.5	110.9	D331 R870 R871 Y874 R875 T876 H877	D331-R866 VanDerWaalsContact CG-NH1 3.31Å; D331-R866 IonicContact OD1-CZ 3.32Å; D331-R866 IonicContact OD1-NH1 2.86Å; D331-R866 PolarHBondContact OD1-NH1 2.85Å; D331-R866 IonicContact OD1-NH2 2.66Å; D331-R866 IonicContact OD2-CZ 2.9Å; D331-R866 IonicContact OD2-NH1 2.83Å; D331-R866 PolarHBondContact OD2-NH1 2.79Å; D331-R866 VanDerWaalsContact OD2-NH1 3.15Å; D331-R866 IonicContact OD2-NH2 3.12Å; D331-R866 PolarHBondContact OD2-NH2 2.95Å; R866-R870 WeakPolarHBondContact CD-O 3.12Å; R866-R870 PolarHBondContact NH1-O 3.32Å; R866-R871 HydrophobicContact CB-CG 3.95Å; R866-R871 VanDerWaalsContact O-CZ 3.26Å; R866-R871 PolarHBondContact O-NE 2.74Å; R866-R871 PolarHBondContact O-NH2 2.83Å; R866-Y874 VanDerWaalsContact CD-O 3.27Å; R866-Y874 WeakPolarHBondContact CD-O 3.29Å; R866-R875 WeakPolarHBondContact CB-O 3.38Å; R866-R875 WeakPolarHBondContact CG-O 3.45Å; R866-R875 PolarHBondContact N-O 3.13Å; R866-T876 VanDerWaalsContact CG-C 3.49Å; R866-T876 PolarHBondContact NE-O 3Å; R866-H877 WeakPolarHBondContact CD-NE2 3.15Å; R866-H877 PolarHBondContact NE-CE1 3.04Å; R866-H877 VanDerWaalsContact NE-CE1 3.25Å; R866-H877 PolarHBondContact NE-ND1 3.01Å; R866-H877 PolarHBondContact NH2-ND1 3.24Å
867	K	85.8	Confident	87.3	Confident	23 Å²	23	16.6 Å²	16.6	10%	0.1	8%	0.077	C	C	.	.	P	Polyproline II helix	trans	-57.9	142.5	164.4	-71.3	175.8	171	-174.8	0	109.4	N293 A294 T295 T869 R870 P1043 V1044	N293-K867 PolarHBondContact O-NZ 2.88Å; A294-K867 PolarHBondContact O-NZ 2.66Å; T295-K867 HydrophobicContact CG2-CD 3.82Å; K867-T869 PolarHBondContact O-N 2.92Å; K867-R870 WeakPolarHBondContact O-CB 3.3Å; K867-R870 PolarHBondContact O-N 2.84Å; K867-P1043 WeakPolarHBondContact CE-O 3.4Å; K867-V1044 HydrophobicContact CG-CG1 4.27Å
868	D	77	Confident	87.9	Confident	27 Å²	27	14 Å²	14	14%	0.144	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-45.6	-58.9	-169	-58.8	-17.7	0	0	0	112.9	R822 R870 R871 Y1045	R822-D868 IonicContact CZ-OD1 3.84Å; R822-D868 IonicContact CZ-OD2 2.75Å; R822-D868 VanDerWaalsContact CZ-OD2 3.22Å; R822-D868 IonicContact NH1-OD2 2.87Å; R822-D868 PolarHBondContact NH1-OD2 2.67Å; R822-D868 IonicContact NH2-OD1 2.89Å; R822-D868 PolarHBondContact NH2-OD1 3.37Å; R822-D868 IonicContact NH2-OD2 3.02Å; R822-D868 PolarHBondContact NH2-OD2 3.47Å; D868-R870 PolarHBondContact O-N 3.32Å; D868-R871 VanDerWaalsContact O-CB 3.32Å; D868-R871 WeakPolarHBondContact O-CB 3.26Å; D868-R871 VanDerWaalsContact O-CG 3.27Å; D868-R871 WeakPolarHBondContact O-CG 3.47Å; D868-R871 PolarHBondContact O-N 3.11Å; D868-R871 VanDerWaalsContact O-N 3.08Å; D868-R871 IonicContact OD1-CZ 2.86Å; D868-R871 IonicContact OD1-NE 3.85Å; D868-R871 IonicContact OD1-NH1 3.96Å; D868-R871 PolarHBondContact OD1-NH1 2.93Å; D868-R871 VanDerWaalsContact OD1-NH1 3.08Å; D868-R871 IonicContact OD1-NH2 3.22Å; D868-R871 PolarHBondContact OD1-NH2 2.84Å; D868-Y1045 WeakPolarHBondContact OD1-CE1 3.22Å; D868-Y1045 PolarHBondContact OD1-OH 3.26Å
869	T	74	Confident	88	Confident	58 Å²	58	14 Å²	14	36%	0.356	7%	0.065	S	C	.	.	G	3₁₀ helix	trans	-64.7	8.9	-179.6	69.8	0	0	0	0	115.8	G82 N293 K867	G82-T869 VanDerWaalsContact CA-O 3.29Å; G82-T869 WeakPolarHBondContact CA-O 3.32Å; N293-T869 PolarHBondContact ND2-OG1 2.88Å; K867-T869 PolarHBondContact O-N 2.92Å
870	R	82	Confident	88.1	Confident	2 Å²	2	13.7 Å²	13.7	1%	0.008	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-116.8	10.9	176.2	-64.7	-170.8	58.2	122.8	4.7	114.2	Y80 G81 T295 D331 R866 K867 D868	Y80-R870 WeakPolarHBondContact O-CG 3.27Å; Y80-R870 PolarHBondContact O-NE 2.9Å; Y80-R870 PolarHBondContact O-NH1 3.49Å; G81-R870 CarbonylContact O-C 3.55Å; G81-R870 VanDerWaalsContact O-CA 3.25Å; G81-R870 WeakPolarHBondContact O-CA 3.43Å; T295-R870 HydrophobicContact CG2-CG 4.27Å; D331-R870 PolarHBondContact O-NH2 2.91Å; D331-R870 IonicContact OD1-CZ 3.19Å; D331-R870 IonicContact OD1-NH2 3.68Å; D331-R870 PolarHBondContact OD1-NH2 2.99Å; R866-R870 WeakPolarHBondContact CD-O 3.12Å; R866-R870 PolarHBondContact NH1-O 3.32Å; K867-R870 WeakPolarHBondContact O-CB 3.3Å; K867-R870 PolarHBondContact O-N 2.84Å; D868-R870 PolarHBondContact O-N 3.32Å
871	R	78.5	Confident	87.8	Confident	2 Å²	2	14.2 Å²	14.2	1%	0.008	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-1	-167.7	-71.5	178.5	-177.3	169	5.8	116.6	R866 D868 K873 Y874 S942 G944 Y1045	R866-R871 HydrophobicContact CB-CG 3.95Å; R866-R871 VanDerWaalsContact O-CZ 3.26Å; R866-R871 PolarHBondContact O-NE 2.74Å; R866-R871 PolarHBondContact O-NH2 2.83Å; D868-R871 VanDerWaalsContact O-CB 3.32Å; D868-R871 WeakPolarHBondContact O-CB 3.26Å; D868-R871 VanDerWaalsContact O-CG 3.27Å; D868-R871 WeakPolarHBondContact O-CG 3.47Å; D868-R871 PolarHBondContact O-N 3.11Å; D868-R871 VanDerWaalsContact O-N 3.08Å; D868-R871 IonicContact OD1-CZ 2.86Å; D868-R871 IonicContact OD1-NE 3.85Å; D868-R871 IonicContact OD1-NH1 3.96Å; D868-R871 PolarHBondContact OD1-NH1 2.93Å; D868-R871 VanDerWaalsContact OD1-NH1 3.08Å; D868-R871 IonicContact OD1-NH2 3.22Å; D868-R871 PolarHBondContact OD1-NH2 2.84Å; R871-K873 PolarHBondContact O-N 3.46Å; R871-Y874 WeakPolarHBondContact CA-O 3.39Å; R871-S942 PolarHBondContact NH1-O 3.09Å; R871-G944 VanDerWaalsContact NH1-CA 3.31Å; R871-Y1045 PolarHBondContact NH2-OH 3.35Å
872	Y	75.4	Confident	87.4	Confident	63 Å²	63	14.3 Å²	14.3	25%	0.247	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-38.1	-173.1	91.9	-99.1	0	0	0	113.6	P78 G81 R83	P78-Y872 HydrophobicContact CB-CE1 4.38Å; P78-Y872 WeakPolarHBondContact CB-OH 3.28Å; G81-Y872 WeakPolarHBondContact O-CD1 3.35Å; G81-Y872 WeakPolarHBondContact O-CE1 3.31Å; R83-Y872 HydrophobicContact CB-CD1 3.95Å; R83-Y872 HydrophobicContact CB-CE1 4.48Å; R83-Y872 HydrophobicContact CB-CG 4.05Å; R83-Y872 HydrophobicContact CG-CD1 3.73Å; R83-Y872 HydrophobicContact CG-CD2 3.78Å; R83-Y872 HydrophobicContact CG-CE1 3.91Å; R83-Y872 HydrophobicContact CG-CE2 3.93Å; R83-Y872 HydrophobicContact CG-CG 3.71Å
873	K	79.7	Confident	86.9	Confident	51 Å²	51	15.2 Å²	15.2	22%	0.222	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-33.9	180	-169.1	173.2	175.6	-164.1	0	113.6	R871 D888 G908	R871-K873 PolarHBondContact O-N 3.46Å; K873-D888 WeakPolarHBondContact CE-OD2 3.35Å; K873-D888 IonicContact NZ-OD2 2.98Å; K873-D888 PolarHBondContact NZ-OD2 3.42Å; K873-G908 WeakPolarHBondContact O-CA 3.37Å
874	Y	85.8	Confident	86.5	Confident	7 Å²	7	15.6 Å²	15.6	3%	0.027	7%	0.073	C	C	.	.			trans	-142.2	146.6	-174.1	-43.8	-82.6	0	0	0	111.7	D331 R866 R871 Y886 D888 G908 Q909	D331-Y874 WeakPolarHBondContact OD2-CE2 3.44Å; R866-Y874 VanDerWaalsContact CD-O 3.27Å; R866-Y874 WeakPolarHBondContact CD-O 3.29Å; R871-Y874 WeakPolarHBondContact CA-O 3.39Å; Y874-Y886 HydrophobicContact CE1-CD1 4.13Å; Y874-Y886 AromaticContact CE2-CD1 3.95Å; Y874-Y886 HydrophobicContact CE2-CD1 3.95Å; Y874-Y886 AromaticContact CE2-CE1 3.69Å; Y874-Y886 HydrophobicContact CE2-CE1 3.69Å; Y874-Y886 AromaticContact CZ-CD1 3.52Å; Y874-Y886 AromaticContact CZ-CE1 3.76Å; Y874-Y886 WeakPolarHBondContact OH-CD1 3.08Å; Y874-D888 WeakPolarHBondContact CE1-OD1 3.4Å; Y874-D888 PolarHBondContact OH-OD2 3.38Å; Y874-G908 CarbonylContact C-O 3.56Å; Y874-G908 VanDerWaalsContact CA-O 3.29Å; Y874-G908 WeakPolarHBondContact CA-O 3.07Å; Y874-Q909 HydrophobicContact CD1-CG 4.04Å
875	R	85.9	Confident	86.2	Confident	38 Å²	38	16.7 Å²	16.7	14%	0.143	8%	0.077	C	C	.	.	S	Bend	trans	-100.5	-25.7	-177.3	-53.6	-59.9	172.1	166.7	-12	113.5	R866 G908 C910 E927 S942	R866-R875 WeakPolarHBondContact CB-O 3.38Å; R866-R875 WeakPolarHBondContact CG-O 3.45Å; R866-R875 PolarHBondContact N-O 3.13Å; R875-G908 PolarHBondContact N-O 2.87Å; R875-C910 HydrophobicContact CB-CB 3.53Å; R875-C910 HydrophobicContact CG-CB 3.56Å; R875-E927 HydrophobicContact CB-CB 4.33Å; R875-E927 VanDerWaalsContact CB-OE2 3.24Å; R875-E927 WeakPolarHBondContact CB-OE2 3.31Å; R875-E927 VanDerWaalsContact CD-OE2 3.27Å; R875-E927 WeakPolarHBondContact CD-OE2 3.43Å; R875-E927 WeakPolarHBondContact CG-OE2 3.48Å; R875-S942 PolarHBondContact NH1-OG 2.99Å
876	T	91.2	Very high	86	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	164.4	171	65.3	0	0	0	0	113	V863 L864 R866 Q909 L946	V863-T876 HydrophobicContact CG1-CG2 4.08Å; L864-T876 CarbonylContact O-C 3.59Å; L864-T876 WeakPolarHBondContact O-CA 3.4Å; L864-T876 WeakPolarHBondContact O-CB 3.39Å; R866-T876 VanDerWaalsContact CG-C 3.49Å; R866-T876 PolarHBondContact NE-O 3Å; T876-Q909 PolarHBondContact OG1-O 2.9Å; T876-L946 HydrophobicContact CG2-CD2 4.36Å
877	H	92.3	Very high	86	Confident	5 Å²	5	18.8 Å²	18.8	2%	0.023	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	124	156.2	-64.7	-74	0	0	0	107.9	V863 L864 R866 L879 L884	V863-H877 WeakPolarHBondContact CA-O 3.4Å; L864-H877 HydrophobicContact CB-CB 4.45Å; L864-H877 PolarHBondContact N-O 3.36Å; L864-H877 PolarHBondContact O-N 2.83Å; R866-H877 WeakPolarHBondContact CD-NE2 3.15Å; R866-H877 PolarHBondContact NE-CE1 3.04Å; R866-H877 VanDerWaalsContact NE-CE1 3.25Å; R866-H877 PolarHBondContact NE-ND1 3.01Å; R866-H877 PolarHBondContact NH2-ND1 3.24Å; H877-L879 HydrophobicContact CB-CD1 3.86Å; H877-L884 HydrophobicContact CB-CD1 3.87Å
878	I	94.5	Very high	85.7	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	113	171	-55.3	174.9	0	0	0	106.5	V861 L862 V863 L884 R885 F887 V900 V902 V912	V861-I878 HydrophobicContact CG1-CG2 4.48Å; L862-I878 CarbonylContact O-C 3.58Å; L862-I878 WeakPolarHBondContact O-CA 3.41Å; V863-I878 HydrophobicContact CG2-CG1 4.41Å; V863-I878 HydrophobicContact CG2-CG2 4.47Å; I878-L884 CarbonylContact O-C 3.44Å; I878-L884 WeakPolarHBondContact O-CA 3.31Å; I878-R885 HydrophobicContact CG2-CB 4.43Å; I878-R885 PolarHBondContact O-N 3.47Å; I878-F887 HydrophobicContact CB-CE2 4.4Å; I878-F887 HydrophobicContact CD1-CD2 3.9Å; I878-F887 HydrophobicContact CD1-CE2 3.67Å; I878-F887 HydrophobicContact CD1-CZ 4.39Å; I878-F887 HydrophobicContact CG2-CE2 4.18Å; I878-V900 HydrophobicContact CG2-CG1 4.3Å; I878-V902 HydrophobicContact CD1-CG1 3.81Å; I878-V912 HydrophobicContact CD1-CB 4.41Å; I878-V912 HydrophobicContact CD1-CG1 3.69Å; I878-V912 HydrophobicContact CD1-CG2 3.76Å; I878-V912 HydrophobicContact CG1-CG1 4.25Å; I878-V912 HydrophobicContact CG1-CG2 4.17Å
879	L	94.1	Very high	85.8	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	134.3	175.1	-55.4	93.4	0	0	0	109.9	V861 L862 L864 H877 E883 E1037 I1041	V861-L879 CarbonylContact C-O 3.43Å; V861-L879 WeakPolarHBondContact CA-O 3.44Å; L862-L879 HydrophobicContact CB-CB 4.36Å; L862-L879 HydrophobicContact CB-CD1 4.44Å; L862-L879 PolarHBondContact N-O 3.2Å; L862-L879 PolarHBondContact O-N 3.05Å; L864-L879 HydrophobicContact CD1-CD1 3.85Å; L864-L879 HydrophobicContact CG-CD1 4.22Å; H877-L879 HydrophobicContact CB-CD1 3.86Å; L879-E883 CarbonylContact C-O 3.27Å; L879-E883 VanDerWaalsContact CA-O 3.27Å; L879-E883 WeakPolarHBondContact CA-O 3.46Å; L879-E1037 HydrophobicContact CD2-CB 4.43Å; L879-I1041 HydrophobicContact CD2-CD1 4.17Å; L879-I1041 HydrophobicContact CD2-CG1 3.92Å
880	V	92.3	Very high	86.1	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.006	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	119.8	174.6	-174.8	0	0	0	0	109.1	D859 R860 V861 D882 E883 R885 F895	D859-V880 HydrophobicContact CB-CG1 3.91Å; R860-V880 CarbonylContact O-C 3.52Å; R860-V880 WeakPolarHBondContact O-CA 3.35Å; V861-V880 HydrophobicContact CG1-CG2 4.28Å; V861-V880 HydrophobicContact CG2-CG1 4.5Å; V861-V880 HydrophobicContact CG2-CG2 4.24Å; V880-D882 PolarHBondContact O-N 3.43Å; V880-E883 PolarHBondContact N-O 3.03Å; V880-E883 WeakPolarHBondContact O-CB 3.42Å; V880-E883 PolarHBondContact O-N 2.83Å; V880-R885 HydrophobicContact CB-CG 4.31Å; V880-R885 HydrophobicContact CG2-CG 3.97Å; V880-F895 HydrophobicContact CB-CD1 4.18Å; V880-F895 HydrophobicContact CB-CE1 3.95Å; V880-F895 HydrophobicContact CB-CZ 4.2Å; V880-F895 HydrophobicContact CG1-CB 4.37Å; V880-F895 HydrophobicContact CG1-CD1 3.59Å; V880-F895 HydrophobicContact CG1-CD2 4.27Å; V880-F895 HydrophobicContact CG1-CE1 3.9Å; V880-F895 HydrophobicContact CG1-CG 3.8Å; V880-F895 HydrophobicContact CG1-CZ 4.39Å; V880-F895 HydrophobicContact CG2-CD1 4.45Å; V880-F895 HydrophobicContact CG2-CD2 4.27Å; V880-F895 HydrophobicContact CG2-CE1 4.04Å; V880-F895 HydrophobicContact CG2-CE2 3.87Å; V880-F895 HydrophobicContact CG2-CZ 3.75Å
881	N	89.4	Confident	86.2	Confident	17 Å²	17	23.5 Å²	23.5	9%	0.091	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	46.7	-166.7	-63.4	-22	0	0	0	112.5	Y410 D859 R860 E883 L1028	Y410-N881 PolarHBondContact OH-ND2 3.17Å; Y410-N881 VanDerWaalsContact OH-ND2 3.1Å; D859-N881 VanDerWaalsContact CG-ND2 3.29Å; D859-N881 PolarHBondContact OD1-ND2 2.64Å; R860-N881 PolarHBondContact N-OD1 3.13Å; R860-N881 PolarHBondContact O-N 3.23Å; N881-E883 PolarHBondContact O-N 3.02Å; N881-L1028 HydrophobicContact CB-CD1 3.76Å
882	D	88.5	Confident	86.5	Confident	2 Å²	2	24.1 Å²	24.1	1%	0.011	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.3	7.7	-176.2	-48.2	-29.2	0	0	0	115.9	R860 V880 L1027 L1028 H1032 W1035 I1041	R860-D882 IonicContact CZ-OD1 2.73Å; R860-D882 IonicContact NH2-OD1 3.92Å; R860-D882 PolarHBondContact NH2-OD1 2.94Å; R860-D882 IonicContact NH2-OD2 3.34Å; V880-D882 PolarHBondContact O-N 3.43Å; D882-L1027 HydrophobicContact CB-CD2 4.26Å; D882-L1027 WeakPolarHBondContact OD2-CA 3.44Å; D882-L1028 WeakPolarHBondContact OD2-CB 3.02Å; D882-L1028 PolarHBondContact OD2-N 3.49Å; D882-H1032 IonicContact OD2-CE1 3.11Å; D882-H1032 IonicContact OD2-CG 2.79Å; D882-H1032 IonicContact OD2-ND1 2.82Å; D882-H1032 PolarHBondContact OD2-ND1 2.79Å; D882-W1035 HydrophobicContact CB-CZ3 4.3Å; D882-I1041 HydrophobicContact CB-CD1 4.31Å
883	E	85.4	Confident	87.1	Confident	19 Å²	19	21.5 Å²	21.5	9%	0.089	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.3	178.4	-169.1	173.1	148.9	0	0	112.3	R347 V430 L879 V880 N881 R885	R347-E883 IonicContact CZ-OE2 3.24Å; R347-E883 IonicContact NH1-OE1 3.31Å; R347-E883 PolarHBondContact NH1-OE1 3.17Å; R347-E883 IonicContact NH1-OE2 2.87Å; R347-E883 PolarHBondContact NH1-OE2 2.75Å; R347-E883 IonicContact NH2-OE2 3.51Å; R347-E883 PolarHBondContact NH2-OE2 2.85Å; V430-E883 WeakPolarHBondContact CB-OE1 3.35Å; V430-E883 VanDerWaalsContact CG2-OE2 3.25Å; V430-E883 WeakPolarHBondContact CG2-OE2 3.38Å; L879-E883 CarbonylContact C-O 3.27Å; L879-E883 VanDerWaalsContact CA-O 3.27Å; L879-E883 WeakPolarHBondContact CA-O 3.46Å; V880-E883 PolarHBondContact N-O 3.03Å; V880-E883 WeakPolarHBondContact O-CB 3.42Å; V880-E883 PolarHBondContact O-N 2.83Å; N881-E883 PolarHBondContact O-N 3.02Å; E883-R885 PolarHBondContact O-N 3.49Å; E883-R885 IonicContact OE1-CZ 2.69Å; E883-R885 IonicContact OE1-NH1 3.29Å; E883-R885 PolarHBondContact OE1-NH1 2.81Å; E883-R885 IonicContact OE1-NH2 2.72Å; E883-R885 PolarHBondContact OE1-NH2 2.87Å; E883-R885 IonicContact OE2-CZ 3.45Å; E883-R885 IonicContact OE2-NH2 2.77Å; E883-R885 PolarHBondContact OE2-NH2 3.02Å
884	L	88.6	Confident	87.6	Confident	8 Å²	8	20.3 Å²	20.3	4%	0.042	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	123.1	179.9	-179.6	61.1	0	0	0	112	I332 H877 I878 Y886 E1037 L1040	I332-L884 HydrophobicContact CD1-CD2 4.38Å; I332-L884 HydrophobicContact CG2-CD2 3.93Å; H877-L884 HydrophobicContact CB-CD1 3.87Å; I878-L884 CarbonylContact O-C 3.44Å; I878-L884 WeakPolarHBondContact O-CA 3.31Å; L884-Y886 HydrophobicContact CD2-CE2 4.09Å; L884-Y886 WeakPolarHBondContact CD2-OH 3.42Å; L884-Y886 HydrophobicContact CG-CE2 3.89Å; L884-E1037 HydrophobicContact CB-CG 3.72Å; L884-L1040 HydrophobicContact CD2-CD1 3.85Å
885	R	89.1	Confident	87.8	Confident	24 Å²	24	20.8 Å²	20.8	9%	0.091	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	136.3	-178.3	-63	-66.5	173.8	-148.2	-12.4	112.5	I878 V880 E883 F887 F895 Q909	I878-R885 HydrophobicContact CG2-CB 4.43Å; I878-R885 PolarHBondContact O-N 3.47Å; V880-R885 HydrophobicContact CB-CG 4.31Å; V880-R885 HydrophobicContact CG2-CG 3.97Å; E883-R885 PolarHBondContact O-N 3.49Å; E883-R885 IonicContact OE1-CZ 2.69Å; E883-R885 IonicContact OE1-NH1 3.29Å; E883-R885 PolarHBondContact OE1-NH1 2.81Å; E883-R885 IonicContact OE1-NH2 2.72Å; E883-R885 PolarHBondContact OE1-NH2 2.87Å; E883-R885 IonicContact OE2-CZ 3.45Å; E883-R885 IonicContact OE2-NH2 2.77Å; E883-R885 PolarHBondContact OE2-NH2 3.02Å; R885-F887 HydrophobicContact CB-CD2 4.36Å; R885-F887 HydrophobicContact CB-CE2 3.71Å; R885-F895 HydrophobicContact CG-CE1 4.33Å; R885-F895 HydrophobicContact CG-CZ 3.91Å; R885-Q909 PolarHBondContact O-NE2 2.77Å
886	Y	87.6	Confident	87.8	Confident	45 Å²	45	23.1 Å²	23.1	18%	0.176	11%	0.109	C	C	.	.			trans	-112.9	143.9	178.1	-61.3	-88.5	0	0	0	109.4	D331 R334 Y874 L884 Q893	D331-Y886 WeakPolarHBondContact OD2-CE1 3.3Å; D331-Y886 PolarHBondContact OD2-OH 3.41Å; R334-Y886 VanDerWaalsContact NH2-CE2 3.27Å; Y874-Y886 HydrophobicContact CE1-CD1 4.13Å; Y874-Y886 AromaticContact CE2-CD1 3.95Å; Y874-Y886 HydrophobicContact CE2-CD1 3.95Å; Y874-Y886 AromaticContact CE2-CE1 3.69Å; Y874-Y886 HydrophobicContact CE2-CE1 3.69Å; Y874-Y886 AromaticContact CZ-CD1 3.52Å; Y874-Y886 AromaticContact CZ-CE1 3.76Å; Y874-Y886 WeakPolarHBondContact OH-CD1 3.08Å; L884-Y886 HydrophobicContact CD2-CE2 4.09Å; L884-Y886 WeakPolarHBondContact CD2-OH 3.42Å; L884-Y886 HydrophobicContact CG-CE2 3.89Å; Y886-Q893 PolarHBondContact O-NE2 3.07Å
887	F	88	Confident	87.7	Confident	2 Å²	2	23.5 Å²	23.5	1%	0.009	11%	0.113	C	C	.	.			trans	-128.4	27.9	-173.8	-71.6	-109.9	0	0	0	111.6	I878 R885 K891 Q893 V900 V902	I878-F887 HydrophobicContact CB-CE2 4.4Å; I878-F887 HydrophobicContact CD1-CD2 3.9Å; I878-F887 HydrophobicContact CD1-CE2 3.67Å; I878-F887 HydrophobicContact CD1-CZ 4.39Å; I878-F887 HydrophobicContact CG2-CE2 4.18Å; R885-F887 HydrophobicContact CB-CD2 4.36Å; R885-F887 HydrophobicContact CB-CE2 3.71Å; F887-K891 WeakPolarHBondContact CD1-O 3.49Å; F887-K891 WeakPolarHBondContact O-CD 3.43Å; F887-K891 WeakPolarHBondContact O-CE 3.22Å; F887-K891 PolarHBondContact O-NZ 2.8Å; F887-Q893 HydrophobicContact CD1-CG 4.19Å; F887-Q893 HydrophobicContact CE1-CB 3.69Å; F887-Q893 HydrophobicContact CE1-CG 3.65Å; F887-Q893 HydrophobicContact CZ-CB 3.86Å; F887-Q893 HydrophobicContact CZ-CG 3.97Å; F887-V900 HydrophobicContact CE1-CB 4.44Å; F887-V900 HydrophobicContact CE1-CG1 4.23Å; F887-V900 WeakPolarHBondContact CE1-O 3.24Å; F887-V900 HydrophobicContact CE2-CG1 4.48Å; F887-V900 HydrophobicContact CZ-CB 4Å; F887-V900 HydrophobicContact CZ-CG1 3.68Å; F887-V902 HydrophobicContact CB-CB 4.44Å; F887-V902 HydrophobicContact CB-CG1 4.08Å; F887-V902 HydrophobicContact CB-CG2 3.47Å; F887-V902 VanDerWaalsContact CB-CG2 3.47Å; F887-V902 HydrophobicContact CD1-CG1 4.03Å; F887-V902 HydrophobicContact CD1-CG2 4.13Å; F887-V902 HydrophobicContact CD2-CG1 4.28Å; F887-V902 HydrophobicContact CG-CG1 3.89Å; F887-V902 HydrophobicContact CG-CG2 4.05Å
888	D	80.6	Confident	87.7	Confident	72 Å²	72	23.2 Å²	23.2	39%	0.385	11%	0.112	S	C	.	.	S	Bend	trans	-65.5	-50.7	179.9	-74.8	-6.3	0	0	0	111.5	K873 Y874 K891	K873-D888 WeakPolarHBondContact CE-OD2 3.35Å; K873-D888 IonicContact NZ-OD2 2.98Å; K873-D888 PolarHBondContact NZ-OD2 3.42Å; Y874-D888 WeakPolarHBondContact CE1-OD1 3.4Å; Y874-D888 PolarHBondContact OH-OD2 3.38Å; D888-K891 WeakPolarHBondContact O-CE 3.13Å; D888-K891 PolarHBondContact O-NZ 2.95Å
889	T	78.5	Confident	87.7	Confident	70 Å²	70	23.2 Å²	23.2	43%	0.429	11%	0.112	S	C	.	.	S	Bend	trans	-81	-39.1	-174.5	44.8	0	0	0	0	113.3	I354	I354-T889 VanDerWaalsContact CD1-OG1 3.27Å; I354-T889 WeakPolarHBondContact CD1-OG1 3.42Å
890	I	80.3	Confident	87.7	Confident	25 Å²	25	23.2 Å²	23.2	13%	0.128	11%	0.112	C	C	.	.			trans	-142.6	133.8	-178.9	-42.8	173.1	0	0	0	109.6	I354 W432 V434 P440	I354-I890 HydrophobicContact CD1-CD1 3.86Å; I354-I890 HydrophobicContact CD1-CG1 4.16Å; I354-I890 HydrophobicContact CG1-CD1 4.39Å; I354-I890 HydrophobicContact CG2-CD1 4Å; W432-I890 HydrophobicContact CE3-CD1 4.1Å; W432-I890 HydrophobicContact CH2-CB 3.37Å; W432-I890 HydrophobicContact CH2-CD1 3.8Å; W432-I890 HydrophobicContact CH2-CG1 4.16Å; W432-I890 HydrophobicContact CH2-CG2 3.37Å; W432-I890 HydrophobicContact CZ2-CB 4.34Å; W432-I890 HydrophobicContact CZ2-CD1 4.18Å; W432-I890 HydrophobicContact CZ2-CG2 3.97Å; W432-I890 HydrophobicContact CZ3-CB 3.57Å; W432-I890 HydrophobicContact CZ3-CD1 3.74Å; W432-I890 HydrophobicContact CZ3-CG1 4.09Å; W432-I890 HydrophobicContact CZ3-CG2 4.12Å; V434-I890 HydrophobicContact CG1-CD1 3.7Å; P440-I890 HydrophobicContact CB-CG1 4.34Å; P440-I890 HydrophobicContact CG-CD1 3.79Å; P440-I890 HydrophobicContact CG-CG1 3.72Å
891	K	83.5	Confident	87.7	Confident	43 Å²	43	23.3 Å²	23.3	19%	0.187	11%	0.112	C	C	.	.	S	Bend	trans	-88.3	-12	-165.5	-48.6	-63.2	144.4	167.2	0	115.5	F638 F887 D888 Y901 V902 D904	F638-K891 HydrophobicContact CD1-CB 3.61Å; F638-K891 HydrophobicContact CD1-CG 4.1Å; F638-K891 HydrophobicContact CE1-CB 3.72Å; F887-K891 WeakPolarHBondContact CD1-O 3.49Å; F887-K891 WeakPolarHBondContact O-CD 3.43Å; F887-K891 WeakPolarHBondContact O-CE 3.22Å; F887-K891 PolarHBondContact O-NZ 2.8Å; D888-K891 WeakPolarHBondContact O-CE 3.13Å; D888-K891 PolarHBondContact O-NZ 2.95Å; K891-Y901 CarbonylContact O-C 3.43Å; K891-Y901 WeakPolarHBondContact O-CA 3.36Å; K891-Y901 VanDerWaalsContact O-CB 3.31Å; K891-Y901 WeakPolarHBondContact O-CB 3.47Å; K891-V902 HydrophobicContact CB-CG2 4.39Å; K891-V902 HydrophobicContact CD-CG2 4.14Å; K891-V902 PolarHBondContact O-N 3.45Å; K891-D904 HydrophobicContact CD-CB 4.18Å; K891-D904 WeakPolarHBondContact CD-OD1 3.35Å; K891-D904 WeakPolarHBondContact CE-OD1 3.25Å; K891-D904 HydrophobicContact CG-CB 4.45Å; K891-D904 IonicContact NZ-OD1 3.53Å; K891-D904 PolarHBondContact NZ-OD1 3.26Å
892	T	86.7	Confident	87.8	Confident	14 Å²	14	22.8 Å²	22.8	9%	0.086	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	109.4	-173.8	-60.3	0	0	0	0	111	W432 M629 F638 T899 V900 Y901	W432-T892 WeakPolarHBondContact CH2-O 3.07Å; W432-T892 WeakPolarHBondContact CZ2-O 3.35Å; M629-T892 HydrophobicContact CE-CG2 4.37Å; F638-T892 WeakPolarHBondContact CZ-OG1 3.47Å; T892-T899 HydrophobicContact CG2-CG2 4.08Å; T892-V900 CarbonylContact C-O 3.52Å; T892-Y901 WeakPolarHBondContact OG1-CB 3.37Å
893	Q	88.2	Confident	87.4	Confident	9 Å²	9	23 Å²	23	4%	0.042	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	133.4	179.7	-75.4	170.4	35.1	0	0	110.7	W432 Y886 F887 F895 V900	W432-Q893 HydrophobicContact CD2-CG 4.19Å; W432-Q893 HydrophobicContact CE3-CG 3.71Å; W432-Q893 HydrophobicContact CH2-CB 4.25Å; W432-Q893 HydrophobicContact CH2-CG 3.22Å; W432-Q893 HydrophobicContact CZ2-CB 4.47Å; W432-Q893 HydrophobicContact CZ2-CG 3.81Å; W432-Q893 HydrophobicContact CZ3-CG 3.18Å; Y886-Q893 PolarHBondContact O-NE2 3.07Å; F887-Q893 HydrophobicContact CD1-CG 4.19Å; F887-Q893 HydrophobicContact CE1-CB 3.69Å; F887-Q893 HydrophobicContact CE1-CG 3.65Å; F887-Q893 HydrophobicContact CZ-CB 3.86Å; F887-Q893 HydrophobicContact CZ-CG 3.97Å; Q893-F895 HydrophobicContact CB-CE2 3.62Å; Q893-F895 HydrophobicContact CB-CZ 3.84Å; Q893-V900 PolarHBondContact N-O 2.94Å; Q893-V900 PolarHBondContact O-N 3.4Å; Q893-V900 VanDerWaalsContact O-O 3.1Å
894	R	88.5	Confident	86.6	Confident	25 Å²	25	24 Å²	24	9%	0.094	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.6	170.7	-63.4	-167.2	87.9	127.2	5.8	111.2	W406 G407 V408 A656 T899 E917	W406-R894 HydrophobicContact CH2-CG 3.76Å; W406-R894 HydrophobicContact CZ2-CG 4.18Å; W406-R894 HydrophobicContact CZ3-CG 3.95Å; G407-R894 CarbonylContact C-O 3.58Å; G407-R894 WeakPolarHBondContact CA-O 3.24Å; V408-R894 PolarHBondContact N-O 2.97Å; A656-R894 VanDerWaalsContact O-CZ 3.25Å; A656-R894 PolarHBondContact O-NH1 2.97Å; A656-R894 PolarHBondContact O-NH2 3.37Å; R894-T899 HydrophobicContact CG-CG2 4.03Å; R894-T899 WeakPolarHBondContact CG-OG1 3.48Å; R894-T899 PolarHBondContact NE-OG1 3.19Å; R894-T899 PolarHBondContact NH2-OG1 3.11Å; R894-E917 IonicContact CZ-OE1 2.77Å; R894-E917 IonicContact NE-OE1 2.76Å; R894-E917 PolarHBondContact NE-OE1 2.91Å; R894-E917 VanDerWaalsContact NH2-CD 3.34Å; R894-E917 IonicContact NH2-OE1 2.65Å; R894-E917 PolarHBondContact NH2-OE1 3.09Å
895	F	89.8	Confident	85.1	Confident	17 Å²	17	31.1 Å²	31.1	8%	0.075	14%	0.143	C	C	.	.			trans	-104.6	-167.6	170	-55.9	-84.7	0	0	0	107.4	V408 D859 V880 R885 Q893 V898 V900	V408-F895 HydrophobicContact CB-CD1 3.78Å; V408-F895 HydrophobicContact CB-CE1 3.86Å; V408-F895 HydrophobicContact CG1-CD1 3.98Å; V408-F895 HydrophobicContact CG1-CE1 3.87Å; V408-F895 HydrophobicContact CG2-CD1 3.88Å; V408-F895 HydrophobicContact CG2-CE1 3.52Å; V408-F895 HydrophobicContact CG2-CZ 3.99Å; D859-F895 HydrophobicContact CB-CB 4.13Å; D859-F895 WeakPolarHBondContact OD2-CB 3.3Å; V880-F895 HydrophobicContact CB-CD1 4.18Å; V880-F895 HydrophobicContact CB-CE1 3.95Å; V880-F895 HydrophobicContact CB-CZ 4.2Å; V880-F895 HydrophobicContact CG1-CB 4.37Å; V880-F895 HydrophobicContact CG1-CD1 3.59Å; V880-F895 HydrophobicContact CG1-CD2 4.27Å; V880-F895 HydrophobicContact CG1-CE1 3.9Å; V880-F895 HydrophobicContact CG1-CG 3.8Å; V880-F895 HydrophobicContact CG1-CZ 4.39Å; V880-F895 HydrophobicContact CG2-CD1 4.45Å; V880-F895 HydrophobicContact CG2-CD2 4.27Å; V880-F895 HydrophobicContact CG2-CE1 4.04Å; V880-F895 HydrophobicContact CG2-CE2 3.87Å; V880-F895 HydrophobicContact CG2-CZ 3.75Å; R885-F895 HydrophobicContact CG-CE1 4.33Å; R885-F895 HydrophobicContact CG-CZ 3.91Å; Q893-F895 HydrophobicContact CB-CE2 3.62Å; Q893-F895 HydrophobicContact CB-CZ 3.84Å; F895-V898 HydrophobicContact CB-CG1 3.84Å; F895-V898 PolarHBondContact N-O 2.9Å; F895-V900 HydrophobicContact CD2-CG2 4.18Å; F895-V900 HydrophobicContact CE2-CB 4.23Å; F895-V900 HydrophobicContact CE2-CG2 4.08Å
896	R	86.5	Confident	83.5	Confident	88 Å²	88	30.5 Å²	30.5	33%	0.332	14%	0.141	S	C	.	.	S	Bend	trans	-80.5	123.1	173.5	167.5	-176.8	50.4	159.8	0.8	109.7	S855 M856 E857 S858 D859 V898	S855-R896 VanDerWaalsContact O-CZ 3.23Å; S855-R896 PolarHBondContact O-NH1 3.39Å; S855-R896 PolarHBondContact O-NH2 3.08Å; M856-R896 VanDerWaalsContact C-NH1 3.26Å; M856-R896 PolarHBondContact O-NH1 3.02Å; E857-R896 WeakPolarHBondContact O-CG 3.32Å; S858-R896 CarbonylContact C-O 3.54Å; S858-R896 VanDerWaalsContact CA-O 3.24Å; S858-R896 WeakPolarHBondContact CA-O 3.49Å; S858-R896 PolarHBondContact OG-O 3.05Å; D859-R896 PolarHBondContact N-O 3.09Å; D859-R896 IonicContact OD1-CZ 3.83Å; D859-R896 IonicContact OD1-NE 2.73Å; D859-R896 PolarHBondContact OD1-NE 2.85Å; D859-R896 IonicContact OD1-NH2 3.95Å; D859-R896 PolarHBondContact OD1-NH2 2.64Å; D859-R896 WeakPolarHBondContact OD2-CB 3.15Å; D859-R896 PolarHBondContact OD2-N 2.82Å; R896-V898 PolarHBondContact O-N 2.74Å; R896-V898 VanDerWaalsContact O-N 3.07Å
897	G	88.4	Confident	82.1	Confident	7 Å²	7	36.7 Å²	36.7	7%	0.072	17%	0.171	C	C	.	.	S	Bend	trans	70.3	-2.6	176.4	0	0	0	0	0	115	E917	G897-E917 VanDerWaalsContact CA-OE2 3.25Å; G897-E917 WeakPolarHBondContact CA-OE2 3.03Å; G897-E917 PolarHBondContact N-OE2 3.07Å; G897-E917 WeakPolarHBondContact O-CB 3.36Å; G897-E917 WeakPolarHBondContact O-CG 3.45Å; G897-E917 PolarHBondContact O-N 2.8Å
898	V	93.7	Very high	81.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	128.4	-178.5	65.3	0	0	0	0	111.6	D859 V861 F895 R896 V900 I914 V915 L916	D859-V898 HydrophobicContact CB-CG1 4.29Å; V861-V898 HydrophobicContact CG2-CB 4.44Å; V861-V898 HydrophobicContact CG2-CG1 3.79Å; V861-V898 HydrophobicContact CG2-CG2 3.82Å; F895-V898 HydrophobicContact CB-CG1 3.84Å; F895-V898 PolarHBondContact N-O 2.9Å; R896-V898 PolarHBondContact O-N 2.74Å; R896-V898 VanDerWaalsContact O-N 3.07Å; V898-V900 HydrophobicContact CG2-CG2 4.36Å; V898-I914 HydrophobicContact CG2-CG2 3.5Å; V898-I914 VanDerWaalsContact CG2-CG2 3.5Å; V898-V915 WeakPolarHBondContact CA-O 3.45Å; V898-L916 HydrophobicContact CB-CD2 4.26Å; V898-L916 HydrophobicContact CG2-CD2 3.89Å
899	T	93.6	Very high	81.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	135.6	169.5	-64.7	0	0	0	0	109	T892 R894 Y901 V915 E917	T892-T899 HydrophobicContact CG2-CG2 4.08Å; R894-T899 HydrophobicContact CG-CG2 4.03Å; R894-T899 WeakPolarHBondContact CG-OG1 3.48Å; R894-T899 PolarHBondContact NE-OG1 3.19Å; R894-T899 PolarHBondContact NH2-OG1 3.11Å; T899-Y901 HydrophobicContact CG2-CD1 4.47Å; T899-V915 PolarHBondContact N-O 3.25Å; T899-V915 PolarHBondContact O-N 2.97Å; T899-E917 PolarHBondContact OG1-OE1 2.95Å
900	V	95	Very high	81.6	Confident	0 Å²	0	31 Å²	31	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	134.1	174.3	-176.7	0	0	0	0	108.4	V861 I878 F887 T892 Q893 F895 V898 V912 F913 I914	V861-V900 HydrophobicContact CG1-CG2 4.16Å; V861-V900 HydrophobicContact CG2-CG2 4.1Å; I878-V900 HydrophobicContact CG2-CG1 4.3Å; F887-V900 HydrophobicContact CE1-CB 4.44Å; F887-V900 HydrophobicContact CE1-CG1 4.23Å; F887-V900 WeakPolarHBondContact CE1-O 3.24Å; F887-V900 HydrophobicContact CE2-CG1 4.48Å; F887-V900 HydrophobicContact CZ-CB 4Å; F887-V900 HydrophobicContact CZ-CG1 3.68Å; T892-V900 CarbonylContact C-O 3.52Å; Q893-V900 PolarHBondContact N-O 2.94Å; Q893-V900 PolarHBondContact O-N 3.4Å; Q893-V900 VanDerWaalsContact O-O 3.1Å; F895-V900 HydrophobicContact CD2-CG2 4.18Å; F895-V900 HydrophobicContact CE2-CB 4.23Å; F895-V900 HydrophobicContact CE2-CG2 4.08Å; V898-V900 HydrophobicContact CG2-CG2 4.36Å; V900-V912 HydrophobicContact CG1-CG1 3.91Å; V900-F913 CarbonylContact C-O 3.51Å; V900-F913 WeakPolarHBondContact CA-O 3.49Å; V900-I914 HydrophobicContact CG2-CG1 4.47Å
901	Y	92.3	Very high	82	Confident	3 Å²	3	30.3 Å²	30.3	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	155.6	172.6	62.2	-88.7	0	0	0	112.7	M629 P630 F638 K891 T892 T899 F913 V915	M629-Y901 HydrophobicContact CB-CE1 3.83Å; P630-Y901 WeakPolarHBondContact CD-OH 3.34Å; P630-Y901 HydrophobicContact CG-CE2 4.07Å; F638-Y901 HydrophobicContact CE1-CD2 4.21Å; F638-Y901 AromaticContact CZ-CD2 3.77Å; F638-Y901 HydrophobicContact CZ-CD2 3.77Å; F638-Y901 HydrophobicContact CZ-CE2 4.42Å; F638-Y901 HydrophobicContact CZ-CG 4.22Å; K891-Y901 CarbonylContact O-C 3.43Å; K891-Y901 WeakPolarHBondContact O-CA 3.36Å; K891-Y901 VanDerWaalsContact O-CB 3.31Å; K891-Y901 WeakPolarHBondContact O-CB 3.47Å; T892-Y901 WeakPolarHBondContact OG1-CB 3.37Å; T899-Y901 HydrophobicContact CG2-CD1 4.47Å; Y901-F913 HydrophobicContact CD1-CB 3.86Å; Y901-F913 HydrophobicContact CD2-CB 3.71Å; Y901-F913 AromaticContact CD2-CD2 3.67Å; Y901-F913 HydrophobicContact CD2-CD2 3.67Å; Y901-F913 AromaticContact CD2-CG 3.87Å; Y901-F913 HydrophobicContact CD2-CG 3.87Å; Y901-F913 HydrophobicContact CE1-CB 3.6Å; Y901-F913 HydrophobicContact CE1-CG 4.34Å; Y901-F913 HydrophobicContact CE2-CB 3.43Å; Y901-F913 VanDerWaalsContact CE2-CB 3.43Å; Y901-F913 AromaticContact CE2-CD1 3.96Å; Y901-F913 HydrophobicContact CE2-CD1 3.96Å; Y901-F913 AromaticContact CE2-CD2 3.41Å; Y901-F913 HydrophobicContact CE2-CD2 3.41Å; Y901-F913 VanDerWaalsContact CE2-CD2 3.41Å; Y901-F913 HydrophobicContact CE2-CE2 4.12Å; Y901-F913 AromaticContact CE2-CG 3.32Å; Y901-F913 HydrophobicContact CE2-CG 3.32Å; Y901-F913 HydrophobicContact CG-CB 3.91Å; Y901-F913 AromaticContact CZ-CD1 3.97Å; Y901-F913 AromaticContact CZ-CG 3.6Å; Y901-F913 PolarHBondContact N-O 2.7Å; Y901-F913 PolarHBondContact O-N 2.81Å; Y901-V915 HydrophobicContact CE1-CG2 3.94Å
902	V	90.3	Very high	82.5	Confident	5 Å²	5	28.2 Å²	28.2	3%	0.03	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	156.5	177.6	-55	0	0	0	0	110.6	F638 I878 F887 K891 Q909 E911 V912	F638-V902 WeakPolarHBondContact CE1-O 3.35Å; I878-V902 HydrophobicContact CD1-CG1 3.81Å; F887-V902 HydrophobicContact CB-CB 4.44Å; F887-V902 HydrophobicContact CB-CG1 4.08Å; F887-V902 HydrophobicContact CB-CG2 3.47Å; F887-V902 VanDerWaalsContact CB-CG2 3.47Å; F887-V902 HydrophobicContact CD1-CG1 4.03Å; F887-V902 HydrophobicContact CD1-CG2 4.13Å; F887-V902 HydrophobicContact CD2-CG1 4.28Å; F887-V902 HydrophobicContact CG-CG1 3.89Å; F887-V902 HydrophobicContact CG-CG2 4.05Å; K891-V902 HydrophobicContact CB-CG2 4.39Å; K891-V902 HydrophobicContact CD-CG2 4.14Å; K891-V902 PolarHBondContact O-N 3.45Å; V902-Q909 HydrophobicContact CG1-CB 4.49Å; V902-E911 WeakPolarHBondContact CA-O 3.37Å; V902-V912 HydrophobicContact CG1-CG1 4.41Å; V902-V912 HydrophobicContact CG1-CG2 4.25Å
903	N	81.6	Confident	83	Confident	7 Å²	7	27.6 Å²	27.6	4%	0.037	13%	0.125	C	C	.	.			trans	-92	130.7	-178.5	-142.9	-21.5	0	0	0	111.3	R637 W905 E911 F913	R637-N903 VanDerWaalsContact CA-OD1 3.23Å; R637-N903 WeakPolarHBondContact CA-OD1 3.24Å; R637-N903 WeakPolarHBondContact CB-OD1 3.46Å; R637-N903 VanDerWaalsContact CG-OD1 3.29Å; R637-N903 WeakPolarHBondContact CG-OD1 3.03Å; R637-N903 PolarHBondContact O-OD1 2.83Å; N903-W905 PolarHBondContact ND2-NE1 3.1Å; N903-E911 HydrophobicContact CB-CB 4.17Å; N903-E911 HydrophobicContact CB-CG 4.49Å; N903-E911 WeakPolarHBondContact CB-OE2 3.36Å; N903-E911 PolarHBondContact N-O 2.03Å; N903-E911 PolarHBondContact ND2-OE2 3.1Å; N903-F913 HydrophobicContact CB-CE2 4.34Å
904	D	67.3	Low	83.4	Confident	40 Å²	40	27.2 Å²	27.2	21%	0.214	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-23	-168.6	-164.4	60.1	0	0	0	114.4	R637 R639 K891 K906	R637-D904 WeakPolarHBondContact O-CB 3.34Å; R637-D904 PolarHBondContact O-N 3.19Å; R639-D904 WeakPolarHBondContact CD-OD2 3.39Å; K891-D904 HydrophobicContact CD-CB 4.18Å; K891-D904 WeakPolarHBondContact CD-OD1 3.35Å; K891-D904 WeakPolarHBondContact CE-OD1 3.25Å; K891-D904 HydrophobicContact CG-CB 4.45Å; K891-D904 IonicContact NZ-OD1 3.53Å; K891-D904 PolarHBondContact NZ-OD1 3.26Å; D904-K906 VanDerWaalsContact C-N 3.29Å; D904-K906 PolarHBondContact O-N 3.47Å
905	W	57	Low	83.8	Confident	157 Å²	157	26 Å²	26	60%	0.595	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-18.2	-179.9	71.7	-66.2	0	0	0	114.8	N903 I931	N903-W905 PolarHBondContact ND2-NE1 3.1Å; W905-I931 HydrophobicContact CE3-CD1 4.05Å; W905-I931 HydrophobicContact CZ3-CD1 4.04Å
906	K	55.3	Low	84	Confident	11 Å²	11	25.3 Å²	25.3	5%	0.048	12%	0.115	C	C	.	.	S	Bend	trans	-107.1	116	178.6	-50.9	-149.6	172	-167	0	110.9	D904 G908 C910 E911 I931	D904-K906 VanDerWaalsContact C-N 3.29Å; D904-K906 PolarHBondContact O-N 3.47Å; K906-G908 PolarHBondContact O-N 2.86Å; K906-C910 WeakPolarHBondContact CB-SG 3.32Å; K906-C910 WeakPolarHBondContact CD-SG 3.24Å; K906-E911 HydrophobicContact CD-CB 4.48Å; K906-I931 HydrophobicContact CB-CD1 3.93Å; K906-I931 HydrophobicContact CD-CD1 3.66Å; K906-I931 HydrophobicContact CD-CG1 4.25Å; K906-I931 HydrophobicContact CG-CD1 3.54Å
907	E	59.7	Low	84.1	Confident	176 Å²	176	23.1 Å²	23.1	82%	0.822	11%	0.109	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	136.6	178.5	-63.3	-171.6	155.7	0	0	111.9
908	G	67.2	Low	84.1	Confident	15 Å²	15	27.2 Å²	27.2	16%	0.155	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	38.9	167.5	0	0	0	0	0	117	K873 Y874 R875 K906 C910	K873-G908 WeakPolarHBondContact O-CA 3.37Å; Y874-G908 CarbonylContact C-O 3.56Å; Y874-G908 VanDerWaalsContact CA-O 3.29Å; Y874-G908 WeakPolarHBondContact CA-O 3.07Å; R875-G908 PolarHBondContact N-O 2.87Å; K906-G908 PolarHBondContact O-N 2.86Å; G908-C910 PolarHBondContact O-N 2.91Å; G908-C910 VanDerWaalsContact O-N 3.16Å
909	Q	82.1	Confident	83.9	Confident	8 Å²	8	27.2 Å²	27.2	4%	0.037	13%	0.127	C	C	.	.	S	Bend	trans	59.1	27.7	171.2	-52.6	174.3	-86	0	0	114.4	Y874 T876 R885 V902 E911 V912	Y874-Q909 HydrophobicContact CD1-CG 4.04Å; T876-Q909 PolarHBondContact OG1-O 2.9Å; R885-Q909 PolarHBondContact O-NE2 2.77Å; V902-Q909 HydrophobicContact CG1-CB 4.49Å; Q909-E911 VanDerWaalsContact C-N 3.31Å; Q909-E911 PolarHBondContact O-N 3.36Å; Q909-V912 WeakPolarHBondContact O-CG2 3.45Å
910	C	86	Confident	83.8	Confident	2 Å²	2	30 Å²	30	1%	0.014	14%	0.137	C	C	.	.			trans	-83.9	0.8	-173.3	76.9	0	0	0	0	115.4	R875 K906 G908 Q926 E927 S930	R875-C910 HydrophobicContact CB-CB 3.53Å; R875-C910 HydrophobicContact CG-CB 3.56Å; K906-C910 WeakPolarHBondContact CB-SG 3.32Å; K906-C910 WeakPolarHBondContact CD-SG 3.24Å; G908-C910 PolarHBondContact O-N 2.91Å; G908-C910 VanDerWaalsContact O-N 3.16Å; C910-Q926 CarbonylContact O-C 3.56Å; C910-Q926 VanDerWaalsContact O-CA 3.3Å; C910-Q926 WeakPolarHBondContact O-CA 3.47Å; C910-Q926 WeakPolarHBondContact O-CG 3.31Å; C910-E927 HydrophobicContact CB-CB 4.07Å; C910-E927 PolarHBondContact O-N 2.04Å; C910-S930 PolarHBondContact SG-OG 3.16Å
911	E	90.2	Very high	83.8	Confident	9 Å²	9	30 Å²	30	4%	0.042	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	116.7	163.8	-170.6	178.1	-147.9	0	0	109	V902 N903 K906 Q909 F913 R924 Q926	V902-E911 WeakPolarHBondContact CA-O 3.37Å; N903-E911 HydrophobicContact CB-CB 4.17Å; N903-E911 HydrophobicContact CB-CG 4.49Å; N903-E911 WeakPolarHBondContact CB-OE2 3.36Å; N903-E911 PolarHBondContact N-O 2.03Å; N903-E911 PolarHBondContact ND2-OE2 3.1Å; K906-E911 HydrophobicContact CD-CB 4.48Å; Q909-E911 VanDerWaalsContact C-N 3.31Å; Q909-E911 PolarHBondContact O-N 3.36Å; E911-F913 HydrophobicContact CG-CD2 4.5Å; E911-F913 HydrophobicContact CG-CE2 3.71Å; E911-F913 HydrophobicContact CG-CZ 4.05Å; E911-R924 HydrophobicContact CG-CG 4.33Å; E911-R924 WeakPolarHBondContact OE1-CD 3.19Å; E911-R924 IonicContact OE1-CZ 2.71Å; E911-R924 IonicContact OE1-NE 3.28Å; E911-R924 IonicContact OE1-NH1 3.76Å; E911-R924 PolarHBondContact OE1-NH1 2.88Å; E911-Q926 HydrophobicContact CB-CG 4.06Å; E911-Q926 HydrophobicContact CG-CB 4.44Å; E911-Q926 HydrophobicContact CG-CG 4.09Å
912	V	94.2	Very high	84	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	133.7	-173.9	-171.8	0	0	0	0	109.3	V863 I878 V900 V902 Q909 I925	V863-V912 HydrophobicContact CG1-CB 4.46Å; V863-V912 HydrophobicContact CG1-CG2 4.23Å; V863-V912 HydrophobicContact CG2-CG1 4.04Å; I878-V912 HydrophobicContact CD1-CB 4.41Å; I878-V912 HydrophobicContact CD1-CG1 3.69Å; I878-V912 HydrophobicContact CD1-CG2 3.76Å; I878-V912 HydrophobicContact CG1-CG1 4.25Å; I878-V912 HydrophobicContact CG1-CG2 4.17Å; V900-V912 HydrophobicContact CG1-CG1 3.91Å; V902-V912 HydrophobicContact CG1-CG1 4.41Å; V902-V912 HydrophobicContact CG1-CG2 4.25Å; Q909-V912 WeakPolarHBondContact O-CG2 3.45Å; V912-I925 PolarHBondContact N-O 2.94Å; V912-I925 PolarHBondContact O-N 3.13Å
913	F	95.8	Very high	84.4	Confident	1 Å²	1	29.6 Å²	29.6	0%	0.004	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	139	175.3	-61.9	-98.5	0	0	0	109.7	I625 V900 Y901 N903 E911 L923 R924	I625-F913 HydrophobicContact CD1-CD1 4.31Å; I625-F913 HydrophobicContact CD1-CE1 4.4Å; I625-F913 HydrophobicContact CG1-CD1 4.15Å; I625-F913 HydrophobicContact CG1-CE1 4.33Å; I625-F913 HydrophobicContact CG2-CB 4.48Å; I625-F913 HydrophobicContact CG2-CD1 3.98Å; V900-F913 CarbonylContact C-O 3.51Å; V900-F913 WeakPolarHBondContact CA-O 3.49Å; Y901-F913 HydrophobicContact CD1-CB 3.86Å; Y901-F913 HydrophobicContact CD2-CB 3.71Å; Y901-F913 AromaticContact CD2-CD2 3.67Å; Y901-F913 HydrophobicContact CD2-CD2 3.67Å; Y901-F913 AromaticContact CD2-CG 3.87Å; Y901-F913 HydrophobicContact CD2-CG 3.87Å; Y901-F913 HydrophobicContact CE1-CB 3.6Å; Y901-F913 HydrophobicContact CE1-CG 4.34Å; Y901-F913 HydrophobicContact CE2-CB 3.43Å; Y901-F913 VanDerWaalsContact CE2-CB 3.43Å; Y901-F913 AromaticContact CE2-CD1 3.96Å; Y901-F913 HydrophobicContact CE2-CD1 3.96Å; Y901-F913 AromaticContact CE2-CD2 3.41Å; Y901-F913 HydrophobicContact CE2-CD2 3.41Å; Y901-F913 VanDerWaalsContact CE2-CD2 3.41Å; Y901-F913 HydrophobicContact CE2-CE2 4.12Å; Y901-F913 AromaticContact CE2-CG 3.32Å; Y901-F913 HydrophobicContact CE2-CG 3.32Å; Y901-F913 HydrophobicContact CG-CB 3.91Å; Y901-F913 AromaticContact CZ-CD1 3.97Å; Y901-F913 AromaticContact CZ-CG 3.6Å; Y901-F913 PolarHBondContact N-O 2.7Å; Y901-F913 PolarHBondContact O-N 2.81Å; N903-F913 HydrophobicContact CB-CE2 4.34Å; E911-F913 HydrophobicContact CG-CD2 4.5Å; E911-F913 HydrophobicContact CG-CE2 3.71Å; E911-F913 HydrophobicContact CG-CZ 4.05Å; F913-L923 CarbonylContact C-O 3.51Å; F913-L923 VanDerWaalsContact CA-O 3.25Å; F913-L923 WeakPolarHBondContact CA-O 3.17Å; F913-R924 HydrophobicContact CD1-CB 3.94Å; F913-R924 HydrophobicContact CD1-CG 3.96Å; F913-R924 HydrophobicContact CE1-CB 3.87Å; F913-R924 VanDerWaalsContact CE1-CD 3.5Å; F913-R924 HydrophobicContact CE1-CG 3.52Å; F913-R924 HydrophobicContact CZ-CG 3.85Å
914	I	97.4	Very high	85	Confident	1 Å²	1	32 Å²	32	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.9	175.7	-54.3	174.2	0	0	0	107.6	V850 V861 V863 V898 V900 G922 L923 I925	V850-I914 HydrophobicContact CG2-CD1 3.97Å; V861-I914 HydrophobicContact CB-CD1 4.31Å; V861-I914 HydrophobicContact CG1-CD1 3.8Å; V861-I914 HydrophobicContact CG1-CG1 4.42Å; V863-I914 HydrophobicContact CG2-CD1 3.95Å; V898-I914 HydrophobicContact CG2-CG2 3.5Å; V898-I914 VanDerWaalsContact CG2-CG2 3.5Å; V900-I914 HydrophobicContact CG2-CG1 4.47Å; I914-G922 CarbonylContact O-C 3.5Å; I914-G922 WeakPolarHBondContact O-CA 3.21Å; I914-L923 HydrophobicContact CB-CB 4.25Å; I914-L923 HydrophobicContact CB-CD1 4.14Å; I914-L923 HydrophobicContact CG2-CD1 4.31Å; I914-L923 PolarHBondContact N-O 3.45Å; I914-L923 PolarHBondContact O-N 2.7Å; I914-I925 HydrophobicContact CD1-CD1 3.67Å; I914-I925 HydrophobicContact CG1-CD1 4.39Å
915	V	95.9	Very high	86.4	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	120.3	176.4	-179.8	0	0	0	0	109.2	I625 G626 A656 V898 T899 Y901	I625-V915 HydrophobicContact CG2-CG2 4.12Å; I625-V915 WeakPolarHBondContact O-CG2 3.04Å; G626-V915 WeakPolarHBondContact O-CG1 3.19Å; A656-V915 HydrophobicContact CB-CG1 3.78Å; V898-V915 WeakPolarHBondContact CA-O 3.45Å; T899-V915 PolarHBondContact N-O 3.25Å; T899-V915 PolarHBondContact O-N 2.97Å; Y901-V915 HydrophobicContact CE1-CG2 3.94Å
916	L	94.7	Very high	88	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.005	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	122.9	174.3	-58.4	175.2	0	0	0	109	V810 V850 E852 V898 S919 R920 I921	V810-L916 HydrophobicContact CG1-CD1 3.61Å; V850-L916 HydrophobicContact CG1-CD1 3.84Å; V850-L916 HydrophobicContact CG1-CD2 3.61Å; V850-L916 HydrophobicContact CG1-CG 4.13Å; E852-L916 HydrophobicContact CB-CB 4.46Å; E852-L916 HydrophobicContact CB-CD1 4.43Å; E852-L916 HydrophobicContact CB-CD2 3.98Å; E852-L916 WeakPolarHBondContact OE1-CB 3.04Å; V898-L916 HydrophobicContact CB-CD2 4.26Å; V898-L916 HydrophobicContact CG2-CD2 3.89Å; L916-S919 WeakPolarHBondContact CB-OG 3.09Å; L916-R920 VanDerWaalsContact O-CA 3.22Å; L916-R920 WeakPolarHBondContact O-CA 3.5Å; L916-R920 PolarHBondContact O-N 2.81Å; L916-I921 HydrophobicContact CD1-CB 4.3Å; L916-I921 HydrophobicContact CD1-CG2 4.43Å; L916-I921 PolarHBondContact N-O 3.26Å
917	E	89.3	Confident	89.6	Confident	42 Å²	42	22.8 Å²	22.8	20%	0.196	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-28.1	-159.9	-64.6	177.6	160	0	0	113.3	E852 R894 G897 T899	E852-E917 PolarHBondContact OE2-N 2.81Å; R894-E917 IonicContact CZ-OE1 2.77Å; R894-E917 IonicContact NE-OE1 2.76Å; R894-E917 PolarHBondContact NE-OE1 2.91Å; R894-E917 VanDerWaalsContact NH2-CD 3.34Å; R894-E917 IonicContact NH2-OE1 2.65Å; R894-E917 PolarHBondContact NH2-OE1 3.09Å; G897-E917 VanDerWaalsContact CA-OE2 3.25Å; G897-E917 WeakPolarHBondContact CA-OE2 3.03Å; G897-E917 PolarHBondContact N-OE2 3.07Å; G897-E917 WeakPolarHBondContact O-CB 3.36Å; G897-E917 WeakPolarHBondContact O-CG 3.45Å; G897-E917 PolarHBondContact O-N 2.8Å; T899-E917 PolarHBondContact OG1-OE1 2.95Å
918	Q	87.1	Confident	90.7	Very high	93 Å²	93	14.4 Å²	14.4	44%	0.435	7%	0.067	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-43.8	-179.3	-53.8	179.7	12.9	0	0	112.2	P808 E852 R920	P808-Q918 HydrophobicContact CG-CB 3.99Å; E852-Q918 VanDerWaalsContact OE2-CB 3.27Å; E852-Q918 WeakPolarHBondContact OE2-CB 3.48Å; E852-Q918 WeakPolarHBondContact OE2-CG 3.46Å; E852-Q918 PolarHBondContact OE2-N 2.96Å; Q918-R920 VanDerWaalsContact C-N 3.33Å
919	S	89.4	Confident	91.1	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.007	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-15.9	176.2	59.3	0	0	0	0	113.8	E852 L916 I921 Y956	E852-S919 WeakPolarHBondContact OE1-CB 3.33Å; E852-S919 PolarHBondContact OE1-N 3.41Å; E852-S919 PolarHBondContact OE1-OG 2.91Å; L916-S919 WeakPolarHBondContact CB-OG 3.09Å; S919-I921 PolarHBondContact O-N 3.1Å; S919-Y956 WeakPolarHBondContact CA-OH 3.29Å; S919-Y956 VanDerWaalsContact CB-OH 3.24Å; S919-Y956 WeakPolarHBondContact CB-OH 3.03Å; S919-Y956 WeakPolarHBondContact O-CE2 3.44Å; S919-Y956 PolarHBondContact O-OH 3.14Å
920	R	92.4	Very high	90.4	Very high	57 Å²	57	14 Å²	14	22%	0.215	6%	0.061	C	C	.	.			trans	57.2	29	-177.3	-47.5	-176.2	-74.4	179.6	-5.8	112.6	G626 R627 H657 L916 Q918 P953 E955	G626-R920 CarbonylContact C-O 3.54Å; G626-R920 VanDerWaalsContact CA-O 3.24Å; G626-R920 WeakPolarHBondContact CA-O 3.44Å; R627-R920 HydrophobicContact CG-CB 4.01Å; H657-R920 WeakPolarHBondContact NE2-CD 3.26Å; L916-R920 VanDerWaalsContact O-CA 3.22Å; L916-R920 WeakPolarHBondContact O-CA 3.5Å; L916-R920 PolarHBondContact O-N 2.81Å; Q918-R920 VanDerWaalsContact C-N 3.33Å; R920-P953 HydrophobicContact CB-CG 3.89Å; R920-P953 WeakPolarHBondContact O-CD 3.22Å; R920-P953 VanDerWaalsContact O-CG 3.23Å; R920-P953 WeakPolarHBondContact O-CG 3.43Å; R920-E955 IonicContact CZ-OE1 3.98Å; R920-E955 IonicContact CZ-OE2 3.24Å; R920-E955 IonicContact NE-OE1 2.6Å; R920-E955 PolarHBondContact NE-OE1 3.02Å; R920-E955 IonicContact NH2-OE1 3.96Å; R920-E955 PolarHBondContact NH2-OE1 2.89Å; R920-E955 IonicContact NH2-OE2 2.74Å; R920-E955 PolarHBondContact NH2-OE2 2.53Å
921	I	95	Very high	89.3	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.067	C	C	.	.			trans	-87.9	133	175.4	-68.2	176.7	0	0	0	109	V810 I812 L916 S919 V950 V952 Y956	V810-I921 HydrophobicContact CG1-CD1 4.32Å; V810-I921 HydrophobicContact CG2-CD1 4.38Å; I812-I921 HydrophobicContact CD1-CG2 4.06Å; L916-I921 HydrophobicContact CD1-CB 4.3Å; L916-I921 HydrophobicContact CD1-CG2 4.43Å; L916-I921 PolarHBondContact N-O 3.26Å; S919-I921 PolarHBondContact O-N 3.1Å; I921-V950 HydrophobicContact CG2-CG1 4.06Å; I921-V952 HydrophobicContact CD1-CG1 4.31Å; I921-V952 HydrophobicContact CD1-CG2 4.28Å; I921-V952 HydrophobicContact CG1-CG1 4.19Å; I921-V952 HydrophobicContact CG1-CG2 4.19Å; I921-V952 HydrophobicContact CG2-CG2 4.25Å; I921-Y956 HydrophobicContact CG1-CE2 4.44Å
922	G	96.6	Very high	88	Confident	0 Å²	0	18 Å²	18	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	143.9	-179.6	0	0	0	0	0	112.4	I914 S951	I914-G922 CarbonylContact O-C 3.5Å; I914-G922 WeakPolarHBondContact O-CA 3.21Å; G922-S951 PolarHBondContact N-O 2.98Å; G922-S951 PolarHBondContact O-N 3.44Å
923	L	97.8	Very high	86.3	Confident	0 Å²	0	18 Å²	18	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	143.9	171.7	-57.8	86.8	0	0	0	110.1	I812 V848 V850 F913 I914 L949 V950	I812-L923 HydrophobicContact CD1-CD1 3.99Å; I812-L923 HydrophobicContact CD1-CD2 3.98Å; I812-L923 HydrophobicContact CD1-CG 4.16Å; I812-L923 HydrophobicContact CG1-CD2 4.31Å; I812-L923 HydrophobicContact CG2-CD2 3.77Å; V848-L923 HydrophobicContact CG1-CD2 4.15Å; V850-L923 HydrophobicContact CG1-CD1 4.27Å; V850-L923 HydrophobicContact CG2-CD1 4.3Å; V850-L923 HydrophobicContact CG2-CD2 3.65Å; F913-L923 CarbonylContact C-O 3.51Å; F913-L923 VanDerWaalsContact CA-O 3.25Å; F913-L923 WeakPolarHBondContact CA-O 3.17Å; I914-L923 HydrophobicContact CB-CB 4.25Å; I914-L923 HydrophobicContact CB-CD1 4.14Å; I914-L923 HydrophobicContact CG2-CD1 4.31Å; I914-L923 PolarHBondContact N-O 3.45Å; I914-L923 PolarHBondContact O-N 2.7Å; L923-L949 CarbonylContact C-O 3.58Å; L923-L949 VanDerWaalsContact CA-O 3.31Å; L923-L949 WeakPolarHBondContact CA-O 3.31Å; L923-V950 HydrophobicContact CD2-CG2 4.08Å; L923-V950 HydrophobicContact CG-CG1 4.41Å; L923-V950 HydrophobicContact CG-CG2 4.15Å
924	R	95.6	Very high	84.7	Confident	58 Å²	58	21.3 Å²	21.3	22%	0.219	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.5	163.8	-177.1	179.7	85.3	101.4	4.5	108.1	I625 E911 F913 V948 L949	I625-R924 HydrophobicContact CD1-CB 3.8Å; E911-R924 HydrophobicContact CG-CG 4.33Å; E911-R924 WeakPolarHBondContact OE1-CD 3.19Å; E911-R924 IonicContact OE1-CZ 2.71Å; E911-R924 IonicContact OE1-NE 3.28Å; E911-R924 IonicContact OE1-NH1 3.76Å; E911-R924 PolarHBondContact OE1-NH1 2.88Å; F913-R924 HydrophobicContact CD1-CB 3.94Å; F913-R924 HydrophobicContact CD1-CG 3.96Å; F913-R924 HydrophobicContact CE1-CB 3.87Å; F913-R924 VanDerWaalsContact CE1-CD 3.5Å; F913-R924 HydrophobicContact CE1-CG 3.52Å; F913-R924 HydrophobicContact CZ-CG 3.85Å; R924-V948 CarbonylContact O-C 3.55Å; R924-V948 WeakPolarHBondContact O-CA 3.48Å; R924-L949 HydrophobicContact CB-CB 4.41Å; R924-L949 PolarHBondContact N-O 3.07Å; R924-L949 PolarHBondContact O-N 3.4Å
925	I	95.4	Very high	83.2	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	119.6	-177.1	-59.2	159.9	0	0	0	106.5	V848 V863 V912 I914 L946 V948	V848-I925 HydrophobicContact CB-CD1 3.79Å; V848-I925 HydrophobicContact CB-CG1 4.41Å; V848-I925 HydrophobicContact CG1-CD1 4.01Å; V848-I925 HydrophobicContact CG2-CD1 3.95Å; V848-I925 HydrophobicContact CG2-CG1 4.02Å; V848-I925 HydrophobicContact CG2-CG2 4.13Å; V863-I925 HydrophobicContact CB-CD1 3.96Å; V863-I925 HydrophobicContact CB-CG2 4.33Å; V863-I925 HydrophobicContact CG1-CB 4.42Å; V863-I925 HydrophobicContact CG1-CD1 4.47Å; V863-I925 HydrophobicContact CG1-CG2 3.79Å; V863-I925 HydrophobicContact CG2-CD1 3.97Å; V912-I925 PolarHBondContact N-O 2.94Å; V912-I925 PolarHBondContact O-N 3.13Å; I914-I925 HydrophobicContact CD1-CD1 3.67Å; I914-I925 HydrophobicContact CG1-CD1 4.39Å; I925-L946 HydrophobicContact CG2-CD1 4.15Å; I925-V948 HydrophobicContact CG1-CG1 4.15Å
926	Q	91.2	Very high	81.6	Confident	15 Å²	15	34 Å²	34	7%	0.07	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	137	-172.2	-162.1	-157.7	-66.9	0	0	110.2	C910 E911 S928 L946 N947	C910-Q926 CarbonylContact O-C 3.56Å; C910-Q926 VanDerWaalsContact O-CA 3.3Å; C910-Q926 WeakPolarHBondContact O-CA 3.47Å; C910-Q926 WeakPolarHBondContact O-CG 3.31Å; E911-Q926 HydrophobicContact CB-CG 4.06Å; E911-Q926 HydrophobicContact CG-CB 4.44Å; E911-Q926 HydrophobicContact CG-CG 4.09Å; Q926-S928 PolarHBondContact O-N 3.24Å; Q926-L946 CarbonylContact O-C 3.58Å; Q926-L946 WeakPolarHBondContact O-CA 3.27Å; Q926-N947 PolarHBondContact N-O 3.18Å; Q926-N947 PolarHBondContact O-N 3.31Å
927	E	88.4	Confident	79.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	126.2	161.6	-168.8	-170.2	-143	0	0	108.6	L865 R875 C910 S930 S942 L945 L946	L865-E927 HydrophobicContact CD1-CG 4.07Å; R875-E927 HydrophobicContact CB-CB 4.33Å; R875-E927 VanDerWaalsContact CB-OE2 3.24Å; R875-E927 WeakPolarHBondContact CB-OE2 3.31Å; R875-E927 VanDerWaalsContact CD-OE2 3.27Å; R875-E927 WeakPolarHBondContact CD-OE2 3.43Å; R875-E927 WeakPolarHBondContact CG-OE2 3.48Å; C910-E927 HydrophobicContact CB-CB 4.07Å; C910-E927 PolarHBondContact O-N 2.04Å; E927-S930 WeakPolarHBondContact OE2-CB 3.49Å; E927-S942 VanDerWaalsContact CD-OG 3.29Å; E927-S942 VanDerWaalsContact OE1-CB 3.25Å; E927-S942 WeakPolarHBondContact OE1-CB 3.33Å; E927-S942 PolarHBondContact OE1-OG 2.97Å; E927-S942 WeakPolarHBondContact OE2-CB 3.39Å; E927-S942 PolarHBondContact OE2-OG 3.42Å; E927-L945 WeakPolarHBondContact CA-O 3.1Å; E927-L946 HydrophobicContact CB-CD2 4.49Å
928	S	83.7	Confident	78.3	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	132.4	-178.6	-33.2	0	0	0	0	109.8	Q926 S930 L945 N947	Q926-S928 PolarHBondContact O-N 3.24Å; S928-S930 PolarHBondContact O-N 3.06Å; S928-S930 VanDerWaalsContact O-N 3.13Å; S928-L945 PolarHBondContact N-O 3.08Å; S928-L945 WeakPolarHBondContact OG-CD1 3.41Å; S928-L945 PolarHBondContact OG-O 3.37Å; S928-N947 PolarHBondContact OG-N 2.91Å; S928-N947 PolarHBondContact OG-ND2 3.46Å; S928-N947 PolarHBondContact OG-OD1 3.12Å
929	Y	75.6	Confident	76.8	Confident	10 Å²	10	45.7 Å²	45.7	4%	0.039	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	19.1	170.7	-39.6	-54.5	0	0	0	116.8	I931 E932 I933 L1118 L1121 L1122 E1125	Y929-I931 VanDerWaalsContact C-N 3.29Å; Y929-I931 PolarHBondContact O-N 3.37Å; Y929-E932 VanDerWaalsContact CA-OE2 3.23Å; Y929-E932 WeakPolarHBondContact CA-OE2 3.46Å; Y929-E932 PolarHBondContact O-N 2.85Å; Y929-I933 WeakPolarHBondContact O-CB 3.37Å; Y929-I933 WeakPolarHBondContact O-CD1 3.48Å; Y929-I933 VanDerWaalsContact O-CG1 3.24Å; Y929-I933 WeakPolarHBondContact O-CG1 3.35Å; Y929-I933 PolarHBondContact O-N 2.87Å; Y929-L1118 HydrophobicContact CD2-CD1 3.37Å; Y929-L1118 HydrophobicContact CD2-CG 4.46Å; Y929-L1118 HydrophobicContact CE2-CD1 3.51Å; Y929-L1118 HydrophobicContact CE2-CG 4.2Å; Y929-L1121 HydrophobicContact CD1-CB 3.59Å; Y929-L1121 HydrophobicContact CD1-CD1 4.1Å; Y929-L1121 HydrophobicContact CD1-CG 4.41Å; Y929-L1121 HydrophobicContact CE1-CB 3.77Å; Y929-L1121 HydrophobicContact CG-CB 4.03Å; Y929-L1121 HydrophobicContact CG-CD1 3.88Å; Y929-L1122 WeakPolarHBondContact OH-CA 3.31Å; Y929-E1125 HydrophobicContact CE1-CB 4.36Å; Y929-E1125 WeakPolarHBondContact CE1-OE2 3.33Å; Y929-E1125 PolarHBondContact OH-OE2 2.94Å
930	S	66.8	Low	75	Confident	4 Å²	4	54.9 Å²	54.9	3%	0.028	26%	0.257	C	S	.	.	H	α-helix	trans	-59.2	-29.1	-172.9	58.5	0	0	0	0	115.7	C910 E927 S928 T934	C910-S930 PolarHBondContact SG-OG 3.16Å; E927-S930 WeakPolarHBondContact OE2-CB 3.49Å; S928-S930 PolarHBondContact O-N 3.06Å; S928-S930 VanDerWaalsContact O-N 3.13Å; S930-T934 WeakPolarHBondContact O-CG2 3.13Å; S930-T934 PolarHBondContact O-OG1 2.78Å
931	I	62.5	Low	73.5	Confident	29 Å²	29	56.2 Å²	56.2	15%	0.149	27%	0.265	C	S	.	.	H	α-helix	trans	-94.4	-31.9	179.2	-73.3	-178.5	0	0	0	111.7	W905 K906 Y929 T934 R935	W905-I931 HydrophobicContact CE3-CD1 4.05Å; W905-I931 HydrophobicContact CZ3-CD1 4.04Å; K906-I931 HydrophobicContact CB-CD1 3.93Å; K906-I931 HydrophobicContact CD-CD1 3.66Å; K906-I931 HydrophobicContact CD-CG1 4.25Å; K906-I931 HydrophobicContact CG-CD1 3.54Å; Y929-I931 VanDerWaalsContact C-N 3.29Å; Y929-I931 PolarHBondContact O-N 3.37Å; I931-T934 PolarHBondContact O-OG1 3.19Å; I931-R935 WeakPolarHBondContact O-CD 3.38Å; I931-R935 WeakPolarHBondContact O-CG 3.47Å
932	E	62.5	Low	72.2	Confident	65 Å²	65	56.3 Å²	56.3	30%	0.304	27%	0.266	S	S	.	.	H	α-helix	trans	-69.7	-51.1	-179.9	-64.9	68.6	-154.8	0	0	109.5	Y929 T934 R935 H936 L1121	Y929-E932 VanDerWaalsContact CA-OE2 3.23Å; Y929-E932 WeakPolarHBondContact CA-OE2 3.46Å; Y929-E932 PolarHBondContact O-N 2.85Å; E932-T934 PolarHBondContact O-N 3.37Å; E932-R935 PolarHBondContact O-N 2.86Å; E932-H936 PolarHBondContact O-CD2 2.03Å; E932-L1121 HydrophobicContact CB-CD1 4.24Å; E932-L1121 HydrophobicContact CB-CD2 4.35Å; E932-L1121 HydrophobicContact CG-CD2 4.33Å
933	I	59	Low	71.1	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-44	-176.1	-64.6	163.4	0	0	0	111.7	Y929 R935 H936 Y939 E941 L943	Y929-I933 WeakPolarHBondContact O-CB 3.37Å; Y929-I933 WeakPolarHBondContact O-CD1 3.48Å; Y929-I933 VanDerWaalsContact O-CG1 3.24Å; Y929-I933 WeakPolarHBondContact O-CG1 3.35Å; Y929-I933 PolarHBondContact O-N 2.87Å; I933-R935 PolarHBondContact O-N 3.49Å; I933-H936 PolarHBondContact O-N 3.11Å; I933-Y939 HydrophobicContact CG2-CG 4.29Å; I933-E941 WeakPolarHBondContact CG2-O 3.32Å; I933-L943 HydrophobicContact CD1-CB 3.8Å; I933-L943 HydrophobicContact CD1-CD1 3.76Å; I933-L943 HydrophobicContact CD1-CG 3.69Å; I933-L943 HydrophobicContact CG1-CD1 4.43Å
934	T	61.4	Low	70.3	Confident	72 Å²	72	57 Å²	57	44%	0.442	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-5.3	-177.9	44.7	0	0	0	0	114.4	S930 I931 E932	S930-T934 WeakPolarHBondContact O-CG2 3.13Å; S930-T934 PolarHBondContact O-OG1 2.78Å; I931-T934 PolarHBondContact O-OG1 3.19Å; E932-T934 PolarHBondContact O-N 3.37Å
935	R	66.4	Low	69.9	Low	192 Å²	192	54.3 Å²	54.3	73%	0.725	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-6.6	171.6	-64.3	169.6	177.8	179.3	-0.4	113.5	I931 E932 I933	I931-R935 WeakPolarHBondContact O-CD 3.38Å; I931-R935 WeakPolarHBondContact O-CG 3.47Å; E932-R935 PolarHBondContact O-N 2.86Å; I933-R935 PolarHBondContact O-N 3.49Å
936	H	62.7	Low	69.8	Low	75 Å²	75	54.4 Å²	54.4	35%	0.347	26%	0.26	S	S	.	.			trans	-105.1	112.8	-179	-67.2	-73.1	0	0	0	111.6	E932 I933 N938 Y939 Y1117	E932-H936 PolarHBondContact O-CD2 2.03Å; I933-H936 PolarHBondContact O-N 3.11Å; H936-N938 PolarHBondContact O-N 3.43Å; H936-Y939 HydrophobicContact CB-CD2 4.07Å; H936-Y939 PolarHBondContact O-N 3.19Å; H936-Y1117 AromaticContact CD2-CE1 3.73Å; H936-Y1117 PolarHBondContact CE1-OH 2.76Å; H936-Y1117 AromaticContact NE2-CE1 3.74Å; H936-Y1117 AromaticContact NE2-CZ 3.53Å; H936-Y1117 PolarHBondContact NE2-OH 2.98Å
937	L	55.5	Low	69.9	Low	175 Å²	175	54 Å²	54	92%	0.916	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-18	178.1	-66.4	166.1	0	0	0	114.7
938	N	58.3	Low	70.3	Confident	151 Å²	151	54.1 Å²	54.1	81%	0.807	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-4.5	178.7	-60.9	13.6	0	0	0	113.5	H936	H936-N938 PolarHBondContact O-N 3.43Å
939	Y	56.5	Low	70.8	Confident	56 Å²	56	54.7 Å²	54.7	22%	0.22	26%	0.262	C	S	.	.			trans	-132.2	96.2	-179.2	-68.3	-77.6	0	0	0	109.7	I933 H936 E941 L943 Q1115 Y1117	I933-Y939 HydrophobicContact CG2-CG 4.29Å; H936-Y939 HydrophobicContact CB-CD2 4.07Å; H936-Y939 PolarHBondContact O-N 3.19Å; Y939-E941 VanDerWaalsContact C-N 3.33Å; Y939-E941 PolarHBondContact O-N 2.97Å; Y939-L943 HydrophobicContact CD1-CD2 4.46Å; Y939-Q1115 PolarHBondContact OH-OE1 2.01Å; Y939-Y1117 AromaticContact CE2-CD1 3.8Å; Y939-Y1117 HydrophobicContact CE2-CD1 3.8Å; Y939-Y1117 HydrophobicContact CE2-CG 4.49Å
940	E	51.1	Low	71.8	Confident	194 Å²	194	54.3 Å²	54.3	91%	0.907	26%	0.261	S	S	*	.			trans	-69.7	-25.3	-170.4	-59.6	-172.4	133.5	0	0	114.2
941	E	62.1	Low	73.2	Confident	84 Å²	84	54.1 Å²	54.1	39%	0.393	26%	0.26	S	S	.	.	S	Bend	trans	-134.4	162	178.8	-64.4	-162.9	148.2	0	0	112.6	I933 Y939	I933-E941 WeakPolarHBondContact CG2-O 3.32Å; Y939-E941 VanDerWaalsContact C-N 3.33Å; Y939-E941 PolarHBondContact O-N 2.97Å
942	S	67.1	Low	74.7	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.021	25%	0.252	C	S	.	.			trans	-64.4	138.9	174.6	54	0	0	0	0	110.4	R871 R875 E927 G944	R871-S942 PolarHBondContact NH1-O 3.09Å; R875-S942 PolarHBondContact NH1-OG 2.99Å; E927-S942 VanDerWaalsContact CD-OG 3.29Å; E927-S942 VanDerWaalsContact OE1-CB 3.25Å; E927-S942 WeakPolarHBondContact OE1-CB 3.33Å; E927-S942 PolarHBondContact OE1-OG 2.97Å; E927-S942 WeakPolarHBondContact OE2-CB 3.39Å; E927-S942 PolarHBondContact OE2-OG 3.42Å; S942-G944 VanDerWaalsContact C-N 3.27Å; S942-G944 PolarHBondContact O-N 3.28Å
943	L	73.3	Confident	76.1	Confident	14 Å²	14	49.7 Å²	49.7	7%	0.073	24%	0.238	C	C	.	.			trans	-65	-29.3	-169.3	-78.3	169.7	0	0	0	112.9	Y819 I933 Y939 L945 L1118	Y819-L943 WeakPolarHBondContact CE2-O 3.19Å; Y819-L943 PolarHBondContact OH-O 3.28Å; I933-L943 HydrophobicContact CD1-CB 3.8Å; I933-L943 HydrophobicContact CD1-CD1 3.76Å; I933-L943 HydrophobicContact CD1-CG 3.69Å; I933-L943 HydrophobicContact CG1-CD1 4.43Å; Y939-L943 HydrophobicContact CD1-CD2 4.46Å; L943-L945 HydrophobicContact CB-CD2 4.32Å; L943-L1118 HydrophobicContact CD1-CD1 3.72Å
944	G	81.3	Confident	77.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.248	C	C	.	.			trans	85.4	71.9	169	0	0	0	0	0	114.8	Y819 L865 R871 S942 Y1045	Y819-G944 WeakPolarHBondContact CE2-O 3.09Å; L865-G944 WeakPolarHBondContact CD2-O 3.01Å; R871-G944 VanDerWaalsContact NH1-CA 3.31Å; S942-G944 VanDerWaalsContact C-N 3.27Å; S942-G944 PolarHBondContact O-N 3.28Å; G944-Y1045 WeakPolarHBondContact O-CE2 3.45Å
945	L	88.1	Confident	78.6	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	25%	0.248	C	C	.	.			trans	-142.8	156.7	164.9	47.5	143.5	0	0	0	108.6	V844 E927 S928 L943 L1118	V844-L945 HydrophobicContact CB-CB 3.86Å; V844-L945 HydrophobicContact CG1-CB 4.1Å; V844-L945 HydrophobicContact CG2-CB 4.14Å; E927-L945 WeakPolarHBondContact CA-O 3.1Å; S928-L945 PolarHBondContact N-O 3.08Å; S928-L945 WeakPolarHBondContact OG-CD1 3.41Å; S928-L945 PolarHBondContact OG-O 3.37Å; L943-L945 HydrophobicContact CB-CD2 4.32Å; L945-L1118 HydrophobicContact CD2-CD1 4.34Å
946	L	93.3	Very high	79.5	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.8	178.8	-59.4	-178.6	0	0	0	111.5	V845 L865 T876 I925 Q926 E927	V845-L946 HydrophobicContact CB-CB 4.37Å; V845-L946 HydrophobicContact CG1-CB 4.19Å; V845-L946 PolarHBondContact O-N 3.44Å; L865-L946 HydrophobicContact CB-CD1 4.26Å; L865-L946 HydrophobicContact CB-CD2 4.16Å; L865-L946 HydrophobicContact CB-CG 4.12Å; L865-L946 HydrophobicContact CD1-CD2 4.04Å; T876-L946 HydrophobicContact CG2-CD2 4.36Å; I925-L946 HydrophobicContact CG2-CD1 4.15Å; Q926-L946 CarbonylContact O-C 3.58Å; Q926-L946 WeakPolarHBondContact O-CA 3.27Å; E927-L946 HydrophobicContact CB-CD2 4.49Å
947	N	92.8	Very high	80.3	Confident	7 Å²	7	46.6 Å²	46.6	4%	0.037	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	134.5	162	-65.4	-9.7	0	0	0	108.6	V764 F765 G766 Q926 S928 E1125	V764-N947 CarbonylContact O-C 3.23Å; V764-N947 WeakPolarHBondContact O-CA 3.39Å; F765-N947 VanDerWaalsContact CA-OD1 3.29Å; F765-N947 WeakPolarHBondContact CA-OD1 3.45Å; F765-N947 HydrophobicContact CB-CB 4.27Å; F765-N947 WeakPolarHBondContact CB-OD1 3.1Å; G766-N947 PolarHBondContact N-OD1 2.97Å; Q926-N947 PolarHBondContact N-O 3.18Å; Q926-N947 PolarHBondContact O-N 3.31Å; S928-N947 PolarHBondContact OG-N 2.91Å; S928-N947 PolarHBondContact OG-ND2 3.46Å; S928-N947 PolarHBondContact OG-OD1 3.12Å; N947-E1125 PolarHBondContact ND2-OE1 2.71Å; N947-E1125 PolarHBondContact ND2-OE2 3.11Å
948	V	95.5	Very high	81.1	Confident	3 Å²	3	39.5 Å²	39.5	2%	0.018	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.8	-178.4	-172.9	0	0	0	0	109.3	S763 V764 L788 V845 V848 R924 I925 V950	S763-V948 CarbonylContact C-O 3.23Å; S763-V948 WeakPolarHBondContact CA-O 3.34Å; S763-V948 WeakPolarHBondContact CB-O 3.41Å; V764-V948 HydrophobicContact CG1-CB 3.78Å; V764-V948 HydrophobicContact CG1-CG2 4.12Å; V764-V948 PolarHBondContact N-O 2.87Å; V764-V948 PolarHBondContact O-N 2.92Å; L788-V948 HydrophobicContact CD2-CG1 4.23Å; V845-V948 HydrophobicContact CG1-CG2 4.21Å; V848-V948 HydrophobicContact CG2-CG1 4.26Å; V848-V948 HydrophobicContact CG2-CG2 3.54Å; R924-V948 CarbonylContact O-C 3.55Å; R924-V948 WeakPolarHBondContact O-CA 3.48Å; I925-V948 HydrophobicContact CG1-CG1 4.15Å; V948-V950 HydrophobicContact CG1-CG2 4.21Å
949	L	95.7	Very high	81.4	Confident	11 Å²	11	39.5 Å²	39.5	6%	0.058	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.3	169.4	-178.5	156.2	0	0	0	108.2	I625 F761 A762 L923 R924	I625-L949 HydrophobicContact CD1-CD2 3.87Å; F761-L949 HydrophobicContact CB-CD2 3.96Å; F761-L949 HydrophobicContact CB-CG 4.2Å; F761-L949 HydrophobicContact CD2-CD1 3.62Å; F761-L949 HydrophobicContact CD2-CD2 4.39Å; F761-L949 HydrophobicContact CD2-CG 3.77Å; F761-L949 HydrophobicContact CE2-CD1 3.8Å; F761-L949 HydrophobicContact CE2-CG 4.42Å; F761-L949 HydrophobicContact CG-CD1 4.14Å; F761-L949 HydrophobicContact CG-CD2 4.31Å; F761-L949 HydrophobicContact CG-CG 4.19Å; F761-L949 HydrophobicContact CZ-CD1 4.43Å; A762-L949 WeakPolarHBondContact O-CA 3.29Å; L923-L949 CarbonylContact C-O 3.58Å; L923-L949 VanDerWaalsContact CA-O 3.31Å; L923-L949 WeakPolarHBondContact CA-O 3.31Å; R924-L949 HydrophobicContact CB-CB 4.41Å; R924-L949 PolarHBondContact N-O 3.07Å; R924-L949 PolarHBondContact O-N 3.4Å
950	V	96.6	Very high	81.3	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.3	175	-175.7	0	0	0	0	108.4	F761 A762 L788 V789 I812 I921 L923 V948 V952	F761-V950 CarbonylContact C-O 3.23Å; F761-V950 WeakPolarHBondContact CA-O 3.49Å; F761-V950 VanDerWaalsContact CB-O 3.31Å; F761-V950 WeakPolarHBondContact CB-O 3.25Å; A762-V950 PolarHBondContact N-O 3.42Å; A762-V950 PolarHBondContact O-N 3.27Å; L788-V950 HydrophobicContact CD2-CG2 3.67Å; L788-V950 HydrophobicContact CG-CG2 4.4Å; V789-V950 HydrophobicContact CG2-CG1 4.05Å; I812-V950 HydrophobicContact CD1-CG1 3.76Å; I921-V950 HydrophobicContact CG2-CG1 4.06Å; L923-V950 HydrophobicContact CD2-CG2 4.08Å; L923-V950 HydrophobicContact CG-CG1 4.41Å; L923-V950 HydrophobicContact CG-CG2 4.15Å; V948-V950 HydrophobicContact CG1-CG2 4.21Å; V950-V952 HydrophobicContact CG1-CG2 4.3Å
951	S	96	Very high	81.1	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.007	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130.8	-176.7	-171	0	0	0	0	110.3	I623 P759 G922	I623-S951 WeakPolarHBondContact O-CB 3.3Å; I623-S951 PolarHBondContact O-OG 3.47Å; P759-S951 WeakPolarHBondContact CB-OG 3.26Å; G922-S951 PolarHBondContact N-O 2.98Å; G922-S951 PolarHBondContact O-N 3.44Å
952	V	94.1	Very high	80.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	134.1	-170.6	-178.7	0	0	0	0	110.2	P759 A760 F773 I921 V950 Y956 L972	P759-V952 WeakPolarHBondContact CA-O 3.4Å; P759-V952 VanDerWaalsContact CB-O 3.26Å; P759-V952 WeakPolarHBondContact CB-O 3.24Å; A760-V952 PolarHBondContact N-O 2.89Å; A760-V952 VanDerWaalsContact N-O 3.08Å; A760-V952 PolarHBondContact O-N 3.24Å; F773-V952 HydrophobicContact CE1-CB 4.1Å; F773-V952 HydrophobicContact CE1-CG2 3.57Å; F773-V952 HydrophobicContact CE2-CG2 4.47Å; F773-V952 HydrophobicContact CZ-CB 4.33Å; F773-V952 HydrophobicContact CZ-CG2 3.46Å; F773-V952 VanDerWaalsContact CZ-CG2 3.46Å; I921-V952 HydrophobicContact CD1-CG1 4.31Å; I921-V952 HydrophobicContact CD1-CG2 4.28Å; I921-V952 HydrophobicContact CG1-CG1 4.19Å; I921-V952 HydrophobicContact CG1-CG2 4.19Å; I921-V952 HydrophobicContact CG2-CG2 4.25Å; V950-V952 HydrophobicContact CG1-CG2 4.3Å; V952-Y956 HydrophobicContact CG1-CD2 3.45Å; V952-Y956 VanDerWaalsContact CG1-CD2 3.45Å; V952-Y956 HydrophobicContact CG1-CE2 4.27Å; V952-Y956 HydrophobicContact CG1-CG 3.6Å; V952-L972 HydrophobicContact CG1-CD1 4.15Å
953	P	92.1	Very high	79.2	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.006	24%	0.24	C	C	.	.			trans	-57.6	150.6	177.5	-25.6	33.7	0	0	0	113.7	R627 R920 E955 Y956	R627-P953 HydrophobicContact CG-CG 4.41Å; R920-P953 HydrophobicContact CB-CG 3.89Å; R920-P953 WeakPolarHBondContact O-CD 3.22Å; R920-P953 VanDerWaalsContact O-CG 3.23Å; R920-P953 WeakPolarHBondContact O-CG 3.43Å; P953-E955 HydrophobicContact CB-CG 3.96Å; P953-E955 WeakPolarHBondContact CB-OE2 3.19Å; P953-E955 PolarHBondContact O-N 2.92Å; P953-E955 VanDerWaalsContact O-N 3.12Å; P953-Y956 HydrophobicContact CB-CD2 4.21Å; P953-Y956 HydrophobicContact CB-CE2 4.44Å; P953-Y956 HydrophobicContact CG-CD2 4.37Å; P953-Y956 HydrophobicContact CG-CE2 4.24Å; P953-Y956 PolarHBondContact O-N 2.96Å
954	P	89	Confident	77.9	Confident	31 Å²	31	49.7 Å²	49.7	20%	0.201	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-65.9	-15.7	-176.1	25.4	-33.3	0	0	0	114.5	R757 Y956 R957	R757-P954 HydrophobicContact CB-CB 4.26Å; R757-P954 HydrophobicContact CB-CG 3.67Å; P954-Y956 PolarHBondContact O-N 2.86Å; P954-R957 VanDerWaalsContact O-CB 3.24Å; P954-R957 WeakPolarHBondContact O-CB 3.47Å; P954-R957 PolarHBondContact O-N 3.19Å
955	E	82.7	Confident	76.1	Confident	97 Å²	97	59.2 Å²	59.2	45%	0.453	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-64.9	-18.7	173.6	65.3	-133.8	-136.5	0	0	114.5	R920 P953 R957	R920-E955 IonicContact CZ-OE1 3.98Å; R920-E955 IonicContact CZ-OE2 3.24Å; R920-E955 IonicContact NE-OE1 2.6Å; R920-E955 PolarHBondContact NE-OE1 3.02Å; R920-E955 IonicContact NH2-OE1 3.96Å; R920-E955 PolarHBondContact NH2-OE1 2.89Å; R920-E955 IonicContact NH2-OE2 2.74Å; R920-E955 PolarHBondContact NH2-OE2 2.53Å; P953-E955 HydrophobicContact CB-CG 3.96Å; P953-E955 WeakPolarHBondContact CB-OE2 3.19Å; P953-E955 PolarHBondContact O-N 2.92Å; P953-E955 VanDerWaalsContact O-N 3.12Å; E955-R957 VanDerWaalsContact C-N 3.28Å
956	Y	85.4	Confident	74.3	Confident	18 Å²	18	61.1 Å²	61.1	7%	0.071	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-82.9	-1.7	175.9	-71.5	-87.6	0	0	0	113.7	K791 L807 S919 I921 V952 P953 P954 L972	K791-Y956 HydrophobicContact CD-CD1 3.94Å; K791-Y956 HydrophobicContact CD-CE1 3.84Å; K791-Y956 HydrophobicContact CG-CE1 4.02Å; L807-Y956 HydrophobicContact CD1-CE1 4.23Å; S919-Y956 WeakPolarHBondContact CA-OH 3.29Å; S919-Y956 VanDerWaalsContact CB-OH 3.24Å; S919-Y956 WeakPolarHBondContact CB-OH 3.03Å; S919-Y956 WeakPolarHBondContact O-CE2 3.44Å; S919-Y956 PolarHBondContact O-OH 3.14Å; I921-Y956 HydrophobicContact CG1-CE2 4.44Å; V952-Y956 HydrophobicContact CG1-CD2 3.45Å; V952-Y956 VanDerWaalsContact CG1-CD2 3.45Å; V952-Y956 HydrophobicContact CG1-CE2 4.27Å; V952-Y956 HydrophobicContact CG1-CG 3.6Å; P953-Y956 HydrophobicContact CB-CD2 4.21Å; P953-Y956 HydrophobicContact CB-CE2 4.44Å; P953-Y956 HydrophobicContact CG-CD2 4.37Å; P953-Y956 HydrophobicContact CG-CE2 4.24Å; P953-Y956 PolarHBondContact O-N 2.96Å; P954-Y956 PolarHBondContact O-N 2.86Å; Y956-L972 HydrophobicContact CD1-CD2 4.2Å; Y956-L972 HydrophobicContact CD1-CG 4.47Å
957	R	80.9	Confident	72.3	Confident	128 Å²	128	68 Å²	68	48%	0.483	35%	0.346	S	S	.	.	S	Bend	trans	-67.5	131.5	-179.2	-169.2	-179.9	-172.2	168.2	4.4	111.2	P954 E955 E959 F979 S981	P954-R957 VanDerWaalsContact O-CB 3.24Å; P954-R957 WeakPolarHBondContact O-CB 3.47Å; P954-R957 PolarHBondContact O-N 3.19Å; E955-R957 VanDerWaalsContact C-N 3.28Å; R957-E959 PolarHBondContact O-N 2.75Å; R957-E959 VanDerWaalsContact O-N 3.08Å; R957-F979 HydrophobicContact CB-CD1 4.03Å; R957-F979 HydrophobicContact CB-CE1 3.65Å; R957-F979 HydrophobicContact CB-CE2 4.15Å; R957-F979 HydrophobicContact CB-CG 4.44Å; R957-F979 HydrophobicContact CB-CZ 3.71Å; R957-F979 HydrophobicContact CG-CD2 4.17Å; R957-F979 HydrophobicContact CG-CE1 4.28Å; R957-F979 HydrophobicContact CG-CE2 3.85Å; R957-F979 HydrophobicContact CG-CG 4.49Å; R957-F979 HydrophobicContact CG-CZ 3.92Å; R957-S981 VanDerWaalsContact CZ-OG 3.31Å; R957-S981 PolarHBondContact NE-OG 2.92Å; R957-S981 PolarHBondContact NH2-OG 2.93Å
958	M	72.2	Confident	70.5	Confident	26 Å²	26	70.5 Å²	70.5	13%	0.128	36%	0.356	C	S	.	.			trans	-77.7	95	178	-61.4	-170.9	70	0	0	112	Q960 V966 Y968 A971 F979	M958-Q960 PolarHBondContact O-N 2.67Å; M958-V966 HydrophobicContact CE-CG1 3.54Å; M958-Y968 HydrophobicContact CE-CD1 3.61Å; M958-Y968 HydrophobicContact CE-CE1 3.76Å; M958-Y968 HydrophobicContact CE-CG 4.16Å; M958-Y968 HydrophobicContact SD-CD1 4.22Å; M958-Y968 HydrophobicContact SD-CE1 4.23Å; M958-A971 HydrophobicContact CE-CB 3.71Å; M958-A971 HydrophobicContact CG-CB 4.47Å; M958-A971 HydrophobicContact SD-CB 3.52Å; M958-A971 VanDerWaalsContact SD-CB 3.52Å; M958-F979 PolarHBondContact N-O 2.65Å
959	E	63.1	Low	68.7	Low	151 Å²	151	73.9 Å²	73.9	71%	0.706	38%	0.379	S	S	*	.			trans	-74	112.9	173.4	-67.9	-163.3	159.9	0	0	112.5	R957 Q961	R957-E959 PolarHBondContact O-N 2.75Å; R957-E959 VanDerWaalsContact O-N 3.08Å; E959-Q961 PolarHBondContact O-N 2.92Å; E959-Q961 VanDerWaalsContact O-N 3.11Å
960	Q	54.1	Low	67.2	Low	95 Å²	95	75.9 Å²	75.9	44%	0.444	39%	0.39	S	S	.	.			trans	-77.9	89.9	169.3	-78.1	-171	-12.8	0	0	111.2	M958 A962 V966	M958-Q960 PolarHBondContact O-N 2.67Å; Q960-A962 PolarHBondContact O-N 3.08Å; Q960-V966 HydrophobicContact CG-CG2 4.01Å
961	Q	47.5	Very low	65.9	Low	100 Å²	100	76.4 Å²	76.4	47%	0.467	39%	0.394	S	S	.	.			trans	-60.6	120.2	162.9	-72.4	-167.4	-21.4	0	0	110	E959 G963 R964	E959-Q961 PolarHBondContact O-N 2.92Å; E959-Q961 VanDerWaalsContact O-N 3.11Å; Q961-G963 PolarHBondContact O-N 3.45Å; Q961-R964 HydrophobicContact CB-CB 4.41Å; Q961-R964 PolarHBondContact O-N 3.1Å
962	A	44.5	Very low	65.1	Low	111 Å²	111	76.4 Å²	76.4	92%	0.917	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	127.1	-178.4	0	0	0	0	0	111.5	Q960	Q960-A962 PolarHBondContact O-N 3.08Å
963	G	44.1	Very low	64.5	Low	92 Å²	92	78.1 Å²	78.1	95%	0.948	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.1	-10.6	179.4	0	0	0	0	0	116.1	Q961	Q961-G963 PolarHBondContact O-N 3.45Å
964	R	46.5	Very low	64	Low	167 Å²	167	79.6 Å²	79.6	63%	0.63	42%	0.421	S	S	*	.	S	Bend	trans	-94.2	136.6	174.8	-119.8	173.4	177.7	162.6	-2.7	111.1	Q961 V966	Q961-R964 HydrophobicContact CB-CB 4.41Å; Q961-R964 PolarHBondContact O-N 3.1Å; R964-V966 PolarHBondContact O-N 2.77Å
965	R	44.8	Very low	63.9	Low	200 Å²	200	79.9 Å²	79.9	76%	0.755	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-66.8	122.1	163.6	-86.8	-174.2	172.2	179.1	-3.1	107.7
966	V	49.4	Very low	64.2	Low	41 Å²	41	75.3 Å²	75.3	25%	0.248	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-79.3	123	171.4	-176	0	0	0	0	108.5	M958 Q960 R964 Y968	M958-V966 HydrophobicContact CE-CG1 3.54Å; Q960-V966 HydrophobicContact CG-CG2 4.01Å; R964-V966 PolarHBondContact O-N 2.77Å; V966-Y968 HydrophobicContact CB-CE2 4.4Å; V966-Y968 WeakPolarHBondContact O-CD2 3.39Å; V966-Y968 PolarHBondContact O-N 2.92Å
967	E	50.4	Low	64.1	Low	146 Å²	146	74.5 Å²	74.5	68%	0.682	40%	0.397	S	S	*	.			trans	-79	101.6	171.2	-67.1	-170.7	119.1	0	0	108.8	S969 D970	E967-S969 PolarHBondContact O-N 3.28Å; E967-D970 PolarHBondContact O-N 3.26Å
968	Y	56	Low	64.1	Low	60 Å²	60	69.1 Å²	69.1	24%	0.235	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-65.3	-1.3	176.3	-73.2	-97.3	0	0	0	113.2	M958 V966 D970 A971 V995	M958-Y968 HydrophobicContact CE-CD1 3.61Å; M958-Y968 HydrophobicContact CE-CE1 3.76Å; M958-Y968 HydrophobicContact CE-CG 4.16Å; M958-Y968 HydrophobicContact SD-CD1 4.22Å; M958-Y968 HydrophobicContact SD-CE1 4.23Å; V966-Y968 HydrophobicContact CB-CE2 4.4Å; V966-Y968 WeakPolarHBondContact O-CD2 3.39Å; V966-Y968 PolarHBondContact O-N 2.92Å; Y968-D970 PolarHBondContact O-N 2.98Å; Y968-A971 WeakPolarHBondContact O-CB 3.36Å; Y968-A971 PolarHBondContact O-N 2.9Å; Y968-V995 HydrophobicContact CE1-CG2 4.37Å; Y968-V995 HydrophobicContact CE2-CB 4.26Å; Y968-V995 HydrophobicContact CE2-CG2 4.1Å
969	S	57.9	Low	64.7	Low	73 Å²	73	68.5 Å²	68.5	51%	0.51	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-61.7	-30.4	172.7	52.4	0	0	0	0	113.4	P792 E967	P792-S969 WeakPolarHBondContact CG-O 3.3Å; E967-S969 PolarHBondContact O-N 3.28Å
970	D	63.5	Low	65.5	Low	54 Å²	54	61.8 Å²	61.8	29%	0.289	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-92.7	-7.6	-175	-60.8	6	0	0	0	111.6	K791 T794 R799 E967 Y968	K791-D970 WeakPolarHBondContact CE-O 3.41Å; K791-D970 PolarHBondContact NZ-O 2.64Å; T794-D970 HydrophobicContact CG2-CB 4.33Å; R799-D970 IonicContact CZ-OD2 3.86Å; R799-D970 IonicContact NH1-OD2 3.65Å; R799-D970 IonicContact NH2-OD2 3.08Å; R799-D970 PolarHBondContact NH2-OD2 2.8Å; R799-D970 VanDerWaalsContact NH2-OD2 3.08Å; E967-D970 PolarHBondContact O-N 3.26Å; Y968-D970 PolarHBondContact O-N 2.98Å
971	A	69.1	Low	66.5	Low	12 Å²	12	60.1 Å²	60.1	10%	0.099	34%	0.344	C	S	.	.	S	Bend	trans	-70.8	165.7	-167.9	0	0	0	0	0	114.6	P792 M958 Y968	P792-A971 VanDerWaalsContact CD-O 3.28Å; P792-A971 WeakPolarHBondContact CD-O 3.19Å; M958-A971 HydrophobicContact CE-CB 3.71Å; M958-A971 HydrophobicContact CG-CB 4.47Å; M958-A971 HydrophobicContact SD-CB 3.52Å; M958-A971 VanDerWaalsContact SD-CB 3.52Å; Y968-A971 WeakPolarHBondContact O-CB 3.36Å; Y968-A971 PolarHBondContact O-N 2.9Å
972	L	80.4	Confident	67.5	Low	2 Å²	2	60.2 Å²	60.2	1%	0.01	34%	0.343	C	S	.	.			trans	-72.3	143.5	156.1	-67.1	171.9	0	0	0	109.7	F773 V789 K791 V952 Y956 F979	F773-L972 HydrophobicContact CD2-CD1 4.46Å; F773-L972 HydrophobicContact CE2-CD1 4.13Å; V789-L972 HydrophobicContact CG1-CD2 3.87Å; K791-L972 HydrophobicContact CB-CD2 4.05Å; K791-L972 HydrophobicContact CD-CD2 4.03Å; V952-L972 HydrophobicContact CG1-CD1 4.15Å; Y956-L972 HydrophobicContact CD1-CD2 4.2Å; Y956-L972 HydrophobicContact CD1-CG 4.47Å; L972-F979 HydrophobicContact CD1-CB 4.09Å; L972-F979 HydrophobicContact CD1-CD1 4.38Å
973	S	80.4	Confident	68.4	Low	36 Å²	36	59.3 Å²	59.3	25%	0.252	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-145.4	170.7	171.7	67.1	0	0	0	0	111.4	V789 H790	V789-S973 CarbonylContact C-O 3.56Å; V789-S973 WeakPolarHBondContact CA-O 3.39Å; H790-S973 PolarHBondContact N-O 3.32Å; H790-S973 PolarHBondContact O-N 2.61Å
974	G	82.8	Confident	69.2	Low	31 Å²	31	59.6 Å²	59.6	32%	0.32	30%	0.304	S	S	.	.	S	Bend	trans	111.6	-175.6	-174.5	0	0	0	0	0	112.5	M787 L788 A976 G977	M787-G974 WeakPolarHBondContact O-CA 3.22Å; L788-G974 CarbonylContact O-C 3.46Å; G974-A976 PolarHBondContact O-N 2.93Å; G974-G977 PolarHBondContact O-N 3.41Å
975	L	87	Confident	69.9	Low	37 Å²	37	52.2 Å²	52.2	19%	0.194	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.5	-173.8	-63.3	-179.2	0	0	0	114.4	F770 Y778 I780 Y786 M787 L788 I814 G977	F770-L975 HydrophobicContact CD1-CB 4.12Å; F770-L975 HydrophobicContact CE1-CB 3.96Å; F770-L975 HydrophobicContact CE1-CD1 3.75Å; F770-L975 HydrophobicContact CZ-CD1 3.86Å; Y778-L975 WeakPolarHBondContact OH-CA 3.48Å; Y778-L975 WeakPolarHBondContact OH-CB 3.33Å; Y778-L975 PolarHBondContact OH-O 2.91Å; I780-L975 HydrophobicContact CD1-CD1 3.75Å; I780-L975 HydrophobicContact CD1-CD2 3.67Å; I780-L975 HydrophobicContact CD1-CG 4.34Å; Y786-L975 HydrophobicContact CG-CD1 4.13Å; M787-L975 PolarHBondContact O-N 2.88Å; L788-L975 HydrophobicContact CD1-CB 4.05Å; L788-L975 PolarHBondContact O-N 2.99Å; L788-L975 VanDerWaalsContact O-N 3.15Å; I814-L975 HydrophobicContact CD1-CD1 4.14Å; L975-G977 PolarHBondContact O-N 2.62Å
976	A	88.1	Confident	70.8	Confident	2 Å²	2	43.3 Å²	43.3	2%	0.017	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-10.1	174.6	0	0	0	0	0	113.9	A762 T772 F773 L788 V789 G974	A762-A976 HydrophobicContact CB-CB 3.54Å; T772-A976 CarbonylContact C-O 3.58Å; T772-A976 VanDerWaalsContact CA-O 3.26Å; T772-A976 WeakPolarHBondContact CA-O 3.49Å; T772-A976 VanDerWaalsContact CB-O 3.24Å; T772-A976 WeakPolarHBondContact CB-O 3.33Å; F773-A976 HydrophobicContact CD2-CB 3.92Å; F773-A976 WeakPolarHBondContact CD2-O 3.44Å; F773-A976 HydrophobicContact CE2-CB 3.36Å; F773-A976 HydrophobicContact CZ-CB 3.78Å; F773-A976 PolarHBondContact N-O 2.85Å; L788-A976 HydrophobicContact CD1-CB 4.12Å; L788-A976 VanDerWaalsContact O-CB 3.22Å; L788-A976 WeakPolarHBondContact O-CB 3.45Å; L788-A976 PolarHBondContact O-N 3.31Å; V789-A976 HydrophobicContact CG2-CB 3.71Å; G974-A976 PolarHBondContact O-N 2.93Å
977	G	83.2	Confident	71.6	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.01	25%	0.247	C	C	.	.			trans	90.2	-165.3	-175.9	0	0	0	0	0	113.8	G974 L975 D986	G974-G977 PolarHBondContact O-N 3.41Å; L975-G977 PolarHBondContact O-N 2.62Å; G977-D986 WeakPolarHBondContact CA-OD1 3.48Å
978	T	80.7	Confident	71.9	Confident	14 Å²	14	39 Å²	39	9%	0.086	23%	0.228	C	C	.	.			trans	-105.7	-14.4	-169.4	56.8	0	0	0	0	114.5	S980 D986	T978-S980 VanDerWaalsContact C-N 3.31Å; T978-S980 PolarHBondContact O-N 3.47Å; T978-S980 WeakPolarHBondContact OG1-CB 3.07Å; T978-S980 PolarHBondContact OG1-OG 3.44Å; T978-D986 PolarHBondContact N-OD1 2.99Å; T978-D986 PolarHBondContact OG1-OD1 2.95Å
979	F	85.8	Confident	71.6	Confident	14 Å²	14	39.3 Å²	39.3	6%	0.061	23%	0.231	C	C	.	.			trans	52.4	47.3	-171.5	-170.1	-158.2	0	0	0	112.4	A760 F773 R957 M958 L972	A760-F979 HydrophobicContact CB-CD1 4.29Å; A760-F979 HydrophobicContact CB-CD2 3.82Å; A760-F979 HydrophobicContact CB-CE1 3.87Å; A760-F979 HydrophobicContact CB-CE2 3.37Å; A760-F979 HydrophobicContact CB-CG 4.28Å; A760-F979 HydrophobicContact CB-CZ 3.39Å; F773-F979 HydrophobicContact CB-CB 3.8Å; F773-F979 HydrophobicContact CB-CD2 4.16Å; F773-F979 HydrophobicContact CB-CG 4.12Å; F773-F979 HydrophobicContact CD2-CB 4.09Å; F773-F979 HydrophobicContact CG-CB 4.1Å; R957-F979 HydrophobicContact CB-CD1 4.03Å; R957-F979 HydrophobicContact CB-CE1 3.65Å; R957-F979 HydrophobicContact CB-CE2 4.15Å; R957-F979 HydrophobicContact CB-CG 4.44Å; R957-F979 HydrophobicContact CB-CZ 3.71Å; R957-F979 HydrophobicContact CG-CD2 4.17Å; R957-F979 HydrophobicContact CG-CE1 4.28Å; R957-F979 HydrophobicContact CG-CE2 3.85Å; R957-F979 HydrophobicContact CG-CG 4.49Å; R957-F979 HydrophobicContact CG-CZ 3.92Å; M958-F979 PolarHBondContact N-O 2.65Å; L972-F979 HydrophobicContact CD1-CB 4.09Å; L972-F979 HydrophobicContact CD1-CD1 4.38Å
980	S	78.5	Confident	71.2	Confident	9 Å²	9	39.3 Å²	39.3	6%	0.063	23%	0.231	C	C	.	.	S	Bend	trans	-101.9	6.8	-177.6	63	0	0	0	0	113.5	D774 T978 K982	D774-S980 PolarHBondContact OD1-N 3.46Å; D774-S980 PolarHBondContact OD2-N 2.73Å; D774-S980 VanDerWaalsContact OD2-N 3.09Å; T978-S980 VanDerWaalsContact C-N 3.31Å; T978-S980 PolarHBondContact O-N 3.47Å; T978-S980 WeakPolarHBondContact OG1-CB 3.07Å; T978-S980 PolarHBondContact OG1-OG 3.44Å; S980-K982 PolarHBondContact O-N 3.31Å
981	S	75.5	Confident	70.2	Confident	60 Å²	60	42 Å²	42	42%	0.42	25%	0.246	S	C	.	.	S	Bend	trans	57.5	24.4	-171.4	-47.7	0	0	0	0	113.6	D774 R957	D774-S981 VanDerWaalsContact CG-CA 3.44Å; D774-S981 VanDerWaalsContact OD1-CA 3.29Å; D774-S981 WeakPolarHBondContact OD1-CA 3.41Å; D774-S981 PolarHBondContact OD1-N 2.87Å; D774-S981 WeakPolarHBondContact OD2-CA 3.46Å; D774-S981 PolarHBondContact OD2-N 2.96Å; R957-S981 VanDerWaalsContact CZ-OG 3.31Å; R957-S981 PolarHBondContact NE-OG 2.92Å; R957-S981 PolarHBondContact NH2-OG 2.93Å
982	K	68.6	Low	69	Low	103 Å²	103	49 Å²	49	45%	0.448	27%	0.27	S	S	.	.			trans	-140.7	87.9	-174.9	-72.3	-174.8	176.7	-179.5	0	109.6	D774 S980 P984 A985	D774-K982 PolarHBondContact OD2-N 3.44Å; S980-K982 PolarHBondContact O-N 3.31Å; K982-P984 WeakPolarHBondContact O-CD 2.97Å; K982-A985 HydrophobicContact CB-CB 4.33Å; K982-A985 WeakPolarHBondContact O-CB 2.98Å; K982-A985 PolarHBondContact O-N 2.91Å
983	Q	64	Low	67	Low	91 Å²	91	57.9 Å²	57.9	43%	0.425	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.5	-33.7	174.6	-64	-176.9	-8.5	0	0	115.9	D774 G775 R776 A985	D774-Q983 HydrophobicContact CB-CG 4.04Å; D774-Q983 VanDerWaalsContact O-CG 3.29Å; D774-Q983 WeakPolarHBondContact O-CG 3.49Å; D774-Q983 PolarHBondContact O-NE2 3.35Å; G775-Q983 PolarHBondContact O-NE2 3.06Å; R776-Q983 HydrophobicContact CB-CB 4.16Å; R776-Q983 HydrophobicContact CB-CG 4.11Å; R776-Q983 VanDerWaalsContact CD-O 3.31Å; R776-Q983 WeakPolarHBondContact CD-O 3.29Å; R776-Q983 PolarHBondContact NH1-O 2.85Å; Q983-A985 VanDerWaalsContact C-N 3.31Å; Q983-A985 PolarHBondContact O-N 2.93Å
984	P	60.6	Low	64.8	Low	98 Å²	98	59.2 Å²	59.2	64%	0.636	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.4	172	-26.5	37.1	0	0	0	114.4	K982	K982-P984 WeakPolarHBondContact O-CD 2.97Å
985	A	60.5	Low	62.5	Low	12 Å²	12	59.4 Å²	59.4	10%	0.099	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-75.3	-27.4	-177	0	0	0	0	0	113.5	K982 Q983 L987 V988	K982-A985 HydrophobicContact CB-CB 4.33Å; K982-A985 WeakPolarHBondContact O-CB 2.98Å; K982-A985 PolarHBondContact O-N 2.91Å; Q983-A985 VanDerWaalsContact C-N 3.31Å; Q983-A985 PolarHBondContact O-N 2.93Å; A985-L987 PolarHBondContact O-N 3.18Å; A985-L987 VanDerWaalsContact O-N 3.09Å; A985-V988 WeakPolarHBondContact O-CB 3.24Å; A985-V988 PolarHBondContact O-N 3.15Å
986	D	65.5	Low	59.8	Low	14 Å²	14	61.7 Å²	61.7	8%	0.075	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-61	-19.9	-178.5	-78.2	-14.9	0	0	0	114.7	T772 D774 G977 T978	T772-D986 WeakPolarHBondContact CB-OD2 3.36Å; T772-D986 HydrophobicContact CG2-CB 4.04Å; T772-D986 PolarHBondContact OG1-OD2 2.83Å; D774-D986 WeakPolarHBondContact CB-OD2 3.4Å; G977-D986 WeakPolarHBondContact CA-OD1 3.48Å; T978-D986 PolarHBondContact N-OD1 2.99Å; T978-D986 PolarHBondContact OG1-OD1 2.95Å
987	L	65.3	Low	57.1	Low	50 Å²	50	68.8 Å²	68.8	26%	0.262	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-102.7	10.9	175.8	-55.4	-173.5	0	0	0	113.2	Y778 A985	Y778-L987 HydrophobicContact CD1-CD2 4.39Å; Y778-L987 HydrophobicContact CE1-CD2 4.35Å; A985-L987 PolarHBondContact O-N 3.18Å; A985-L987 VanDerWaalsContact O-N 3.09Å
988	V	56.3	Low	54.5	Low	45 Å²	45	76 Å²	76	27%	0.273	40%	0.395	S	S	.	.	S	Bend	trans	-91.8	121.7	-179.7	-175.5	0	0	0	0	110.2	A985 R992 V995	A985-V988 WeakPolarHBondContact O-CB 3.24Å; A985-V988 PolarHBondContact O-N 3.15Å; V988-R992 HydrophobicContact CG1-CB 4.42Å; V988-V995 HydrophobicContact CG1-CG1 4.24Å; V988-V995 HydrophobicContact CG1-CG2 3.78Å; V988-V995 HydrophobicContact CG2-CG1 4.39Å
989	H	50.1	Low	52	Low	67 Å²	67	79.7 Å²	79.7	31%	0.31	43%	0.427	S	S	.	.			trans	-66.5	139.8	-175.8	-176.4	39.5	0	0	0	113.4	D991 R992 V1016	H989-D991 VanDerWaalsContact C-N 3.32Å; H989-D991 PolarHBondContact O-N 2.83Å; H989-R992 PolarHBondContact O-N 2.74Å; H989-R992 VanDerWaalsContact O-N 3.11Å; H989-V1016 VanDerWaalsContact CE1-CG2 3.44Å; H989-V1016 WeakPolarHBondContact CE1-CG2 3.35Å; H989-V1016 VanDerWaalsContact NE2-CA 3.29Å; H989-V1016 WeakPolarHBondContact NE2-CA 3.26Å; H989-V1016 WeakPolarHBondContact NE2-CG2 3.37Å
990	S	48.3	Very low	49.2	Very low	73 Å²	73	86.4 Å²	86.4	51%	0.51	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-32	-171.4	47.6	0	0	0	0	115.4	R992	S990-R992 PolarHBondContact O-N 2.99Å; S990-R992 VanDerWaalsContact O-N 3.12Å
991	D	43.7	Very low	46.6	Very low	112 Å²	112	92.5 Å²	92.5	60%	0.599	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.1	177.6	-86.6	-32.6	0	0	0	113.7	H989 K993	H989-D991 VanDerWaalsContact C-N 3.32Å; H989-D991 PolarHBondContact O-N 2.83Å; D991-K993 VanDerWaalsContact C-N 3.31Å; D991-K993 PolarHBondContact O-N 3.39Å
992	R	42.7	Very low	44.3	Very low	158 Å²	158	96.9 Å²	96.9	60%	0.596	51%	0.509	S	S	*	.			trans	-78.2	78.5	176.1	-73.2	-171.9	167.3	-166.4	-4.2	111.7	V988 H989 S990 T994	V988-R992 HydrophobicContact CG1-CB 4.42Å; H989-R992 PolarHBondContact O-N 2.74Å; H989-R992 VanDerWaalsContact O-N 3.11Å; S990-R992 PolarHBondContact O-N 2.99Å; S990-R992 VanDerWaalsContact O-N 3.12Å; R992-T994 PolarHBondContact O-N 2.88Å
993	K	38.4	Very low	42.3	Very low	188 Å²	188	99.4 Å²	99.4	82%	0.817	52%	0.52	S	S	*	.	S	Bend	trans	-49.7	-11.3	173.4	-65	-169.5	176.1	-171.9	0	116.2	D991	D991-K993 VanDerWaalsContact C-N 3.31Å; D991-K993 PolarHBondContact O-N 3.39Å
994	T	34.2	Very low	40.6	Very low	65 Å²	65	100.1 Å²	100.1	40%	0.399	53%	0.53	S	S	.	.			trans	-141.6	93.8	176	49.2	0	0	0	0	112.1	R992 A996	R992-T994 PolarHBondContact O-N 2.88Å; T994-A996 VanDerWaalsContact C-N 3.33Å
995	V	36	Very low	38.9	Very low	34 Å²	34	102.4 Å²	102.4	21%	0.206	54%	0.537	C	S	.	.			trans	-79.7	-17.7	171.2	-170	0	0	0	0	112.2	Y968 V988 Q997 Y998	Y968-V995 HydrophobicContact CE1-CG2 4.37Å; Y968-V995 HydrophobicContact CE2-CB 4.26Å; Y968-V995 HydrophobicContact CE2-CG2 4.1Å; V988-V995 HydrophobicContact CG1-CG1 4.24Å; V988-V995 HydrophobicContact CG1-CG2 3.78Å; V988-V995 HydrophobicContact CG2-CG1 4.39Å; V995-Q997 PolarHBondContact O-N 2.86Å; V995-Y998 PolarHBondContact O-N 3.08Å
996	A	30.2	Very low	37.3	Very low	86 Å²	86	106.2 Å²	106.2	71%	0.711	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	3.5	-172.3	0	0	0	0	0	117	T994	T994-A996 VanDerWaalsContact C-N 3.33Å
997	Q	30.7	Very low	35.7	Very low	151 Å²	151	108.1 Å²	108.1	71%	0.706	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-8	177.2	-84.8	-179.3	-61.3	0	0	114.9	V995	V995-Q997 PolarHBondContact O-N 2.86Å
998	Y	29.3	Very low	33.9	Very low	153 Å²	153	116.6 Å²	116.6	60%	0.6	61%	0.605	S	S	*	*			trans	-128.5	30.4	-173.3	-77.3	-85.9	0	0	0	114.1	V995 N1000	V995-Y998 PolarHBondContact O-N 3.08Å; Y998-N1000 VanDerWaalsContact C-N 3.27Å; Y998-N1000 PolarHBondContact O-N 3.18Å
999	A	27.4	Very low	32.5	Very low	90 Å²	90	122.9 Å²	122.9	74%	0.744	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-5	175.4	0	0	0	0	0	114.4
1000	N	27.5	Very low	31.4	Very low	156 Å²	156	124.9 Å²	124.9	83%	0.834	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	-3.7	-171.6	-75.9	13.1	0	0	0	114.9	Y998	Y998-N1000 VanDerWaalsContact C-N 3.27Å; Y998-N1000 PolarHBondContact O-N 3.18Å
1001	E	24.6	Very low	30.5	Very low	137 Å²	137	124 Å²	124	64%	0.64	65%	0.652	S	S	*	*	S	Bend	trans	-98.6	125.1	174.9	-68.7	-171.1	152.3	0	0	110.2	F1003	E1001-F1003 PolarHBondContact O-N 2.86Å
1002	L	26.3	Very low	29.8	Very low	151 Å²	151	130.4 Å²	130.4	79%	0.791	67%	0.667	S	S	*	*			trans	-66	123.8	178.5	-84.8	76.3	0	0	0	110.1	V1004	L1002-V1004 PolarHBondContact O-N 2.8Å
1003	F	26.6	Very low	29.4	Very low	156 Å²	156	128 Å²	128	68%	0.684	66%	0.662	S	S	*	*	S	Bend	trans	-80.7	64.1	-177.3	-138.1	-81	0	0	0	111.6	E1001	E1001-F1003 PolarHBondContact O-N 2.86Å
1004	V	27.8	Very low	28.8	Very low	106 Å²	106	121.2 Å²	121.2	64%	0.642	64%	0.644	S	S	*	*	S	Bend	trans	-129.4	-60.1	-179.9	-177	0	0	0	0	112	L1002	L1002-V1004 PolarHBondContact O-N 2.8Å
1005	D	26.1	Very low	28.6	Very low	147 Å²	147	125.3 Å²	125.3	79%	0.786	65%	0.652	S	S	*	*	S	Bend	trans	-92.9	-20.1	-161	-73.2	-53.1	0	0	0	117.3
1006	S	26.8	Very low	28.4	Very low	92 Å²	92	127 Å²	127	64%	0.643	66%	0.663	S	S	*	*	S	Bend	trans	-86.5	-10	-173.1	64.3	0	0	0	0	115.2	R1008	S1006-R1008 PolarHBondContact O-N 3.28Å
1007	C	30.8	Very low	28.6	Very low	54 Å²	54	125.3 Å²	125.3	37%	0.365	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.8	21	-166.5	-146.4	0	0	0	0	115.2	C1011	C1007-C1011 PolarHBondContact SG-SG 3.15Å
1008	R	28.5	Very low	28.9	Very low	227 Å²	227	122.1 Å²	122.1	86%	0.857	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-15.3	-175.2	-86.4	-174.8	170.3	174	-0.4	117.2	S1006	S1006-R1008 PolarHBondContact O-N 3.28Å
1009	L	27.5	Very low	29.2	Very low	178 Å²	178	123 Å²	123	93%	0.932	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.3	-20.1	-178.6	-90.4	108.8	0	0	0	117.5
1010	S	26.3	Very low	30.1	Very low	108 Å²	108	125.6 Å²	125.6	76%	0.755	64%	0.635	S	S	*	*			trans	-119.1	-6.9	-168.7	-154.2	0	0	0	0	115.5	R1012	S1010-R1012 VanDerWaalsContact C-N 3.25Å; S1010-R1012 PolarHBondContact O-N 2.86Å
1011	C	30.1	Very low	31.6	Very low	56 Å²	56	121.4 Å²	121.4	38%	0.378	61%	0.61	S	S	.	*			trans	-73.2	80.3	173.1	-70.4	0	0	0	0	110.9	C1007 F1013	C1007-C1011 PolarHBondContact SG-SG 3.15Å; C1011-F1013 HydrophobicContact CB-CD2 4.2Å; C1011-F1013 HydrophobicContact CB-CE2 3.81Å; C1011-F1013 HydrophobicContact CB-CZ 4.19Å; C1011-F1013 VanDerWaalsContact O-CD2 3.27Å; C1011-F1013 WeakPolarHBondContact O-CD2 3.38Å; C1011-F1013 PolarHBondContact O-N 3.49Å
1012	R	27.8	Very low	33.8	Very low	245 Å²	245	121.4 Å²	121.4	93%	0.925	61%	0.61	S	S	*	*			trans	-59.4	93.9	148.6	-77	-172.1	179.5	-175.2	1	106.8	S1010 G1014	S1010-R1012 VanDerWaalsContact C-N 3.25Å; S1010-R1012 PolarHBondContact O-N 2.86Å; R1012-G1014 VanDerWaalsContact C-N 3.31Å; R1012-G1014 PolarHBondContact O-N 2.04Å
1013	F	34.7	Very low	36.5	Very low	109 Å²	109	116.2 Å²	116.2	48%	0.478	59%	0.586	S	S	.	*			trans	-58.1	102.1	163.7	-70.7	-85.8	0	0	0	106.6	C1011 R1015 V1061	C1011-F1013 HydrophobicContact CB-CD2 4.2Å; C1011-F1013 HydrophobicContact CB-CE2 3.81Å; C1011-F1013 HydrophobicContact CB-CZ 4.19Å; C1011-F1013 VanDerWaalsContact O-CD2 3.27Å; C1011-F1013 WeakPolarHBondContact O-CD2 3.38Å; C1011-F1013 PolarHBondContact O-N 3.49Å; F1013-R1015 PolarHBondContact O-N 2.7Å; F1013-V1061 HydrophobicContact CB-CB 4.1Å; F1013-V1061 HydrophobicContact CB-CG1 4.08Å; F1013-V1061 HydrophobicContact CB-CG2 4.45Å; F1013-V1061 WeakPolarHBondContact O-CG2 3.33Å
1014	G	26.7	Very low	39.4	Very low	44 Å²	44	109 Å²	109	45%	0.454	56%	0.555	S	S	.	*			trans	-56.4	139.3	176.8	0	0	0	0	0	108.6	R1012 V1016	R1012-G1014 VanDerWaalsContact C-N 3.31Å; R1012-G1014 PolarHBondContact O-N 2.04Å; G1014-V1016 PolarHBondContact O-N 2.76Å; G1014-V1016 VanDerWaalsContact O-N 3.15Å
1015	R	28.6	Very low	42.2	Very low	151 Å²	151	104.9 Å²	104.9	57%	0.57	53%	0.528	S	S	*	.			trans	-57.7	123.4	-179.6	-60.2	175.3	-177.8	170.3	-2.2	108.8	F1013 D1017	F1013-R1015 PolarHBondContact O-N 2.7Å; R1015-D1017 HydrophobicContact CB-CB 3.9Å; R1015-D1017 VanDerWaalsContact CD-CG 3.41Å; R1015-D1017 WeakPolarHBondContact CD-OD2 3.36Å; R1015-D1017 IonicContact CZ-OD2 3.95Å; R1015-D1017 IonicContact NE-OD2 3Å; R1015-D1017 IonicContact NH1-OD1 2.77Å; R1015-D1017 IonicContact NH1-OD2 3.78Å; R1015-D1017 PolarHBondContact NH1-OD2 2.87Å; R1015-D1017 PolarHBondContact O-N 3.28Å
1016	V	32.3	Very low	45.1	Very low	70 Å²	70	99.9 Å²	99.9	42%	0.424	51%	0.505	S	S	.	.			trans	-63.4	94	134.6	179.8	0	0	0	0	104	H989 G1014 N1018	H989-V1016 VanDerWaalsContact CE1-CG2 3.44Å; H989-V1016 WeakPolarHBondContact CE1-CG2 3.35Å; H989-V1016 VanDerWaalsContact NE2-CA 3.29Å; H989-V1016 WeakPolarHBondContact NE2-CA 3.26Å; H989-V1016 WeakPolarHBondContact NE2-CG2 3.37Å; G1014-V1016 PolarHBondContact O-N 2.76Å; G1014-V1016 VanDerWaalsContact O-N 3.15Å; V1016-N1018 PolarHBondContact O-N 2.68Å
1017	D	34.1	Very low	47.8	Very low	50 Å²	50	98 Å²	98	27%	0.267	49%	0.487	S	S	.	.			trans	-74.7	97.2	-174.7	-142.7	-29.7	0	0	0	107.1	R1015 H1019 Q1020	R1015-D1017 HydrophobicContact CB-CB 3.9Å; R1015-D1017 VanDerWaalsContact CD-CG 3.41Å; R1015-D1017 WeakPolarHBondContact CD-OD2 3.36Å; R1015-D1017 IonicContact CZ-OD2 3.95Å; R1015-D1017 IonicContact NE-OD2 3Å; R1015-D1017 IonicContact NH1-OD1 2.77Å; R1015-D1017 IonicContact NH1-OD2 3.78Å; R1015-D1017 PolarHBondContact NH1-OD2 2.87Å; R1015-D1017 PolarHBondContact O-N 3.28Å; D1017-H1019 PolarHBondContact O-N 2.78Å; D1017-H1019 IonicContact OD1-CD2 3.39Å; D1017-H1019 PolarHBondContact OD1-CD2 2.87Å; D1017-H1019 VanDerWaalsContact OD1-CD2 3.28Å; D1017-H1019 IonicContact OD1-CG 3.62Å; D1017-Q1020 PolarHBondContact O-N 3.24Å
1018	N	37.6	Very low	50.2	Low	84 Å²	84	98.4 Å²	98.4	45%	0.449	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-4.5	-177.5	-92.3	9.8	0	0	0	113.5	T785 V1016	T785-N1018 PolarHBondContact O-ND2 2.94Å; V1016-N1018 PolarHBondContact O-N 2.68Å
1019	H	35.7	Very low	52.6	Low	173 Å²	173	89 Å²	89	80%	0.801	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-14.8	167.9	-63.9	-53.2	0	0	0	115.1	D1017	D1017-H1019 PolarHBondContact O-N 2.78Å; D1017-H1019 IonicContact OD1-CD2 3.39Å; D1017-H1019 PolarHBondContact OD1-CD2 2.87Å; D1017-H1019 VanDerWaalsContact OD1-CD2 3.28Å; D1017-H1019 IonicContact OD1-CG 3.62Å
1020	Q	45.7	Very low	54.8	Low	143 Å²	143	84.8 Å²	84.8	67%	0.668	44%	0.435	S	S	*	.	S	Bend	trans	-76.6	-31.5	178.9	-88.3	-170.6	-8.4	0	0	114	D1017	D1017-Q1020 PolarHBondContact O-N 3.24Å
1021	F	58.7	Low	56.8	Low	69 Å²	69	80.3 Å²	80.3	30%	0.303	40%	0.403	S	S	.	.	S	Bend	trans	-111.1	132.3	-177.3	-62.9	-80.6	0	0	0	110.6	M787 H790 S1023	M787-F1021 HydrophobicContact SD-CB 4.49Å; H790-F1021 AromaticContact CE1-CE1 3.75Å; H790-F1021 AromaticContact NE2-CE1 3.89Å; F1021-S1023 PolarHBondContact O-N 2.9Å
1022	H	71.7	Confident	58.9	Low	136 Å²	136	79 Å²	79	63%	0.63	39%	0.391	S	S	*	.			trans	-66.9	134.4	173.6	-167.2	-89.1	0	0	0	109.5	Q813 L1024 S1026	Q813-H1022 PolarHBondContact NE2-O 2.79Å; H1022-L1024 PolarHBondContact O-N 3.49Å; H1022-S1026 PolarHBondContact CE1-OG 2.96Å
1023	S	81.8	Confident	61.1	Low	42 Å²	42	75.1 Å²	75.1	29%	0.294	38%	0.376	S	S	.	.			trans	-63.7	130.4	174.4	-176.8	0	0	0	0	109.7	F1021 F1025 S1026	F1021-S1023 PolarHBondContact O-N 2.9Å; S1023-F1025 PolarHBondContact O-N 3.5Å; S1023-F1025 PolarHBondContact OG-N 3.46Å; S1023-F1025 VanDerWaalsContact OG-N 3.17Å; S1023-S1026 PolarHBondContact O-OG 3.3Å; S1023-S1026 VanDerWaalsContact O-OG 3.11Å
1024	L	87.3	Confident	62.9	Low	6 Å²	6	74.2 Å²	74.2	3%	0.031	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.4	170.1	-62.2	179.9	0	0	0	111.6	Q811 Q813 A849 Q851 R860 H1022 S1026	Q811-L1024 HydrophobicContact CB-CD1 3.94Å; Q813-L1024 HydrophobicContact CG-CD1 4.31Å; Q813-L1024 HydrophobicContact CG-CG 4.46Å; A849-L1024 HydrophobicContact CB-CB 3.52Å; A849-L1024 HydrophobicContact CB-CD1 4.38Å; Q851-L1024 HydrophobicContact CB-CD1 4.12Å; Q851-L1024 HydrophobicContact CB-CD2 4.3Å; R860-L1024 PolarHBondContact NH1-O 2.03Å; R860-L1024 VanDerWaalsContact NH1-O 3.09Å; H1022-L1024 PolarHBondContact O-N 3.49Å; L1024-S1026 VanDerWaalsContact C-N 3.33Å
1025	F	87.7	Confident	65.2	Low	19 Å²	19	73 Å²	73	8%	0.083	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	18.6	174.2	-59.5	-86.1	0	0	0	113.7	T785 Q813 R815 A849 L862 L864 S1023 I1041	T785-F1025 HydrophobicContact CG2-CD2 3.76Å; T785-F1025 HydrophobicContact CG2-CE2 3.88Å; Q813-F1025 HydrophobicContact CB-CE2 3.84Å; R815-F1025 HydrophobicContact CB-CD1 4.47Å; R815-F1025 HydrophobicContact CB-CD2 4.44Å; R815-F1025 HydrophobicContact CB-CE1 4.01Å; R815-F1025 HydrophobicContact CB-CE2 3.96Å; R815-F1025 HydrophobicContact CB-CZ 3.73Å; A849-F1025 HydrophobicContact CB-CD1 4.14Å; A849-F1025 HydrophobicContact CB-CD2 4.12Å; A849-F1025 HydrophobicContact CB-CE1 3.78Å; A849-F1025 HydrophobicContact CB-CE2 3.77Å; A849-F1025 HydrophobicContact CB-CG 4.3Å; A849-F1025 HydrophobicContact CB-CZ 3.6Å; L862-F1025 HydrophobicContact CD2-CD1 4.2Å; L864-F1025 HydrophobicContact CD2-CD1 3.84Å; L864-F1025 HydrophobicContact CD2-CE1 3.63Å; S1023-F1025 PolarHBondContact O-N 3.5Å; S1023-F1025 PolarHBondContact OG-N 3.46Å; S1023-F1025 VanDerWaalsContact OG-N 3.17Å; F1025-I1041 VanDerWaalsContact O-CG2 3.25Å; F1025-I1041 WeakPolarHBondContact O-CG2 3.23Å
1026	S	86.3	Confident	67.6	Low	42 Å²	42	66.7 Å²	66.7	29%	0.294	34%	0.336	S	S	.	.	S	Bend	trans	-111.5	149.6	167.3	61.9	0	0	0	0	110.8	R860 H1022 S1023 L1024	R860-S1026 VanDerWaalsContact CZ-O 3.24Å; R860-S1026 PolarHBondContact NH1-O 2.82Å; R860-S1026 PolarHBondContact NH2-O 3.14Å; H1022-S1026 PolarHBondContact CE1-OG 2.96Å; S1023-S1026 PolarHBondContact O-OG 3.3Å; S1023-S1026 VanDerWaalsContact O-OG 3.11Å; L1024-S1026 VanDerWaalsContact C-N 3.33Å
1027	L	84.4	Confident	70	Confident	51 Å²	51	64 Å²	64	27%	0.267	32%	0.319	S	S	.	.			trans	-53.2	142	178.4	-65.3	165.1	0	0	0	111.8	D882 T1029 H1032 R1033 A1038 I1041	D882-L1027 HydrophobicContact CB-CD2 4.26Å; D882-L1027 WeakPolarHBondContact OD2-CA 3.44Å; L1027-T1029 VanDerWaalsContact C-N 3.3Å; L1027-T1029 WeakPolarHBondContact CB-O 3.16Å; L1027-T1029 PolarHBondContact O-N 3.02Å; L1027-H1032 HydrophobicContact CD2-CB 3.97Å; L1027-R1033 HydrophobicContact CD1-CB 4.12Å; L1027-A1038 HydrophobicContact CD1-CB 4.27Å; L1027-A1038 HydrophobicContact CD2-CB 4.11Å; L1027-I1041 HydrophobicContact CD2-CD1 3.71Å
1028	L	81.9	Confident	72.3	Confident	64 Å²	64	62.4 Å²	62.4	34%	0.335	31%	0.313	S	S	.	.	S	Bend	trans	-65.6	-31.9	176.5	-72.1	176.4	0	0	0	112.9	N881 D882	N881-L1028 HydrophobicContact CB-CD1 3.76Å; D882-L1028 WeakPolarHBondContact OD2-CB 3.02Å; D882-L1028 PolarHBondContact OD2-N 3.49Å
1029	T	78.3	Confident	74.4	Confident	30 Å²	30	61.5 Å²	61.5	18%	0.184	31%	0.306	C	S	.	.	S	Bend	trans	-137.6	160.4	179.2	79.2	0	0	0	0	110.5	L1027 D1031 H1032 V1326	L1027-T1029 VanDerWaalsContact C-N 3.3Å; L1027-T1029 WeakPolarHBondContact CB-O 3.16Å; L1027-T1029 PolarHBondContact O-N 3.02Å; T1029-D1031 PolarHBondContact O-N 2.55Å; T1029-D1031 PolarHBondContact OG1-N 3.31Å; T1029-H1032 PolarHBondContact OG1-CD2 3.19Å; T1029-H1032 VanDerWaalsContact OG1-CG 3.27Å; T1029-H1032 PolarHBondContact OG1-N 2.9Å; T1029-H1032 PolarHBondContact OG1-NE2 2.99Å; T1029-V1326 HydrophobicContact CG2-CG1 4.45Å
1030	T	72.2	Confident	76.8	Confident	89 Å²	89	53.9 Å²	53.9	55%	0.546	27%	0.271	S	S	.	.	S	Bend	trans	-70	-12.7	173.1	54.2	0	0	0	0	113.8	R1033 K1330	T1030-R1033 VanDerWaalsContact O-CB 3.28Å; T1030-R1033 WeakPolarHBondContact O-CB 3.39Å; T1030-K1330 PolarHBondContact OG1-NZ 2.89Å
1031	D	68.5	Low	78.8	Confident	14 Å²	14	47.7 Å²	47.7	8%	0.075	24%	0.242	C	C	.	.	S	Bend	trans	-98.3	-20.2	-165.1	-42.4	-35.9	0	0	0	110.2	T1029 R1033 G1328 M1329 K1330	T1029-D1031 PolarHBondContact O-N 2.55Å; T1029-D1031 PolarHBondContact OG1-N 3.31Å; D1031-R1033 PolarHBondContact O-N 2.56Å; D1031-G1328 WeakPolarHBondContact OD2-CA 3.38Å; D1031-M1329 HydrophobicContact CB-CB 4.04Å; D1031-M1329 HydrophobicContact CB-CG 4Å; D1031-M1329 HydrophobicContact CB-SD 4Å; D1031-M1329 PolarHBondContact OD2-N 3.46Å; D1031-K1330 WeakPolarHBondContact OD1-CE 3.07Å; D1031-K1330 IonicContact OD1-NZ 3.65Å; D1031-K1330 PolarHBondContact OD1-NZ 3.49Å
1032	H	74.6	Confident	80.1	Confident	27 Å²	27	45.6 Å²	45.6	13%	0.125	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-66	-12.2	164.5	-57.4	177.4	0	0	0	112.7	D882 L1027 T1029 D1034 W1035	D882-H1032 IonicContact OD2-CE1 3.11Å; D882-H1032 IonicContact OD2-CG 2.79Å; D882-H1032 IonicContact OD2-ND1 2.82Å; D882-H1032 PolarHBondContact OD2-ND1 2.79Å; L1027-H1032 HydrophobicContact CD2-CB 3.97Å; T1029-H1032 PolarHBondContact OG1-CD2 3.19Å; T1029-H1032 VanDerWaalsContact OG1-CG 3.27Å; T1029-H1032 PolarHBondContact OG1-N 2.9Å; T1029-H1032 PolarHBondContact OG1-NE2 2.99Å; H1032-D1034 VanDerWaalsContact C-N 3.25Å; H1032-D1034 PolarHBondContact O-N 3.44Å; H1032-W1035 HydrophobicContact CB-CD2 4.04Å; H1032-W1035 HydrophobicContact CB-CE3 3.82Å; H1032-W1035 HydrophobicContact CB-CH2 4.29Å; H1032-W1035 HydrophobicContact CB-CZ2 4.5Å; H1032-W1035 HydrophobicContact CB-CZ3 3.94Å; H1032-W1035 AromaticContact CD2-CE2 3.92Å; H1032-W1035 AromaticContact CD2-CH2 3.09Å; H1032-W1035 WeakPolarHBondContact CD2-CH2 3.04Å; H1032-W1035 AromaticContact CD2-CZ2 3.29Å; H1032-W1035 WeakPolarHBondContact CD2-CZ2 3.36Å; H1032-W1035 AromaticContact CD2-CZ3 3.6Å; H1032-W1035 AromaticContact CE1-CH2 3.78Å; H1032-W1035 AromaticContact CG-CE3 3.93Å; H1032-W1035 AromaticContact CG-CH2 3.53Å; H1032-W1035 AromaticContact CG-CZ2 3.98Å; H1032-W1035 AromaticContact CG-CZ3 3.5Å; H1032-W1035 VanDerWaalsContact CG-CZ3 3.5Å; H1032-W1035 AromaticContact ND1-CH2 3.93Å; H1032-W1035 AromaticContact ND1-CZ3 3.78Å; H1032-W1035 AromaticContact NE2-CH2 3.33Å; H1032-W1035 VanDerWaalsContact NE2-CH2 3.33Å; H1032-W1035 WeakPolarHBondContact NE2-CH2 3.4Å; H1032-W1035 AromaticContact NE2-CZ2 3.86Å; H1032-W1035 AromaticContact NE2-CZ3 3.98Å; H1032-W1035 WeakPolarHBondContact O-CB 3.46Å; H1032-W1035 PolarHBondContact O-N 3Å; H1032-W1035 VanDerWaalsContact O-N 3.16Å
1033	R	74.9	Confident	80.7	Confident	165 Å²	165	42 Å²	42	62%	0.623	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-61.8	-33.7	-179.5	-179.4	178.1	171.9	172.1	-1.9	112.6	L1027 T1030 D1031 W1035	L1027-R1033 HydrophobicContact CD1-CB 4.12Å; T1030-R1033 VanDerWaalsContact O-CB 3.28Å; T1030-R1033 WeakPolarHBondContact O-CB 3.39Å; D1031-R1033 PolarHBondContact O-N 2.56Å; R1033-W1035 PolarHBondContact O-N 2.77Å
1034	D	71	Confident	81.1	Confident	89 Å²	89	40.5 Å²	40.5	48%	0.476	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-79.1	-5	-178	-62.8	-3.4	0	0	0	112	H1032	H1032-D1034 VanDerWaalsContact C-N 3.25Å; H1032-D1034 PolarHBondContact O-N 3.44Å
1035	W	76.9	Confident	81.1	Confident	19 Å²	19	41 Å²	41	7%	0.072	22%	0.22	C	C	.	.	S	Bend	trans	-78.4	140.7	177.7	-59.9	-6.3	0	0	0	111.6	R347 D882 H1032 R1033 E1037 A1038	R347-W1035 HydrophobicContact CG-CD2 4.45Å; R347-W1035 HydrophobicContact CG-CZ2 4.33Å; R347-W1035 VanDerWaalsContact NE-CE3 3.33Å; D882-W1035 HydrophobicContact CB-CZ3 4.3Å; H1032-W1035 HydrophobicContact CB-CD2 4.04Å; H1032-W1035 HydrophobicContact CB-CE3 3.82Å; H1032-W1035 HydrophobicContact CB-CH2 4.29Å; H1032-W1035 HydrophobicContact CB-CZ2 4.5Å; H1032-W1035 HydrophobicContact CB-CZ3 3.94Å; H1032-W1035 AromaticContact CD2-CE2 3.92Å; H1032-W1035 AromaticContact CD2-CH2 3.09Å; H1032-W1035 WeakPolarHBondContact CD2-CH2 3.04Å; H1032-W1035 AromaticContact CD2-CZ2 3.29Å; H1032-W1035 WeakPolarHBondContact CD2-CZ2 3.36Å; H1032-W1035 AromaticContact CD2-CZ3 3.6Å; H1032-W1035 AromaticContact CE1-CH2 3.78Å; H1032-W1035 AromaticContact CG-CE3 3.93Å; H1032-W1035 AromaticContact CG-CH2 3.53Å; H1032-W1035 AromaticContact CG-CZ2 3.98Å; H1032-W1035 AromaticContact CG-CZ3 3.5Å; H1032-W1035 VanDerWaalsContact CG-CZ3 3.5Å; H1032-W1035 AromaticContact ND1-CH2 3.93Å; H1032-W1035 AromaticContact ND1-CZ3 3.78Å; H1032-W1035 AromaticContact NE2-CH2 3.33Å; H1032-W1035 VanDerWaalsContact NE2-CH2 3.33Å; H1032-W1035 WeakPolarHBondContact NE2-CH2 3.4Å; H1032-W1035 AromaticContact NE2-CZ2 3.86Å; H1032-W1035 AromaticContact NE2-CZ3 3.98Å; H1032-W1035 WeakPolarHBondContact O-CB 3.46Å; H1032-W1035 PolarHBondContact O-N 3Å; H1032-W1035 VanDerWaalsContact O-N 3.16Å; R1033-W1035 PolarHBondContact O-N 2.77Å; W1035-E1037 PolarHBondContact O-N 2.67Å; W1035-E1037 VanDerWaalsContact O-N 3.1Å; W1035-A1038 WeakPolarHBondContact O-CB 2.99Å; W1035-A1038 PolarHBondContact O-N 3.08Å; W1035-A1038 VanDerWaalsContact O-N 3.07Å
1036	P	77.3	Confident	80.9	Confident	18 Å²	18	41 Å²	41	12%	0.117	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-50.9	-36.2	174.9	-25.8	32.2	0	0	0	113.7	V298 V333 A1038	V298-P1036 HydrophobicContact CG2-CB 4.17Å; V298-P1036 HydrophobicContact CG2-CG 3.81Å; V333-P1036 WeakPolarHBondContact O-CG 3.46Å; P1036-A1038 VanDerWaalsContact C-N 3.3Å; P1036-A1038 PolarHBondContact O-N 2.9Å
1037	E	82.6	Confident	80.8	Confident	14 Å²	14	40.6 Å²	40.6	7%	0.065	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-66.8	-22.9	-178	-63.9	89.3	155.1	0	0	114.2	I332 L879 L884 W1035 H1039 L1040	I332-E1037 HydrophobicContact CD1-CG 4.04Å; I332-E1037 WeakPolarHBondContact CD1-OE1 3.23Å; L879-E1037 HydrophobicContact CD2-CB 4.43Å; L884-E1037 HydrophobicContact CB-CG 3.72Å; W1035-E1037 PolarHBondContact O-N 2.67Å; W1035-E1037 VanDerWaalsContact O-N 3.1Å; E1037-H1039 PolarHBondContact O-N 3.47Å; E1037-L1040 HydrophobicContact CB-CD1 4.38Å; E1037-L1040 VanDerWaalsContact O-CB 3.25Å; E1037-L1040 WeakPolarHBondContact O-CB 3.32Å; E1037-L1040 WeakPolarHBondContact O-CG 3.44Å; E1037-L1040 PolarHBondContact O-N 3.41Å
1038	A	83.4	Confident	80.7	Confident	17 Å²	17	38.1 Å²	38.1	14%	0.14	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-59.1	-34.9	-174.1	0	0	0	0	0	113.2	L1027 W1035 P1036 L1040 I1041	L1027-A1038 HydrophobicContact CD1-CB 4.27Å; L1027-A1038 HydrophobicContact CD2-CB 4.11Å; W1035-A1038 WeakPolarHBondContact O-CB 2.99Å; W1035-A1038 PolarHBondContact O-N 3.08Å; W1035-A1038 VanDerWaalsContact O-N 3.07Å; P1036-A1038 VanDerWaalsContact C-N 3.3Å; P1036-A1038 PolarHBondContact O-N 2.9Å; A1038-L1040 PolarHBondContact O-N 3.03Å; A1038-I1041 PolarHBondContact O-N 3.39Å
1039	H	82.4	Confident	80.7	Confident	64 Å²	64	39.7 Å²	39.7	30%	0.296	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-70	-19.4	179.2	-65.7	88.3	0	0	0	113.2	E1037 I1041 G1042	E1037-H1039 PolarHBondContact O-N 3.47Å; H1039-I1041 VanDerWaalsContact C-N 3.29Å; H1039-I1041 PolarHBondContact O-N 2.79Å; H1039-G1042 PolarHBondContact O-N 3.25Å
1040	L	86.1	Confident	80.7	Confident	14 Å²	14	43.7 Å²	43.7	7%	0.073	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-74.4	-20.7	177.5	-51.1	176.9	0	0	0	112.3	I332 L864 L884 E1037 A1038 G1042	I332-L1040 HydrophobicContact CG2-CD1 4.24Å; L864-L1040 VanDerWaalsContact CD1-O 3.28Å; L864-L1040 WeakPolarHBondContact CD1-O 3.47Å; L884-L1040 HydrophobicContact CD2-CD1 3.85Å; E1037-L1040 HydrophobicContact CB-CD1 4.38Å; E1037-L1040 VanDerWaalsContact O-CB 3.25Å; E1037-L1040 WeakPolarHBondContact O-CB 3.32Å; E1037-L1040 WeakPolarHBondContact O-CG 3.44Å; E1037-L1040 PolarHBondContact O-N 3.41Å; A1038-L1040 PolarHBondContact O-N 3.03Å; L1040-G1042 VanDerWaalsContact C-N 3.26Å; L1040-G1042 PolarHBondContact O-N 2.82Å
1041	I	88	Confident	80.8	Confident	12 Å²	12	41.6 Å²	41.6	6%	0.062	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-76.8	-15.3	178.1	-55.1	-178.4	0	0	0	111.6	R815 L862 L864 L879 D882 F1025 L1027 A1038 H1039	R815-I1041 PolarHBondContact NH1-O 2.85Å; L862-I1041 HydrophobicContact CD2-CD1 4.47Å; L862-I1041 HydrophobicContact CD2-CG2 4Å; L864-I1041 HydrophobicContact CD1-CG1 4.49Å; L879-I1041 HydrophobicContact CD2-CD1 4.17Å; L879-I1041 HydrophobicContact CD2-CG1 3.92Å; D882-I1041 HydrophobicContact CB-CD1 4.31Å; F1025-I1041 VanDerWaalsContact O-CG2 3.25Å; F1025-I1041 WeakPolarHBondContact O-CG2 3.23Å; L1027-I1041 HydrophobicContact CD2-CD1 3.71Å; A1038-I1041 PolarHBondContact O-N 3.39Å; H1039-I1041 VanDerWaalsContact C-N 3.29Å; H1039-I1041 PolarHBondContact O-N 2.79Å
1042	G	84	Confident	80.9	Confident	26 Å²	26	46 Å²	46	27%	0.268	23%	0.225	S	C	.	.	S	Bend	trans	-62.1	176.9	175.6	0	0	0	0	0	114.7	R815 H1039 L1040	R815-G1042 PolarHBondContact NH1-O 2.93Å; R815-G1042 PolarHBondContact NH2-O 2.93Å; H1039-G1042 PolarHBondContact O-N 3.25Å; L1040-G1042 VanDerWaalsContact C-N 3.26Å; L1040-G1042 PolarHBondContact O-N 2.82Å
1043	P	85.5	Confident	80.1	Confident	60 Å²	60	53.4 Å²	53.4	39%	0.39	26%	0.257	S	S	.	.			trans	-60.4	144.9	176.2	26	-34.3	0	0	0	111.9	E817 K867	E817-P1043 VanDerWaalsContact OE2-CA 3.31Å; E817-P1043 WeakPolarHBondContact OE2-CA 3.49Å; E817-P1043 WeakPolarHBondContact OE2-CB 3.46Å; K867-P1043 WeakPolarHBondContact CE-O 3.4Å
1044	V	89.1	Confident	79	Confident	10 Å²	10	52.1 Å²	52.1	6%	0.061	26%	0.259	C	S	.	.	S	Bend	trans	-82.9	-40.2	173.7	-170.8	0	0	0	0	110.2	E817 T846 L865 K867 P1046	E817-V1044 PolarHBondContact OE1-N 3.22Å; E817-V1044 VanDerWaalsContact OE1-N 3.12Å; E817-V1044 PolarHBondContact OE2-N 3.27Å; T846-V1044 HydrophobicContact CG2-CB 4.28Å; T846-V1044 HydrophobicContact CG2-CG2 4.46Å; L865-V1044 HydrophobicContact CB-CG2 4.33Å; L865-V1044 HydrophobicContact CD2-CG1 4.21Å; L865-V1044 HydrophobicContact CG-CG1 4.35Å; L865-V1044 VanDerWaalsContact O-CG2 3.3Å; L865-V1044 WeakPolarHBondContact O-CG2 3.31Å; K867-V1044 HydrophobicContact CG-CG1 4.27Å; V1044-P1046 VanDerWaalsContact C-CD 3.48Å; V1044-P1046 WeakPolarHBondContact O-CD 3.37Å
1045	Y	87.8	Confident	77.6	Confident	16 Å²	16	52.7 Å²	52.7	6%	0.063	26%	0.261	C	S	.	.	S	Bend	trans	-116.7	75.5	-178.4	-64.8	-47.5	0	0	0	110.2	E817 N818 Y819 P820 R822 T846 L865 D868 R871 G944	E817-Y1045 PolarHBondContact OE2-N 3.49Å; N818-Y1045 WeakPolarHBondContact O-CB 3.18Å; Y819-Y1045 HydrophobicContact CD2-CD2 4.05Å; Y819-Y1045 AromaticContact CD2-CE2 3.61Å; Y819-Y1045 HydrophobicContact CD2-CE2 3.61Å; Y819-Y1045 HydrophobicContact CE2-CE2 4.05Å; P820-Y1045 HydrophobicContact CG-CD1 3.54Å; P820-Y1045 HydrophobicContact CG-CE1 3.74Å; P820-Y1045 HydrophobicContact CG-CG 4.06Å; R822-Y1045 PolarHBondContact NH2-OH 2.85Å; T846-Y1045 HydrophobicContact CG2-CD2 3.84Å; T846-Y1045 HydrophobicContact CG2-CE2 4.23Å; L865-Y1045 HydrophobicContact CD2-CE2 4.06Å; D868-Y1045 WeakPolarHBondContact OD1-CE1 3.22Å; D868-Y1045 PolarHBondContact OD1-OH 3.26Å; R871-Y1045 PolarHBondContact NH2-OH 3.35Å; G944-Y1045 WeakPolarHBondContact O-CE2 3.45Å
1046	P	84.9	Confident	75.8	Confident	20 Å²	20	59.4 Å²	59.4	13%	0.13	29%	0.288	C	S	.	.			trans	-64.8	149.1	175.7	35.7	-42.3	0	0	0	110	W116 P117 V837 V1044	W116-P1046 HydrophobicContact CE3-CB 4.4Å; W116-P1046 HydrophobicContact CH2-CB 3.57Å; W116-P1046 HydrophobicContact CH2-CG 3.39Å; W116-P1046 HydrophobicContact CZ2-CB 4.22Å; W116-P1046 HydrophobicContact CZ2-CG 3.6Å; W116-P1046 HydrophobicContact CZ3-CB 3.67Å; W116-P1046 HydrophobicContact CZ3-CG 4Å; P117-P1046 HydrophobicContact CB-CG 4.25Å; P117-P1046 HydrophobicContact CG-CB 3.94Å; P117-P1046 HydrophobicContact CG-CG 4.06Å; V837-P1046 WeakPolarHBondContact CB-O 3.25Å; V837-P1046 HydrophobicContact CG1-CG 4.27Å; V1044-P1046 VanDerWaalsContact C-CD 3.48Å; V1044-P1046 WeakPolarHBondContact O-CD 3.37Å
1047	V	83.3	Confident	73.7	Confident	33 Å²	33	70.3 Å²	70.3	20%	0.2	33%	0.327	C	S	.	.			trans	-113.2	128.4	177	179.7	0	0	0	0	109.4	P839 W1051 L1052	P839-V1047 HydrophobicContact CB-CG1 4.4Å; P839-V1047 HydrophobicContact CB-CG2 4.1Å; P839-V1047 HydrophobicContact CG-CG1 3.78Å; P839-V1047 HydrophobicContact CG-CG2 4.38Å; V1047-W1051 HydrophobicContact CG1-CB 3.94Å; V1047-L1052 HydrophobicContact CB-CD2 4.3Å; V1047-L1052 HydrophobicContact CB-CG 4.38Å; V1047-L1052 HydrophobicContact CG1-CD2 3.96Å; V1047-L1052 HydrophobicContact CG1-CG 3.9Å
1048	A	82.4	Confident	71.3	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	36%	0.355	C	S	.	.			trans	-62.9	140.3	177.3	0	0	0	0	0	111.5	P117 D118 H834 V837 R1050 W1051	P117-A1048 HydrophobicContact CG-CB 4.16Å; D118-A1048 WeakPolarHBondContact OD1-CB 3.36Å; H834-A1048 HydrophobicContact CB-CB 4.04Å; V837-A1048 HydrophobicContact CG2-CB 3.94Å; A1048-R1050 HydrophobicContact CB-CG 4.22Å; A1048-R1050 PolarHBondContact O-N 3.46Å; A1048-W1051 PolarHBondContact O-N 2.94Å
1049	K	80.6	Confident	68.9	Low	97 Å²	97	83.3 Å²	83.3	42%	0.422	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.9	-175.1	-61.6	170.6	-168.4	176.3	0	112.2	E114 N115 D118	E114-K1049 PolarHBondContact O-NZ 3.4Å; N115-K1049 PolarHBondContact OD1-NZ 3.4Å; D118-K1049 VanDerWaalsContact CG-N 3.27Å; D118-K1049 PolarHBondContact OD1-N 3.17Å; D118-K1049 WeakPolarHBondContact OD2-CB 3.32Å; D118-K1049 VanDerWaalsContact OD2-CG 3.26Å; D118-K1049 WeakPolarHBondContact OD2-CG 3.48Å; D118-K1049 PolarHBondContact OD2-N 3.41Å
1050	R	78.6	Confident	66.6	Low	114 Å²	114	88 Å²	88	43%	0.43	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-40.9	171	67	168	-69.2	160.3	6.4	113.5	D118 H834 A1048 K1053	D118-R1050 PolarHBondContact OD1-N 3.32Å; D118-R1050 VanDerWaalsContact OD1-N 3.11Å; H834-R1050 PolarHBondContact NE2-NH1 2.94Å; H834-R1050 VanDerWaalsContact NE2-NH1 3.14Å; A1048-R1050 HydrophobicContact CB-CG 4.22Å; A1048-R1050 PolarHBondContact O-N 3.46Å; R1050-K1053 PolarHBondContact O-N 2.84Å
1051	W	75.9	Confident	64.4	Low	45 Å²	45	89.7 Å²	89.7	17%	0.17	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-79.1	-30.7	-174.8	-57.8	124.4	0	0	0	112.1	H834 Q838 P839 V1047 A1048 K1053 E1054	H834-W1051 PolarHBondContact O-NE1 2.8Å; Q838-W1051 HydrophobicContact CB-CZ2 3.94Å; Q838-W1051 HydrophobicContact CG-CD2 4.24Å; Q838-W1051 HydrophobicContact CG-CH2 4.14Å; Q838-W1051 HydrophobicContact CG-CZ2 3.8Å; P839-W1051 HydrophobicContact CG-CB 4.06Å; V1047-W1051 HydrophobicContact CG1-CB 3.94Å; A1048-W1051 PolarHBondContact O-N 2.94Å; W1051-K1053 PolarHBondContact O-N 3.44Å; W1051-E1054 PolarHBondContact O-N 2.97Å
1052	L	70.4	Confident	62.3	Low	105 Å²	105	90.5 Å²	90.5	55%	0.55	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-66.3	-12.6	173.7	-66.1	173.4	0	0	0	114	V1047	V1047-L1052 HydrophobicContact CB-CD2 4.3Å; V1047-L1052 HydrophobicContact CB-CG 4.38Å; V1047-L1052 HydrophobicContact CG1-CD2 3.96Å; V1047-L1052 HydrophobicContact CG1-CG 3.9Å
1053	K	57	Low	60.7	Low	183 Å²	183	93 Å²	93	80%	0.796	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-81.6	-21.9	178.8	-78.3	-179.3	176.8	177.7	0	114.1	R1050 W1051	R1050-K1053 PolarHBondContact O-N 2.84Å; W1051-K1053 PolarHBondContact O-N 3.44Å
1054	E	51.3	Low	59.3	Low	139 Å²	139	93 Å²	93	65%	0.65	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-18.1	-174.2	-67.6	177.1	155.8	0	0	112.8	W1051	W1051-E1054 PolarHBondContact O-N 2.97Å
1055	N	41.8	Very low	58.1	Low	100 Å²	100	93.8 Å²	93.8	54%	0.535	44%	0.438	S	S	.	.	S	Bend	trans	-140.2	137.2	179	-78.4	-68.6	0	0	0	113
1056	Y	39.6	Very low	56.9	Low	160 Å²	160	96.6 Å²	96.6	63%	0.627	45%	0.454	S	S	*	.			trans	62.3	77.8	173.2	-69.4	-78.8	0	0	0	118.6	K782	K782-Y1056 VanDerWaalsContact NZ-CZ 3.32Å; K782-Y1056 PolarHBondContact NZ-OH 3.42Å
1057	R	32.5	Very low	56.2	Low	247 Å²	247	98 Å²	98	93%	0.932	46%	0.463	S	S	*	.				-88.8	101.6	124	-84.1	-176.3	170	-176.1	-2.4	108.7
1058	E	33.5	Very low	55.6	Low	140 Å²	140	99.7 Å²	99.7	65%	0.654	48%	0.481	S	S	*	.	S	Bend	trans	-179.5	143	142.9	-107.6	171	-144.2	0	0	112.4	F1060	E1058-F1060 VanDerWaalsContact C-N 3.27Å; E1058-F1060 HydrophobicContact CB-CD2 4.33Å; E1058-F1060 PolarHBondContact O-N 3.26Å; E1058-F1060 WeakPolarHBondContact OE2-CE2 3.32Å
1059	N	32.7	Very low	55.2	Low	164 Å²	164	105.1 Å²	105.1	88%	0.877	51%	0.506	S	S	*	.			trans	-82.5	67.4	178.5	-70.3	-18.6	0	0	0	111
1060	F	34.2	Very low	55.2	Low	162 Å²	162	100.5 Å²	100.5	71%	0.711	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-90.1	135.6	171.7	-104.7	-91	0	0	0	111.6	E1058	E1058-F1060 VanDerWaalsContact C-N 3.27Å; E1058-F1060 HydrophobicContact CB-CD2 4.33Å; E1058-F1060 PolarHBondContact O-N 3.26Å; E1058-F1060 WeakPolarHBondContact OE2-CE2 3.32Å
1061	V	39.4	Very low	55.4	Low	50 Å²	50	98.1 Å²	98.1	30%	0.303	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-60	140.6	167	178.8	0	0	0	0	108.3	F1013 S1063	F1013-V1061 HydrophobicContact CB-CB 4.1Å; F1013-V1061 HydrophobicContact CB-CG1 4.08Å; F1013-V1061 HydrophobicContact CB-CG2 4.45Å; F1013-V1061 WeakPolarHBondContact O-CG2 3.33Å; V1061-S1063 PolarHBondContact O-N 3.17Å
1062	P	44.2	Very low	55.7	Low	30 Å²	30	101.3 Å²	101.3	20%	0.195	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-56	116.5	179.5	-25.4	34.4	0	0	0	111.5	I780 K782 Y786 Q1064	I780-P1062 HydrophobicContact CG2-CB 4.2Å; K782-P1062 HydrophobicContact CB-CB 4.14Å; K782-P1062 HydrophobicContact CB-CG 3.99Å; K782-P1062 HydrophobicContact CG-CB 3.8Å; K782-P1062 HydrophobicContact CG-CG 4Å; Y786-P1062 HydrophobicContact CE1-CG 3.96Å; Y786-P1062 WeakPolarHBondContact OH-CG 3.28Å; P1062-Q1064 PolarHBondContact O-N 3.19Å
1063	S	49.5	Very low	56.2	Low	78 Å²	78	99.8 Å²	99.8	55%	0.545	49%	0.49	S	S	.	.			trans	-62.2	115.3	162.6	50.5	0	0	0	0	107.7	V1061 I1065	V1061-S1063 PolarHBondContact O-N 3.17Å; S1063-I1065 PolarHBondContact O-N 3.23Å
1064	Q	57.5	Low	57.6	Low	59 Å²	59	91.3 Å²	91.3	28%	0.276	45%	0.453	S	S	.	.			trans	-59.1	122.9	171.7	-63.4	165.7	1.1	0	0	107.6	P1062 L1066	P1062-Q1064 PolarHBondContact O-N 3.19Å; Q1064-L1066 PolarHBondContact O-N 3.38Å
1065	I	62.4	Low	59.2	Low	27 Å²	27	89.4 Å²	89.4	14%	0.138	44%	0.444	C	S	.	.	B	Isolated β-bridge	trans	-78.8	110	171.9	-62.9	178.5	0	0	0	106.3	S779 N781 S1063 F1070 Y1108	S779-I1065 PolarHBondContact O-N 2.94Å; S779-I1065 VanDerWaalsContact O-N 3.14Å; N781-I1065 HydrophobicContact CB-CD1 3.59Å; N781-I1065 HydrophobicContact CB-CG1 4.48Å; S1063-I1065 PolarHBondContact O-N 3.23Å; I1065-F1070 HydrophobicContact CG2-CB 4.03Å; I1065-Y1108 HydrophobicContact CD1-CE2 4.35Å; I1065-Y1108 HydrophobicContact CG2-CE2 4.18Å
1066	L	63.8	Low	61.2	Low	76 Å²	76	92 Å²	92	40%	0.398	45%	0.45	S	S	.	.			trans	-77.7	146.9	172.5	-66.5	173.8	0	0	0	109.2	Q1064 A1068 E1069 F1070	Q1064-L1066 PolarHBondContact O-N 3.38Å; L1066-A1068 PolarHBondContact O-N 2.83Å; L1066-E1069 HydrophobicContact CB-CG 4.34Å; L1066-E1069 PolarHBondContact N-OE2 2.7Å; L1066-E1069 VanDerWaalsContact N-OE2 3.13Å; L1066-E1069 WeakPolarHBondContact O-CB 3.45Å; L1066-E1069 PolarHBondContact O-N 3.31Å; L1066-F1070 PolarHBondContact O-N 3.3Å
1067	P	70.3	Confident	63.4	Low	49 Å²	49	85 Å²	85	32%	0.318	43%	0.425	S	S	.	.	H	α-helix	trans	-52.7	-34.3	-178.7	-29.1	35	0	0	0	114.3	E1069 Q1071 Y1104	P1067-E1069 VanDerWaalsContact C-N 3.34Å; P1067-E1069 PolarHBondContact O-N 2.78Å; P1067-Q1071 WeakPolarHBondContact O-CG 2.9Å; P1067-Q1071 PolarHBondContact O-N 2.89Å; P1067-Y1104 HydrophobicContact CB-CD1 4.05Å; P1067-Y1104 HydrophobicContact CB-CD2 3.86Å; P1067-Y1104 HydrophobicContact CB-CE1 4.22Å; P1067-Y1104 HydrophobicContact CB-CE2 4.02Å; P1067-Y1104 HydrophobicContact CB-CG 3.89Å; P1067-Y1104 HydrophobicContact CG-CD1 3.87Å; P1067-Y1104 HydrophobicContact CG-CD2 4.49Å; P1067-Y1104 HydrophobicContact CG-CE1 3.8Å; P1067-Y1104 HydrophobicContact CG-CE2 4.42Å; P1067-Y1104 HydrophobicContact CG-CG 4.24Å
1068	A	69.6	Low	65.7	Low	69 Å²	69	75.3 Å²	75.3	57%	0.57	39%	0.391	S	S	*	.	H	α-helix	trans	-71.1	-22.3	177.9	0	0	0	0	0	114.7	L1066 N1072	L1066-A1068 PolarHBondContact O-N 2.83Å; A1068-N1072 PolarHBondContact O-ND2 3.5Å; A1068-N1072 VanDerWaalsContact O-ND2 3.11Å
1069	E	74.2	Confident	67.9	Low	113 Å²	113	74.4 Å²	74.4	53%	0.528	39%	0.391	S	S	.	.	H	α-helix	trans	-78.9	-47.2	174.6	-64.4	179.9	132.3	0	0	110.1	L1066 P1067 Q1071 N1072 E1073	L1066-E1069 HydrophobicContact CB-CG 4.34Å; L1066-E1069 PolarHBondContact N-OE2 2.7Å; L1066-E1069 VanDerWaalsContact N-OE2 3.13Å; L1066-E1069 WeakPolarHBondContact O-CB 3.45Å; L1066-E1069 PolarHBondContact O-N 3.31Å; P1067-E1069 VanDerWaalsContact C-N 3.34Å; P1067-E1069 PolarHBondContact O-N 2.78Å; E1069-Q1071 PolarHBondContact O-N 3.05Å; E1069-N1072 WeakPolarHBondContact O-CB 3.42Å; E1069-N1072 PolarHBondContact O-N 3.09Å; E1069-E1073 PolarHBondContact O-N 2.93Å
1070	F	82.2	Confident	69.5	Low	1 Å²	1	68.5 Å²	68.5	0%	0.004	36%	0.362	C	S	.	.	H	α-helix	trans	-58.9	-46	173.2	167	-103.9	0	0	0	112.2	I1065 L1066 N1072 E1073 Y1074 Y1104 Q1107 Y1108 F1111 Y1112	I1065-F1070 HydrophobicContact CG2-CB 4.03Å; L1066-F1070 PolarHBondContact O-N 3.3Å; F1070-N1072 PolarHBondContact O-N 2.84Å; F1070-E1073 WeakPolarHBondContact O-CA 3.03Å; F1070-E1073 PolarHBondContact O-N 3.41Å; F1070-Y1074 HydrophobicContact CE1-CD2 4.44Å; F1070-Y1074 HydrophobicContact CE1-CG 4.25Å; F1070-Y1074 AromaticContact CZ-CD2 3.83Å; F1070-Y1074 HydrophobicContact CZ-CD2 3.83Å; F1070-Y1074 HydrophobicContact CZ-CG 4.01Å; F1070-Y1074 PolarHBondContact O-N 2.96Å; F1070-Y1104 HydrophobicContact CB-CE2 3.86Å; F1070-Y1104 AromaticContact CD1-CD2 3.66Å; F1070-Y1104 HydrophobicContact CD1-CD2 3.66Å; F1070-Y1104 AromaticContact CD1-CE2 3.53Å; F1070-Y1104 HydrophobicContact CD1-CE2 3.53Å; F1070-Y1104 HydrophobicContact CE1-CD2 4.28Å; F1070-Y1104 HydrophobicContact CE1-CE2 4.4Å; F1070-Y1104 HydrophobicContact CG-CD2 4.47Å; F1070-Y1104 AromaticContact CG-CE2 3.91Å; F1070-Y1104 HydrophobicContact CG-CE2 3.91Å; F1070-Q1107 HydrophobicContact CE1-CB 3.71Å; F1070-Q1107 HydrophobicContact CZ-CB 4.01Å; F1070-Y1108 HydrophobicContact CB-CD2 4.22Å; F1070-Y1108 HydrophobicContact CD1-CD2 4.34Å; F1070-Y1108 AromaticContact CD2-CD2 3.77Å; F1070-Y1108 HydrophobicContact CD2-CD2 3.77Å; F1070-Y1108 HydrophobicContact CD2-CE2 4.43Å; F1070-Y1108 HydrophobicContact CE2-CD2 4.22Å; F1070-Y1108 AromaticContact CG-CD2 3.81Å; F1070-Y1108 HydrophobicContact CG-CD2 3.81Å; F1070-F1111 HydrophobicContact CE2-CB 4.2Å; F1070-F1111 AromaticContact CE2-CD1 3.89Å; F1070-F1111 HydrophobicContact CE2-CD1 3.89Å; F1070-F1111 HydrophobicContact CE2-CG 4.12Å; F1070-F1111 HydrophobicContact CZ-CB 4.22Å; F1070-F1111 HydrophobicContact CZ-CG 4.47Å; F1070-Y1112 HydrophobicContact CD2-CD2 4.32Å; F1070-Y1112 AromaticContact CD2-CE2 3.39Å; F1070-Y1112 HydrophobicContact CD2-CE2 3.39Å; F1070-Y1112 AromaticContact CD2-CZ 3.84Å; F1070-Y1112 HydrophobicContact CE2-CD2 4.16Å; F1070-Y1112 AromaticContact CE2-CE2 3.62Å; F1070-Y1112 HydrophobicContact CE2-CE2 3.62Å; F1070-Y1112 HydrophobicContact CG-CE2 4.49Å
1071	Q	82.2	Confident	71	Confident	63 Å²	63	72.3 Å²	72.3	29%	0.294	37%	0.374	S	S	.	.	H	α-helix	trans	-62.6	-27.4	-179.3	-76.7	-150.9	-28.5	0	0	113.1	P1067 E1069 H1075 Q1107	P1067-Q1071 WeakPolarHBondContact O-CG 2.9Å; P1067-Q1071 PolarHBondContact O-N 2.89Å; E1069-Q1071 PolarHBondContact O-N 3.05Å; Q1071-H1075 VanDerWaalsContact O-CB 3.24Å; Q1071-H1075 WeakPolarHBondContact O-CB 3.47Å; Q1071-H1075 PolarHBondContact O-N 3.35Å; Q1071-Q1107 VanDerWaalsContact NE2-OE1 3.08Å
1072	N	82.5	Confident	72	Confident	112 Å²	112	77.4 Å²	77.4	60%	0.599	39%	0.394	S	S	*	.	H	α-helix	trans	-66.5	-36.6	169.8	-97.5	-69.3	0	0	0	113	A1068 E1069 F1070 K1076	A1068-N1072 PolarHBondContact O-ND2 3.5Å; A1068-N1072 VanDerWaalsContact O-ND2 3.11Å; E1069-N1072 WeakPolarHBondContact O-CB 3.42Å; E1069-N1072 PolarHBondContact O-N 3.09Å; F1070-N1072 PolarHBondContact O-N 2.84Å; N1072-K1076 WeakPolarHBondContact O-CG 3.48Å; N1072-K1076 PolarHBondContact O-N 2.98Å
1073	E	80.7	Confident	72.7	Confident	74 Å²	74	84.5 Å²	84.5	35%	0.346	42%	0.418	S	S	.	.	H	α-helix	trans	-73.1	-45.7	174.5	-171.6	171.9	-161.1	0	0	111.2	E1069 F1070 H1075 K1076 C1077 F1111 Y1112	E1069-E1073 PolarHBondContact O-N 2.93Å; F1070-E1073 WeakPolarHBondContact O-CA 3.03Å; F1070-E1073 PolarHBondContact O-N 3.41Å; E1073-H1075 PolarHBondContact O-N 2.85Å; E1073-K1076 WeakPolarHBondContact O-CB 3.44Å; E1073-K1076 PolarHBondContact O-N 3.07Å; E1073-K1076 VanDerWaalsContact O-N 3.1Å; E1073-C1077 PolarHBondContact O-N 3.11Å; E1073-F1111 HydrophobicContact CG-CZ 4.47Å; E1073-Y1112 PolarHBondContact OE2-OH 2.92Å
1074	Y	85.4	Confident	73.5	Confident	5 Å²	5	85.9 Å²	85.9	2%	0.02	42%	0.416	C	S	.	.	H	α-helix	trans	-59.3	-45.3	177.3	-175.6	-102.2	0	0	0	112.3	F1070 K1076 C1077 M1078 M1093 I1096 E1097 F1111	F1070-Y1074 HydrophobicContact CE1-CD2 4.44Å; F1070-Y1074 HydrophobicContact CE1-CG 4.25Å; F1070-Y1074 AromaticContact CZ-CD2 3.83Å; F1070-Y1074 HydrophobicContact CZ-CD2 3.83Å; F1070-Y1074 HydrophobicContact CZ-CG 4.01Å; F1070-Y1074 PolarHBondContact O-N 2.96Å; Y1074-K1076 VanDerWaalsContact C-N 3.34Å; Y1074-K1076 PolarHBondContact O-N 2.73Å; Y1074-C1077 PolarHBondContact O-N 2.82Å; Y1074-M1078 HydrophobicContact CD1-CG 4.48Å; Y1074-M1078 HydrophobicContact CE1-CG 4.04Å; Y1074-M1078 PolarHBondContact O-N 2.79Å; Y1074-M1093 HydrophobicContact CD2-CE 3.72Å; Y1074-M1093 HydrophobicContact CE2-CE 3.43Å; Y1074-M1093 VanDerWaalsContact CE2-CE 3.43Å; Y1074-M1093 HydrophobicContact CE2-SD 4.38Å; Y1074-M1093 HydrophobicContact CG-CE 4.46Å; Y1074-I1096 HydrophobicContact CE2-CG2 3.99Å; Y1074-E1097 PolarHBondContact OH-N 2.82Å; Y1074-F1111 AromaticContact CD2-CD2 3.9Å; Y1074-F1111 HydrophobicContact CD2-CD2 3.9Å; Y1074-F1111 HydrophobicContact CD2-CE2 4.48Å; Y1074-F1111 HydrophobicContact CD2-CG 4.4Å; Y1074-F1111 HydrophobicContact CE2-CD2 4.37Å
1075	H	84.9	Confident	73.8	Confident	98 Å²	98	87.6 Å²	87.6	45%	0.454	44%	0.44	S	S	.	.	H	α-helix	trans	-67.6	-28.2	174.8	-76.9	-0.7	0	0	0	113.6	Q1071 E1073 N1079	Q1071-H1075 VanDerWaalsContact O-CB 3.24Å; Q1071-H1075 WeakPolarHBondContact O-CB 3.47Å; Q1071-H1075 PolarHBondContact O-N 3.35Å; E1073-H1075 PolarHBondContact O-N 2.85Å; H1075-N1079 WeakPolarHBondContact O-CB 3.46Å; H1075-N1079 PolarHBondContact O-N 2.92Å; H1075-N1079 VanDerWaalsContact O-N 3.11Å; H1075-N1079 PolarHBondContact O-ND2 2.91Å
1076	K	84.3	Confident	74.1	Confident	154 Å²	154	91 Å²	91	67%	0.67	46%	0.462	S	S	*	.	H	α-helix	trans	-65	-46.7	169.7	-81.4	174.5	177.1	-179.4	0	111.1	N1072 E1073 Y1074 M1078 N1079 S1080	N1072-K1076 WeakPolarHBondContact O-CG 3.48Å; N1072-K1076 PolarHBondContact O-N 2.98Å; E1073-K1076 WeakPolarHBondContact O-CB 3.44Å; E1073-K1076 PolarHBondContact O-N 3.07Å; E1073-K1076 VanDerWaalsContact O-N 3.1Å; Y1074-K1076 VanDerWaalsContact C-N 3.34Å; Y1074-K1076 PolarHBondContact O-N 2.73Å; K1076-M1078 PolarHBondContact O-N 3.17Å; K1076-N1079 PolarHBondContact O-N 2.91Å; K1076-S1080 WeakPolarHBondContact O-CB 3.32Å; K1076-S1080 PolarHBondContact O-N 2.79Å
1077	C	85	Confident	74.7	Confident	15 Å²	15	88.1 Å²	88.1	10%	0.101	45%	0.448	C	S	.	.	H	α-helix	trans	-64.7	-37.2	177.2	-71.1	0	0	0	0	113	E1073 Y1074 C1087 M1093 F1111	E1073-C1077 PolarHBondContact O-N 3.11Å; Y1074-C1077 PolarHBondContact O-N 2.82Å; C1077-C1087 VanDerWaalsContact CA-SG 3.53Å; C1077-C1087 HydrophobicContact CB-CB 3.75Å; C1077-C1087 WeakPolarHBondContact CB-SG 3.12Å; C1077-C1087 WeakPolarHBondContact SG-CB 3.46Å; C1077-C1087 CovalentContact SG-SG 2.04Å; C1077-C1087 PolarHBondContact SG-SG 3.3Å; C1077-M1093 HydrophobicContact CB-CE 3.74Å; C1077-M1093 HydrophobicContact CB-SD 4.31Å; C1077-F1111 HydrophobicContact CB-CE2 3.88Å; C1077-F1111 HydrophobicContact CB-CZ 4.42Å; C1077-F1111 VanDerWaalsContact SG-CE2 3.56Å; C1077-F1111 VanDerWaalsContact SG-CZ 3.54Å
1078	M	81.9	Confident	75.1	Confident	42 Å²	42	86.8 Å²	86.8	21%	0.207	44%	0.439	C	S	.	.	H	α-helix	trans	-65.2	-38.6	175.2	-85.5	-67.8	-73	0	0	113.6	Y1074 K1076 M1093 E1097	Y1074-M1078 HydrophobicContact CD1-CG 4.48Å; Y1074-M1078 HydrophobicContact CE1-CG 4.04Å; Y1074-M1078 PolarHBondContact O-N 2.79Å; K1076-M1078 PolarHBondContact O-N 3.17Å; M1078-M1093 HydrophobicContact CG-CE 3.72Å; M1078-M1093 HydrophobicContact SD-CB 3.89Å; M1078-M1093 HydrophobicContact SD-CE 4.14Å; M1078-E1097 HydrophobicContact CE-CB 4.4Å; M1078-E1097 VanDerWaalsContact CE-CD 3.43Å; M1078-E1097 HydrophobicContact CE-CG 4.38Å; M1078-E1097 VanDerWaalsContact CE-OE1 3.25Å; M1078-E1097 WeakPolarHBondContact CE-OE1 3.34Å
1079	N	78.6	Confident	75.6	Confident	122 Å²	122	86 Å²	86	65%	0.652	43%	0.43	S	S	*	.	H	α-helix	trans	-95.6	-0.4	-174.3	-66.7	-58	0	0	0	114	H1075 K1076 Y1081	H1075-N1079 WeakPolarHBondContact O-CB 3.46Å; H1075-N1079 PolarHBondContact O-N 2.92Å; H1075-N1079 VanDerWaalsContact O-N 3.11Å; H1075-N1079 PolarHBondContact O-ND2 2.91Å; K1076-N1079 PolarHBondContact O-N 2.91Å; N1079-Y1081 PolarHBondContact O-N 3.25Å
1080	S	67.8	Low	76	Confident	40 Å²	40	87.4 Å²	87.4	28%	0.28	43%	0.432	S	S	.	.			trans	-79.4	120.9	179.8	-167.5	0	0	0	0	111.6	K1076 E1082	K1076-S1080 WeakPolarHBondContact O-CB 3.32Å; K1076-S1080 PolarHBondContact O-N 2.79Å; S1080-E1082 VanDerWaalsContact C-N 3.28Å; S1080-E1082 WeakPolarHBondContact CB-O 3.45Å; S1080-E1082 PolarHBondContact OG-N 3.18Å; S1080-E1082 PolarHBondContact OG-O 2.94Å
1081	Y	64.4	Low	76	Confident	241 Å²	241	93.2 Å²	93.2	95%	0.945	46%	0.462	S	S	*	.	S	Bend	trans	-76.6	-16.6	166	-76.8	-91.3	0	0	0	112.5	N1079	N1079-Y1081 PolarHBondContact O-N 3.25Å
1082	E	60	Low	76.1	Confident	158 Å²	158	92 Å²	92	74%	0.738	46%	0.46	S	S	*	.	S	Bend	trans	-100.3	141.1	176.3	-65.4	-170.1	130.4	0	0	111.4	S1080 H1084	S1080-E1082 VanDerWaalsContact C-N 3.28Å; S1080-E1082 WeakPolarHBondContact CB-O 3.45Å; S1080-E1082 PolarHBondContact OG-N 3.18Å; S1080-E1082 PolarHBondContact OG-O 2.94Å; E1082-H1084 PolarHBondContact O-N 2.89Å; E1082-H1084 VanDerWaalsContact O-N 3.14Å
1083	Y	59.4	Low	76.3	Confident	179 Å²	179	86.9 Å²	86.9	70%	0.702	43%	0.432	S	S	*	.			trans	-76.1	100.8	179	-177.9	-94.6	0	0	0	111.1
1084	H	65.4	Low	76.7	Confident	107 Å²	107	87.9 Å²	87.9	50%	0.495	44%	0.435	S	S	.	.			trans	-78.1	127.1	166.1	-83.1	-61.8	0	0	0	110.4	E1082 T1086 C1087	E1082-H1084 PolarHBondContact O-N 2.89Å; E1082-H1084 VanDerWaalsContact O-N 3.14Å; H1084-T1086 PolarHBondContact O-N 3.05Å; H1084-C1087 HydrophobicContact CB-CB 4.47Å; H1084-C1087 PolarHBondContact O-N 3.47Å
1085	A	65	Low	76.7	Confident	94 Å²	94	89.6 Å²	89.6	78%	0.777	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-10	-177.5	0	0	0	0	0	115.4
1086	T	68.2	Low	77	Confident	99 Å²	99	84.9 Å²	84.9	61%	0.607	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-18.1	172.9	49.6	0	0	0	0	113.7	H1084	H1084-T1086 PolarHBondContact O-N 3.05Å
1087	C	76.6	Confident	77.2	Confident	15 Å²	15	82.1 Å²	82.1	10%	0.101	42%	0.418	C	S	.	.	S	Bend	trans	-83.4	146.1	178.8	-61.2	0	0	0	0	111	C1077 H1084	C1077-C1087 VanDerWaalsContact CA-SG 3.53Å; C1077-C1087 HydrophobicContact CB-CB 3.75Å; C1077-C1087 WeakPolarHBondContact CB-SG 3.12Å; C1077-C1087 WeakPolarHBondContact SG-CB 3.46Å; C1077-C1087 CovalentContact SG-SG 2.04Å; C1077-C1087 PolarHBondContact SG-SG 3.3Å; H1084-C1087 HydrophobicContact CB-CB 4.47Å; H1084-C1087 PolarHBondContact O-N 3.47Å
1088	P	78.3	Confident	77.4	Confident	21 Å²	21	89.7 Å²	89.7	14%	0.136	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-58.6	162.5	161.2	-21.8	33.1	0	0	0	112.4	T1092 M1093 F1111	P1088-T1092 HydrophobicContact CB-CG2 3.73Å; P1088-M1093 HydrophobicContact CB-CG 4.29Å; P1088-M1093 HydrophobicContact CB-SD 3.95Å; P1088-M1093 HydrophobicContact CG-SD 3.82Å; P1088-F1111 HydrophobicContact CG-CD2 3.75Å; P1088-F1111 HydrophobicContact CG-CE2 4.07Å; P1088-F1111 HydrophobicContact CG-CG 4.37Å
1089	S	80.7	Confident	77.8	Confident	54 Å²	54	89.9 Å²	89.9	38%	0.378	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-62.3	154.7	174.9	64.5	0	0	0	0	112.4	D1091 T1092 M1093	S1089-D1091 VanDerWaalsContact C-N 3.33Å; S1089-D1091 PolarHBondContact O-N 2.84Å; S1089-T1092 CarbonylContact O-C 3.53Å; S1089-T1092 WeakPolarHBondContact O-CA 3.36Å; S1089-T1092 VanDerWaalsContact O-CB 3.28Å; S1089-T1092 WeakPolarHBondContact O-CB 3.27Å; S1089-T1092 PolarHBondContact O-N 2.82Å; S1089-T1092 WeakPolarHBondContact OG-CB 3.24Å; S1089-T1092 PolarHBondContact OG-OG1 3.49Å; S1089-M1093 PolarHBondContact O-N 3.24Å
1090	Y	81.8	Confident	78.4	Confident	142 Å²	142	84.1 Å²	84.1	56%	0.557	42%	0.422	S	S	*	.	H	α-helix	trans	-55.3	-42.6	-176.6	-178	-104.7	0	0	0	113.8	T1092 M1093 K1094	Y1090-T1092 VanDerWaalsContact C-N 3.34Å; Y1090-T1092 PolarHBondContact O-N 3.34Å; Y1090-M1093 PolarHBondContact O-N 2.93Å; Y1090-K1094 HydrophobicContact CE1-CD 3.98Å; Y1090-K1094 VanDerWaalsContact CE1-NZ 3.35Å; Y1090-K1094 PolarHBondContact O-N 3.24Å; Y1090-K1094 WeakPolarHBondContact OH-CE 3.35Å; Y1090-K1094 PolarHBondContact OH-NZ 2.95Å
1091	D	83.6	Confident	79.4	Confident	122 Å²	122	87.6 Å²	87.6	65%	0.652	44%	0.437	S	S	*	.	H	α-helix	trans	-67.7	-35.5	177.1	-59.5	-47.1	0	0	0	111.9	S1089 A1095	S1089-D1091 VanDerWaalsContact C-N 3.33Å; S1089-D1091 PolarHBondContact O-N 2.84Å; D1091-A1095 WeakPolarHBondContact O-CB 2.99Å; D1091-A1095 PolarHBondContact O-N 2.86Å
1092	T	83.9	Confident	80.4	Confident	39 Å²	39	84.3 Å²	84.3	24%	0.239	43%	0.43	C	S	.	.	H	α-helix	trans	-63.4	-46.2	171.3	-59.8	0	0	0	0	110.6	P1088 S1089 Y1090 K1094 A1095 I1096 P1116	P1088-T1092 HydrophobicContact CB-CG2 3.73Å; S1089-T1092 CarbonylContact O-C 3.53Å; S1089-T1092 WeakPolarHBondContact O-CA 3.36Å; S1089-T1092 VanDerWaalsContact O-CB 3.28Å; S1089-T1092 WeakPolarHBondContact O-CB 3.27Å; S1089-T1092 PolarHBondContact O-N 2.82Å; S1089-T1092 WeakPolarHBondContact OG-CB 3.24Å; S1089-T1092 PolarHBondContact OG-OG1 3.49Å; Y1090-T1092 VanDerWaalsContact C-N 3.34Å; Y1090-T1092 PolarHBondContact O-N 3.34Å; T1092-K1094 PolarHBondContact O-N 2.85Å; T1092-A1095 WeakPolarHBondContact O-CB 3.47Å; T1092-A1095 PolarHBondContact O-N 3.36Å; T1092-A1095 VanDerWaalsContact O-N 3.11Å; T1092-I1096 HydrophobicContact CG2-CD1 3.99Å; T1092-I1096 HydrophobicContact CG2-CG1 4.43Å; T1092-I1096 VanDerWaalsContact O-CG1 3.28Å; T1092-I1096 WeakPolarHBondContact O-CG1 3.36Å; T1092-I1096 PolarHBondContact O-N 3.28Å; T1092-P1116 HydrophobicContact CG2-CG 3.73Å
1093	M	87.3	Confident	81.8	Confident	3 Å²	3	79 Å²	79	2%	0.015	41%	0.406	C	S	.	.	H	α-helix	trans	-58.4	-44.4	177.9	-68.7	-61.3	-64.3	0	0	112.1	Y1074 C1077 M1078 P1088 S1089 Y1090 I1096 E1097 F1111	Y1074-M1093 HydrophobicContact CD2-CE 3.72Å; Y1074-M1093 HydrophobicContact CE2-CE 3.43Å; Y1074-M1093 VanDerWaalsContact CE2-CE 3.43Å; Y1074-M1093 HydrophobicContact CE2-SD 4.38Å; Y1074-M1093 HydrophobicContact CG-CE 4.46Å; C1077-M1093 HydrophobicContact CB-CE 3.74Å; C1077-M1093 HydrophobicContact CB-SD 4.31Å; M1078-M1093 HydrophobicContact CG-CE 3.72Å; M1078-M1093 HydrophobicContact SD-CB 3.89Å; M1078-M1093 HydrophobicContact SD-CE 4.14Å; P1088-M1093 HydrophobicContact CB-CG 4.29Å; P1088-M1093 HydrophobicContact CB-SD 3.95Å; P1088-M1093 HydrophobicContact CG-SD 3.82Å; S1089-M1093 PolarHBondContact O-N 3.24Å; Y1090-M1093 PolarHBondContact O-N 2.93Å; M1093-I1096 PolarHBondContact O-N 3.2Å; M1093-E1097 PolarHBondContact O-N 3.43Å; M1093-F1111 HydrophobicContact CE-CD2 4.15Å; M1093-F1111 HydrophobicContact CE-CE2 4.17Å; M1093-F1111 HydrophobicContact SD-CD2 3.8Å; M1093-F1111 HydrophobicContact SD-CE2 3.97Å
1094	K	87.1	Confident	83.1	Confident	95 Å²	95	71.7 Å²	71.7	41%	0.413	38%	0.378	S	S	.	.	H	α-helix	trans	-64.7	-37.2	173.4	-79.8	-173.8	173.1	173.8	0	113.6	Y1090 T1092 I1096 K1098	Y1090-K1094 HydrophobicContact CE1-CD 3.98Å; Y1090-K1094 VanDerWaalsContact CE1-NZ 3.35Å; Y1090-K1094 PolarHBondContact O-N 3.24Å; Y1090-K1094 WeakPolarHBondContact OH-CE 3.35Å; Y1090-K1094 PolarHBondContact OH-NZ 2.95Å; T1092-K1094 PolarHBondContact O-N 2.85Å; K1094-I1096 VanDerWaalsContact C-N 3.32Å; K1094-K1098 VanDerWaalsContact O-CB 3.32Å; K1094-K1098 WeakPolarHBondContact O-CB 3.26Å; K1094-K1098 PolarHBondContact O-N 2.76Å
1095	A	87.4	Confident	84.3	Confident	41 Å²	41	66.9 Å²	66.9	34%	0.339	36%	0.355	S	S	.	.	H	α-helix	trans	-63.8	-39.9	174.4	0	0	0	0	0	111.2	D1091 T1092 T1099	D1091-A1095 WeakPolarHBondContact O-CB 2.99Å; D1091-A1095 PolarHBondContact O-N 2.86Å; T1092-A1095 WeakPolarHBondContact O-CB 3.47Å; T1092-A1095 PolarHBondContact O-N 3.36Å; T1092-A1095 VanDerWaalsContact O-N 3.11Å; A1095-T1099 WeakPolarHBondContact O-CB 3.1Å; A1095-T1099 PolarHBondContact O-N 2.73Å; A1095-T1099 PolarHBondContact O-OG1 3.5Å
1096	I	90.1	Very high	85.5	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.7	-51.6	176.1	-63.6	171.8	0	0	0	110.6	Y1074 T1092 M1093 K1094 K1098 T1099 C1100 P1116	Y1074-I1096 HydrophobicContact CE2-CG2 3.99Å; T1092-I1096 HydrophobicContact CG2-CD1 3.99Å; T1092-I1096 HydrophobicContact CG2-CG1 4.43Å; T1092-I1096 VanDerWaalsContact O-CG1 3.28Å; T1092-I1096 WeakPolarHBondContact O-CG1 3.36Å; T1092-I1096 PolarHBondContact O-N 3.28Å; M1093-I1096 PolarHBondContact O-N 3.2Å; K1094-I1096 VanDerWaalsContact C-N 3.32Å; I1096-K1098 PolarHBondContact O-N 2.96Å; I1096-T1099 PolarHBondContact O-N 3.39Å; I1096-C1100 VanDerWaalsContact O-CB 3.32Å; I1096-C1100 WeakPolarHBondContact O-CB 3.25Å; I1096-C1100 PolarHBondContact O-N 2.9Å; I1096-P1116 HydrophobicContact CG1-CB 4.19Å; I1096-P1116 HydrophobicContact CG1-CG 4.13Å
1097	E	88.8	Confident	86.6	Confident	95 Å²	95	58.2 Å²	58.2	44%	0.444	29%	0.292	S	S	.	.	H	α-helix	trans	-53.1	-53	178.2	178.2	-176	-130.1	0	0	111.3	Y1074 M1078 M1093 T1099 L1101	Y1074-E1097 PolarHBondContact OH-N 2.82Å; M1078-E1097 HydrophobicContact CE-CB 4.4Å; M1078-E1097 VanDerWaalsContact CE-CD 3.43Å; M1078-E1097 HydrophobicContact CE-CG 4.38Å; M1078-E1097 VanDerWaalsContact CE-OE1 3.25Å; M1078-E1097 WeakPolarHBondContact CE-OE1 3.34Å; M1093-E1097 PolarHBondContact O-N 3.43Å; E1097-T1099 VanDerWaalsContact C-N 3.3Å; E1097-T1099 PolarHBondContact O-N 2.86Å; E1097-L1101 WeakPolarHBondContact O-CA 3.23Å; E1097-L1101 PolarHBondContact O-N 2.76Å
1098	K	90	Very high	87.2	Confident	174 Å²	174	57.5 Å²	57.5	76%	0.757	29%	0.287	S	S	*	.	H	α-helix	trans	-61.4	-35.4	-179.8	-176.2	-178	177.2	-174	0	113.2	K1094 I1096	K1094-K1098 VanDerWaalsContact O-CB 3.32Å; K1094-K1098 WeakPolarHBondContact O-CB 3.26Å; K1094-K1098 PolarHBondContact O-N 2.76Å; I1096-K1098 PolarHBondContact O-N 2.96Å
1099	T	89.8	Confident	87.8	Confident	46 Å²	46	56.5 Å²	56.5	28%	0.282	28%	0.28	S	S	.	.	H	α-helix	trans	-85.7	-45.5	-173.4	-56.5	0	0	0	0	111.5	A1095 I1096 E1097 Y1120 K1123	A1095-T1099 WeakPolarHBondContact O-CB 3.1Å; A1095-T1099 PolarHBondContact O-N 2.73Å; A1095-T1099 PolarHBondContact O-OG1 3.5Å; I1096-T1099 PolarHBondContact O-N 3.39Å; E1097-T1099 VanDerWaalsContact C-N 3.3Å; E1097-T1099 PolarHBondContact O-N 2.86Å; T1099-Y1120 HydrophobicContact CG2-CD2 3.71Å; T1099-Y1120 HydrophobicContact CG2-CG 4.16Å; T1099-K1123 PolarHBondContact O-NZ 3.12Å
1100	C	90.9	Very high	88.1	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.007	26%	0.262	C	S	.	.	H	α-helix	trans	-80.4	-33.6	-177.8	-64.6	0	0	0	0	113.1	I1096 M1103 C1106 Q1107 K1123	I1096-C1100 VanDerWaalsContact O-CB 3.32Å; I1096-C1100 WeakPolarHBondContact O-CB 3.25Å; I1096-C1100 PolarHBondContact O-N 2.9Å; C1100-M1103 WeakPolarHBondContact O-CB 3.37Å; C1100-M1103 PolarHBondContact O-N 2.79Å; C1100-C1106 WeakPolarHBondContact CA-SG 3.22Å; C1100-C1106 HydrophobicContact CB-CB 3.65Å; C1100-C1106 WeakPolarHBondContact CB-SG 3.49Å; C1100-C1106 WeakPolarHBondContact SG-CB 3.25Å; C1100-C1106 PolarHBondContact SG-O 3.41Å; C1100-C1106 CovalentContact SG-SG 2.04Å; C1100-C1106 PolarHBondContact SG-SG 2.88Å; C1100-Q1107 HydrophobicContact CB-CG 3.87Å; C1100-Q1107 PolarHBondContact SG-N 3.36Å; C1100-Q1107 VanDerWaalsContact SG-N 3.45Å; C1100-K1123 VanDerWaalsContact C-NZ 3.32Å; C1100-K1123 PolarHBondContact O-NZ 3.19Å
1101	L	88.2	Confident	88.4	Confident	113 Å²	113	47.5 Å²	47.5	59%	0.592	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	-138.8	-160	-48.3	174.5	0	0	0	108.7	E1097 M1103 Q1107	E1097-L1101 WeakPolarHBondContact O-CA 3.23Å; E1097-L1101 PolarHBondContact O-N 2.76Å; L1101-M1103 VanDerWaalsContact C-N 3.26Å; L1101-M1103 PolarHBondContact O-N 2.84Å; L1101-Q1107 PolarHBondContact O-NE2 2.94Å
1102	E	85.8	Confident	88.5	Confident	172 Å²	172	43.1 Å²	43.1	80%	0.804	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	3.6	-178.5	-59.4	-179.4	166.4	0	0	114.6	Y1104	E1102-Y1104 PolarHBondContact O-N 2.88Å
1103	M	88.6	Confident	88.6	Confident	47 Å²	47	41.4 Å²	41.4	23%	0.232	20%	0.201	C	C	.	.			trans	-71.1	102.7	-174.5	-174.3	174	-84.7	0	0	111.9	C1100 L1101 H1105 C1106 Q1107 K1123 V1127	C1100-M1103 WeakPolarHBondContact O-CB 3.37Å; C1100-M1103 PolarHBondContact O-N 2.79Å; L1101-M1103 VanDerWaalsContact C-N 3.26Å; L1101-M1103 PolarHBondContact O-N 2.84Å; M1103-H1105 PolarHBondContact O-N 3.02Å; M1103-C1106 HydrophobicContact CB-CB 4.16Å; M1103-C1106 HydrophobicContact CG-CB 4.08Å; M1103-C1106 WeakPolarHBondContact O-CB 3.25Å; M1103-C1106 PolarHBondContact O-N 3.01Å; M1103-C1106 HydrophobicContact SD-CB 4.28Å; M1103-Q1107 PolarHBondContact O-N 3.31Å; M1103-K1123 HydrophobicContact CE-CG 4.21Å; M1103-K1123 HydrophobicContact SD-CB 3.61Å; M1103-K1123 HydrophobicContact SD-CD 3.88Å; M1103-K1123 HydrophobicContact SD-CG 3.49Å; M1103-K1123 WeakPolarHBondContact SD-CG 3.13Å; M1103-V1127 HydrophobicContact CE-CG2 4.06Å
1104	Y	87.9	Confident	88.3	Confident	26 Å²	26	45.1 Å²	45.1	10%	0.102	22%	0.217	C	C	.	.	H	α-helix	trans	-47	-55.3	-174.1	163.7	-117.1	0	0	0	114.2	S779 P1067 F1070 E1102 C1106 Q1107 Y1108	S779-Y1104 WeakPolarHBondContact CB-OH 3.29Å; S779-Y1104 PolarHBondContact OG-OH 3.49Å; P1067-Y1104 HydrophobicContact CB-CD1 4.05Å; P1067-Y1104 HydrophobicContact CB-CD2 3.86Å; P1067-Y1104 HydrophobicContact CB-CE1 4.22Å; P1067-Y1104 HydrophobicContact CB-CE2 4.02Å; P1067-Y1104 HydrophobicContact CB-CG 3.89Å; P1067-Y1104 HydrophobicContact CG-CD1 3.87Å; P1067-Y1104 HydrophobicContact CG-CD2 4.49Å; P1067-Y1104 HydrophobicContact CG-CE1 3.8Å; P1067-Y1104 HydrophobicContact CG-CE2 4.42Å; P1067-Y1104 HydrophobicContact CG-CG 4.24Å; F1070-Y1104 HydrophobicContact CB-CE2 3.86Å; F1070-Y1104 AromaticContact CD1-CD2 3.66Å; F1070-Y1104 HydrophobicContact CD1-CD2 3.66Å; F1070-Y1104 AromaticContact CD1-CE2 3.53Å; F1070-Y1104 HydrophobicContact CD1-CE2 3.53Å; F1070-Y1104 HydrophobicContact CE1-CD2 4.28Å; F1070-Y1104 HydrophobicContact CE1-CE2 4.4Å; F1070-Y1104 HydrophobicContact CG-CD2 4.47Å; F1070-Y1104 AromaticContact CG-CE2 3.91Å; F1070-Y1104 HydrophobicContact CG-CE2 3.91Å; E1102-Y1104 PolarHBondContact O-N 2.88Å; Y1104-C1106 PolarHBondContact O-N 2.81Å; Y1104-Q1107 WeakPolarHBondContact O-CB 3.31Å; Y1104-Q1107 PolarHBondContact O-N 2.89Å; Y1104-Y1108 AromaticContact CE2-CD2 3.86Å; Y1104-Y1108 HydrophobicContact CE2-CD2 3.86Å; Y1104-Y1108 HydrophobicContact CE2-CG 4.42Å; Y1104-Y1108 AromaticContact CZ-CD2 3.94Å; Y1104-Y1108 WeakPolarHBondContact O-CB 3.4Å; Y1104-Y1108 PolarHBondContact O-N 3.09Å; Y1104-Y1108 WeakPolarHBondContact OH-CD2 3.29Å
1105	H	89.8	Confident	88	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.028	20%	0.204	C	C	.	.	H	α-helix	trans	-63.6	-41.5	-175.5	-54.9	128.5	0	0	0	112.1	F765 H769 M1103 Q1107 Y1108 D1109 L1122 E1126	F765-H1105 HydrophobicContact CE2-CB 4.47Å; F765-H1105 AromaticContact CZ-ND1 3.94Å; H769-H1105 AromaticContact CD2-CD2 3.56Å; H769-H1105 AromaticContact CD2-CG 3.76Å; H769-H1105 AromaticContact CE1-CD2 3.66Å; H769-H1105 AromaticContact CG-CD2 3.34Å; H769-H1105 AromaticContact CG-CG 3.97Å; H769-H1105 AromaticContact ND1-CD2 3.44Å; H769-H1105 PolarHBondContact ND1-CD2 2.81Å; H769-H1105 WeakPolarHBondContact NE2-CA 3.47Å; H769-H1105 AromaticContact NE2-CD2 3.71Å; H769-H1105 AromaticContact NE2-CG 3.97Å; M1103-H1105 PolarHBondContact O-N 3.02Å; H1105-Q1107 PolarHBondContact O-N 2.79Å; H1105-Y1108 PolarHBondContact O-N 3.43Å; H1105-D1109 PolarHBondContact O-N 3.15Å; H1105-L1122 HydrophobicContact CB-CD2 3.49Å; H1105-L1122 VanDerWaalsContact CB-CD2 3.49Å; H1105-E1126 IonicContact CE1-OE1 3.35Å; H1105-E1126 PolarHBondContact CE1-OE1 3.3Å; H1105-E1126 VanDerWaalsContact CE1-OE1 3.25Å; H1105-E1126 IonicContact CE1-OE2 2.8Å; H1105-E1126 IonicContact CG-OE2 2.65Å; H1105-E1126 IonicContact ND1-OE1 3.81Å; H1105-E1126 PolarHBondContact ND1-OE1 3.16Å; H1105-E1126 IonicContact ND1-OE2 2.9Å; H1105-E1126 PolarHBondContact ND1-OE2 3.01Å
1106	C	91.5	Very high	87.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.1	-45	174.1	179.4	0	0	0	0	111.9	C1100 M1103 Y1104 S1110 G1119 K1123	C1100-C1106 WeakPolarHBondContact CA-SG 3.22Å; C1100-C1106 HydrophobicContact CB-CB 3.65Å; C1100-C1106 WeakPolarHBondContact CB-SG 3.49Å; C1100-C1106 WeakPolarHBondContact SG-CB 3.25Å; C1100-C1106 PolarHBondContact SG-O 3.41Å; C1100-C1106 CovalentContact SG-SG 2.04Å; C1100-C1106 PolarHBondContact SG-SG 2.88Å; M1103-C1106 HydrophobicContact CB-CB 4.16Å; M1103-C1106 HydrophobicContact CG-CB 4.08Å; M1103-C1106 WeakPolarHBondContact O-CB 3.25Å; M1103-C1106 PolarHBondContact O-N 3.01Å; M1103-C1106 HydrophobicContact SD-CB 4.28Å; Y1104-C1106 PolarHBondContact O-N 2.81Å; C1106-S1110 VanDerWaalsContact O-CB 3.25Å; C1106-S1110 WeakPolarHBondContact O-CB 3.47Å; C1106-S1110 PolarHBondContact O-N 3.09Å; C1106-S1110 VanDerWaalsContact O-N 3.14Å; C1106-S1110 PolarHBondContact O-OG 2.75Å; C1106-G1119 PolarHBondContact SG-O 3.16Å; C1106-K1123 HydrophobicContact CB-CB 4.08Å
1107	Q	90.5	Very high	87.2	Confident	10 Å²	10	44.7 Å²	44.7	5%	0.047	21%	0.211	C	C	.	.	H	α-helix	trans	-61.6	-45.9	176.3	-67.9	177.7	-12.7	0	0	110.8	F1070 Q1071 C1100 L1101 M1103 Y1104 H1105 F1111	F1070-Q1107 HydrophobicContact CE1-CB 3.71Å; F1070-Q1107 HydrophobicContact CZ-CB 4.01Å; Q1071-Q1107 VanDerWaalsContact NE2-OE1 3.08Å; C1100-Q1107 HydrophobicContact CB-CG 3.87Å; C1100-Q1107 PolarHBondContact SG-N 3.36Å; C1100-Q1107 VanDerWaalsContact SG-N 3.45Å; L1101-Q1107 PolarHBondContact O-NE2 2.94Å; M1103-Q1107 PolarHBondContact O-N 3.31Å; Y1104-Q1107 WeakPolarHBondContact O-CB 3.31Å; Y1104-Q1107 PolarHBondContact O-N 2.89Å; H1105-Q1107 PolarHBondContact O-N 2.79Å; Q1107-F1111 WeakPolarHBondContact O-CB 3.47Å; Q1107-F1111 PolarHBondContact O-N 2.86Å
1108	Y	89.8	Confident	86.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.3	-54.4	-176.9	-175.4	-78.1	0	0	0	112.5	A767 H769 N781 V842 I1065 F1070 Y1104 H1105 S1110 F1111 Y1112	A767-Y1108 HydrophobicContact CB-CD1 3.89Å; A767-Y1108 HydrophobicContact CB-CE1 3.58Å; H769-Y1108 AromaticContact CE1-CD1 3.2Å; H769-Y1108 WeakPolarHBondContact CE1-CD1 3.43Å; H769-Y1108 AromaticContact CE1-CE1 3.75Å; H769-Y1108 AromaticContact CE1-CG 3.43Å; H769-Y1108 VanDerWaalsContact CE1-CG 3.43Å; H769-Y1108 AromaticContact NE2-CD1 3.54Å; H769-Y1108 AromaticContact NE2-CG 3.91Å; N781-Y1108 WeakPolarHBondContact CB-OH 3.43Å; N781-Y1108 PolarHBondContact ND2-OH 3.5Å; V842-Y1108 HydrophobicContact CG2-CE1 4.45Å; I1065-Y1108 HydrophobicContact CD1-CE2 4.35Å; I1065-Y1108 HydrophobicContact CG2-CE2 4.18Å; F1070-Y1108 HydrophobicContact CB-CD2 4.22Å; F1070-Y1108 HydrophobicContact CD1-CD2 4.34Å; F1070-Y1108 AromaticContact CD2-CD2 3.77Å; F1070-Y1108 HydrophobicContact CD2-CD2 3.77Å; F1070-Y1108 HydrophobicContact CD2-CE2 4.43Å; F1070-Y1108 HydrophobicContact CE2-CD2 4.22Å; F1070-Y1108 AromaticContact CG-CD2 3.81Å; F1070-Y1108 HydrophobicContact CG-CD2 3.81Å; Y1104-Y1108 AromaticContact CE2-CD2 3.86Å; Y1104-Y1108 HydrophobicContact CE2-CD2 3.86Å; Y1104-Y1108 HydrophobicContact CE2-CG 4.42Å; Y1104-Y1108 AromaticContact CZ-CD2 3.94Å; Y1104-Y1108 WeakPolarHBondContact O-CB 3.4Å; Y1104-Y1108 PolarHBondContact O-N 3.09Å; Y1104-Y1108 WeakPolarHBondContact OH-CD2 3.29Å; H1105-Y1108 PolarHBondContact O-N 3.43Å; Y1108-S1110 PolarHBondContact O-N 2.92Å; Y1108-F1111 PolarHBondContact O-N 2.96Å; Y1108-Y1112 AromaticContact CD1-CD2 3.84Å; Y1108-Y1112 HydrophobicContact CD1-CD2 3.84Å; Y1108-Y1112 HydrophobicContact CD1-CE2 4.44Å; Y1108-Y1112 AromaticContact CD2-CD2 3.76Å; Y1108-Y1112 HydrophobicContact CD2-CD2 3.76Å; Y1108-Y1112 AromaticContact CD2-CE2 3.53Å; Y1108-Y1112 HydrophobicContact CD2-CE2 3.53Å; Y1108-Y1112 AromaticContact CE1-CD2 3.74Å; Y1108-Y1112 HydrophobicContact CE1-CD2 3.74Å; Y1108-Y1112 HydrophobicContact CE1-CE2 4.27Å; Y1108-Y1112 AromaticContact CE2-CD2 3.68Å; Y1108-Y1112 HydrophobicContact CE2-CD2 3.68Å; Y1108-Y1112 AromaticContact CE2-CE2 3.32Å; Y1108-Y1112 HydrophobicContact CE2-CE2 3.32Å; Y1108-Y1112 AromaticContact CG-CD2 3.83Å; Y1108-Y1112 HydrophobicContact CG-CD2 3.83Å; Y1108-Y1112 HydrophobicContact CG-CE2 4.09Å; Y1108-Y1112 AromaticContact CZ-CD2 3.65Å; Y1108-Y1112 AromaticContact CZ-CE2 3.72Å; Y1108-Y1112 PolarHBondContact O-N 2.77Å
1109	D	89.6	Confident	86.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60	-47.4	178.1	-96.7	45.6	0	0	0	110.7	G766 A767 H769 H1105 F1111 L1113 L1118 L1122	G766-D1109 WeakPolarHBondContact CA-OD2 3.49Å; A767-D1109 WeakPolarHBondContact CB-OD1 3.26Å; A767-D1109 PolarHBondContact N-OD1 2.92Å; A767-D1109 PolarHBondContact N-OD2 2.82Å; H769-D1109 IonicContact CD2-OD1 3.68Å; H769-D1109 IonicContact NE2-OD1 3.8Å; H769-D1109 PolarHBondContact NE2-OD1 3.41Å; H1105-D1109 PolarHBondContact O-N 3.15Å; D1109-F1111 VanDerWaalsContact C-N 3.27Å; D1109-F1111 PolarHBondContact O-N 2.76Å; D1109-L1113 HydrophobicContact CB-CD1 4.3Å; D1109-L1113 VanDerWaalsContact O-CB 3.25Å; D1109-L1113 WeakPolarHBondContact O-CB 3.35Å; D1109-L1113 PolarHBondContact O-N 2.67Å; D1109-L1118 HydrophobicContact CB-CD2 4.31Å; D1109-L1118 WeakPolarHBondContact OD2-CD2 3.34Å; D1109-L1122 HydrophobicContact CB-CD1 4.35Å; D1109-L1122 WeakPolarHBondContact OD2-CD1 3.45Å
1110	S	88.7	Confident	86.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.1	-37.9	179.9	-56.8	0	0	0	0	113.1	C1106 Y1108 K1114 Q1115 G1119	C1106-S1110 VanDerWaalsContact O-CB 3.25Å; C1106-S1110 WeakPolarHBondContact O-CB 3.47Å; C1106-S1110 PolarHBondContact O-N 3.09Å; C1106-S1110 VanDerWaalsContact O-N 3.14Å; C1106-S1110 PolarHBondContact O-OG 2.75Å; Y1108-S1110 PolarHBondContact O-N 2.92Å; S1110-K1114 WeakPolarHBondContact O-CA 3.29Å; S1110-K1114 PolarHBondContact O-N 3.47Å; S1110-Q1115 PolarHBondContact O-N 2.86Å; S1110-G1119 WeakPolarHBondContact OG-CA 2.98Å
1111	F	87.7	Confident	86.1	Confident	7 Å²	7	34.8 Å²	34.8	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-74.8	-57.8	-178.1	-179.5	-91.7	0	0	0	111.4	F1070 E1073 Y1074 C1077 P1088 M1093 Q1107 Y1108 D1109 K1114	F1070-F1111 HydrophobicContact CE2-CB 4.2Å; F1070-F1111 AromaticContact CE2-CD1 3.89Å; F1070-F1111 HydrophobicContact CE2-CD1 3.89Å; F1070-F1111 HydrophobicContact CE2-CG 4.12Å; F1070-F1111 HydrophobicContact CZ-CB 4.22Å; F1070-F1111 HydrophobicContact CZ-CG 4.47Å; E1073-F1111 HydrophobicContact CG-CZ 4.47Å; Y1074-F1111 AromaticContact CD2-CD2 3.9Å; Y1074-F1111 HydrophobicContact CD2-CD2 3.9Å; Y1074-F1111 HydrophobicContact CD2-CE2 4.48Å; Y1074-F1111 HydrophobicContact CD2-CG 4.4Å; Y1074-F1111 HydrophobicContact CE2-CD2 4.37Å; C1077-F1111 HydrophobicContact CB-CE2 3.88Å; C1077-F1111 HydrophobicContact CB-CZ 4.42Å; C1077-F1111 VanDerWaalsContact SG-CE2 3.56Å; C1077-F1111 VanDerWaalsContact SG-CZ 3.54Å; P1088-F1111 HydrophobicContact CG-CD2 3.75Å; P1088-F1111 HydrophobicContact CG-CE2 4.07Å; P1088-F1111 HydrophobicContact CG-CG 4.37Å; M1093-F1111 HydrophobicContact CE-CD2 4.15Å; M1093-F1111 HydrophobicContact CE-CE2 4.17Å; M1093-F1111 HydrophobicContact SD-CD2 3.8Å; M1093-F1111 HydrophobicContact SD-CE2 3.97Å; Q1107-F1111 WeakPolarHBondContact O-CB 3.47Å; Q1107-F1111 PolarHBondContact O-N 2.86Å; Y1108-F1111 PolarHBondContact O-N 2.96Å; D1109-F1111 VanDerWaalsContact C-N 3.27Å; D1109-F1111 PolarHBondContact O-N 2.76Å; F1111-K1114 PolarHBondContact O-N 3.05Å
1112	Y	85.5	Confident	86.1	Confident	30 Å²	30	29.4 Å²	29.4	12%	0.118	13%	0.132	C	C	.	.	H	α-helix	trans	-80	-31.3	-172.2	-70.3	-64.2	0	0	0	114.1	F1070 E1073 Y1108 K1114	F1070-Y1112 HydrophobicContact CD2-CD2 4.32Å; F1070-Y1112 AromaticContact CD2-CE2 3.39Å; F1070-Y1112 HydrophobicContact CD2-CE2 3.39Å; F1070-Y1112 AromaticContact CD2-CZ 3.84Å; F1070-Y1112 HydrophobicContact CE2-CD2 4.16Å; F1070-Y1112 AromaticContact CE2-CE2 3.62Å; F1070-Y1112 HydrophobicContact CE2-CE2 3.62Å; F1070-Y1112 HydrophobicContact CG-CE2 4.49Å; E1073-Y1112 PolarHBondContact OE2-OH 2.92Å; Y1108-Y1112 AromaticContact CD1-CD2 3.84Å; Y1108-Y1112 HydrophobicContact CD1-CD2 3.84Å; Y1108-Y1112 HydrophobicContact CD1-CE2 4.44Å; Y1108-Y1112 AromaticContact CD2-CD2 3.76Å; Y1108-Y1112 HydrophobicContact CD2-CD2 3.76Å; Y1108-Y1112 AromaticContact CD2-CE2 3.53Å; Y1108-Y1112 HydrophobicContact CD2-CE2 3.53Å; Y1108-Y1112 AromaticContact CE1-CD2 3.74Å; Y1108-Y1112 HydrophobicContact CE1-CD2 3.74Å; Y1108-Y1112 HydrophobicContact CE1-CE2 4.27Å; Y1108-Y1112 AromaticContact CE2-CD2 3.68Å; Y1108-Y1112 HydrophobicContact CE2-CD2 3.68Å; Y1108-Y1112 AromaticContact CE2-CE2 3.32Å; Y1108-Y1112 HydrophobicContact CE2-CE2 3.32Å; Y1108-Y1112 AromaticContact CG-CD2 3.83Å; Y1108-Y1112 HydrophobicContact CG-CD2 3.83Å; Y1108-Y1112 HydrophobicContact CG-CE2 4.09Å; Y1108-Y1112 AromaticContact CZ-CD2 3.65Å; Y1108-Y1112 AromaticContact CZ-CE2 3.72Å; Y1108-Y1112 PolarHBondContact O-N 2.77Å; Y1112-K1114 VanDerWaalsContact C-N 3.28Å
1113	L	84.7	Confident	86.3	Confident	3 Å²	3	23.4 Å²	23.4	2%	0.016	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-1.6	172.9	-64.4	162.5	0	0	0	112.4	A767 Y819 V842 V844 D1109 Q1115 L1118	A767-L1113 HydrophobicContact CB-CD1 4Å; A767-L1113 HydrophobicContact CB-CG 4.5Å; Y819-L1113 HydrophobicContact CD1-CD2 3.46Å; Y819-L1113 VanDerWaalsContact CD1-CD2 3.46Å; Y819-L1113 HydrophobicContact CE1-CD2 3.91Å; Y819-L1113 HydrophobicContact CG-CD2 4.01Å; V842-L1113 HydrophobicContact CB-CD2 4.45Å; V842-L1113 HydrophobicContact CG1-CD2 3.43Å; V842-L1113 VanDerWaalsContact CG1-CD2 3.43Å; V842-L1113 HydrophobicContact CG1-CG 4.08Å; V842-L1113 HydrophobicContact CG2-CD2 4.19Å; V842-L1113 HydrophobicContact CG2-CG 4.19Å; V844-L1113 HydrophobicContact CG1-CD2 4.24Å; D1109-L1113 HydrophobicContact CB-CD1 4.3Å; D1109-L1113 VanDerWaalsContact O-CB 3.25Å; D1109-L1113 WeakPolarHBondContact O-CB 3.35Å; D1109-L1113 PolarHBondContact O-N 2.67Å; L1113-Q1115 WeakPolarHBondContact O-CG 3.37Å; L1113-Q1115 PolarHBondContact O-N 3.41Å; L1113-L1118 HydrophobicContact CB-CD2 4.31Å; L1113-L1118 HydrophobicContact CD1-CD2 3.29Å; L1113-L1118 HydrophobicContact CG-CD2 4.4Å
1114	K	81.8	Confident	86.3	Confident	81 Å²	81	25.9 Å²	25.9	35%	0.352	12%	0.115	S	C	.	.	S	Bend	trans	55.1	26.3	-178.7	-55.6	178.8	178	175.3	0	114.5	D821 T823 L840 S1110 F1111 Y1112	D821-K1114 IonicContact OD1-NZ 2.7Å; D821-K1114 IonicContact OD2-NZ 3.16Å; D821-K1114 PolarHBondContact OD2-NZ 3.43Å; T823-K1114 HydrophobicContact CG2-CB 3.97Å; T823-K1114 HydrophobicContact CG2-CD 3.88Å; L840-K1114 HydrophobicContact CD2-CD 3.92Å; L840-K1114 VanDerWaalsContact CD2-CE 3.49Å; L840-K1114 HydrophobicContact CD2-CG 4.34Å; S1110-K1114 WeakPolarHBondContact O-CA 3.29Å; S1110-K1114 PolarHBondContact O-N 3.47Å; F1111-K1114 PolarHBondContact O-N 3.05Å; Y1112-K1114 VanDerWaalsContact C-N 3.28Å
1115	Q	81.3	Confident	86.2	Confident	27 Å²	27	26 Å²	26	13%	0.126	12%	0.116	C	C	.	.			trans	-128.6	88.1	-173.5	-73.9	-68.2	-20	0	0	110.8	Y939 S1110 L1113 Y1117 L1118	Y939-Q1115 PolarHBondContact OH-OE1 2.01Å; S1110-Q1115 PolarHBondContact O-N 2.86Å; L1113-Q1115 WeakPolarHBondContact O-CG 3.37Å; L1113-Q1115 PolarHBondContact O-N 3.41Å; Q1115-Y1117 PolarHBondContact O-N 2.87Å; Q1115-Y1117 VanDerWaalsContact O-N 3.14Å; Q1115-L1118 HydrophobicContact CB-CB 4.02Å; Q1115-L1118 WeakPolarHBondContact O-CB 3.38Å; Q1115-L1118 PolarHBondContact O-N 2.97Å
1116	P	81	Confident	86.1	Confident	36 Å²	36	26.7 Å²	26.7	23%	0.234	12%	0.119	C	C	.	.	H	α-helix	trans	-59	-27.2	-178.5	-25.7	35.2	0	0	0	114.4	T1092 I1096 Y1120	T1092-P1116 HydrophobicContact CG2-CG 3.73Å; I1096-P1116 HydrophobicContact CG1-CB 4.19Å; I1096-P1116 HydrophobicContact CG1-CG 4.13Å; P1116-Y1120 PolarHBondContact O-N 2.85Å
1117	Y	80.4	Confident	86	Confident	65 Å²	65	30.6 Å²	30.6	26%	0.255	14%	0.143	S	C	.	.	H	α-helix	trans	-70.3	-32	176.4	-170.7	-125.1	0	0	0	112.8	H936 Y939 Q1115 Y1120 L1121	H936-Y1117 AromaticContact CD2-CE1 3.73Å; H936-Y1117 PolarHBondContact CE1-OH 2.76Å; H936-Y1117 AromaticContact NE2-CE1 3.74Å; H936-Y1117 AromaticContact NE2-CZ 3.53Å; H936-Y1117 PolarHBondContact NE2-OH 2.98Å; Y939-Y1117 AromaticContact CE2-CD1 3.8Å; Y939-Y1117 HydrophobicContact CE2-CD1 3.8Å; Y939-Y1117 HydrophobicContact CE2-CG 4.49Å; Q1115-Y1117 PolarHBondContact O-N 2.87Å; Q1115-Y1117 VanDerWaalsContact O-N 3.14Å; Y1117-Y1120 HydrophobicContact CD2-CD1 4.24Å; Y1117-Y1120 AromaticContact CE2-CD1 3.85Å; Y1117-Y1120 HydrophobicContact CE2-CD1 3.85Å; Y1117-Y1120 HydrophobicContact CE2-CE1 4.45Å; Y1117-Y1120 WeakPolarHBondContact O-CB 3.34Å; Y1117-Y1120 PolarHBondContact O-N 3.44Å; Y1117-L1121 HydrophobicContact CD1-CD1 4.13Å; Y1117-L1121 HydrophobicContact CE1-CD1 3.72Å; Y1117-L1121 HydrophobicContact CE1-CG 4.23Å; Y1117-L1121 HydrophobicContact CE2-CD2 4.41Å; Y1117-L1121 HydrophobicContact CE2-CG 4.36Å; Y1117-L1121 PolarHBondContact O-N 3.47Å; Y1117-L1121 VanDerWaalsContact O-N 3.16Å
1118	L	80.2	Confident	85.8	Confident	4 Å²	4	34.5 Å²	34.5	2%	0.021	16%	0.164	C	C	.	.	H	α-helix	trans	-64.2	-45.6	175.5	-171.7	82.5	0	0	0	110.9	Y929 L943 L945 D1109 L1113 Q1115 Y1120 L1121 L1122	Y929-L1118 HydrophobicContact CD2-CD1 3.37Å; Y929-L1118 HydrophobicContact CD2-CG 4.46Å; Y929-L1118 HydrophobicContact CE2-CD1 3.51Å; Y929-L1118 HydrophobicContact CE2-CG 4.2Å; L943-L1118 HydrophobicContact CD1-CD1 3.72Å; L945-L1118 HydrophobicContact CD2-CD1 4.34Å; D1109-L1118 HydrophobicContact CB-CD2 4.31Å; D1109-L1118 WeakPolarHBondContact OD2-CD2 3.34Å; L1113-L1118 HydrophobicContact CB-CD2 4.31Å; L1113-L1118 HydrophobicContact CD1-CD2 3.29Å; L1113-L1118 HydrophobicContact CG-CD2 4.4Å; Q1115-L1118 HydrophobicContact CB-CB 4.02Å; Q1115-L1118 WeakPolarHBondContact O-CB 3.38Å; Q1115-L1118 PolarHBondContact O-N 2.97Å; L1118-Y1120 VanDerWaalsContact C-N 3.28Å; L1118-Y1120 PolarHBondContact O-N 3.12Å; L1118-L1121 PolarHBondContact O-N 3.19Å; L1118-L1121 VanDerWaalsContact O-N 3.14Å; L1118-L1122 WeakPolarHBondContact O-CB 3.47Å; L1118-L1122 PolarHBondContact O-N 3.42Å
1119	G	84.1	Confident	85.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.8	-36.5	176.6	0	0	0	0	0	112.9	C1106 S1110 L1122 K1123	C1106-G1119 PolarHBondContact SG-O 3.16Å; S1110-G1119 WeakPolarHBondContact OG-CA 2.98Å; G1119-L1122 PolarHBondContact O-N 2.92Å; G1119-K1123 VanDerWaalsContact O-CB 3.29Å; G1119-K1123 WeakPolarHBondContact O-CB 3.41Å; G1119-K1123 PolarHBondContact O-N 3.19Å
1120	Y	86	Confident	85.5	Confident	97 Å²	97	40 Å²	40	38%	0.38	19%	0.192	S	C	.	.	H	α-helix	trans	-60.9	-45.6	172.8	176.7	-104.2	0	0	0	112.7	T1099 P1116 Y1117 L1118 K1123 Q1124	T1099-Y1120 HydrophobicContact CG2-CD2 3.71Å; T1099-Y1120 HydrophobicContact CG2-CG 4.16Å; P1116-Y1120 PolarHBondContact O-N 2.85Å; Y1117-Y1120 HydrophobicContact CD2-CD1 4.24Å; Y1117-Y1120 AromaticContact CE2-CD1 3.85Å; Y1117-Y1120 HydrophobicContact CE2-CD1 3.85Å; Y1117-Y1120 HydrophobicContact CE2-CE1 4.45Å; Y1117-Y1120 WeakPolarHBondContact O-CB 3.34Å; Y1117-Y1120 PolarHBondContact O-N 3.44Å; L1118-Y1120 VanDerWaalsContact C-N 3.28Å; L1118-Y1120 PolarHBondContact O-N 3.12Å; Y1120-K1123 WeakPolarHBondContact O-CB 3.47Å; Y1120-K1123 PolarHBondContact O-N 2.7Å; Y1120-Q1124 PolarHBondContact O-N 2.78Å; Y1120-Q1124 PolarHBondContact OH-NE2 2.9Å
1121	L	85.8	Confident	85.6	Confident	7 Å²	7	46 Å²	46	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-67.2	-41.3	177.5	-65.6	175.9	0	0	0	111.7	Y929 E932 Y1117 L1118 K1123 Q1124 E1125	Y929-L1121 HydrophobicContact CD1-CB 3.59Å; Y929-L1121 HydrophobicContact CD1-CD1 4.1Å; Y929-L1121 HydrophobicContact CD1-CG 4.41Å; Y929-L1121 HydrophobicContact CE1-CB 3.77Å; Y929-L1121 HydrophobicContact CG-CB 4.03Å; Y929-L1121 HydrophobicContact CG-CD1 3.88Å; E932-L1121 HydrophobicContact CB-CD1 4.24Å; E932-L1121 HydrophobicContact CB-CD2 4.35Å; E932-L1121 HydrophobicContact CG-CD2 4.33Å; Y1117-L1121 HydrophobicContact CD1-CD1 4.13Å; Y1117-L1121 HydrophobicContact CE1-CD1 3.72Å; Y1117-L1121 HydrophobicContact CE1-CG 4.23Å; Y1117-L1121 HydrophobicContact CE2-CD2 4.41Å; Y1117-L1121 HydrophobicContact CE2-CG 4.36Å; Y1117-L1121 PolarHBondContact O-N 3.47Å; Y1117-L1121 VanDerWaalsContact O-N 3.16Å; L1118-L1121 PolarHBondContact O-N 3.19Å; L1118-L1121 VanDerWaalsContact O-N 3.14Å; L1121-K1123 VanDerWaalsContact C-N 3.3Å; L1121-K1123 PolarHBondContact O-N 3.36Å; L1121-Q1124 WeakPolarHBondContact O-CB 3.34Å; L1121-Q1124 PolarHBondContact O-N 2.7Å; L1121-Q1124 VanDerWaalsContact O-N 3.11Å; L1121-E1125 PolarHBondContact O-N 2.75Å
1122	L	88.3	Confident	85.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.7	-38.2	174.3	-176.2	147.2	0	0	0	111.9	F765 Y929 H1105 D1109 L1118 G1119 Q1124 E1125 E1126	F765-L1122 HydrophobicContact CD2-CD1 3.93Å; F765-L1122 HydrophobicContact CD2-CG 4.15Å; F765-L1122 HydrophobicContact CE2-CD1 4.33Å; F765-L1122 HydrophobicContact CE2-CD2 4.2Å; F765-L1122 HydrophobicContact CE2-CG 4.31Å; Y929-L1122 WeakPolarHBondContact OH-CA 3.31Å; H1105-L1122 HydrophobicContact CB-CD2 3.49Å; H1105-L1122 VanDerWaalsContact CB-CD2 3.49Å; D1109-L1122 HydrophobicContact CB-CD1 4.35Å; D1109-L1122 WeakPolarHBondContact OD2-CD1 3.45Å; L1118-L1122 WeakPolarHBondContact O-CB 3.47Å; L1118-L1122 PolarHBondContact O-N 3.42Å; G1119-L1122 PolarHBondContact O-N 2.92Å; L1122-Q1124 VanDerWaalsContact C-N 3.3Å; L1122-Q1124 PolarHBondContact O-N 3.39Å; L1122-E1125 PolarHBondContact O-N 2.86Å; L1122-E1126 WeakPolarHBondContact O-CB 3.12Å; L1122-E1126 PolarHBondContact O-N 3.4Å
1123	K	89.3	Confident	85.8	Confident	46 Å²	46	48 Å²	48	20%	0.2	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-34.3	173.3	165.7	161	-179.1	174.9	0	112.9	T1099 C1100 M1103 C1106 G1119 Y1120 L1121 V1127	T1099-K1123 PolarHBondContact O-NZ 3.12Å; C1100-K1123 VanDerWaalsContact C-NZ 3.32Å; C1100-K1123 PolarHBondContact O-NZ 3.19Å; M1103-K1123 HydrophobicContact CE-CG 4.21Å; M1103-K1123 HydrophobicContact SD-CB 3.61Å; M1103-K1123 HydrophobicContact SD-CD 3.88Å; M1103-K1123 HydrophobicContact SD-CG 3.49Å; M1103-K1123 WeakPolarHBondContact SD-CG 3.13Å; C1106-K1123 HydrophobicContact CB-CB 4.08Å; G1119-K1123 VanDerWaalsContact O-CB 3.29Å; G1119-K1123 WeakPolarHBondContact O-CB 3.41Å; G1119-K1123 PolarHBondContact O-N 3.19Å; Y1120-K1123 WeakPolarHBondContact O-CB 3.47Å; Y1120-K1123 PolarHBondContact O-N 2.7Å; L1121-K1123 VanDerWaalsContact C-N 3.3Å; L1121-K1123 PolarHBondContact O-N 3.36Å; K1123-V1127 VanDerWaalsContact O-CG2 3.31Å; K1123-V1127 WeakPolarHBondContact O-CG2 3.34Å; K1123-V1127 PolarHBondContact O-N 3.01Å
1124	Q	87.8	Confident	86.1	Confident	99 Å²	99	52.8 Å²	52.8	46%	0.463	26%	0.259	S	S	.	.	H	α-helix	trans	-71.1	-42.9	172.2	-65.4	-174.1	-22.8	0	0	111.5	Y1120 L1121 L1122 L1128	Y1120-Q1124 PolarHBondContact O-N 2.78Å; Y1120-Q1124 PolarHBondContact OH-NE2 2.9Å; L1121-Q1124 WeakPolarHBondContact O-CB 3.34Å; L1121-Q1124 PolarHBondContact O-N 2.7Å; L1121-Q1124 VanDerWaalsContact O-N 3.11Å; L1122-Q1124 VanDerWaalsContact C-N 3.3Å; L1122-Q1124 PolarHBondContact O-N 3.39Å; Q1124-L1128 PolarHBondContact O-N 2.86Å
1125	E	85.5	Confident	86.5	Confident	29 Å²	29	50 Å²	50	14%	0.136	25%	0.251	C	S	.	.	H	α-helix	trans	-68.2	-40.5	-179.4	-168.9	173.2	-159.5	0	0	112.8	Y929 N947 L1121 L1122 V1127 L1128 Q1129	Y929-E1125 HydrophobicContact CE1-CB 4.36Å; Y929-E1125 WeakPolarHBondContact CE1-OE2 3.33Å; Y929-E1125 PolarHBondContact OH-OE2 2.94Å; N947-E1125 PolarHBondContact ND2-OE1 2.71Å; N947-E1125 PolarHBondContact ND2-OE2 3.11Å; L1121-E1125 PolarHBondContact O-N 2.75Å; L1122-E1125 PolarHBondContact O-N 2.86Å; E1125-V1127 PolarHBondContact O-N 2.69Å; E1125-L1128 PolarHBondContact O-N 2.71Å; E1125-Q1129 VanDerWaalsContact O-CB 3.24Å; E1125-Q1129 WeakPolarHBondContact O-CB 3.37Å; E1125-Q1129 PolarHBondContact O-N 3.39Å
1126	E	88	Confident	86.8	Confident	20 Å²	20	48.7 Å²	48.7	9%	0.093	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-43	176.3	176.2	167.2	-162.6	0	0	111.6	H1105 L1122 Q1129 L1130	H1105-E1126 IonicContact CE1-OE1 3.35Å; H1105-E1126 PolarHBondContact CE1-OE1 3.3Å; H1105-E1126 VanDerWaalsContact CE1-OE1 3.25Å; H1105-E1126 IonicContact CE1-OE2 2.8Å; H1105-E1126 IonicContact CG-OE2 2.65Å; H1105-E1126 IonicContact ND1-OE1 3.81Å; H1105-E1126 PolarHBondContact ND1-OE1 3.16Å; H1105-E1126 IonicContact ND1-OE2 2.9Å; H1105-E1126 PolarHBondContact ND1-OE2 3.01Å; L1122-E1126 WeakPolarHBondContact O-CB 3.12Å; L1122-E1126 PolarHBondContact O-N 3.4Å; E1126-Q1129 PolarHBondContact O-N 2.87Å; E1126-L1130 HydrophobicContact CG-CD1 4.03Å; E1126-L1130 HydrophobicContact CG-CG 4.44Å; E1126-L1130 WeakPolarHBondContact O-CB 3.46Å; E1126-L1130 VanDerWaalsContact O-CG 3.28Å; E1126-L1130 WeakPolarHBondContact O-CG 3.27Å; E1126-L1130 PolarHBondContact O-N 2.9Å
1127	V	89.5	Confident	87.3	Confident	81 Å²	81	49.8 Å²	49.8	49%	0.491	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-46.7	176.5	170.7	0	0	0	0	111	M1103 K1123 E1125 Q1129 L1130 E1131	M1103-V1127 HydrophobicContact CE-CG2 4.06Å; K1123-V1127 VanDerWaalsContact O-CG2 3.31Å; K1123-V1127 WeakPolarHBondContact O-CG2 3.34Å; K1123-V1127 PolarHBondContact O-N 3.01Å; E1125-V1127 PolarHBondContact O-N 2.69Å; V1127-Q1129 VanDerWaalsContact C-N 3.3Å; V1127-Q1129 PolarHBondContact O-N 3.46Å; V1127-L1130 PolarHBondContact O-N 3.33Å; V1127-E1131 PolarHBondContact O-N 2.92Å; V1127-E1131 VanDerWaalsContact O-N 3.07Å
1128	L	86.7	Confident	87.8	Confident	93 Å²	93	53.7 Å²	53.7	49%	0.487	26%	0.262	S	S	.	.	H	α-helix	trans	-61.4	-38.9	175.1	177	62.7	0	0	0	111.9	Q1124 E1125 E1131 I1132	Q1124-L1128 PolarHBondContact O-N 2.86Å; E1125-L1128 PolarHBondContact O-N 2.71Å; L1128-E1131 PolarHBondContact O-N 2.81Å; L1128-I1132 HydrophobicContact CD1-CD1 3.98Å; L1128-I1132 HydrophobicContact CD1-CG1 4.34Å; L1128-I1132 HydrophobicContact CG-CD1 3.91Å; L1128-I1132 WeakPolarHBondContact O-CB 3.03Å; L1128-I1132 VanDerWaalsContact O-CG1 3.31Å; L1128-I1132 WeakPolarHBondContact O-CG1 3.29Å; L1128-I1132 PolarHBondContact O-N 3.46Å
1129	Q	85.5	Confident	88.2	Confident	29 Å²	29	58.7 Å²	58.7	14%	0.136	29%	0.289	C	S	.	.	H	α-helix	trans	-71.1	-33.6	-179.6	-170.1	166.9	17.4	0	0	112.4	S763 E1125 E1126 V1127 R1133	S763-Q1129 PolarHBondContact OG-NE2 3Å; E1125-Q1129 VanDerWaalsContact O-CB 3.24Å; E1125-Q1129 WeakPolarHBondContact O-CB 3.37Å; E1125-Q1129 PolarHBondContact O-N 3.39Å; E1126-Q1129 PolarHBondContact O-N 2.87Å; V1127-Q1129 VanDerWaalsContact C-N 3.3Å; V1127-Q1129 PolarHBondContact O-N 3.46Å; Q1129-R1133 VanDerWaalsContact O-CB 3.26Å; Q1129-R1133 WeakPolarHBondContact O-CB 3.48Å; Q1129-R1133 PolarHBondContact O-N 3.13Å
1130	L	88.3	Confident	88.5	Confident	86 Å²	86	61.1 Å²	61.1	45%	0.45	30%	0.299	S	S	.	.	H	α-helix	trans	-68	-40.1	171.5	-72	167.2	0	0	0	111.9	E1126 V1127 R1133 T1134	E1126-L1130 HydrophobicContact CG-CD1 4.03Å; E1126-L1130 HydrophobicContact CG-CG 4.44Å; E1126-L1130 WeakPolarHBondContact O-CB 3.46Å; E1126-L1130 VanDerWaalsContact O-CG 3.28Å; E1126-L1130 WeakPolarHBondContact O-CG 3.27Å; E1126-L1130 PolarHBondContact O-N 2.9Å; V1127-L1130 PolarHBondContact O-N 3.33Å; L1130-R1133 PolarHBondContact O-N 2.87Å; L1130-T1134 WeakPolarHBondContact O-CG2 3.01Å; L1130-T1134 PolarHBondContact O-N 2.87Å; L1130-T1134 PolarHBondContact O-OG1 3.32Å
1131	E	89.7	Confident	88.5	Confident	126 Å²	126	60.8 Å²	60.8	59%	0.589	30%	0.303	S	S	*	.	H	α-helix	trans	-62.7	-50.3	172.9	-174.3	173.8	-160.9	0	0	111.1	V1127 L1128 R1133 T1134 A1135	V1127-E1131 PolarHBondContact O-N 2.92Å; V1127-E1131 VanDerWaalsContact O-N 3.07Å; L1128-E1131 PolarHBondContact O-N 2.81Å; E1131-R1133 VanDerWaalsContact C-N 3.29Å; E1131-R1133 PolarHBondContact O-N 3.29Å; E1131-T1134 PolarHBondContact O-N 3.11Å; E1131-T1134 PolarHBondContact O-OG1 2.95Å; E1131-T1134 VanDerWaalsContact O-OG1 3.09Å; E1131-A1135 WeakPolarHBondContact O-CB 3.48Å; E1131-A1135 PolarHBondContact O-N 2.92Å
1132	I	87	Confident	88.6	Confident	46 Å²	46	60.7 Å²	60.7	24%	0.236	30%	0.303	C	S	.	.	H	α-helix	trans	-60.2	-38.3	175.8	-69.8	169.4	0	0	0	111.3	I623 L1128 G1136	I623-I1132 HydrophobicContact CG2-CG2 3.45Å; I623-I1132 VanDerWaalsContact CG2-CG2 3.45Å; L1128-I1132 HydrophobicContact CD1-CD1 3.98Å; L1128-I1132 HydrophobicContact CD1-CG1 4.34Å; L1128-I1132 HydrophobicContact CG-CD1 3.91Å; L1128-I1132 WeakPolarHBondContact O-CB 3.03Å; L1128-I1132 VanDerWaalsContact O-CG1 3.31Å; L1128-I1132 WeakPolarHBondContact O-CG1 3.29Å; L1128-I1132 PolarHBondContact O-N 3.46Å; I1132-G1136 WeakPolarHBondContact O-CA 3.19Å; I1132-G1136 PolarHBondContact O-N 2.98Å
1133	R	90.4	Very high	88.4	Confident	33 Å²	33	61.2 Å²	61.2	13%	0.125	31%	0.307	C	S	.	.	H	α-helix	trans	-63.8	-48.1	176.6	-166.6	174	-174.1	83.3	1	112	F761 T772 F773 Q1129 L1130 E1131 M1137	F761-R1133 HydrophobicContact CE1-CB 4.12Å; F761-R1133 HydrophobicContact CE1-CG 4.01Å; F761-R1133 HydrophobicContact CZ-CB 3.64Å; F761-R1133 HydrophobicContact CZ-CG 3.75Å; F761-R1133 PolarHBondContact O-NH1 3.17Å; F761-R1133 PolarHBondContact O-NH2 3.34Å; T772-R1133 PolarHBondContact O-NH2 3.01Å; F773-R1133 PolarHBondContact O-NH2 2.81Å; Q1129-R1133 VanDerWaalsContact O-CB 3.26Å; Q1129-R1133 WeakPolarHBondContact O-CB 3.48Å; Q1129-R1133 PolarHBondContact O-N 3.13Å; L1130-R1133 PolarHBondContact O-N 2.87Å; E1131-R1133 VanDerWaalsContact C-N 3.29Å; E1131-R1133 PolarHBondContact O-N 3.29Å; R1133-M1137 HydrophobicContact CG-CG 4.48Å; R1133-M1137 HydrophobicContact CG-SD 3.8Å; R1133-M1137 VanDerWaalsContact CZ-SD 3.6Å; R1133-M1137 WeakPolarHBondContact O-CB 3.37Å; R1133-M1137 PolarHBondContact O-N 2.95Å
1134	T	90.7	Very high	87.9	Confident	103 Å²	103	59.3 Å²	59.3	63%	0.632	30%	0.3	S	S	*	.	H	α-helix	trans	-72.8	-33.3	-177.2	51.2	0	0	0	0	113	L1130 E1131 R1138	L1130-T1134 WeakPolarHBondContact O-CG2 3.01Å; L1130-T1134 PolarHBondContact O-N 2.87Å; L1130-T1134 PolarHBondContact O-OG1 3.32Å; E1131-T1134 PolarHBondContact O-N 3.11Å; E1131-T1134 PolarHBondContact O-OG1 2.95Å; E1131-T1134 VanDerWaalsContact O-OG1 3.09Å; T1134-R1138 WeakPolarHBondContact O-CB 3.34Å
1135	A	90.3	Very high	87.2	Confident	23 Å²	23	56.6 Å²	56.6	19%	0.19	30%	0.295	C	S	.	.	H	α-helix	trans	-77.5	-43.8	174.7	0	0	0	0	0	113	E619 E1131	E619-A1135 HydrophobicContact CB-CB 3.83Å; E619-A1135 HydrophobicContact CG-CB 3.92Å; E1131-A1135 WeakPolarHBondContact O-CB 3.48Å; E1131-A1135 PolarHBondContact O-N 2.92Å
1136	G	89.2	Confident	86.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-79.5	-34.9	-174	0	0	0	0	0	114.8	Q620 I623 P758 I1132 R1138	Q620-G1136 WeakPolarHBondContact CG-O 3.44Å; I623-G1136 VanDerWaalsContact CD1-C 3.49Å; P758-G1136 WeakPolarHBondContact CB-O 3.39Å; I1132-G1136 WeakPolarHBondContact O-CA 3.19Å; I1132-G1136 PolarHBondContact O-N 2.98Å; G1136-R1138 VanDerWaalsContact C-N 3.28Å; G1136-R1138 PolarHBondContact O-N 3.39Å
1137	M	91.3	Very high	85.7	Confident	58 Å²	58	61.5 Å²	61.5	29%	0.286	32%	0.323	S	S	.	.	S	Bend	trans	-85.8	2.9	176.4	-63.3	-176.2	60.8	0	0	113.4	I623 A760 F761 R1133	I623-M1137 HydrophobicContact CD1-CG 4.19Å; A760-M1137 HydrophobicContact CB-CE 3.9Å; F761-M1137 HydrophobicContact CD1-CG 4.12Å; F761-M1137 HydrophobicContact CD1-SD 4.01Å; F761-M1137 HydrophobicContact CE1-CG 4.1Å; F761-M1137 HydrophobicContact CE1-SD 4.1Å; R1133-M1137 HydrophobicContact CG-CG 4.48Å; R1133-M1137 HydrophobicContact CG-SD 3.8Å; R1133-M1137 VanDerWaalsContact CZ-SD 3.6Å; R1133-M1137 WeakPolarHBondContact O-CB 3.37Å; R1133-M1137 PolarHBondContact O-N 2.95Å
1138	R	90.7	Very high	84.6	Confident	147 Å²	147	58.5 Å²	58.5	56%	0.555	30%	0.304	S	S	*	.			trans	-75.3	126.7	178	177.8	166.9	177.6	-179.9	2.6	110.9	Q620 T1134 G1136 Y1140	Q620-R1138 PolarHBondContact NE2-O 3.47Å; T1134-R1138 WeakPolarHBondContact O-CB 3.34Å; G1136-R1138 VanDerWaalsContact C-N 3.28Å; G1136-R1138 PolarHBondContact O-N 3.39Å; R1138-Y1140 HydrophobicContact CB-CE2 3.95Å; R1138-Y1140 HydrophobicContact CG-CD2 4.25Å; R1138-Y1140 HydrophobicContact CG-CE1 4.42Å; R1138-Y1140 HydrophobicContact CG-CE2 3.79Å; R1138-Y1140 WeakPolarHBondContact O-CD2 3.4Å
1139	N	89.1	Confident	83.7	Confident	110 Å²	110	60.7 Å²	60.7	59%	0.588	31%	0.312	S	S	*	.			trans	-70.2	139.3	163.5	-74.6	12.8	0	0	0	109.9	P758	P758-N1139 WeakPolarHBondContact CD-OD1 3.41Å; P758-N1139 WeakPolarHBondContact CG-OD1 3.26Å
1140	Y	89	Confident	82.8	Confident	51 Å²	51	66.4 Å²	66.4	20%	0.2	33%	0.333	C	S	.	.			trans	-121.8	137	166.8	-64.3	-95.7	0	0	0	107.5	C616 R617 R1138 L1165	C616-Y1140 HydrophobicContact CB-CD2 4.47Å; R617-Y1140 HydrophobicContact CB-CE2 4.43Å; R617-Y1140 HydrophobicContact CG-CD2 4.47Å; R617-Y1140 HydrophobicContact CG-CE1 4.43Å; R617-Y1140 HydrophobicContact CG-CE2 3.81Å; R1138-Y1140 HydrophobicContact CB-CE2 3.95Å; R1138-Y1140 HydrophobicContact CG-CD2 4.25Å; R1138-Y1140 HydrophobicContact CG-CE1 4.42Å; R1138-Y1140 HydrophobicContact CG-CE2 3.79Å; R1138-Y1140 WeakPolarHBondContact O-CD2 3.4Å; Y1140-L1165 HydrophobicContact CD1-CD1 4.18Å
1141	N	87.4	Confident	81.6	Confident	89 Å²	89	63.9 Å²	63.9	48%	0.476	32%	0.322	S	S	.	.			trans	-88.4	123.8	171.6	-64.4	-21.9	0	0	0	107.9	E1166	N1141-E1166 HydrophobicContact CB-CB 3.96Å; N1141-E1166 WeakPolarHBondContact CB-OE2 3.43Å; N1141-E1166 PolarHBondContact ND2-OE2 3.37Å; N1141-E1166 PolarHBondContact O-N 2.86Å
1142	S	87.2	Confident	80.6	Confident	5 Å²	5	62.4 Å²	62.4	4%	0.035	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-101.5	151	169.9	175.8	0	0	0	0	109.8	S752 L754 G1144 Y1164 G1191	S752-S1142 WeakPolarHBondContact O-CB 3.33Å; S752-S1142 PolarHBondContact O-OG 2.73Å; L754-S1142 VanDerWaalsContact CD1-O 3.29Å; L754-S1142 WeakPolarHBondContact CD1-O 2.95Å; S1142-G1144 PolarHBondContact OG-N 3.5Å; S1142-G1144 VanDerWaalsContact OG-N 3.12Å; S1142-Y1164 CarbonylContact C-O 3.56Å; S1142-Y1164 WeakPolarHBondContact CA-O 3.1Å; S1142-Y1164 PolarHBondContact OG-O 3.01Å; S1142-G1191 WeakPolarHBondContact O-CA 3.25Å
1143	C	83.8	Confident	79.8	Confident	12 Å²	12	64.1 Å²	64.1	8%	0.081	32%	0.324	C	S	.	.			trans	-93.6	0	170.5	-70.2	0	0	0	0	113.6	Y1164 C1188 R1192 W1193	C1143-Y1164 PolarHBondContact N-O 2.6Å; C1143-C1188 HydrophobicContact CB-CB 3.86Å; C1143-C1188 WeakPolarHBondContact CB-SG 3.29Å; C1143-C1188 WeakPolarHBondContact SG-CA 3.5Å; C1143-C1188 WeakPolarHBondContact SG-CB 3.43Å; C1143-C1188 CovalentContact SG-SG 2.01Å; C1143-C1188 PolarHBondContact SG-SG 2.76Å; C1143-R1192 PolarHBondContact SG-N 2.78Å; C1143-R1192 PolarHBondContact SG-O 3.1Å; C1143-R1192 VanDerWaalsContact SG-O 3.36Å; C1143-W1193 HydrophobicContact CB-CD2 3.86Å; C1143-W1193 VanDerWaalsContact CB-CE2 3.41Å; C1143-W1193 HydrophobicContact CB-CG 4.13Å; C1143-W1193 HydrophobicContact CB-CH2 4.44Å; C1143-W1193 HydrophobicContact CB-CZ2 3.74Å; C1143-W1193 PolarHBondContact O-NE1 3.48Å
1144	G	78.4	Confident	78.9	Confident	5 Å²	5	62.5 Å²	62.5	5%	0.052	32%	0.318	C	S	.	.			trans	76.2	168.5	-172.8	0	0	0	0	0	112.9	S1142 W1193	S1142-G1144 PolarHBondContact OG-N 3.5Å; S1142-G1144 VanDerWaalsContact OG-N 3.12Å; G1144-W1193 PolarHBondContact O-NE1 3.3Å
1145	A	73.9	Confident	77.9	Confident	43 Å²	43	60.1 Å²	60.1	36%	0.355	30%	0.299	S	S	.	.			trans	-66.5	149.7	172.3	0	0	0	0	0	111.4	Y1164	A1145-Y1164 HydrophobicContact CB-CE2 3.87Å
1146	I	73.6	Confident	77	Confident	11 Å²	11	59.6 Å²	59.6	6%	0.056	29%	0.293	C	S	.	.			trans	-88.7	127.5	-179.4	-55.8	163.9	0	0	0	109.2	Q685 V1148 V1170 F1172 F1186 W1193	Q685-I1146 PolarHBondContact NE2-O 2.84Å; Q685-I1146 PolarHBondContact OE1-O 2.81Å; I1146-V1148 HydrophobicContact CG2-CG2 4.02Å; I1146-V1170 HydrophobicContact CD1-CB 4.12Å; I1146-V1170 HydrophobicContact CD1-CG1 3.94Å; I1146-V1170 HydrophobicContact CD1-CG2 4.07Å; I1146-F1172 HydrophobicContact CD1-CE2 4.26Å; I1146-F1172 HydrophobicContact CD1-CZ 3.75Å; I1146-F1172 HydrophobicContact CG2-CZ 4.13Å; I1146-F1186 HydrophobicContact CD1-CB 4.44Å; I1146-F1186 HydrophobicContact CD1-CD2 3.98Å; I1146-F1186 HydrophobicContact CG1-CD2 4.43Å; I1146-F1186 HydrophobicContact CG2-CD2 3.91Å; I1146-F1186 HydrophobicContact CG2-CE2 3.76Å; I1146-W1193 HydrophobicContact CD1-CD2 4.04Å; I1146-W1193 HydrophobicContact CD1-CE3 4.24Å; I1146-W1193 HydrophobicContact CD1-CH2 4.11Å; I1146-W1193 HydrophobicContact CD1-CZ2 3.9Å; I1146-W1193 HydrophobicContact CD1-CZ3 4.26Å; I1146-W1193 HydrophobicContact CG1-CD2 3.88Å; I1146-W1193 VanDerWaalsContact CG1-CE2 3.44Å; I1146-W1193 HydrophobicContact CG1-CG 4.19Å; I1146-W1193 HydrophobicContact CG1-CZ2 3.84Å
1147	N	67.6	Low	76	Confident	141 Å²	141	63 Å²	63	75%	0.754	31%	0.311	S	S	*	.			trans	-96.2	115.2	172	-73.2	-22.6	0	0	0	109.8	Q1198	N1147-Q1198 PolarHBondContact O-NE2 2.91Å
1148	V	67.4	Low	74.5	Confident	18 Å²	18	63.2 Å²	63.2	11%	0.109	32%	0.317	C	S	.	.			trans	-115.1	134.1	173.3	179.6	0	0	0	0	108.4	Q685 I1146 L1154 F1172 P1199	Q685-V1148 VanDerWaalsContact CD-CG2 3.43Å; Q685-V1148 HydrophobicContact CG-CB 3.62Å; Q685-V1148 HydrophobicContact CG-CG1 4.35Å; Q685-V1148 HydrophobicContact CG-CG2 3.74Å; I1146-V1148 HydrophobicContact CG2-CG2 4.02Å; V1148-L1154 HydrophobicContact CG1-CD2 4.32Å; V1148-F1172 HydrophobicContact CG2-CE1 4.34Å; V1148-F1172 HydrophobicContact CG2-CZ 4.47Å; V1148-P1199 HydrophobicContact CG1-CG 4.35Å; V1148-P1199 WeakPolarHBondContact CG1-O 3.24Å; V1148-P1199 HydrophobicContact CG2-CG 4.01Å
1149	E	66.9	Low	73	Confident	138 Å²	138	59.5 Å²	59.5	65%	0.645	32%	0.318	S	S	*	.	S	Bend	trans	-74.5	-34.6	-174.2	-65.2	172.7	119.2	0	0	113.7	P1151	E1149-P1151 WeakPolarHBondContact O-CD 3.5Å
1150	Y	67.3	Low	71.7	Confident	150 Å²	150	57.3 Å²	57.3	59%	0.588	31%	0.308	S	S	*	.			trans	-123.3	75.3	-173.1	-54.7	-72.3	0	0	0	110.2
1151	P	63.3	Low	70.2	Confident	33 Å²	33	55.1 Å²	55.1	21%	0.214	30%	0.301	C	S	.	.			trans	-68.8	-43	-175	30.1	-36.4	0	0	0	111.8	Q685 T686 E1149 F1153 L1154	Q685-P1151 HydrophobicContact CB-CB 4.17Å; Q685-P1151 HydrophobicContact CG-CB 4.05Å; T686-P1151 HydrophobicContact CG2-CB 3.8Å; T686-P1151 HydrophobicContact CG2-CG 3.97Å; T686-P1151 PolarHBondContact OG1-O 2.8Å; E1149-P1151 WeakPolarHBondContact O-CD 3.5Å; P1151-F1153 PolarHBondContact O-N 2.96Å; P1151-L1154 WeakPolarHBondContact O-CA 3.27Å; P1151-L1154 WeakPolarHBondContact O-CB 3.37Å; P1151-L1154 PolarHBondContact O-N 3.39Å
1152	D	67.6	Low	69.4	Low	94 Å²	94	54.3 Å²	54.3	50%	0.503	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-24.3	112	-170.2	-62.7	-1.2	0	0	0	116.2	L1154 C1201	D1152-L1154 VanDerWaalsContact C-N 3.32Å; D1152-L1154 PolarHBondContact O-N 3.1Å; D1152-C1201 WeakPolarHBondContact O-CB 3.34Å
1153	F	69.9	Low	68.6	Low	82 Å²	82	54.7 Å²	54.7	36%	0.36	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	10.6	-178.1	-45.3	-83.2	0	0	0	116.5	T686 P1151 C1174 Y1175 H1178 C1201	T686-F1153 PolarHBondContact OG1-N 3.31Å; P1151-F1153 PolarHBondContact O-N 2.96Å; F1153-C1174 WeakPolarHBondContact O-CA 3.49Å; F1153-Y1175 HydrophobicContact CB-CD2 4.22Å; F1153-Y1175 WeakPolarHBondContact O-CD2 3.41Å; F1153-Y1175 PolarHBondContact O-N 3.22Å; F1153-Y1175 VanDerWaalsContact O-N 3.09Å; F1153-H1178 AromaticContact CD1-CE1 3.8Å; F1153-H1178 AromaticContact CD2-CD2 3.77Å; F1153-H1178 AromaticContact CD2-CE1 3.52Å; F1153-H1178 AromaticContact CD2-NE2 3.23Å; F1153-H1178 WeakPolarHBondContact CD2-NE2 3.46Å; F1153-H1178 AromaticContact CE2-CE1 3.83Å; F1153-H1178 AromaticContact CE2-NE2 3.6Å; F1153-H1178 AromaticContact CG-CE1 3.51Å; F1153-H1178 AromaticContact CG-ND1 3.89Å; F1153-H1178 AromaticContact CG-NE2 3.66Å; F1153-C1201 HydrophobicContact CB-CB 4.17Å; F1153-C1201 PolarHBondContact O-SG 3.29Å
1154	L	71.8	Confident	68.3	Low	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	124.2	173.1	-168.4	80.3	0	0	0	110.9	Q685 T686 V1148 P1151 D1152 F1172 E1173 L1180 P1199 C1201	Q685-L1154 CarbonylContact C-O 3.5Å; Q685-L1154 HydrophobicContact CG-CD2 4.37Å; T686-L1154 CarbonylContact O-C 3.53Å; T686-L1154 PolarHBondContact OG1-N 3.3Å; T686-L1154 PolarHBondContact OG1-O 2.81Å; V1148-L1154 HydrophobicContact CG1-CD2 4.32Å; P1151-L1154 WeakPolarHBondContact O-CA 3.27Å; P1151-L1154 WeakPolarHBondContact O-CB 3.37Å; P1151-L1154 PolarHBondContact O-N 3.39Å; D1152-L1154 VanDerWaalsContact C-N 3.32Å; D1152-L1154 PolarHBondContact O-N 3.1Å; L1154-F1172 HydrophobicContact CD1-CB 4.15Å; L1154-F1172 HydrophobicContact CD2-CD1 3.69Å; L1154-F1172 HydrophobicContact CD2-CE1 4.27Å; L1154-F1172 HydrophobicContact CD2-CG 4.43Å; L1154-F1172 HydrophobicContact CG-CB 4.49Å; L1154-F1172 HydrophobicContact CG-CD1 4.16Å; L1154-E1173 CarbonylContact C-O 3.46Å; L1154-E1173 WeakPolarHBondContact CA-O 3.34Å; L1154-L1180 HydrophobicContact CD1-CD1 3.31Å; L1154-P1199 HydrophobicContact CD1-CB 4.21Å; L1154-P1199 HydrophobicContact CD2-CB 3.9Å; L1154-P1199 HydrophobicContact CD2-CG 3.85Å; L1154-C1201 WeakPolarHBondContact CA-SG 3.14Å; L1154-C1201 VanDerWaalsContact CB-SG 3.59Å; L1154-C1201 WeakPolarHBondContact CD1-SG 3.22Å; L1154-C1201 PolarHBondContact N-SG 2.81Å; L1154-C1201 VanDerWaalsContact N-SG 3.41Å
1155	F	70.6	Confident	68.6	Low	52 Å²	52	54.9 Å²	54.9	23%	0.228	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	160.2	175.9	68	-91.9	0	0	0	112.3	V687 E1173 Y1175	V687-F1155 HydrophobicContact CG2-CB 3.93Å; F1155-E1173 HydrophobicContact CD1-CB 4.27Å; F1155-E1173 WeakPolarHBondContact CD1-O 3.2Å; F1155-E1173 HydrophobicContact CD2-CB 4.11Å; F1155-E1173 HydrophobicContact CE1-CB 3.75Å; F1155-E1173 HydrophobicContact CE2-CB 3.55Å; F1155-E1173 HydrophobicContact CE2-CG 4.28Å; F1155-E1173 HydrophobicContact CG-CB 4.44Å; F1155-E1173 HydrophobicContact CZ-CB 3.35Å; F1155-E1173 HydrophobicContact CZ-CG 4.27Å; F1155-E1173 PolarHBondContact N-O 3.04Å; F1155-E1173 PolarHBondContact O-N 3.44Å; F1155-Y1175 HydrophobicContact CD1-CD2 4.19Å; F1155-Y1175 HydrophobicContact CD1-CE2 4.35Å
1156	I	70.9	Confident	69.3	Low	12 Å²	12	56.8 Å²	56.8	6%	0.062	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.6	-175.6	-65.7	174.5	0	0	0	111.1	Q685 L1163 V1170 F1172	Q685-I1156 HydrophobicContact CB-CD1 4.32Å; I1156-L1163 HydrophobicContact CG2-CD1 4.04Å; I1156-L1163 HydrophobicContact CG2-CD2 3.56Å; I1156-L1163 HydrophobicContact CG2-CG 4.47Å; I1156-V1170 HydrophobicContact CG2-CG1 3.66Å; I1156-F1172 HydrophobicContact CD1-CE1 3.98Å; I1156-F1172 HydrophobicContact CG1-CD1 3.93Å; I1156-F1172 HydrophobicContact CG1-CE1 3.76Å
1157	N	67.8	Low	69.8	Low	72 Å²	72	59.1 Å²	59.1	39%	0.385	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	128	179.7	-163.4	2.5	0	0	0	110.1	L1171 E1173	N1157-L1171 HydrophobicContact CB-CB 4.46Å; N1157-L1171 PolarHBondContact N-O 3.41Å; N1157-L1171 WeakPolarHBondContact O-CB 3.49Å; N1157-L1171 PolarHBondContact O-N 2.81Å; N1157-L1171 VanDerWaalsContact O-N 3.15Å; N1157-E1173 PolarHBondContact ND2-OE1 3.33Å
1158	P	60.9	Low	70.6	Confident	62 Å²	62	55.1 Å²	55.1	40%	0.403	30%	0.3	S	S	.	.	S	Bend	cis	-81.9	140.7	-1.8	34.1	-34.7	0	0	0	113.5	T1160 L1163	P1158-T1160 PolarHBondContact O-N 3.11Å; P1158-L1163 WeakPolarHBondContact O-CD2 3.24Å; P1158-L1163 WeakPolarHBondContact O-CG 3.41Å
1159	A	58.5	Low	71.3	Confident	70 Å²	70	59.3 Å²	59.3	58%	0.579	32%	0.319	S	S	*	.			trans	-75.1	43.4	179.7	0	0	0	0	0	114.5
1160	T	61	Low	71.9	Confident	64 Å²	64	52.8 Å²	52.8	39%	0.393	29%	0.288	S	S	.	.	S	Bend	trans	-132	158.2	-173	59	0	0	0	0	111.9	P1158 K1162 L1163	P1158-T1160 PolarHBondContact O-N 3.11Å; T1160-K1162 PolarHBondContact O-N 2.74Å; T1160-L1163 WeakPolarHBondContact O-CG 3.36Å; T1160-L1163 PolarHBondContact O-N 3.45Å
1161	G	59.2	Low	72.5	Confident	5 Å²	5	48.9 Å²	48.9	5%	0.052	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-1.5	-160.1	0	0	0	0	0	117.9	D674 L679 L1163	D674-G1161 PolarHBondContact OD2-N 3.12Å; L679-G1161 WeakPolarHBondContact O-CA 3.43Å; G1161-L1163 VanDerWaalsContact C-N 3.28Å; G1161-L1163 PolarHBondContact O-N 3.24Å
1162	K	69.5	Low	73.4	Confident	71 Å²	71	47.4 Å²	47.4	31%	0.309	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-19.6	178.5	-71.9	165.4	-172.7	154.6	0	113.4	D676 Y678 T1160 Y1164 L1165 N1168	D676-K1162 IonicContact OD2-NZ 3.53Å; D676-K1162 PolarHBondContact OD2-NZ 3.33Å; Y678-K1162 HydrophobicContact CD1-CG 3.82Å; Y678-K1162 HydrophobicContact CD2-CD 4.32Å; Y678-K1162 HydrophobicContact CD2-CG 3.7Å; Y678-K1162 HydrophobicContact CE1-CG 3.82Å; Y678-K1162 HydrophobicContact CE2-CD 4.01Å; Y678-K1162 HydrophobicContact CE2-CG 3.71Å; Y678-K1162 HydrophobicContact CG-CG 3.76Å; T1160-K1162 PolarHBondContact O-N 2.74Å; K1162-Y1164 VanDerWaalsContact C-N 3.34Å; K1162-Y1164 PolarHBondContact O-N 2.9Å; K1162-L1165 PolarHBondContact O-N 3.29Å; K1162-N1168 PolarHBondContact O-ND2 2.82Å
1163	L	70.3	Confident	74	Confident	13 Å²	13	46 Å²	46	7%	0.068	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-42.1	-44.8	-160.7	-79.9	161.3	0	0	0	116.9	I1156 P1158 T1160 G1161 V1170	I1156-L1163 HydrophobicContact CG2-CD1 4.04Å; I1156-L1163 HydrophobicContact CG2-CD2 3.56Å; I1156-L1163 HydrophobicContact CG2-CG 4.47Å; P1158-L1163 WeakPolarHBondContact O-CD2 3.24Å; P1158-L1163 WeakPolarHBondContact O-CG 3.41Å; T1160-L1163 WeakPolarHBondContact O-CG 3.36Å; T1160-L1163 PolarHBondContact O-N 3.45Å; G1161-L1163 VanDerWaalsContact C-N 3.28Å; G1161-L1163 PolarHBondContact O-N 3.24Å; L1163-V1170 HydrophobicContact CD2-CB 4.46Å; L1163-V1170 HydrophobicContact CD2-CG1 4.14Å; L1163-V1170 HydrophobicContact CD2-CG2 3.88Å
1164	Y	77.4	Confident	74.6	Confident	7 Å²	7	43.1 Å²	43.1	3%	0.027	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	3.9	-165	-52.1	-31.8	0	0	0	116.4	H681 S1142 C1143 A1145 K1162 C1188 W1193	H681-Y1164 HydrophobicContact CB-CD2 4.47Å; H681-Y1164 HydrophobicContact CB-CE2 3.66Å; H681-Y1164 AromaticContact CD2-CD2 3.46Å; H681-Y1164 VanDerWaalsContact CD2-CD2 3.46Å; H681-Y1164 WeakPolarHBondContact CD2-CD2 3.24Å; H681-Y1164 AromaticContact CD2-CE2 3.55Å; H681-Y1164 AromaticContact CE1-CD2 3.6Å; H681-Y1164 AromaticContact CE1-CE2 3.96Å; H681-Y1164 AromaticContact CG-CD2 3.69Å; H681-Y1164 AromaticContact CG-CE2 3.35Å; H681-Y1164 AromaticContact ND1-CD2 3.77Å; H681-Y1164 AromaticContact ND1-CE2 3.64Å; H681-Y1164 AromaticContact NE2-CD2 3.39Å; H681-Y1164 WeakPolarHBondContact NE2-CD2 3.27Å; H681-Y1164 AromaticContact NE2-CE2 3.92Å; S1142-Y1164 CarbonylContact C-O 3.56Å; S1142-Y1164 WeakPolarHBondContact CA-O 3.1Å; S1142-Y1164 PolarHBondContact OG-O 3.01Å; C1143-Y1164 PolarHBondContact N-O 2.6Å; A1145-Y1164 HydrophobicContact CB-CE2 3.87Å; K1162-Y1164 VanDerWaalsContact C-N 3.34Å; K1162-Y1164 PolarHBondContact O-N 2.9Å; Y1164-C1188 PolarHBondContact O-SG 2.95Å; Y1164-C1188 VanDerWaalsContact O-SG 3.41Å; Y1164-W1193 HydrophobicContact CD1-CH2 4.23Å; Y1164-W1193 AromaticContact CD1-CZ2 3.71Å; Y1164-W1193 HydrophobicContact CD1-CZ2 3.71Å; Y1164-W1193 HydrophobicContact CG-CZ2 4.35Å
1165	L	86	Confident	74.8	Confident	15 Å²	15	45.8 Å²	45.8	8%	0.079	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-85.6	151.6	-176.9	-55.3	-177.8	0	0	0	113.8	C616 Y678 Y1140 K1162 G1167 N1168 C1188	C616-L1165 HydrophobicContact CB-CD2 4.14Å; Y678-L1165 HydrophobicContact CD1-CD1 4.05Å; Y678-L1165 HydrophobicContact CE1-CD1 3.99Å; Y1140-L1165 HydrophobicContact CD1-CD1 4.18Å; K1162-L1165 PolarHBondContact O-N 3.29Å; L1165-G1167 PolarHBondContact O-N 3.3Å; L1165-N1168 VanDerWaalsContact O-CB 3.3Å; L1165-N1168 WeakPolarHBondContact O-CB 3.47Å; L1165-N1168 PolarHBondContact O-N 3.28Å; L1165-C1188 WeakPolarHBondContact O-CB 3.43Å
1166	E	87	Confident	75.3	Confident	83 Å²	83	48.7 Å²	48.7	39%	0.388	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	131.4	-179.2	-179.2	167.2	-156.4	0	0	113.1	N1141 C1188 R1190	N1141-E1166 HydrophobicContact CB-CB 3.96Å; N1141-E1166 WeakPolarHBondContact CB-OE2 3.43Å; N1141-E1166 PolarHBondContact ND2-OE2 3.37Å; N1141-E1166 PolarHBondContact O-N 2.86Å; E1166-C1188 WeakPolarHBondContact CA-SG 3.4Å; E1166-C1188 PolarHBondContact N-SG 2.86Å; E1166-C1188 VanDerWaalsContact N-SG 3.43Å; E1166-R1190 VanDerWaalsContact OE1-CA 3.25Å; E1166-R1190 WeakPolarHBondContact OE1-CA 3.21Å; E1166-R1190 PolarHBondContact OE1-N 2.91Å
1167	G	85.4	Confident	75.7	Confident	59 Å²	59	51.2 Å²	51.2	61%	0.608	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.4	-13.1	-173.7	0	0	0	0	0	114.2	L1165 C1188	L1165-G1167 PolarHBondContact O-N 3.3Å; G1167-C1188 PolarHBondContact N-O 2.86Å
1168	N	83	Confident	76.6	Confident	57 Å²	57	48.8 Å²	48.8	31%	0.305	29%	0.287	S	S	.	.			trans	-85.5	154.9	178.4	-65.1	-25.4	0	0	0	112.7	K1162 L1165 C1188	K1162-N1168 PolarHBondContact O-ND2 2.82Å; L1165-N1168 VanDerWaalsContact O-CB 3.3Å; L1165-N1168 WeakPolarHBondContact O-CB 3.47Å; L1165-N1168 PolarHBondContact O-N 3.28Å; N1168-C1188 PolarHBondContact O-N 3.32Å
1169	E	82.8	Confident	77.8	Confident	107 Å²	107	51.6 Å²	51.6	50%	0.5	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	136.5	-177.7	-46.2	-167.7	130.1	0	0	109.1	K1185 F1186 T1187	E1169-K1185 WeakPolarHBondContact OE1-CE 3.06Å; E1169-K1185 IonicContact OE1-NZ 3.11Å; E1169-K1185 PolarHBondContact OE1-NZ 2.95Å; E1169-K1185 VanDerWaalsContact OE2-CE 3.3Å; E1169-K1185 WeakPolarHBondContact OE2-CE 3.37Å; E1169-K1185 IonicContact OE2-NZ 2.9Å; E1169-K1185 PolarHBondContact OE2-NZ 2.74Å; E1169-F1186 CarbonylContact C-O 3.48Å; E1169-F1186 WeakPolarHBondContact CA-O 3.4Å; E1169-T1187 HydrophobicContact CB-CG2 4.4Å; E1169-T1187 HydrophobicContact CG-CG2 4.06Å
1170	V	78.9	Confident	79.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	117.7	-179.7	179.8	0	0	0	0	107.6	I1146 I1156 L1163 F1172 K1185 F1186 W1193	I1146-V1170 HydrophobicContact CD1-CB 4.12Å; I1146-V1170 HydrophobicContact CD1-CG1 3.94Å; I1146-V1170 HydrophobicContact CD1-CG2 4.07Å; I1156-V1170 HydrophobicContact CG2-CG1 3.66Å; L1163-V1170 HydrophobicContact CD2-CB 4.46Å; L1163-V1170 HydrophobicContact CD2-CG1 4.14Å; L1163-V1170 HydrophobicContact CD2-CG2 3.88Å; V1170-F1172 HydrophobicContact CG1-CE1 4.47Å; V1170-F1172 HydrophobicContact CG1-CE2 4.1Å; V1170-F1172 HydrophobicContact CG1-CZ 4.04Å; V1170-K1185 WeakPolarHBondContact O-CA 3.47Å; V1170-F1186 PolarHBondContact N-O 2.73Å; V1170-F1186 PolarHBondContact O-N 2.77Å; V1170-W1193 HydrophobicContact CB-CZ3 4.38Å; V1170-W1193 HydrophobicContact CG2-CH2 3.39Å; V1170-W1193 HydrophobicContact CG2-CZ2 4.37Å; V1170-W1193 HydrophobicContact CG2-CZ3 3.64Å
1171	L	81.4	Confident	80.5	Confident	68 Å²	68	50.3 Å²	50.3	36%	0.356	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	132.8	175.2	-155.4	80.2	0	0	0	110	N1157 E1173 S1184 K1185	N1157-L1171 HydrophobicContact CB-CB 4.46Å; N1157-L1171 PolarHBondContact N-O 3.41Å; N1157-L1171 WeakPolarHBondContact O-CB 3.49Å; N1157-L1171 PolarHBondContact O-N 2.81Å; N1157-L1171 VanDerWaalsContact O-N 3.15Å; L1171-E1173 HydrophobicContact CD2-CG 4.25Å; L1171-S1184 WeakPolarHBondContact CA-O 3.32Å; L1171-S1184 WeakPolarHBondContact CD1-O 3.26Å; L1171-K1185 HydrophobicContact CD1-CB 4.14Å
1172	F	81.5	Confident	81.9	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.009	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	127.3	175.8	-68.7	-78.3	0	0	0	110.1	I1146 V1148 L1154 I1156 V1170 L1180 S1184 F1186 P1199	I1146-F1172 HydrophobicContact CD1-CE2 4.26Å; I1146-F1172 HydrophobicContact CD1-CZ 3.75Å; I1146-F1172 HydrophobicContact CG2-CZ 4.13Å; V1148-F1172 HydrophobicContact CG2-CE1 4.34Å; V1148-F1172 HydrophobicContact CG2-CZ 4.47Å; L1154-F1172 HydrophobicContact CD1-CB 4.15Å; L1154-F1172 HydrophobicContact CD2-CD1 3.69Å; L1154-F1172 HydrophobicContact CD2-CE1 4.27Å; L1154-F1172 HydrophobicContact CD2-CG 4.43Å; L1154-F1172 HydrophobicContact CG-CB 4.49Å; L1154-F1172 HydrophobicContact CG-CD1 4.16Å; I1156-F1172 HydrophobicContact CD1-CE1 3.98Å; I1156-F1172 HydrophobicContact CG1-CD1 3.93Å; I1156-F1172 HydrophobicContact CG1-CE1 3.76Å; V1170-F1172 HydrophobicContact CG1-CE1 4.47Å; V1170-F1172 HydrophobicContact CG1-CE2 4.1Å; V1170-F1172 HydrophobicContact CG1-CZ 4.04Å; F1172-L1180 WeakPolarHBondContact O-CD2 3.31Å; F1172-S1184 PolarHBondContact N-O 2.98Å; F1172-F1186 HydrophobicContact CE2-CB 4.2Å; F1172-F1186 HydrophobicContact CE2-CD1 4.22Å; F1172-F1186 AromaticContact CE2-CD2 3.79Å; F1172-F1186 HydrophobicContact CE2-CD2 3.79Å; F1172-F1186 HydrophobicContact CE2-CE2 4.15Å; F1172-F1186 AromaticContact CE2-CG 3.81Å; F1172-F1186 HydrophobicContact CE2-CG 3.81Å; F1172-F1186 HydrophobicContact CZ-CD2 4.26Å; F1172-F1186 HydrophobicContact CZ-CE2 4.48Å; F1172-P1199 HydrophobicContact CB-CB 4.03Å; F1172-P1199 HydrophobicContact CB-CG 4.32Å; F1172-P1199 HydrophobicContact CD1-CB 4.42Å; F1172-P1199 HydrophobicContact CD1-CG 3.87Å; F1172-P1199 HydrophobicContact CD2-CB 4.25Å; F1172-P1199 HydrophobicContact CD2-CG 3.77Å; F1172-P1199 HydrophobicContact CE1-CG 4.03Å; F1172-P1199 HydrophobicContact CE2-CG 3.94Å; F1172-P1199 HydrophobicContact CG-CB 3.99Å; F1172-P1199 HydrophobicContact CG-CG 3.73Å; F1172-P1199 HydrophobicContact CZ-CG 4.06Å
1173	E	81.2	Confident	82.7	Confident	66 Å²	66	51.8 Å²	51.8	31%	0.308	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	152.8	179.9	-71.6	-178	-127.9	0	0	110.6	L1154 F1155 N1157 L1171	L1154-E1173 CarbonylContact C-O 3.46Å; L1154-E1173 WeakPolarHBondContact CA-O 3.34Å; F1155-E1173 HydrophobicContact CD1-CB 4.27Å; F1155-E1173 WeakPolarHBondContact CD1-O 3.2Å; F1155-E1173 HydrophobicContact CD2-CB 4.11Å; F1155-E1173 HydrophobicContact CE1-CB 3.75Å; F1155-E1173 HydrophobicContact CE2-CB 3.55Å; F1155-E1173 HydrophobicContact CE2-CG 4.28Å; F1155-E1173 HydrophobicContact CG-CB 4.44Å; F1155-E1173 HydrophobicContact CZ-CB 3.35Å; F1155-E1173 HydrophobicContact CZ-CG 4.27Å; F1155-E1173 PolarHBondContact N-O 3.04Å; F1155-E1173 PolarHBondContact O-N 3.44Å; N1157-E1173 PolarHBondContact ND2-OE1 3.33Å; L1171-E1173 HydrophobicContact CD2-CG 4.25Å
1174	C	82.5	Confident	83.5	Confident	21 Å²	21	53.9 Å²	53.9	14%	0.142	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	153	173.6	-67.8	0	0	0	0	110.7	F1153 H1178 L1180 C1201	F1153-C1174 WeakPolarHBondContact O-CA 3.49Å; C1174-H1178 HydrophobicContact CB-CB 3.95Å; C1174-L1180 WeakPolarHBondContact SG-CA 3.44Å; C1174-L1180 PolarHBondContact SG-N 3.12Å; C1174-C1201 VanDerWaalsContact CA-SG 3.58Å; C1174-C1201 HydrophobicContact CB-CB 3.97Å; C1174-C1201 WeakPolarHBondContact CB-SG 3.48Å; C1174-C1201 VanDerWaalsContact SG-CA 3.52Å; C1174-C1201 WeakPolarHBondContact SG-CB 3.32Å; C1174-C1201 CovalentContact SG-SG 2.03Å; C1174-C1201 PolarHBondContact SG-SG 3.11Å
1175	Y	74.7	Confident	83.9	Confident	56 Å²	56	57.4 Å²	57.4	22%	0.22	32%	0.316	C	S	.	.			trans	-51.1	149.5	170.3	-87.2	-109.7	0	0	0	111.8	V687 V688 F1153 F1155 S1177 H1178	V687-Y1175 WeakPolarHBondContact CG1-OH 3.41Å; V688-Y1175 PolarHBondContact N-OH 2.92Å; V688-Y1175 PolarHBondContact O-OH 3.36Å; F1153-Y1175 HydrophobicContact CB-CD2 4.22Å; F1153-Y1175 WeakPolarHBondContact O-CD2 3.41Å; F1153-Y1175 PolarHBondContact O-N 3.22Å; F1153-Y1175 VanDerWaalsContact O-N 3.09Å; F1155-Y1175 HydrophobicContact CD1-CD2 4.19Å; F1155-Y1175 HydrophobicContact CD1-CE2 4.35Å; Y1175-S1177 PolarHBondContact O-N 2.9Å; Y1175-H1178 PolarHBondContact O-N 3.43Å
1176	P	82	Confident	84	Confident	113 Å²	113	57.2 Å²	57.2	73%	0.734	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-18.6	-179.8	-28.7	36	0	0	0	115.7	H1178 K1204	P1176-H1178 VanDerWaalsContact C-N 3.33Å; P1176-K1204 WeakPolarHBondContact O-CD 3.39Å; P1176-K1204 WeakPolarHBondContact O-CE 3.31Å; P1176-K1204 PolarHBondContact O-NZ 3.48Å
1177	S	79.5	Confident	84	Confident	64 Å²	64	54.9 Å²	54.9	45%	0.448	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-7.8	173.5	53.2	0	0	0	0	114.7	Y1175 K1204	Y1175-S1177 PolarHBondContact O-N 2.9Å; S1177-K1204 WeakPolarHBondContact O-CB 3.41Å; S1177-K1204 WeakPolarHBondContact O-CG 3.43Å; S1177-K1204 PolarHBondContact O-N 2.64Å
1178	H	85.6	Confident	84.1	Confident	22 Å²	22	52.1 Å²	52.1	10%	0.102	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	158.3	-171.3	-73.7	69	0	0	0	112.5	F1153 C1174 Y1175 P1176 C1201 R1202 S1203 K1204	F1153-H1178 AromaticContact CD1-CE1 3.8Å; F1153-H1178 AromaticContact CD2-CD2 3.77Å; F1153-H1178 AromaticContact CD2-CE1 3.52Å; F1153-H1178 AromaticContact CD2-NE2 3.23Å; F1153-H1178 WeakPolarHBondContact CD2-NE2 3.46Å; F1153-H1178 AromaticContact CE2-CE1 3.83Å; F1153-H1178 AromaticContact CE2-NE2 3.6Å; F1153-H1178 AromaticContact CG-CE1 3.51Å; F1153-H1178 AromaticContact CG-ND1 3.89Å; F1153-H1178 AromaticContact CG-NE2 3.66Å; C1174-H1178 HydrophobicContact CB-CB 3.95Å; Y1175-H1178 PolarHBondContact O-N 3.43Å; P1176-H1178 VanDerWaalsContact C-N 3.33Å; H1178-C1201 HydrophobicContact CB-CB 4.01Å; H1178-R1202 CarbonylContact C-O 3.55Å; H1178-R1202 VanDerWaalsContact CA-O 3.28Å; H1178-R1202 WeakPolarHBondContact CA-O 3.46Å; H1178-S1203 WeakPolarHBondContact CD2-CA 3.29Å; H1178-S1203 PolarHBondContact CD2-N 3.17Å; H1178-S1203 WeakPolarHBondContact NE2-CA 3.28Å; H1178-S1203 WeakPolarHBondContact NE2-CB 3.19Å; H1178-K1204 WeakPolarHBondContact O-CE 3.46Å
1179	W	86.9	Confident	84.3	Confident	121 Å²	121	53 Å²	53	46%	0.458	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.5	167.9	-71.1	127.6	0	0	0	110.2	C1201 R1202 K1204	W1179-C1201 WeakPolarHBondContact O-CA 3.5Å; W1179-R1202 PolarHBondContact N-O 3.45Å; W1179-R1202 PolarHBondContact O-N 3.05Å; W1179-K1204 HydrophobicContact CD2-CD 4.46Å; W1179-K1204 HydrophobicContact CD2-CG 4.22Å; W1179-K1204 HydrophobicContact CG-CG 4.1Å; W1179-K1204 HydrophobicContact CZ2-CD 4.36Å
1180	L	87.3	Confident	84.4	Confident	51 Å²	51	58.5 Å²	58.5	27%	0.267	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	142.7	169	-174.3	66.9	0	0	0	111.4	L1154 F1172 C1174 S1184 P1199	L1154-L1180 HydrophobicContact CD1-CD1 3.31Å; F1172-L1180 WeakPolarHBondContact O-CD2 3.31Å; C1174-L1180 WeakPolarHBondContact SG-CA 3.44Å; C1174-L1180 PolarHBondContact SG-N 3.12Å; L1180-S1184 VanDerWaalsContact CD2-CB 3.43Å; L1180-P1199 HydrophobicContact CD1-CB 4.19Å
1181	K	89	Confident	84.6	Confident	56 Å²	56	59.7 Å²	59.7	24%	0.243	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	157.6	169.7	-54.1	-62.6	171.2	-165.6	0	108.1	P1199 W1200 E1207	K1181-P1199 CarbonylContact O-C 3.5Å; K1181-P1199 VanDerWaalsContact O-CA 3.27Å; K1181-P1199 WeakPolarHBondContact O-CA 3.34Å; K1181-W1200 HydrophobicContact CB-CD2 3.91Å; K1181-W1200 VanDerWaalsContact CB-CE2 3.43Å; K1181-W1200 HydrophobicContact CB-CG 4.31Å; K1181-W1200 HydrophobicContact CB-CH2 4.21Å; K1181-W1200 HydrophobicContact CB-CZ2 3.6Å; K1181-W1200 HydrophobicContact CG-CD2 4.28Å; K1181-W1200 HydrophobicContact CG-CE3 4.4Å; K1181-W1200 HydrophobicContact CG-CH2 3.75Å; K1181-W1200 HydrophobicContact CG-CZ2 3.64Å; K1181-W1200 HydrophobicContact CG-CZ3 4.17Å; K1181-W1200 PolarHBondContact N-O 3.17Å; K1181-W1200 PolarHBondContact O-N 3.4Å; K1181-E1207 WeakPolarHBondContact CE-OE2 3.37Å; K1181-E1207 IonicContact NZ-OE1 3.39Å; K1181-E1207 PolarHBondContact NZ-OE1 2.89Å; K1181-E1207 IonicContact NZ-OE2 3.57Å; K1181-E1207 PolarHBondContact NZ-OE2 3.08Å
1182	G	87.4	Confident	84.7	Confident	31 Å²	31	65.7 Å²	65.7	32%	0.32	33%	0.331	S	S	.	.	S	Bend	trans	79	-170.4	-169.5	0	0	0	0	0	112.8
1183	D	87.7	Confident	84.9	Confident	76 Å²	76	67.5 Å²	67.5	41%	0.406	34%	0.338	S	S	.	.			trans	-84.8	121.2	-176.7	-72.7	-39.8	0	0	0	111.5	K1185 F1186 G1196 W1197	D1183-K1185 PolarHBondContact O-N 3.4Å; D1183-K1185 VanDerWaalsContact O-N 3.16Å; D1183-F1186 HydrophobicContact CB-CE1 4.22Å; D1183-G1196 WeakPolarHBondContact OD2-CA 3.38Å; D1183-W1197 PolarHBondContact N-O 3.24Å; D1183-W1197 PolarHBondContact OD2-N 3.4Å
1184	S	85.3	Confident	85.1	Confident	57 Å²	57	67 Å²	67	40%	0.399	34%	0.337	S	S	.	.	S	Bend	trans	-70.5	-5.1	-176.7	64.1	0	0	0	0	116.1	L1171 F1172 L1180	L1171-S1184 WeakPolarHBondContact CA-O 3.32Å; L1171-S1184 WeakPolarHBondContact CD1-O 3.26Å; F1172-S1184 PolarHBondContact N-O 2.98Å; L1180-S1184 VanDerWaalsContact CD2-CB 3.43Å
1185	K	87.5	Confident	84.4	Confident	81 Å²	81	75.8 Å²	75.8	35%	0.352	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	115.5	-168.8	175.5	172.7	158.5	164.6	0	111.7	E1169 V1170 L1171 D1183 T1187	E1169-K1185 WeakPolarHBondContact OE1-CE 3.06Å; E1169-K1185 IonicContact OE1-NZ 3.11Å; E1169-K1185 PolarHBondContact OE1-NZ 2.95Å; E1169-K1185 VanDerWaalsContact OE2-CE 3.3Å; E1169-K1185 WeakPolarHBondContact OE2-CE 3.37Å; E1169-K1185 IonicContact OE2-NZ 2.9Å; E1169-K1185 PolarHBondContact OE2-NZ 2.74Å; V1170-K1185 WeakPolarHBondContact O-CA 3.47Å; L1171-K1185 HydrophobicContact CD1-CB 4.14Å; D1183-K1185 PolarHBondContact O-N 3.4Å; D1183-K1185 VanDerWaalsContact O-N 3.16Å; K1185-T1187 HydrophobicContact CG-CG2 4.34Å
1186	F	86.1	Confident	84.5	Confident	11 Å²	11	74.6 Å²	74.6	5%	0.048	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	152.3	167	-69.5	2	0	0	0	110.6	I1146 E1169 V1170 F1172 D1183 W1193 N1194	I1146-F1186 HydrophobicContact CD1-CB 4.44Å; I1146-F1186 HydrophobicContact CD1-CD2 3.98Å; I1146-F1186 HydrophobicContact CG1-CD2 4.43Å; I1146-F1186 HydrophobicContact CG2-CD2 3.91Å; I1146-F1186 HydrophobicContact CG2-CE2 3.76Å; E1169-F1186 CarbonylContact C-O 3.48Å; E1169-F1186 WeakPolarHBondContact CA-O 3.4Å; V1170-F1186 PolarHBondContact N-O 2.73Å; V1170-F1186 PolarHBondContact O-N 2.77Å; F1172-F1186 HydrophobicContact CE2-CB 4.2Å; F1172-F1186 HydrophobicContact CE2-CD1 4.22Å; F1172-F1186 AromaticContact CE2-CD2 3.79Å; F1172-F1186 HydrophobicContact CE2-CD2 3.79Å; F1172-F1186 HydrophobicContact CE2-CE2 4.15Å; F1172-F1186 AromaticContact CE2-CG 3.81Å; F1172-F1186 HydrophobicContact CE2-CG 3.81Å; F1172-F1186 HydrophobicContact CZ-CD2 4.26Å; F1172-F1186 HydrophobicContact CZ-CE2 4.48Å; D1183-F1186 HydrophobicContact CB-CE1 4.22Å; F1186-W1193 HydrophobicContact CB-CE3 3.8Å; F1186-W1193 HydrophobicContact CB-CZ3 4.29Å; F1186-N1194 WeakPolarHBondContact CA-OD1 3.41Å; F1186-N1194 WeakPolarHBondContact CB-OD1 3.14Å
1187	T	88	Confident	84.5	Confident	34 Å²	34	78.1 Å²	78.1	21%	0.209	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	124.6	-175.9	59	0	0	0	0	109.9	E1169 K1185 T1189 N1194	E1169-T1187 HydrophobicContact CB-CG2 4.4Å; E1169-T1187 HydrophobicContact CG-CG2 4.06Å; K1185-T1187 HydrophobicContact CG-CG2 4.34Å; T1187-T1189 PolarHBondContact O-N 3.47Å; T1187-N1194 PolarHBondContact N-OD1 2.95Å; T1187-N1194 PolarHBondContact O-N 3.12Å
1188	C	86.6	Confident	84.8	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.007	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	115	-178	177.3	0	0	0	0	111.1	C1143 Y1164 L1165 E1166 G1167 N1168 W1193	C1143-C1188 HydrophobicContact CB-CB 3.86Å; C1143-C1188 WeakPolarHBondContact CB-SG 3.29Å; C1143-C1188 WeakPolarHBondContact SG-CA 3.5Å; C1143-C1188 WeakPolarHBondContact SG-CB 3.43Å; C1143-C1188 CovalentContact SG-SG 2.01Å; C1143-C1188 PolarHBondContact SG-SG 2.76Å; Y1164-C1188 PolarHBondContact O-SG 2.95Å; Y1164-C1188 VanDerWaalsContact O-SG 3.41Å; L1165-C1188 WeakPolarHBondContact O-CB 3.43Å; E1166-C1188 WeakPolarHBondContact CA-SG 3.4Å; E1166-C1188 PolarHBondContact N-SG 2.86Å; E1166-C1188 VanDerWaalsContact N-SG 3.43Å; G1167-C1188 PolarHBondContact N-O 2.86Å; N1168-C1188 PolarHBondContact O-N 3.32Å; C1188-W1193 HydrophobicContact CB-CE3 4.09Å; C1188-W1193 HydrophobicContact CB-CH2 3.79Å; C1188-W1193 HydrophobicContact CB-CZ2 4.41Å; C1188-W1193 HydrophobicContact CB-CZ3 3.62Å
1189	T	88.5	Confident	84.7	Confident	75 Å²	75	77.1 Å²	77.1	46%	0.46	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	130.2	-179	64.6	0	0	0	0	111.4	T1187 G1191 R1192	T1187-T1189 PolarHBondContact O-N 3.47Å; T1189-G1191 PolarHBondContact O-N 3.41Å; T1189-R1192 PolarHBondContact N-O 3.11Å; T1189-R1192 PolarHBondContact O-N 3.28Å
1190	R	85	Confident	84.7	Confident	223 Å²	223	74.1 Å²	74.1	84%	0.842	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	39.1	-179.1	-56.9	178.9	-179.2	162.6	0.7	114	E1166 R1192	E1166-R1190 VanDerWaalsContact OE1-CA 3.25Å; E1166-R1190 WeakPolarHBondContact OE1-CA 3.21Å; E1166-R1190 PolarHBondContact OE1-N 2.91Å; R1190-R1192 VanDerWaalsContact C-N 3.29Å; R1190-R1192 PolarHBondContact O-N 2.95Å
1191	G	81.8	Confident	84.6	Confident	24 Å²	24	72.5 Å²	72.5	25%	0.247	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	21.5	-176.6	0	0	0	0	0	114.9	S1142 T1189	S1142-G1191 WeakPolarHBondContact O-CA 3.25Å; T1189-G1191 PolarHBondContact O-N 3.41Å
1192	R	85.2	Confident	84.5	Confident	195 Å²	195	74.1 Å²	74.1	74%	0.736	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.3	144.7	171.4	-63	-174.6	179.7	-178.2	-0.9	112.5	C1143 T1189 R1190	C1143-R1192 PolarHBondContact SG-N 2.78Å; C1143-R1192 PolarHBondContact SG-O 3.1Å; C1143-R1192 VanDerWaalsContact SG-O 3.36Å; T1189-R1192 PolarHBondContact N-O 3.11Å; T1189-R1192 PolarHBondContact O-N 3.28Å; R1190-R1192 VanDerWaalsContact C-N 3.29Å; R1190-R1192 PolarHBondContact O-N 2.95Å
1193	W	84.1	Confident	84.4	Confident	40 Å²	40	74.3 Å²	74.3	15%	0.152	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	147.5	165.1	-61.9	108.7	0	0	0	110.8	C1143 G1144 I1146 Y1164 V1170 F1186 C1188	C1143-W1193 HydrophobicContact CB-CD2 3.86Å; C1143-W1193 VanDerWaalsContact CB-CE2 3.41Å; C1143-W1193 HydrophobicContact CB-CG 4.13Å; C1143-W1193 HydrophobicContact CB-CH2 4.44Å; C1143-W1193 HydrophobicContact CB-CZ2 3.74Å; C1143-W1193 PolarHBondContact O-NE1 3.48Å; G1144-W1193 PolarHBondContact O-NE1 3.3Å; I1146-W1193 HydrophobicContact CD1-CD2 4.04Å; I1146-W1193 HydrophobicContact CD1-CE3 4.24Å; I1146-W1193 HydrophobicContact CD1-CH2 4.11Å; I1146-W1193 HydrophobicContact CD1-CZ2 3.9Å; I1146-W1193 HydrophobicContact CD1-CZ3 4.26Å; I1146-W1193 HydrophobicContact CG1-CD2 3.88Å; I1146-W1193 VanDerWaalsContact CG1-CE2 3.44Å; I1146-W1193 HydrophobicContact CG1-CG 4.19Å; I1146-W1193 HydrophobicContact CG1-CZ2 3.84Å; Y1164-W1193 HydrophobicContact CD1-CH2 4.23Å; Y1164-W1193 AromaticContact CD1-CZ2 3.71Å; Y1164-W1193 HydrophobicContact CD1-CZ2 3.71Å; Y1164-W1193 HydrophobicContact CG-CZ2 4.35Å; V1170-W1193 HydrophobicContact CB-CZ3 4.38Å; V1170-W1193 HydrophobicContact CG2-CH2 3.39Å; V1170-W1193 HydrophobicContact CG2-CZ2 4.37Å; V1170-W1193 HydrophobicContact CG2-CZ3 3.64Å; F1186-W1193 HydrophobicContact CB-CE3 3.8Å; F1186-W1193 HydrophobicContact CB-CZ3 4.29Å; C1188-W1193 HydrophobicContact CB-CE3 4.09Å; C1188-W1193 HydrophobicContact CB-CH2 3.79Å; C1188-W1193 HydrophobicContact CB-CZ2 4.41Å; C1188-W1193 HydrophobicContact CB-CZ3 3.62Å
1194	N	86.4	Confident	84.4	Confident	54 Å²	54	73.7 Å²	73.7	29%	0.289	34%	0.344	S	S	.	.			trans	-61.3	138.9	165.8	58.1	-42.9	0	0	0	110.1	F1186 T1187 G1196	F1186-N1194 WeakPolarHBondContact CA-OD1 3.41Å; F1186-N1194 WeakPolarHBondContact CB-OD1 3.14Å; T1187-N1194 PolarHBondContact N-OD1 2.95Å; T1187-N1194 PolarHBondContact O-N 3.12Å; N1194-G1196 VanDerWaalsContact C-N 3.29Å; N1194-G1196 PolarHBondContact O-N 3.08Å
1195	Q	68.3	Low	84.4	Confident	207 Å²	207	78.9 Å²	78.9	97%	0.967	36%	0.362	S	S	*	.			trans	-79.9	79.1	177.6	-69.5	-176.5	-36.3	0	0	110.3
1196	G	76.4	Confident	84.2	Confident	31 Å²	31	79.2 Å²	79.2	32%	0.32	37%	0.367	S	S	.	.			trans	-88.4	176.9	169.7	0	0	0	0	0	113.1	D1183 N1194	D1183-G1196 WeakPolarHBondContact OD2-CA 3.38Å; N1194-G1196 VanDerWaalsContact C-N 3.29Å; N1194-G1196 PolarHBondContact O-N 3.08Å
1197	W	82.5	Confident	84.1	Confident	186 Å²	186	79.5 Å²	79.5	71%	0.705	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-76.5	131.6	169.8	-127.4	62	0	0	0	110.2	D1183	D1183-W1197 PolarHBondContact N-O 3.24Å; D1183-W1197 PolarHBondContact OD2-N 3.4Å
1198	Q	84.2	Confident	84	Confident	65 Å²	65	81.4 Å²	81.4	30%	0.304	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-53.2	127.1	-177.1	-77.1	-73.4	9.6	0	0	111.9	N1147	N1147-Q1198 PolarHBondContact O-NE2 2.91Å
1199	P	85.3	Confident	84	Confident	0 Å²	0	84.8 Å²	84.8	0%	0	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-73.8	140.9	177.2	30.7	-35.6	0	0	0	111.2	V1148 L1154 F1172 L1180 K1181	V1148-P1199 HydrophobicContact CG1-CG 4.35Å; V1148-P1199 WeakPolarHBondContact CG1-O 3.24Å; V1148-P1199 HydrophobicContact CG2-CG 4.01Å; L1154-P1199 HydrophobicContact CD1-CB 4.21Å; L1154-P1199 HydrophobicContact CD2-CB 3.9Å; L1154-P1199 HydrophobicContact CD2-CG 3.85Å; F1172-P1199 HydrophobicContact CB-CB 4.03Å; F1172-P1199 HydrophobicContact CB-CG 4.32Å; F1172-P1199 HydrophobicContact CD1-CB 4.42Å; F1172-P1199 HydrophobicContact CD1-CG 3.87Å; F1172-P1199 HydrophobicContact CD2-CB 4.25Å; F1172-P1199 HydrophobicContact CD2-CG 3.77Å; F1172-P1199 HydrophobicContact CE1-CG 4.03Å; F1172-P1199 HydrophobicContact CE2-CG 3.94Å; F1172-P1199 HydrophobicContact CG-CB 3.99Å; F1172-P1199 HydrophobicContact CG-CG 3.73Å; F1172-P1199 HydrophobicContact CZ-CG 4.06Å; L1180-P1199 HydrophobicContact CD1-CB 4.19Å; K1181-P1199 CarbonylContact O-C 3.5Å; K1181-P1199 VanDerWaalsContact O-CA 3.27Å; K1181-P1199 WeakPolarHBondContact O-CA 3.34Å
1200	W	86.1	Confident	83.9	Confident	59 Å²	59	84.8 Å²	84.8	22%	0.223	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	160.9	173.1	60.2	-83.4	0	0	0	111.4	K1181 R1202	K1181-W1200 HydrophobicContact CB-CD2 3.91Å; K1181-W1200 VanDerWaalsContact CB-CE2 3.43Å; K1181-W1200 HydrophobicContact CB-CG 4.31Å; K1181-W1200 HydrophobicContact CB-CH2 4.21Å; K1181-W1200 HydrophobicContact CB-CZ2 3.6Å; K1181-W1200 HydrophobicContact CG-CD2 4.28Å; K1181-W1200 HydrophobicContact CG-CE3 4.4Å; K1181-W1200 HydrophobicContact CG-CH2 3.75Å; K1181-W1200 HydrophobicContact CG-CZ2 3.64Å; K1181-W1200 HydrophobicContact CG-CZ3 4.17Å; K1181-W1200 PolarHBondContact N-O 3.17Å; K1181-W1200 PolarHBondContact O-N 3.4Å; W1200-R1202 HydrophobicContact CH2-CB 4.37Å; W1200-R1202 HydrophobicContact CZ3-CB 3.75Å; W1200-R1202 HydrophobicContact CZ3-CG 4.41Å
1201	C	85	Confident	83.9	Confident	17 Å²	17	81 Å²	81	12%	0.115	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	137.4	-175.1	-60.3	0	0	0	0	112.8	D1152 F1153 L1154 C1174 H1178 W1179	D1152-C1201 WeakPolarHBondContact O-CB 3.34Å; F1153-C1201 HydrophobicContact CB-CB 4.17Å; F1153-C1201 PolarHBondContact O-SG 3.29Å; L1154-C1201 WeakPolarHBondContact CA-SG 3.14Å; L1154-C1201 VanDerWaalsContact CB-SG 3.59Å; L1154-C1201 WeakPolarHBondContact CD1-SG 3.22Å; L1154-C1201 PolarHBondContact N-SG 2.81Å; L1154-C1201 VanDerWaalsContact N-SG 3.41Å; C1174-C1201 VanDerWaalsContact CA-SG 3.58Å; C1174-C1201 HydrophobicContact CB-CB 3.97Å; C1174-C1201 WeakPolarHBondContact CB-SG 3.48Å; C1174-C1201 VanDerWaalsContact SG-CA 3.52Å; C1174-C1201 WeakPolarHBondContact SG-CB 3.32Å; C1174-C1201 CovalentContact SG-SG 2.03Å; C1174-C1201 PolarHBondContact SG-SG 3.11Å; H1178-C1201 HydrophobicContact CB-CB 4.01Å; W1179-C1201 WeakPolarHBondContact O-CA 3.5Å
1202	R	86.1	Confident	84.2	Confident	89 Å²	89	84.1 Å²	84.1	34%	0.336	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	133.4	170.3	-172.7	164	-79.9	-176.9	-2.5	110.8	H1178 W1179 W1200 K1204 E1207	H1178-R1202 CarbonylContact C-O 3.55Å; H1178-R1202 VanDerWaalsContact CA-O 3.28Å; H1178-R1202 WeakPolarHBondContact CA-O 3.46Å; W1179-R1202 PolarHBondContact N-O 3.45Å; W1179-R1202 PolarHBondContact O-N 3.05Å; W1200-R1202 HydrophobicContact CH2-CB 4.37Å; W1200-R1202 HydrophobicContact CZ3-CB 3.75Å; W1200-R1202 HydrophobicContact CZ3-CG 4.41Å; R1202-K1204 PolarHBondContact O-N 3.49Å; R1202-E1207 HydrophobicContact CG-CB 4.16Å
1203	S	86.4	Confident	84.4	Confident	35 Å²	35	79.1 Å²	79.1	25%	0.245	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	138.3	179.6	88.3	0	0	0	0	111.2	H1178 Q1205 L1206 E1207	H1178-S1203 WeakPolarHBondContact CD2-CA 3.29Å; H1178-S1203 PolarHBondContact CD2-N 3.17Å; H1178-S1203 WeakPolarHBondContact NE2-CA 3.28Å; H1178-S1203 WeakPolarHBondContact NE2-CB 3.19Å; S1203-Q1205 PolarHBondContact O-N 2.84Å; S1203-L1206 PolarHBondContact O-N 2.77Å; S1203-L1206 VanDerWaalsContact OG-CB 3.24Å; S1203-L1206 WeakPolarHBondContact OG-CB 2.99Å; S1203-L1206 PolarHBondContact OG-N 3.31Å; S1203-E1207 PolarHBondContact O-N 3.11Å
1204	K	87.2	Confident	84.6	Confident	64 Å²	64	80.7 Å²	80.7	28%	0.278	40%	0.398	S	S	.	.	H	α-helix	trans	-61.7	-31.8	-177.5	-74.7	177.7	174.1	166.2	0	112	P1176 S1177 H1178 W1179 R1202 T1208	P1176-K1204 WeakPolarHBondContact O-CD 3.39Å; P1176-K1204 WeakPolarHBondContact O-CE 3.31Å; P1176-K1204 PolarHBondContact O-NZ 3.48Å; S1177-K1204 WeakPolarHBondContact O-CB 3.41Å; S1177-K1204 WeakPolarHBondContact O-CG 3.43Å; S1177-K1204 PolarHBondContact O-N 2.64Å; H1178-K1204 WeakPolarHBondContact O-CE 3.46Å; W1179-K1204 HydrophobicContact CD2-CD 4.46Å; W1179-K1204 HydrophobicContact CD2-CG 4.22Å; W1179-K1204 HydrophobicContact CG-CG 4.1Å; W1179-K1204 HydrophobicContact CZ2-CD 4.36Å; R1202-K1204 PolarHBondContact O-N 3.49Å; K1204-T1208 WeakPolarHBondContact O-CB 3.24Å; K1204-T1208 PolarHBondContact O-N 2.93Å; K1204-T1208 VanDerWaalsContact O-N 3.08Å; K1204-T1208 PolarHBondContact O-OG1 3.3Å
1205	Q	84.8	Confident	84.8	Confident	165 Å²	165	83.3 Å²	83.3	77%	0.771	41%	0.411	S	S	*	.	H	α-helix	trans	-65.9	-50.8	173.8	-69.4	178	-14.3	0	0	111.6	S1203 E1207 T1208 T1209	S1203-Q1205 PolarHBondContact O-N 2.84Å; Q1205-E1207 PolarHBondContact O-N 2.94Å; Q1205-T1208 PolarHBondContact O-N 2.68Å; Q1205-T1208 VanDerWaalsContact O-N 3.13Å; Q1205-T1209 PolarHBondContact O-N 2.99Å; Q1205-T1209 PolarHBondContact O-OG1 3.42Å
1206	L	84.3	Confident	85.9	Confident	88 Å²	88	77.2 Å²	77.2	46%	0.461	39%	0.385	S	S	.	.	H	α-helix	trans	-65.2	-38.2	-179.1	-178.9	62.8	0	0	0	112.3	S1203 T1208 T1209 L1210	S1203-L1206 PolarHBondContact O-N 2.77Å; S1203-L1206 VanDerWaalsContact OG-CB 3.24Å; S1203-L1206 WeakPolarHBondContact OG-CB 2.99Å; S1203-L1206 PolarHBondContact OG-N 3.31Å; L1206-T1208 VanDerWaalsContact C-N 3.31Å; L1206-T1209 WeakPolarHBondContact CA-OG1 3.06Å; L1206-T1209 PolarHBondContact O-OG1 3.29Å; L1206-T1209 VanDerWaalsContact O-OG1 3.11Å; L1206-L1210 HydrophobicContact CD1-CD1 4.34Å; L1206-L1210 HydrophobicContact CD1-CG 4.39Å; L1206-L1210 HydrophobicContact CG-CD1 4.07Å; L1206-L1210 VanDerWaalsContact O-CB 3.31Å; L1206-L1210 WeakPolarHBondContact O-CB 3.31Å; L1206-L1210 VanDerWaalsContact O-CG 3.26Å; L1206-L1210 WeakPolarHBondContact O-CG 3.38Å; L1206-L1210 PolarHBondContact O-N 2.88Å
1207	E	84	Confident	86.5	Confident	18 Å²	18	82.3 Å²	82.3	8%	0.084	40%	0.398	C	S	.	.	H	α-helix	trans	-68.9	-32.1	174.3	-167.9	168.5	158	0	0	112.3	K1181 R1202 S1203 Q1205 R1211	K1181-E1207 WeakPolarHBondContact CE-OE2 3.37Å; K1181-E1207 IonicContact NZ-OE1 3.39Å; K1181-E1207 PolarHBondContact NZ-OE1 2.89Å; K1181-E1207 IonicContact NZ-OE2 3.57Å; K1181-E1207 PolarHBondContact NZ-OE2 3.08Å; R1202-E1207 HydrophobicContact CG-CB 4.16Å; S1203-E1207 PolarHBondContact O-N 3.11Å; Q1205-E1207 PolarHBondContact O-N 2.94Å; E1207-R1211 WeakPolarHBondContact O-CB 3.31Å; E1207-R1211 WeakPolarHBondContact O-CG 3.49Å; E1207-R1211 PolarHBondContact O-N 3.01Å; E1207-R1211 IonicContact OE1-CZ 2.88Å; E1207-R1211 IonicContact OE1-NE 3.21Å; E1207-R1211 PolarHBondContact OE1-NE 3.26Å; E1207-R1211 IonicContact OE1-NH2 3.6Å; E1207-R1211 PolarHBondContact OE1-NH2 3.25Å
1208	T	85	Confident	86.9	Confident	74 Å²	74	75.1 Å²	75.1	45%	0.454	38%	0.381	S	S	.	.	H	α-helix	trans	-69.5	-44.6	175.2	-58	0	0	0	0	111.4	K1204 Q1205 L1206 R1211 I1212	K1204-T1208 WeakPolarHBondContact O-CB 3.24Å; K1204-T1208 PolarHBondContact O-N 2.93Å; K1204-T1208 VanDerWaalsContact O-N 3.08Å; K1204-T1208 PolarHBondContact O-OG1 3.3Å; Q1205-T1208 PolarHBondContact O-N 2.68Å; Q1205-T1208 VanDerWaalsContact O-N 3.13Å; L1206-T1208 VanDerWaalsContact C-N 3.31Å; T1208-R1211 PolarHBondContact O-N 2.64Å; T1208-I1212 HydrophobicContact CG2-CD1 3.99Å; T1208-I1212 VanDerWaalsContact O-CG1 3.32Å; T1208-I1212 WeakPolarHBondContact O-CG1 3.01Å; T1208-I1212 PolarHBondContact O-N 2.81Å
1209	T	87.2	Confident	87.3	Confident	72 Å²	72	76.9 Å²	76.9	44%	0.442	39%	0.392	S	S	.	.	H	α-helix	trans	-66.6	-38.4	175.8	52.2	0	0	0	0	112.2	Q1205 L1206 R1211 I1212 L1213	Q1205-T1209 PolarHBondContact O-N 2.99Å; Q1205-T1209 PolarHBondContact O-OG1 3.42Å; L1206-T1209 WeakPolarHBondContact CA-OG1 3.06Å; L1206-T1209 PolarHBondContact O-OG1 3.29Å; L1206-T1209 VanDerWaalsContact O-OG1 3.11Å; T1209-R1211 PolarHBondContact O-N 3.17Å; T1209-I1212 PolarHBondContact O-N 2.92Å; T1209-L1213 WeakPolarHBondContact O-CB 3.38Å; T1209-L1213 VanDerWaalsContact O-CG 3.31Å; T1209-L1213 WeakPolarHBondContact O-CG 3.34Å; T1209-L1213 PolarHBondContact O-N 3.04Å
1210	L	86.3	Confident	87.6	Confident	75 Å²	75	81.4 Å²	81.4	39%	0.393	42%	0.416	S	S	.	.	H	α-helix	trans	-61.7	-40.1	172.5	-77.3	168.8	0	0	0	112.7	L1206 L1213 S1214	L1206-L1210 HydrophobicContact CD1-CD1 4.34Å; L1206-L1210 HydrophobicContact CD1-CG 4.39Å; L1206-L1210 HydrophobicContact CG-CD1 4.07Å; L1206-L1210 VanDerWaalsContact O-CB 3.31Å; L1206-L1210 WeakPolarHBondContact O-CB 3.31Å; L1206-L1210 VanDerWaalsContact O-CG 3.26Å; L1206-L1210 WeakPolarHBondContact O-CG 3.38Å; L1206-L1210 PolarHBondContact O-N 2.88Å; L1210-L1213 PolarHBondContact O-N 3.08Å; L1210-S1214 PolarHBondContact O-N 3.14Å; L1210-S1214 PolarHBondContact O-OG 3.29Å
1211	R	86	Confident	87.8	Confident	143 Å²	143	83.2 Å²	83.2	54%	0.54	43%	0.434	S	S	.	.	H	α-helix	trans	-67	-38.7	174.4	-73.3	171.8	-173.8	-151.7	7.1	112.3	E1207 T1208 T1209 S1214 I1215	E1207-R1211 WeakPolarHBondContact O-CB 3.31Å; E1207-R1211 WeakPolarHBondContact O-CG 3.49Å; E1207-R1211 PolarHBondContact O-N 3.01Å; E1207-R1211 IonicContact OE1-CZ 2.88Å; E1207-R1211 IonicContact OE1-NE 3.21Å; E1207-R1211 PolarHBondContact OE1-NE 3.26Å; E1207-R1211 IonicContact OE1-NH2 3.6Å; E1207-R1211 PolarHBondContact OE1-NH2 3.25Å; T1208-R1211 PolarHBondContact O-N 2.64Å; T1209-R1211 PolarHBondContact O-N 3.17Å; R1211-S1214 PolarHBondContact O-OG 2.75Å; R1211-S1214 VanDerWaalsContact O-OG 3.11Å; R1211-I1215 WeakPolarHBondContact O-CD1 3.33Å; R1211-I1215 VanDerWaalsContact O-CG1 3.24Å; R1211-I1215 WeakPolarHBondContact O-CG1 3.48Å; R1211-I1215 PolarHBondContact O-N 3.46Å; R1211-I1215 VanDerWaalsContact O-N 3.1Å
1212	I	87.4	Confident	88	Confident	90 Å²	90	85.8 Å²	85.8	46%	0.462	45%	0.451	S	S	.	.	H	α-helix	trans	-65.6	-45.3	174.9	-69.5	164.9	0	0	0	110.2	T1208 T1209 S1214 I1215 I1216	T1208-I1212 HydrophobicContact CG2-CD1 3.99Å; T1208-I1212 VanDerWaalsContact O-CG1 3.32Å; T1208-I1212 WeakPolarHBondContact O-CG1 3.01Å; T1208-I1212 PolarHBondContact O-N 2.81Å; T1209-I1212 PolarHBondContact O-N 2.92Å; I1212-S1214 PolarHBondContact O-N 2.91Å; I1212-I1215 PolarHBondContact O-N 3.37Å; I1212-I1216 HydrophobicContact CG2-CD1 3.76Å; I1212-I1216 VanDerWaalsContact O-CG1 3.31Å; I1212-I1216 WeakPolarHBondContact O-CG1 3.34Å; I1212-I1216 PolarHBondContact O-N 3.44Å
1213	L	89.5	Confident	88.1	Confident	90 Å²	90	86.7 Å²	86.7	47%	0.471	46%	0.461	S	S	.	.	H	α-helix	trans	-62.8	-40.9	177.4	-74.6	168.1	0	0	0	112.3	T1209 L1210 I1216 F1217	T1209-L1213 WeakPolarHBondContact O-CB 3.38Å; T1209-L1213 VanDerWaalsContact O-CG 3.31Å; T1209-L1213 WeakPolarHBondContact O-CG 3.34Å; T1209-L1213 PolarHBondContact O-N 3.04Å; L1210-L1213 PolarHBondContact O-N 3.08Å; L1213-I1216 PolarHBondContact O-N 2.87Å; L1213-F1217 WeakPolarHBondContact O-CB 3.45Å; L1213-F1217 WeakPolarHBondContact O-CD2 3.49Å; L1213-F1217 PolarHBondContact O-N 2.89Å
1214	S	88.9	Confident	88.2	Confident	73 Å²	73	88 Å²	88	51%	0.51	48%	0.475	S	S	.	.	H	α-helix	trans	-69.1	-33.5	177.2	67.4	0	0	0	0	112.9	L1210 R1211 I1212 G1218	L1210-S1214 PolarHBondContact O-N 3.14Å; L1210-S1214 PolarHBondContact O-OG 3.29Å; R1211-S1214 PolarHBondContact O-OG 2.75Å; R1211-S1214 VanDerWaalsContact O-OG 3.11Å; I1212-S1214 PolarHBondContact O-N 2.91Å; S1214-G1218 PolarHBondContact O-N 3.5Å
1215	I	90	Very high	88.3	Confident	108 Å²	108	91.7 Å²	91.7	55%	0.554	49%	0.491	S	S	*	.	H	α-helix	trans	-65.1	-43.3	170.4	-69.5	165.1	0	0	0	110.9	R1211 I1212 G1218 L1219	R1211-I1215 WeakPolarHBondContact O-CD1 3.33Å; R1211-I1215 VanDerWaalsContact O-CG1 3.24Å; R1211-I1215 WeakPolarHBondContact O-CG1 3.48Å; R1211-I1215 PolarHBondContact O-N 3.46Å; R1211-I1215 VanDerWaalsContact O-N 3.1Å; I1212-I1215 PolarHBondContact O-N 3.37Å; I1215-G1218 PolarHBondContact O-N 3.32Å; I1215-L1219 HydrophobicContact CG2-CD1 4.16Å; I1215-L1219 WeakPolarHBondContact O-CB 3.28Å; I1215-L1219 WeakPolarHBondContact O-CG 3.49Å; I1215-L1219 PolarHBondContact O-N 3.49Å
1216	I	90.4	Very high	88.4	Confident	80 Å²	80	89 Å²	89	41%	0.41	48%	0.48	S	S	.	.	H	α-helix	trans	-64.3	-46.2	176.9	-69.1	166.3	0	0	0	111.1	I1212 L1213 G1218 L1219 L1220	I1212-I1216 HydrophobicContact CG2-CD1 3.76Å; I1212-I1216 VanDerWaalsContact O-CG1 3.31Å; I1212-I1216 WeakPolarHBondContact O-CG1 3.34Å; I1212-I1216 PolarHBondContact O-N 3.44Å; L1213-I1216 PolarHBondContact O-N 2.87Å; I1216-G1218 PolarHBondContact O-N 3.32Å; I1216-L1219 PolarHBondContact O-N 3.29Å; I1216-L1220 HydrophobicContact CG2-CD1 4.06Å; I1216-L1220 WeakPolarHBondContact O-CG 3.49Å; I1216-L1220 PolarHBondContact O-N 3.26Å
1217	F	90.1	Very high	88.5	Confident	138 Å²	138	86.4 Å²	86.4	61%	0.605	48%	0.475	S	S	*	.	H	α-helix	trans	-62.7	-40.6	175	-95.3	-80.7	0	0	0	112.1	L1213 L1219 L1220 V1221	L1213-F1217 WeakPolarHBondContact O-CB 3.45Å; L1213-F1217 WeakPolarHBondContact O-CD2 3.49Å; L1213-F1217 PolarHBondContact O-N 2.89Å; F1217-L1219 PolarHBondContact O-N 2.85Å; F1217-L1220 PolarHBondContact O-N 3.18Å; F1217-V1221 WeakPolarHBondContact O-CG2 3.47Å; F1217-V1221 PolarHBondContact O-N 3.29Å
1218	G	90.5	Very high	88.5	Confident	34 Å²	34	88 Å²	88	35%	0.351	49%	0.492	S	S	.	.	H	α-helix	trans	-59.6	-44.8	173.8	0	0	0	0	0	112.5	S1214 I1215 I1216 V1221 C1222	S1214-G1218 PolarHBondContact O-N 3.5Å; I1215-G1218 PolarHBondContact O-N 3.32Å; I1216-G1218 PolarHBondContact O-N 3.32Å; G1218-V1221 PolarHBondContact O-N 3.28Å; G1218-C1222 WeakPolarHBondContact O-CB 3.5Å; G1218-C1222 PolarHBondContact O-N 3.11Å; G1218-C1222 PolarHBondContact O-SG 3.48Å
1219	L	91.9	Very high	88.4	Confident	102 Å²	102	88.5 Å²	88.5	53%	0.534	49%	0.49	S	S	.	.	H	α-helix	trans	-62.6	-43.9	173.9	-78.6	166.2	0	0	0	112.2	I1215 I1216 F1217 V1221 C1222 I1223	I1215-L1219 HydrophobicContact CG2-CD1 4.16Å; I1215-L1219 WeakPolarHBondContact O-CB 3.28Å; I1215-L1219 WeakPolarHBondContact O-CG 3.49Å; I1215-L1219 PolarHBondContact O-N 3.49Å; I1216-L1219 PolarHBondContact O-N 3.29Å; F1217-L1219 PolarHBondContact O-N 2.85Å; L1219-V1221 PolarHBondContact O-N 2.89Å; L1219-C1222 PolarHBondContact O-N 3.33Å; L1219-I1223 WeakPolarHBondContact O-CB 3.5Å; L1219-I1223 WeakPolarHBondContact O-CD1 3.46Å; L1219-I1223 VanDerWaalsContact O-CG1 3.24Å; L1219-I1223 WeakPolarHBondContact O-CG1 3.24Å; L1219-I1223 PolarHBondContact O-N 2.92Å
1220	L	91.8	Very high	88.2	Confident	96 Å²	96	92.6 Å²	92.6	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-62.7	-40.4	176.8	-72.6	170.8	0	0	0	112.2	I1216 F1217 I1223 A1224	I1216-L1220 HydrophobicContact CG2-CD1 4.06Å; I1216-L1220 WeakPolarHBondContact O-CG 3.49Å; I1216-L1220 PolarHBondContact O-N 3.26Å; F1217-L1220 PolarHBondContact O-N 3.18Å; L1220-I1223 PolarHBondContact O-N 3.33Å; L1220-A1224 WeakPolarHBondContact O-CB 3.35Å; L1220-A1224 PolarHBondContact O-N 3.16Å
1221	V	90.3	Very high	87.9	Confident	97 Å²	97	93.5 Å²	93.5	59%	0.588	51%	0.511	S	S	*	.	H	α-helix	trans	-65.6	-41	174	170.4	0	0	0	0	111.2	F1217 G1218 L1219 A1224 F1225	F1217-V1221 WeakPolarHBondContact O-CG2 3.47Å; F1217-V1221 PolarHBondContact O-N 3.29Å; G1218-V1221 PolarHBondContact O-N 3.28Å; L1219-V1221 PolarHBondContact O-N 2.89Å; V1221-A1224 PolarHBondContact O-N 2.93Å; V1221-F1225 WeakPolarHBondContact O-CB 3.36Å; V1221-F1225 PolarHBondContact O-N 3.25Å
1222	C	89.8	Confident	87.5	Confident	70 Å²	70	90.4 Å²	90.4	47%	0.473	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-41.8	174.5	-67.7	0	0	0	0	112.2	G1218 L1219 F1225 I1226	G1218-C1222 WeakPolarHBondContact O-CB 3.5Å; G1218-C1222 PolarHBondContact O-N 3.11Å; G1218-C1222 PolarHBondContact O-SG 3.48Å; L1219-C1222 PolarHBondContact O-N 3.33Å; C1222-F1225 PolarHBondContact O-N 3.38Å; C1222-I1226 VanDerWaalsContact O-CG1 3.28Å; C1222-I1226 WeakPolarHBondContact O-CG1 3.28Å; C1222-I1226 PolarHBondContact O-N 3.01Å
1223	I	89.4	Confident	87	Confident	108 Å²	108	89.7 Å²	89.7	55%	0.554	51%	0.512	S	S	*	.	H	α-helix	trans	-64.4	-42.9	175.9	-69.8	163.1	0	0	0	110.6	L1219 L1220 F1225 I1226 G1227	L1219-I1223 WeakPolarHBondContact O-CB 3.5Å; L1219-I1223 WeakPolarHBondContact O-CD1 3.46Å; L1219-I1223 VanDerWaalsContact O-CG1 3.24Å; L1219-I1223 WeakPolarHBondContact O-CG1 3.24Å; L1219-I1223 PolarHBondContact O-N 2.92Å; L1220-I1223 PolarHBondContact O-N 3.33Å; I1223-F1225 VanDerWaalsContact C-N 3.35Å; I1223-F1225 PolarHBondContact O-N 3.41Å; I1223-I1226 PolarHBondContact O-N 2.88Å; I1223-G1227 PolarHBondContact O-N 3.48Å
1224	A	87.1	Confident	86.4	Confident	64 Å²	64	93.2 Å²	93.2	53%	0.529	52%	0.519	S	S	.	.	H	α-helix	trans	-62.9	-39.6	175.2	0	0	0	0	0	112.2	L1220 V1221 G1227 A1228	L1220-A1224 WeakPolarHBondContact O-CB 3.35Å; L1220-A1224 PolarHBondContact O-N 3.16Å; V1221-A1224 PolarHBondContact O-N 2.93Å; A1224-G1227 PolarHBondContact O-N 2.89Å; A1224-A1228 WeakPolarHBondContact O-CB 3.36Å; A1224-A1228 PolarHBondContact O-N 2.98Å
1225	F	88.6	Confident	85.4	Confident	140 Å²	140	92.6 Å²	92.6	61%	0.614	52%	0.519	S	S	*	.	H	α-helix	trans	-66.3	-43.8	176.1	-173.6	-106	0	0	0	112.3	V1221 C1222 I1223 G1227 A1228 I1229	V1221-F1225 WeakPolarHBondContact O-CB 3.36Å; V1221-F1225 PolarHBondContact O-N 3.25Å; C1222-F1225 PolarHBondContact O-N 3.38Å; I1223-F1225 VanDerWaalsContact C-N 3.35Å; I1223-F1225 PolarHBondContact O-N 3.41Å; F1225-G1227 VanDerWaalsContact C-N 3.33Å; F1225-G1227 PolarHBondContact O-N 3.45Å; F1225-A1228 PolarHBondContact O-N 3.11Å; F1225-I1229 HydrophobicContact CD1-CD1 3.89Å; F1225-I1229 HydrophobicContact CE1-CD1 3.6Å; F1225-I1229 HydrophobicContact CZ-CD1 4.15Å; F1225-I1229 WeakPolarHBondContact O-CG1 3.42Å; F1225-I1229 PolarHBondContact O-N 3.37Å
1226	I	88.3	Confident	84.4	Confident	109 Å²	109	94 Å²	94	56%	0.559	53%	0.527	S	S	*	.	H	α-helix	trans	-62.6	-41.1	173.2	-67.9	163.8	0	0	0	110.6	C1222 I1223 I1229 F1230	C1222-I1226 VanDerWaalsContact O-CG1 3.28Å; C1222-I1226 WeakPolarHBondContact O-CG1 3.28Å; C1222-I1226 PolarHBondContact O-N 3.01Å; I1223-I1226 PolarHBondContact O-N 2.88Å; I1226-I1229 PolarHBondContact O-N 2.84Å; I1226-F1230 PolarHBondContact O-N 3.4Å
1227	G	85.5	Confident	83.1	Confident	33 Å²	33	96.4 Å²	96.4	34%	0.34	54%	0.541	S	S	.	.	H	α-helix	trans	-61	-43.6	174.2	0	0	0	0	0	112.8	I1223 A1224 F1225 F1230 V1231	I1223-G1227 PolarHBondContact O-N 3.48Å; A1224-G1227 PolarHBondContact O-N 2.89Å; F1225-G1227 VanDerWaalsContact C-N 3.33Å; F1225-G1227 PolarHBondContact O-N 3.45Å; G1227-F1230 PolarHBondContact O-N 3.37Å; G1227-V1231 WeakPolarHBondContact O-CG2 3.37Å; G1227-V1231 PolarHBondContact O-N 2.87Å
1228	A	83.6	Confident	81.5	Confident	53 Å²	53	94.3 Å²	94.3	44%	0.438	54%	0.535	S	S	.	.	H	α-helix	trans	-62.2	-42.5	175.6	0	0	0	0	0	112	A1224 F1225 F1230 V1231 C1232	A1224-A1228 WeakPolarHBondContact O-CB 3.36Å; A1224-A1228 PolarHBondContact O-N 2.98Å; F1225-A1228 PolarHBondContact O-N 3.11Å; A1228-F1230 VanDerWaalsContact C-N 3.35Å; A1228-F1230 PolarHBondContact O-N 2.85Å; A1228-V1231 PolarHBondContact O-N 3.48Å; A1228-C1232 PolarHBondContact O-N 2.9Å; A1228-C1232 PolarHBondContact O-SG 3.41Å; A1228-C1232 VanDerWaalsContact O-SG 3.4Å
1229	I	83.9	Confident	79.6	Confident	84 Å²	84	97.7 Å²	97.7	43%	0.431	55%	0.554	S	S	.	*	H	α-helix	trans	-59.3	-46.3	172.3	-69	167.1	0	0	0	110.5	F1225 I1226 V1231 C1232 C1233	F1225-I1229 HydrophobicContact CD1-CD1 3.89Å; F1225-I1229 HydrophobicContact CE1-CD1 3.6Å; F1225-I1229 HydrophobicContact CZ-CD1 4.15Å; F1225-I1229 WeakPolarHBondContact O-CG1 3.42Å; F1225-I1229 PolarHBondContact O-N 3.37Å; I1226-I1229 PolarHBondContact O-N 2.84Å; I1229-V1231 VanDerWaalsContact C-N 3.34Å; I1229-V1231 PolarHBondContact O-N 3.29Å; I1229-C1232 PolarHBondContact O-N 3.01Å; I1229-C1233 PolarHBondContact O-N 3.49Å; I1229-C1233 PolarHBondContact O-SG 3.36Å; I1229-C1233 VanDerWaalsContact O-SG 3.36Å
1230	F	82.5	Confident	77.2	Confident	157 Å²	157	101.7 Å²	101.7	69%	0.689	57%	0.567	S	S	*	*	H	α-helix	trans	-63	-39.3	-179.7	-149.5	-83.1	0	0	0	112.3	I1226 G1227 A1228 C1233 W1234	I1226-F1230 PolarHBondContact O-N 3.4Å; G1227-F1230 PolarHBondContact O-N 3.37Å; A1228-F1230 VanDerWaalsContact C-N 3.35Å; A1228-F1230 PolarHBondContact O-N 2.85Å; F1230-C1233 PolarHBondContact O-N 2.94Å; F1230-W1234 WeakPolarHBondContact O-CB 3.45Å; F1230-W1234 PolarHBondContact O-N 3.34Å
1231	V	81.2	Confident	74.8	Confident	95 Å²	95	106.8 Å²	106.8	58%	0.576	59%	0.585	S	S	*	*	H	α-helix	trans	-65.9	-41.8	173.9	170.8	0	0	0	0	111.5	G1227 A1228 I1229 W1234 A1235	G1227-V1231 WeakPolarHBondContact O-CG2 3.37Å; G1227-V1231 PolarHBondContact O-N 2.87Å; A1228-V1231 PolarHBondContact O-N 3.48Å; I1229-V1231 VanDerWaalsContact C-N 3.34Å; I1229-V1231 PolarHBondContact O-N 3.29Å; V1231-W1234 PolarHBondContact O-N 3.21Å; V1231-A1235 WeakPolarHBondContact O-CB 3.45Å; V1231-A1235 PolarHBondContact O-N 2.9Å
1232	C	77.5	Confident	72.4	Confident	78 Å²	78	111.3 Å²	111.3	53%	0.527	60%	0.6	S	S	.	*	H	α-helix	trans	-61.1	-45.3	173.2	-73.3	0	0	0	0	112	A1228 I1229 W1234 A1235 L1236	A1228-C1232 PolarHBondContact O-N 2.9Å; A1228-C1232 PolarHBondContact O-SG 3.41Å; A1228-C1232 VanDerWaalsContact O-SG 3.4Å; I1229-C1232 PolarHBondContact O-N 3.01Å; C1232-W1234 VanDerWaalsContact C-N 3.34Å; C1232-W1234 PolarHBondContact O-N 3.42Å; C1232-A1235 PolarHBondContact O-N 2.92Å; C1232-L1236 VanDerWaalsContact O-CG 3.32Å; C1232-L1236 WeakPolarHBondContact O-CG 3.39Å; C1232-L1236 PolarHBondContact O-N 3.42Å
1233	C	76.8	Confident	70.3	Confident	75 Å²	75	113.7 Å²	113.7	51%	0.507	62%	0.615	S	S	.	*	H	α-helix	trans	-62.8	-38.8	175.8	-68.5	0	0	0	0	112.4	I1229 F1230 N1237	I1229-C1233 PolarHBondContact O-N 3.49Å; I1229-C1233 PolarHBondContact O-SG 3.36Å; I1229-C1233 VanDerWaalsContact O-SG 3.36Å; F1230-C1233 PolarHBondContact O-N 2.94Å; C1233-N1237 WeakPolarHBondContact O-CB 3.4Å; C1233-N1237 PolarHBondContact O-N 3.36Å; C1233-N1237 VanDerWaalsContact O-N 3.09Å
1234	W	75.3	Confident	68.2	Low	163 Å²	163	113.9 Å²	113.9	62%	0.617	62%	0.623	S	S	*	*	H	α-helix	trans	-67.1	-42.7	176.2	-175.1	73.6	0	0	0	112.5	F1230 V1231 C1232 L1236 N1237 N1238	F1230-W1234 WeakPolarHBondContact O-CB 3.45Å; F1230-W1234 PolarHBondContact O-N 3.34Å; V1231-W1234 PolarHBondContact O-N 3.21Å; C1232-W1234 VanDerWaalsContact C-N 3.34Å; C1232-W1234 PolarHBondContact O-N 3.42Å; W1234-L1236 PolarHBondContact O-N 2.94Å; W1234-N1237 PolarHBondContact O-N 2.91Å; W1234-N1238 VanDerWaalsContact CE2-ND2 3.3Å; W1234-N1238 WeakPolarHBondContact CZ2-ND2 3.46Å; W1234-N1238 PolarHBondContact O-N 3.19Å
1235	A	69.8	Low	66.2	Low	60 Å²	60	115.6 Å²	115.6	50%	0.496	63%	0.629	S	S	.	*	H	α-helix	trans	-61.3	-42	175.6	0	0	0	0	0	112.2	V1231 C1232	V1231-A1235 WeakPolarHBondContact O-CB 3.45Å; V1231-A1235 PolarHBondContact O-N 2.9Å; C1232-A1235 PolarHBondContact O-N 2.92Å
1236	L	68.4	Low	63.8	Low	138 Å²	138	116.3 Å²	116.3	72%	0.723	64%	0.638	S	S	*	*	H	α-helix	trans	-65.9	-36.3	176	-70.6	168.8	0	0	0	112.6	C1232 W1234 S1239	C1232-L1236 VanDerWaalsContact O-CG 3.32Å; C1232-L1236 WeakPolarHBondContact O-CG 3.39Å; C1232-L1236 PolarHBondContact O-N 3.42Å; W1234-L1236 PolarHBondContact O-N 2.94Å; L1236-S1239 PolarHBondContact O-N 3.4Å
1237	N	62.5	Low	61.4	Low	131 Å²	131	114.2 Å²	114.2	70%	0.701	64%	0.637	S	S	*	*	H	α-helix	trans	-71.9	-27.9	-179.1	-163.2	29.8	0	0	0	113.4	C1233 W1234 S1239	C1233-N1237 WeakPolarHBondContact O-CB 3.4Å; C1233-N1237 PolarHBondContact O-N 3.36Å; C1233-N1237 VanDerWaalsContact O-N 3.09Å; W1234-N1237 PolarHBondContact O-N 2.91Å; N1237-S1239 VanDerWaalsContact C-N 3.27Å; N1237-S1239 PolarHBondContact O-N 3.49Å
1238	N	56.6	Low	59	Low	93 Å²	93	123 Å²	123	50%	0.497	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.6	-4.9	179.2	-77.3	-28.5	0	0	0	114.3	W1234 K1240	W1234-N1238 VanDerWaalsContact CE2-ND2 3.3Å; W1234-N1238 WeakPolarHBondContact CZ2-ND2 3.46Å; W1234-N1238 PolarHBondContact O-N 3.19Å; N1238-K1240 PolarHBondContact O-N 3.22Å
1239	S	51.7	Low	56.8	Low	105 Å²	105	132 Å²	132	73%	0.734	69%	0.685	S	S	*	*			trans	-77.7	38.6	-176.5	-150.9	0	0	0	0	114.4	L1236 N1237	L1236-S1239 PolarHBondContact O-N 3.4Å; N1237-S1239 VanDerWaalsContact C-N 3.27Å; N1237-S1239 PolarHBondContact O-N 3.49Å
1240	K	39.6	Very low	54.5	Low	186 Å²	186	134.4 Å²	134.4	81%	0.809	70%	0.704	S	S	*	*			trans	-146.8	76.4	177.1	-71.7	-167.8	179.4	179.1	0	113.1	N1238	N1238-K1240 PolarHBondContact O-N 3.22Å
1241	K	41.4	Very low	52.3	Low	204 Å²	204	130.6 Å²	130.6	89%	0.887	71%	0.708	S	S	*	*			trans	-172.3	114.6	154.7	-102.9	149.3	-171.8	178.4	0	110.5
1242	E	41.3	Very low	50.3	Low	191 Å²	191	132.7 Å²	132.7	89%	0.893	72%	0.721	S	S	*	*			trans	-87.2	149.3	170.4	-60.8	-179.2	148.6	0	0	110.9
1243	P	44.2	Very low	48.7	Very low	121 Å²	121	134.6 Å²	134.6	79%	0.786	73%	0.732	S	S	*	*			trans	-136.3	136.4	134.4	35.5	-24	0	0	0	113.2
1244	P	46.2	Very low	46.7	Very low	112 Å²	112	138.5 Å²	138.5	73%	0.727	75%	0.747	S	S	*	*			trans	-102.4	-176.4	178.4	44.3	-38.7	0	0	0	111.9
1245	P	44.7	Very low	44.9	Very low	100 Å²	100	137.6 Å²	137.6	65%	0.649	75%	0.754	S	S	*	*				-138.9	-168.4	-79.4	39.7	-20.3	0	0	0	114.7
1246	N	38.7	Very low	43.3	Very low	154 Å²	154	139.6 Å²	139.6	82%	0.824	76%	0.764	S	S	*	*			trans	82.5	149.4	158	-60.8	-19.7	0	0	0	120.3
1247	A	37.3	Very low	41.7	Very low	65 Å²	65	143.2 Å²	143.2	54%	0.537	77%	0.774	S	S	.	*			cis	-170.3	160.2	-24.6	0	0	0	0	0	113.1
1248	Y	36.1	Very low	40.5	Very low	219 Å²	219	140.7 Å²	140.7	86%	0.859	77%	0.772	S	S	*	*			trans	68.3	154.5	164.5	-54.9	-62	0	0	0	117.9
1249	R	37.3	Very low	39.5	Very low	241 Å²	241	143.1 Å²	143.1	91%	0.909	79%	0.785	S	S	*	*			cis	-140.9	179.2	15	-147.8	175	-170.3	178.8	4	113.2
1250	T	36	Very low	38.9	Very low	135 Å²	135	146.4 Å²	146.4	83%	0.828	79%	0.788	S	S	*	*			trans	-102.2	158.4	-159.6	50.9	0	0	0	0	116.9
1251	G	36.3	Very low	38.9	Very low	76 Å²	76	143.6 Å²	143.6	78%	0.784	79%	0.787	S	S	*	*			trans	-177.3	115.9	157.7	0	0	0	0	0	115.7
1252	V	38.5	Very low	38.6	Very low	140 Å²	140	145.8 Å²	145.8	85%	0.848	79%	0.79	S	S	*	*			trans	-153.5	125.4	175.7	170.4	0	0	0	0	108.1
1253	P	44.7	Very low	38	Very low	118 Å²	118	140.3 Å²	140.3	77%	0.766	78%	0.784	S	S	*	*				-153.7	172.2	106.6	38.3	-19	0	0	0	114.3
1254	L	33.9	Very low	37.4	Very low	156 Å²	156	139 Å²	139	82%	0.817	78%	0.784	S	S	*	*			cis	-164.2	178.9	-15	-112.8	171.5	0	0	0	110.6
1255	L	37.4	Very low	36.7	Very low	145 Å²	145	141.4 Å²	141.4	76%	0.759	79%	0.789	S	S	*	*			trans	90	112.4	157.6	-111.6	74.2	0	0	0	121.4
1256	S	35.7	Very low	36.8	Very low	102 Å²	102	141.3 Å²	141.3	71%	0.713	79%	0.788	S	S	*	*			trans	23.2	143.9	141.2	63.6	0	0	0	0	121.4
1257	K	34.8	Very low	36.5	Very low	213 Å²	213	142.7 Å²	142.7	93%	0.926	79%	0.787	S	S	*	*			cis	-154.8	177.3	38.4	-152.8	174.2	179.9	-178.2	0	111.9
1258	A	37.5	Very low	36.5	Very low	79 Å²	79	144.2 Å²	144.2	65%	0.653	79%	0.794	S	S	*	*			trans	-82.7	160.4	-160.7	0	0	0	0	0	117.8
1259	D	36.9	Very low	36.3	Very low	144 Å²	144	142 Å²	142	77%	0.77	79%	0.791	S	S	*	*			trans	49.4	115.3	153.9	-49.9	-14.7	0	0	0	118.7
1260	E	38.7	Very low	36	Very low	173 Å²	173	141.9 Å²	141.9	81%	0.808	79%	0.791	S	S	*	*				70.8	128.6	65.9	-67.7	-141.6	156.1	0	0	114.2
1261	T	39.9	Very low	36.2	Very low	127 Å²	127	140.6 Å²	140.6	78%	0.779	78%	0.784	S	S	*	*			cis	-144	167.6	-6.1	9.8	0	0	0	0	111.5
1262	R	34.1	Very low	36	Very low	251 Å²	251	148.5 Å²	148.5	95%	0.947	79%	0.791	S	S	*	*			trans	-95	165.3	-176.7	-63.3	173	175.4	155	-3.7	112.7
1263	G	28.3	Very low	35.7	Very low	75 Å²	75	147.1 Å²	147.1	77%	0.773	79%	0.787	S	S	*	*			trans	-138.4	152.7	157.7	0	0	0	0	0	112.7
1264	A	32.5	Very low	35.4	Very low	94 Å²	94	149.3 Å²	149.3	78%	0.777	79%	0.792	S	S	*	*			trans	174.6	113.5	153.1	0	0	0	0	0	113.7
1265	I	31.1	Very low	35.7	Very low	163 Å²	163	147.7 Å²	147.7	84%	0.836	79%	0.791	S	S	*	*			trans	2.9	173.3	131.9	30.9	171.2	0	0	0	121.3
1266	P	46.1	Very low	35.6	Very low	97 Å²	97	145.4 Å²	145.4	63%	0.63	79%	0.794	S	S	*	*			cis	-130	-168.1	-0.3	15.5	14.4	0	0	0	113.9
1267	F	33.9	Very low	35.5	Very low	184 Å²	184	149 Å²	149	81%	0.807	80%	0.804	S	S	*	*			cis	-170.8	132.3	46.4	-121.9	-73.2	0	0	0	116.3
1268	S	35.9	Very low	35.3	Very low	97 Å²	97	148 Å²	148	68%	0.678	80%	0.802	S	S	*	*			trans	47.7	157.2	148.9	76.9	0	0	0	0	124.2
1269	Q	32.9	Very low	35.2	Very low	173 Å²	173	149.9 Å²	149.9	81%	0.808	81%	0.808	S	S	*	*			cis	-144.5	140.3	20.2	-57.8	179.8	11.3	0	0	115.4
1270	R	31.9	Very low	35.3	Very low	238 Å²	238	148.6 Å²	148.6	90%	0.898	81%	0.807	S	S	*	*			trans	31.5	161	137.1	-76.3	-177.1	-179.3	-177.3	1.6	124.3
1271	P	39.6	Very low	35.3	Very low	107 Å²	107	146.3 Å²	146.3	70%	0.695	81%	0.808	S	S	*	*			cis	-144	158.3	-16.8	35.8	-15.1	0	0	0	119.7
1272	R	31	Very low	35	Very low	242 Å²	242	150.3 Å²	150.3	91%	0.913	82%	0.815	S	S	*	*			trans	55.1	124.7	146.2	-72.3	-178.8	170.3	177.4	-3.9	123.3
1273	S	33.6	Very low	35	Very low	111 Å²	111	149.2 Å²	149.2	78%	0.776	81%	0.812	S	S	*	*				179	120.2	93.3	62.8	0	0	0	0	117.2
1274	N	37.4	Very low	35.2	Very low	164 Å²	164	153.2 Å²	153.2	88%	0.877	82%	0.816	S	S	*	*			trans	55.3	161.4	146.6	-78.2	30.6	0	0	0	124.6
1275	P	40	Very low	35.2	Very low	122 Å²	122	155.3 Å²	155.3	79%	0.792	82%	0.819	S	S	*	*			trans	-131.2	178.2	-148.1	45.3	-31	0	0	0	118.2
1276	A	35.1	Very low	35.4	Very low	98 Å²	98	153.6 Å²	153.6	81%	0.81	82%	0.819	S	S	*	*			trans	-152.9	173.4	161.7	0	0	0	0	0	112.6
1277	L	34.5	Very low	34.8	Very low	177 Å²	177	158.6 Å²	158.6	93%	0.927	83%	0.834	S	S	*	*			trans	-82.1	162	-162	-78.3	61.4	0	0	0	117.2
1278	E	31.1	Very low	34.6	Very low	191 Å²	191	153.3 Å²	153.3	89%	0.893	83%	0.831	S	S	*	*			trans	-139.1	144.4	157.6	-105.4	-176.1	162.7	0	0	110.8
1279	P	35.4	Very low	34.3	Very low	119 Å²	119	153.2 Å²	153.2	77%	0.773	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-102.5	165.3	178.1	38.7	-34.2	0	0	0	114.7
1280	P	37.7	Very low	34.2	Very low	117 Å²	117	152.4 Å²	152.4	76%	0.76	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-86.9	159.8	-175.3	34.9	-36.5	0	0	0	115.3
1281	P	38.8	Very low	34.2	Very low	126 Å²	126	148 Å²	148	82%	0.818	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-88.1	161.8	-175.1	35.5	-36.9	0	0	0	115.4
1282	F	34.5	Very low	33.7	Very low	211 Å²	211	151.8 Å²	151.8	93%	0.925	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-91.3	170.1	178	-103.7	-103	0	0	0	114
1283	Y	34.4	Very low	34.2	Very low	227 Å²	227	145.6 Å²	145.6	89%	0.89	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-88.9	138.6	178	-84.4	-99.8	0	0	0	113.5
1284	D	31.7	Very low	34.1	Very low	160 Å²	160	146.2 Å²	146.2	86%	0.856	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-84.9	145	163.8	-81.9	-46.5	0	0	0	112.4
1285	T	32.4	Very low	33.6	Very low	138 Å²	138	145.1 Å²	145.1	85%	0.847	83%	0.829	S	S	*	*			trans	-147.2	132.7	158.6	49.3	0	0	0	0	111.9
1286	P	36.3	Very low	33.2	Very low	127 Å²	127	148.7 Å²	148.7	83%	0.825	84%	0.836	S	S	*	*			trans	-110.1	158.8	168.5	36.4	-28.7	0	0	0	113.9
1287	Q	32.2	Very low	32.9	Very low	202 Å²	202	149.2 Å²	149.2	94%	0.944	83%	0.828	S	S	*	*			trans	-77.6	160.4	176.1	-56.3	156.9	14	0	0	110.5
1288	G	29.3	Very low	32.7	Very low	73 Å²	73	151.2 Å²	151.2	75%	0.753	83%	0.83	S	S	*	*			cis	170.2	-163.8	0.2	0	0	0	0	0	111.4
1289	A	31.1	Very low	32.6	Very low	95 Å²	95	152.7 Å²	152.7	79%	0.785	83%	0.827	S	S	*	*			trans	76.8	97.4	167.6	0	0	0	0	0	121.2
1290	N	29.5	Very low	32.1	Very low	156 Å²	156	156.8 Å²	156.8	83%	0.834	83%	0.827	S	S	*	*				49.9	113.6	128	-55.9	-9	0	0	0	122.1
1291	T	32.6	Very low	31.9	Very low	145 Å²	145	157.1 Å²	157.1	89%	0.89	83%	0.83	S	S	*	*				-163.2	151.3	124.4	23.7	0	0	0	0	111.2
1292	H	29	Very low	31.3	Very low	187 Å²	187	157.5 Å²	157.5	87%	0.866	82%	0.82	S	S	*	*			trans	-139.1	166.9	176	-83.3	-42.4	0	0	0	108.1
1293	P	40.5	Very low	31.1	Very low	111 Å²	111	154.1 Å²	154.1	72%	0.721	81%	0.812	S	S	*	*			cis	-130.9	-173.7	-25.3	36.2	-18.5	0	0	0	112.1
1294	V	31.9	Very low	30.9	Very low	124 Å²	124	151.4 Å²	151.4	75%	0.752	81%	0.812	S	S	*	*				176.8	128.1	122.8	150.5	0	0	0	0	112.1
1295	N	27.9	Very low	30.6	Very low	142 Å²	142	154.2 Å²	154.2	76%	0.759	81%	0.812	S	S	*	*			trans	7.1	123.4	160	-53.5	-23.1	0	0	0	121.2
1296	Q	32	Very low	30.5	Very low	197 Å²	197	152.4 Å²	152.4	92%	0.921	81%	0.805	S	S	*	*				-149.8	103.8	120.9	-117.2	174.9	48.1	0	0	114.2
1297	V	27.6	Very low	30.3	Very low	109 Å²	109	153.3 Å²	153.3	66%	0.661	80%	0.803	S	S	*	*			trans	12	119.8	142.9	-174	0	0	0	0	118.7	R1299	V1297-R1299 HydrophobicContact CG1-CG 4.34Å
1298	F	30.5	Very low	30.2	Very low	218 Å²	218	150 Å²	150	96%	0.956	80%	0.797	S	S	*	*			trans	-137.1	147	131.6	-110.6	-85.3	0	0	0	109.8
1299	R	29.3	Very low	30.4	Very low	222 Å²	222	150 Å²	150	84%	0.838	79%	0.79	S	S	*	*			trans	-106.4	157.7	-170.1	-68.7	-179.2	173.5	174.6	-2.7	112.9	V1297	V1297-R1299 HydrophobicContact CG1-CG 4.34Å
1300	R	25.4	Very low	30.4	Very low	205 Å²	205	153.6 Å²	153.6	77%	0.774	80%	0.796	S	S	*	*			trans	-60.1	164.4	154.3	-60.7	-174.9	-173.8	179.3	5.3	110.7
1301	P	32.2	Very low	30.5	Very low	125 Å²	125	149.7 Å²	149.7	81%	0.812	79%	0.792	S	S	*	*				-122.6	153	127.3	35.3	-30.1	0	0	0	112.9
1302	Q	26.9	Very low	30.4	Very low	133 Å²	133	147.8 Å²	147.8	62%	0.621	79%	0.785	S	S	*	*			trans	-133.5	170.2	160.4	-77.7	-177.8	-101.9	0	0	107.5
1303	D	30	Very low	30.6	Very low	141 Å²	141	145 Å²	145	75%	0.754	78%	0.781	S	S	*	*			trans	71.6	141.4	176.5	-42.4	-36.7	0	0	0	113.9
1304	L	29.8	Very low	30.1	Very low	169 Å²	169	145 Å²	145	89%	0.885	78%	0.783	S	S	*	*			cis	-132	171.5	26.6	-100.2	88.3	0	0	0	115.1
1305	Y	26.6	Very low	29.8	Very low	220 Å²	220	144.9 Å²	144.9	86%	0.863	79%	0.789	S	S	*	*			trans	-84.1	153.9	172.1	-82	-109.6	0	0	0	114
1306	S	31	Very low	29.8	Very low	100 Å²	100	143.2 Å²	143.2	70%	0.699	79%	0.788	S	S	*	*				176.3	141	111.5	52.8	0	0	0	0	114.1
1307	N	30.8	Very low	29.5	Very low	146 Å²	146	142.9 Å²	142.9	78%	0.781	79%	0.786	S	S	*	*			trans	44.8	134.9	141.6	-57	-9.9	0	0	0	119.6
1308	T	31.1	Very low	29.5	Very low	133 Å²	133	144.4 Å²	144.4	82%	0.816	79%	0.791	S	S	*	*			cis	-169.9	178.6	15.9	1.1	0	0	0	0	108.2
1309	A	32.3	Very low	29.2	Very low	73 Å²	73	138.8 Å²	138.8	60%	0.603	78%	0.778	S	S	*	*			cis	-162.1	169.9	2.4	0	0	0	0	0	110.9
1310	N	31.6	Very low	29.2	Very low	170 Å²	170	134.3 Å²	134.3	91%	0.909	78%	0.778	S	S	*	*			trans	59.4	118.3	149.7	-63.2	-6.8	0	0	0	121.7
1311	G	30.9	Very low	29.3	Very low	73 Å²	73	134.9 Å²	134.9	75%	0.753	78%	0.78	S	S	*	*			trans	-178.7	24.3	170.1	0	0	0	0	0	118.7
1312	S	31.8	Very low	29	Very low	105 Å²	105	140.5 Å²	140.5	73%	0.734	79%	0.785	S	S	*	*			trans	34.6	123	165.1	64.1	0	0	0	0	120.2
1313	T	31.9	Very low	29	Very low	129 Å²	129	141.4 Å²	141.4	79%	0.791	79%	0.793	S	S	*	*				-169.9	151.6	73.2	27	0	0	0	0	114.5
1314	S	31.1	Very low	28.8	Very low	110 Å²	110	137.1 Å²	137.1	77%	0.769	77%	0.774	S	S	*	*			trans	30.7	120.3	156	58.6	0	0	0	0	121.6
1315	S	24.4	Very low	28.8	Very low	123 Å²	123	133.3 Å²	133.3	86%	0.86	76%	0.759	S	S	*	*			trans	-69.4	158.7	162.8	49.1	0	0	0	0	114.2
1316	S	29.6	Very low	29.1	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	74%	0.742	S	S	*	*			trans	-147.7	141.1	144.2	69.5	0	0	0	0	110.8
1317	H	24.5	Very low	29.1	Very low	189 Å²	189	127.8 Å²	127.8	88%	0.875	74%	0.743	S	S	*	*			trans	-75.6	133.9	163.5	-78.8	-93	0	0	0	108.8
1318	N	27.5	Very low	29	Very low	142 Å²	142	122.3 Å²	122.3	76%	0.759	72%	0.722	S	S	*	*			trans	-152.3	114.6	151.8	-101.9	-51.6	0	0	0	111.1
1319	S	25.2	Very low	29.2	Very low	100 Å²	100	120.5 Å²	120.5	70%	0.699	71%	0.705	S	S	*	*			trans	-66	142.2	166.1	-44.4	0	0	0	0	109.5	R1321	S1319-R1321 PolarHBondContact O-N 3.37Å
1320	P	29.2	Very low	28.9	Very low	127 Å²	127	123.6 Å²	123.6	83%	0.825	71%	0.705	S	S	*	*			trans	-63	110.4	169.1	26.7	-32.7	0	0	0	108.7	R1322	P1320-R1322 PolarHBondContact O-N 3.26Å
1321	R	26.8	Very low	28.6	Very low	218 Å²	218	121.6 Å²	121.6	82%	0.823	70%	0.699	S	S	*	*			trans	-61.7	126.4	175.9	-72.1	-175.6	177.9	-174.5	-0.8	108.6	S1319 I1323	S1319-R1321 PolarHBondContact O-N 3.37Å; R1321-I1323 VanDerWaalsContact C-N 3.33Å; R1321-I1323 PolarHBondContact O-N 3.09Å
1322	R	25.6	Very low	28.3	Very low	243 Å²	243	124.3 Å²	124.3	92%	0.917	70%	0.695	S	S	*	*			trans	-64.5	94.1	165.7	-66.5	-178.7	-176.6	175.2	0.1	108.3	P1320 S1324	P1320-R1322 PolarHBondContact O-N 3.26Å; R1322-S1324 PolarHBondContact O-N 3.47Å
1323	I	26.4	Very low	28	Very low	152 Å²	152	128.3 Å²	128.3	78%	0.779	72%	0.715	S	S	*	*			trans	-78.8	100.1	170.9	-63.2	176.1	0	0	0	106.7	R1321 P1325	R1321-I1323 VanDerWaalsContact C-N 3.33Å; R1321-I1323 PolarHBondContact O-N 3.09Å; I1323-P1325 WeakPolarHBondContact O-CD 3.41Å
1324	S	25.6	Very low	27.8	Very low	51 Å²	51	128.3 Å²	128.3	36%	0.357	71%	0.711	S	S	.	*			trans	-69.9	126.4	174.6	178.5	0	0	0	0	110.2	R1322 V1326	R1322-S1324 PolarHBondContact O-N 3.47Å; S1324-V1326 PolarHBondContact O-N 3.04Å; S1324-V1326 PolarHBondContact OG-N 3.38Å; S1324-V1326 VanDerWaalsContact OG-N 3.11Å
1325	P	30.8	Very low	27.6	Very low	89 Å²	89	129.3 Å²	129.3	58%	0.578	71%	0.708	S	S	*	*	S	Bend	trans	-81.6	29	166.6	36.2	-35	0	0	0	112.1	I1323	I1323-P1325 WeakPolarHBondContact O-CD 3.41Å
1326	V	32.4	Very low	27.8	Very low	83 Å²	83	129.6 Å²	129.6	50%	0.503	70%	0.7	S	S	.	*			trans	-122.9	72.4	170	-169.7	0	0	0	0	108.2	T1029 S1324 G1328	T1029-V1326 HydrophobicContact CG2-CG1 4.45Å; S1324-V1326 PolarHBondContact O-N 3.04Å; S1324-V1326 PolarHBondContact OG-N 3.38Å; S1324-V1326 VanDerWaalsContact OG-N 3.11Å; V1326-G1328 PolarHBondContact O-N 2.9Å
1327	V	31.1	Very low	27.7	Very low	120 Å²	120	130.9 Å²	130.9	73%	0.727	70%	0.697	S	S	*	*			trans	-87.1	100.6	168	178.8	0	0	0	0	107.5
1328	G	29.9	Very low	27.9	Very low	32 Å²	32	127.3 Å²	127.3	33%	0.33	69%	0.686	S	S	.	*			trans	-61.9	138.4	167.2	0	0	0	0	0	110.2	D1031 V1326 K1330	D1031-G1328 WeakPolarHBondContact OD2-CA 3.38Å; V1326-G1328 PolarHBondContact O-N 2.9Å; G1328-K1330 PolarHBondContact O-N 3.31Å
1329	M	34.3	Very low	27.9	Very low	94 Å²	94	126.3 Å²	126.3	46%	0.463	68%	0.681	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.5	20	-166.8	-61.2	-177.6	168.3	0	0	114.6	G344 D1031	G344-M1329 WeakPolarHBondContact CA-SD 3.4Å; D1031-M1329 HydrophobicContact CB-CB 4.04Å; D1031-M1329 HydrophobicContact CB-CG 4Å; D1031-M1329 HydrophobicContact CB-SD 4Å; D1031-M1329 PolarHBondContact OD2-N 3.46Å
1330	K	26	Very low	28.1	Very low	139 Å²	139	128.2 Å²	128.2	60%	0.604	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	6.2	-166.7	-77.8	177	179.7	162.4	0	116.3	T1030 D1031 G1328	T1030-K1330 PolarHBondContact OG1-NZ 2.89Å; D1031-K1330 WeakPolarHBondContact OD1-CE 3.07Å; D1031-K1330 IonicContact OD1-NZ 3.65Å; D1031-K1330 PolarHBondContact OD1-NZ 3.49Å; G1328-K1330 PolarHBondContact O-N 3.31Å
1331	T	25.9	Very low	28	Very low	128 Å²	128	128.3 Å²	128.3	79%	0.785	67%	0.669	S	S	*	*	S	Bend	trans	-139.1	64.3	173.9	49.5	0	0	0	0	112.2
1332	L	24.2	Very low	28.1	Very low	129 Å²	129	120.8 Å²	120.8	68%	0.675	66%	0.656	S	S	*	*			trans	-161.8	62.9	157.8	-102	168.2	0	0	0	108.4	V422	V422-L1332 HydrophobicContact CG1-CB 3.94Å; V422-L1332 HydrophobicContact CG1-CD2 3.73Å; V422-L1332 HydrophobicContact CG1-CG 4.33Å; V422-L1332 WeakPolarHBondContact CG1-O 3.32Å
1333	V	25.3	Very low	28.4	Very low	190 Å²	190	109.7 Å²	109.7	100%	1.152	63%	0.632	S	S	*	*			trans	-136.5	0	174.4	179.9	0	0	0	0	107.7

Retrieved 1,333 of 1,333 residues in 546.4 ms (Link to these results)

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