A0A077YXQ0_TRITR Loading...

Laminin G 3 and Notch and Sushi and Peptidase M43 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YXQ0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,801 aa.

						>A0A077YXQ0_TRITR|A0A077YXQ0
MQVAVIRVALDSSAFRFQQVGSVRLLPMSFSIVYLLLAFVEAGPYPDCALRDATKTHENYHPHGRYPRSDVLNNGTRFAFYFDGTERTVRLNDDLNNVWSTESEKLFPRTQFTLAAWIRPEGGQGDPSVIIELADGCSEDGPPFVWRLGIGTKTGGRERGAHYYFQMKTEMSSRSSVLWSHYGYSAQRWTHLAVTYNEKTLKLFVNGALVAASDNQVGPLFSKIKAACKHLLLGGPMPGRYEEGQLMNYRGMVADVKLWNVTKGAPFIRRIAGDASLSLGTEEIFLWAKFDSIEKWKLIVRRVEKLFLERAVSLGAHAPTLIASDLSSFFDSYVLTVPPCGQTICDHPDIVKSYNVHWELRHPKVLRYKVVNLLDGKTGQATVTKEQIDQQHMSLNAAFSKYNISWQLTVVEMSVGRLRLKKVVFGCDSSKIGNKQCDIECLHPITGSDNGDCGNAAILSKCLPRMLHNGRCDQECNYPDFSWDHGDCCNETLTDVTVSCIDPNSPYRAYVSIEEYKRTLNVSNENSLSVAFVEWSNGDMIGLSTFPWEKHAFSVHGGVVVQPGRFGTDGHRNNLVHELGHALGLWHVHHGVSEMSCDDPCRETKSSMLTGDLCEDTNPTPKNVECRDPIHVFYDRDKGSESLLCEDVRKPYTNTPFNNYMSYSDGECANHFTAQQVARMHCYVDLKYAGWLAGPSMPRDCIPTAPRVIRKTNSSITFVWLPPLGHHSCKPDGIICQDCGCDQNGRFFQYASRVLAHSGNKSSSYWSPEQALGPPDADPCEASAKAWLPDSQNCDQPGSCVIAVGFDVVVVPAELRLWISWNAADGLKQLLLYYADGSVQLVSPVTALCDMPFSLLLDTDKSLLRVEIETQTPFVSVDAIQVISRPGQNPCASCNLLDYQIVREPRFSNALYRRTSLTVFTDTDVKPDKVYVYRIGARTRGAMKNINSCLSPPLVFSLGWPFCGDGIVDKYRVVVNIQTLIASECVKYFRQREACDDGNVLDYDGCSMNCETEEGFKCKGSPSLCFSVSGIKATHSTDPFSLIDYSVAYSAPEFNDQWAVSARSNDDVISARCNASLAVGKPRVPLEFEQAVVATSVFVYLASDGYVGMYSEYQSLRVELIAIDGKAYEIRGSQTKVASCAKSPIEYTVWHDLSKPFFYSKAVRVHVGSERISIAAVRLRSKRGFDPVVVDLCAKSDMFYSVAVNSCVSNRCSSTECEHLRVDNADVHCSGSNSGDSCLVTCNSGYHTMSDAFVQSKGYDRMAKVICLNGRWNPRRPVCQPIDCGLPEISRAKLSCPDGTKFAAKCYFHCVYPAVMKGTISERFVPPLLSLFVLGVNNNIVCGEHGVWSVPEAYCQLSCSPLLERELNGRAVNKMCRINFFTLDPHSVSFPVGTKCRIVCKAGYHVEGYPVSKRLFKRSCDSTGTWRGPRCVKIKCPEPNVVYRGLYNCTRGFEVGSQCSFHCPGKTRESICLSDGTWSSSNPCVLPKDLCPMPIAPPHILVSCPSKRHVGNACQVTCDAQGYDTVQEHIVTTDRSFKMQVMQRVDQITCSLQRRWEPNVASLVCVKKCTQDFIKDGWCDFQNNRGYCGWDGGDCCASTAAEGKVKLMFPSLCASHLCRCLDPYAIENRNEIVRQGLVRRADVDVASFQLARTNENSNGSLRFGGGKKLNRSSDRTSSLQGRILLAERFDQISDKSLRHSTLPAYLWTANWLEQFVNLSSELHSCIIRSLHPNGLDCNNCTCSLADSARHWYNVDRLTRLMKQSSRNMLTRQYMPHMPSPHLRAAIVKALRKLTKNFHVKS
					

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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	33.9	Very low	30.5	Very low	239 Å²	239	152.4 Å²	152.4	100%	1.177	83%	0.832	S	S	*	*				0	132.2	0	-85	172.5	160.7	0	0	108.7
2	Q	30.2	Very low	30.2	Very low	186 Å²	186	148.7 Å²	148.7	87%	0.869	83%	0.825	S	S	*	*			trans	35.5	110.4	161.4	-66.3	169.8	-18.8	0	0	118.4
3	V	28.6	Very low	30.3	Very low	136 Å²	136	147.3 Å²	147.3	82%	0.824	83%	0.832	S	S	*	*			cis	79.2	108	47.3	-176.5	0	0	0	0	114.8
4	A	31	Very low	30.3	Very low	90 Å²	90	143.5 Å²	143.5	74%	0.744	83%	0.828	S	S	*	*			trans	39.2	143.9	144.2	0	0	0	0	0	123.7
5	V	35.9	Very low	30.4	Very low	123 Å²	123	148.5 Å²	148.5	75%	0.745	84%	0.837	S	S	*	*			trans	-177.7	103.3	141.8	148.5	0	0	0	0	106.8
6	I	34.3	Very low	30.2	Very low	147 Å²	147	153.6 Å²	153.6	75%	0.754	84%	0.839	S	S	*	*				55.8	147.1	101.8	-27	131.9	0	0	0	114.8
7	R	26.5	Very low	30.3	Very low	221 Å²	221	155.5 Å²	155.5	83%	0.834	84%	0.837	S	S	*	*			cis	172.4	166.5	-16	-177.6	-175	-152.4	-173.1	7	106
8	V	29.4	Very low	30.4	Very low	138 Å²	138	155.7 Å²	155.7	84%	0.836	83%	0.832	S	S	*	*			trans	76	137.9	172.8	-161.5	0	0	0	0	112.4
9	A	28.9	Very low	30.3	Very low	91 Å²	91	157.2 Å²	157.2	75%	0.752	83%	0.834	S	S	*	*			cis	-135	155.2	25.2	0	0	0	0	0	115.4
10	L	29.2	Very low	30.5	Very low	161 Å²	161	156.8 Å²	156.8	84%	0.843	84%	0.837	S	S	*	*			trans	-86.9	154.4	153.9	-78.2	154.9	0	0	0	109
11	D	27.8	Very low	30.6	Very low	144 Å²	144	152.5 Å²	152.5	77%	0.77	83%	0.83	S	S	*	*			trans	69.6	135.4	151.3	-109.7	-51	0	0	0	123.2
12	S	27.2	Very low	30.4	Very low	108 Å²	108	146.8 Å²	146.8	76%	0.755	81%	0.814	S	S	*	*			trans	58.8	107.3	143.7	-68.4	0	0	0	0	121.9
13	S	31.6	Very low	30.5	Very low	131 Å²	131	145.1 Å²	145.1	92%	0.916	82%	0.816	S	S	*	*			trans	-153.9	131.5	140.5	57.1	0	0	0	0	112.3
14	A	29.7	Very low	30.6	Very low	94 Å²	94	149 Å²	149	78%	0.777	82%	0.816	S	S	*	*			trans	-106.2	159.2	-175.4	0	0	0	0	0	112.6
15	F	32.1	Very low	30.4	Very low	218 Å²	218	151.5 Å²	151.5	96%	0.956	82%	0.816	S	S	*	*			trans	-136.9	137.6	161.6	-106.5	-91.5	0	0	0	111
16	R	27.3	Very low	30.2	Very low	230 Å²	230	152.4 Å²	152.4	87%	0.868	82%	0.816	S	S	*	*			trans	-89.7	161.8	-171.6	-67.1	171	164.3	171.9	-6.1	112.9
17	F	31.7	Very low	30.2	Very low	186 Å²	186	150.8 Å²	150.8	82%	0.816	82%	0.815	S	S	*	*				-167.1	132.2	113.6	-112.9	-81.9	0	0	0	113.2
18	Q	32.7	Very low	30.5	Very low	160 Å²	160	148.8 Å²	148.8	75%	0.748	82%	0.817	S	S	*	*			trans	47.7	118.2	164.5	-74.5	161.3	-46.1	0	0	120.8
19	Q	28.2	Very low	30.5	Very low	184 Å²	184	146.8 Å²	146.8	86%	0.86	81%	0.81	S	S	*	*				48.1	120.2	78	-92.5	-179.3	-28.2	0	0	113.1
20	V	34.2	Very low	30.7	Very low	149 Å²	149	151.9 Å²	151.9	90%	0.903	82%	0.815	S	S	*	*				-150.4	156.1	51.3	175.2	0	0	0	0	108.7
21	G	33.3	Very low	30.7	Very low	66 Å²	66	149.1 Å²	149.1	68%	0.68	81%	0.809	S	S	*	*			cis	-172.6	165	-0.5	0	0	0	0	0	109.8
22	S	28.9	Very low	31.1	Very low	120 Å²	120	149.5 Å²	149.5	84%	0.839	81%	0.81	S	S	*	*			trans	-91.2	140.3	-169.1	-51	0	0	0	0	114.4
23	V	33	Very low	31.4	Very low	151 Å²	151	149.8 Å²	149.8	92%	0.915	81%	0.807	S	S	*	*			trans	-129.6	138.4	144.3	-177.5	0	0	0	0	108.1
24	R	29	Very low	31.5	Very low	216 Å²	216	153.4 Å²	153.4	82%	0.815	80%	0.802	S	S	*	*			trans	-124.7	164.4	-171.5	-125.2	-174.8	-170.9	-173.1	3	108
25	L	28.3	Very low	31.5	Very low	143 Å²	143	155.7 Å²	155.7	75%	0.749	80%	0.8	S	S	*	*			trans	70.5	126	158.6	-65.9	157.2	0	0	0	114.6
26	L	31.3	Very low	31.5	Very low	142 Å²	142	152 Å²	152	74%	0.743	79%	0.79	S	S	*	*			cis	-161.4	157.8	35.4	-90.1	120.9	0	0	0	111.4
27	P	33.5	Very low	31.9	Very low	114 Å²	114	148.3 Å²	148.3	74%	0.74	79%	0.786	S	S	*	*			trans	-93.1	124	159.9	34.2	-25.9	0	0	0	110.8
28	M	32.5	Very low	31.8	Very low	178 Å²	178	143 Å²	143	88%	0.877	78%	0.777	S	S	*	*			trans	-150.1	135.9	154.6	-90.9	-143.7	-85.5	0	0	112.4
29	S	29.3	Very low	31.6	Very low	97 Å²	97	145 Å²	145	68%	0.678	78%	0.783	S	S	*	*			trans	-67.9	143.5	173.5	48	0	0	0	0	113.2
30	F	33.4	Very low	31.6	Very low	198 Å²	198	142.1 Å²	142.1	87%	0.868	78%	0.778	S	S	*	*			trans	-139.9	123.9	145.1	-104.3	-82.6	0	0	0	110.4
31	S	30.3	Very low	31.3	Very low	102 Å²	102	143.5 Å²	143.5	71%	0.713	78%	0.775	S	S	*	*			trans	-88.3	-163.4	171	-55	0	0	0	0	110.5
32	I	34.7	Very low	31.1	Very low	153 Å²	153	145.5 Å²	145.5	79%	0.785	79%	0.785	S	S	*	*			trans	82.8	117.7	179.4	-40.4	161	0	0	0	108.7
33	V	34.3	Very low	31	Very low	114 Å²	114	143.5 Å²	143.5	69%	0.691	78%	0.783	S	S	*	*				-155.9	141.9	59	172.5	0	0	0	0	111.8
34	Y	34.5	Very low	31.1	Very low	207 Å²	207	141.9 Å²	141.9	81%	0.812	78%	0.776	S	S	*	*			trans	41.4	114.2	167.2	-66.5	-63.8	0	0	0	120
35	L	28.6	Very low	31.2	Very low	141 Å²	141	142.2 Å²	142.2	74%	0.738	78%	0.778	S	S	*	*			cis	75.2	104.7	32.4	-146.6	174.9	0	0	0	113.7
36	L	33.4	Very low	31.6	Very low	142 Å²	142	140.6 Å²	140.6	74%	0.743	78%	0.776	S	S	*	*			trans	174.3	115.6	134.8	-90.2	164.4	0	0	0	112.5
37	L	34.2	Very low	31.5	Very low	151 Å²	151	141.4 Å²	141.4	79%	0.791	78%	0.782	S	S	*	*			trans	30	119.1	135.4	-54.4	173.5	0	0	0	119
38	A	30.5	Very low	31.1	Very low	75 Å²	75	142.4 Å²	142.4	62%	0.62	79%	0.79	S	S	*	*				92.1	120.8	52.9	0	0	0	0	0	115
39	F	27.9	Very low	30.8	Very low	201 Å²	201	138 Å²	138	88%	0.882	78%	0.781	S	S	*	*			trans	64.8	123.5	171.7	-61.2	-83.2	0	0	0	119.4
40	V	29.1	Very low	30.7	Very low	125 Å²	125	141 Å²	141	76%	0.758	79%	0.79	S	S	*	*				161.3	122.4	120.7	161.1	0	0	0	0	111.4
41	E	27.9	Very low	30.3	Very low	178 Å²	178	142.7 Å²	142.7	83%	0.832	79%	0.79	S	S	*	*			trans	37.7	121	146.7	-56.8	175.4	155	0	0	123.8
42	A	27.8	Very low	30.1	Very low	108 Å²	108	145.3 Å²	145.3	89%	0.893	80%	0.796	S	S	*	*			trans	41.2	109.7	131.5	0	0	0	0	0	121.9
43	G	28.5	Very low	29.7	Very low	78 Å²	78	142.8 Å²	142.8	80%	0.804	80%	0.798	S	S	*	*			trans	-176.9	148.1	159.2	0	0	0	0	0	112.8
44	P	34.1	Very low	29.2	Very low	117 Å²	117	143.8 Å²	143.8	76%	0.76	81%	0.805	S	S	*	*			trans	-118.5	136.7	-161.3	37.4	-24.4	0	0	0	117.4
45	Y	30.9	Very low	28.8	Very low	222 Å²	222	142.7 Å²	142.7	87%	0.871	80%	0.804	S	S	*	*			trans	55.5	171.8	160.1	-77.8	-73.1	0	0	0	118.5
46	P	37.3	Very low	28.7	Very low	109 Å²	109	142 Å²	142	71%	0.708	81%	0.806	S	S	*	*			cis	-122.5	157.6	-46.3	34.7	-22	0	0	0	112
47	D	28.2	Very low	28.3	Very low	159 Å²	159	141.2 Å²	141.2	85%	0.85	80%	0.798	S	S	*	*			trans	-163.7	133.2	145.4	-126.8	-23	0	0	0	112.2
48	C	25	Very low	28	Very low	135 Å²	135	138.5 Å²	138.5	91%	0.912	78%	0.781	S	S	*	*			trans	-154.5	109	174.5	-93.6	0	0	0	0	110.3
49	A	27.1	Very low	27.8	Very low	85 Å²	85	138 Å²	138	70%	0.702	77%	0.768	S	S	*	*			trans	-137.6	137.1	173.6	0	0	0	0	0	111.4
50	L	26.8	Very low	27.9	Very low	162 Å²	162	131.8 Å²	131.8	85%	0.848	74%	0.739	S	S	*	*			trans	65.8	101.1	157.8	-64	154.7	0	0	0	118.3
51	R	25.2	Very low	27.9	Very low	233 Å²	233	127.8 Å²	127.8	88%	0.879	71%	0.712	S	S	*	*				-173.8	160.3	96.3	-97.7	169.9	-174.3	-163.8	-0.2	114
52	D	27.1	Very low	28	Very low	156 Å²	156	119.7 Å²	119.7	83%	0.834	68%	0.675	S	S	*	*			trans	65.2	105.6	173.4	-60.5	-12.9	0	0	0	118.7
53	A	24.7	Very low	28.1	Very low	100 Å²	100	118.2 Å²	118.2	83%	0.826	65%	0.649	S	S	*	*			trans	-84.5	120.1	175	0	0	0	0	0	111.3
54	T	24.7	Very low	28	Very low	136 Å²	136	116.8 Å²	116.8	83%	0.834	64%	0.635	S	S	*	*			trans	-174.8	143.8	147.2	19.3	0	0	0	0	109
55	K	25.6	Very low	27.8	Very low	184 Å²	184	115.3 Å²	115.3	80%	0.8	61%	0.614	S	S	*	*			trans	68.6	80.8	-176.6	-52.5	-179.5	178.9	-176.5	0	115.2	H57	K55-H57 PolarHBondContact O-N 3.41Å
56	T	26.5	Very low	27.8	Very low	126 Å²	126	111.5 Å²	111.5	77%	0.773	60%	0.599	S	S	*	*			trans	-67.9	123.1	158.1	43	0	0	0	0	109.8	E58	T56-E58 PolarHBondContact O-N 3.03Å
57	H	26.5	Very low	27.2	Very low	126 Å²	126	107.7 Å²	107.7	58%	0.583	57%	0.574	S	S	*	*			trans	-60.9	123.4	176.4	-102.2	-114.5	0	0	0	111.9	K55 N59	K55-H57 PolarHBondContact O-N 3.41Å; H57-N59 PolarHBondContact ND1-OD1 3.12Å; H57-N59 PolarHBondContact O-N 3.25Å
58	E	26.9	Very low	27.2	Very low	94 Å²	94	103.1 Å²	103.1	44%	0.439	55%	0.545	S	S	.	.			trans	-90.1	68.3	169.8	-71.1	-176.4	159.7	0	0	110.2	T56 Y60 R518 H556	T56-E58 PolarHBondContact O-N 3.03Å; E58-Y60 PolarHBondContact O-N 3.36Å; E58-R518 IonicContact OE1-NE 3.94Å; E58-H556 IonicContact OE1-CD2 2.65Å; E58-H556 IonicContact OE1-CE1 3.86Å; E58-H556 IonicContact OE1-NE2 3.76Å; E58-H556 PolarHBondContact OE1-NE2 2.91Å; E58-H556 IonicContact OE2-NE2 3.25Å
59	N	27.2	Very low	27.4	Very low	64 Å²	64	97.5 Å²	97.5	34%	0.342	51%	0.508	S	S	.	.			trans	-77.4	103.1	175.4	-75.7	31.6	0	0	0	110.1	H57 D807	H57-N59 PolarHBondContact ND1-OD1 3.12Å; H57-N59 PolarHBondContact O-N 3.25Å; N59-D807 PolarHBondContact ND2-OD2 3.35Å
60	Y	29.9	Very low	27.4	Very low	71 Å²	71	94.5 Å²	94.5	28%	0.278	48%	0.48	S	S	.	.			trans	-143.2	131	168.7	-107.3	-65.2	0	0	0	115.8	E58 E525 F553	E58-Y60 PolarHBondContact O-N 3.36Å; Y60-E525 WeakPolarHBondContact OH-CB 3.21Å; Y60-E525 WeakPolarHBondContact OH-CG 3.49Å; Y60-E525 PolarHBondContact OH-OE1 3.35Å; Y60-F553 HydrophobicContact CD1-CB 3.54Å; Y60-F553 HydrophobicContact CE1-CB 3.24Å; Y60-F553 HydrophobicContact CE1-CG 4.27Å; Y60-F553 WeakPolarHBondContact CE2-O 3.25Å; Y60-F553 HydrophobicContact CG-CB 4.39Å
61	H	27.3	Very low	27.5	Very low	40 Å²	40	90 Å²	90	19%	0.185	46%	0.459	C	S	.	.			trans	-121.5	106.5	179.3	-73.5	-34.4	0	0	0	112	Y750	H61-Y750 PolarHBondContact CE1-O 3.28Å
62	P	31.7	Very low	27.8	Very low	8 Å²	8	83.7 Å²	83.7	5%	0.052	44%	0.442	C	S	.	.			trans	-71.5	128.8	168.2	-6	3.3	0	0	0	114.6	K550 P774	P62-K550 VanDerWaalsContact CG-CA 3.47Å; P62-K550 WeakPolarHBondContact CG-O 3.17Å; P62-P774 HydrophobicContact CB-CG 3.92Å; P62-P774 VanDerWaalsContact CD-CD 3.46Å; P62-P774 HydrophobicContact CG-CG 3.79Å; P62-P774 WeakPolarHBondContact O-CG 3.37Å
63	H	28.3	Very low	27.9	Very low	77 Å²	77	83.8 Å²	83.8	36%	0.356	44%	0.442	S	S	.	.			trans	-67.9	153.8	174.9	-57.2	-86.7	0	0	0	112.6	K687 H727	H63-K687 HydrophobicContact CB-CD 4.38Å; H63-K687 VanDerWaalsContact O-CE 3.28Å; H63-K687 WeakPolarHBondContact O-CE 3.25Å; H63-K687 PolarHBondContact O-NZ 3.43Å; H63-H727 PolarHBondContact CE1-O 2.81Å; H63-H727 PolarHBondContact ND1-O 2.81Å
64	G	27.2	Very low	28.3	Very low	48 Å²	48	86.8 Å²	86.8	50%	0.495	45%	0.445	S	S	.	.			trans	146.4	68.8	168	0	0	0	0	0	115.1
65	R	30.5	Very low	29.1	Very low	87 Å²	87	82.6 Å²	82.6	33%	0.328	43%	0.429	S	S	.	.			trans	-166.1	120.3	164.9	-112.1	156.9	-109.2	-121.2	-0.2	112.4	P775 W818	R65-P775 VanDerWaalsContact CZ-CG 3.49Å; R65-P775 PolarHBondContact NH2-O 3.3Å; R65-W818 VanDerWaalsContact NH1-NE1 3.11Å
66	Y	29.3	Very low	30.5	Very low	141 Å²	141	80.2 Å²	80.2	55%	0.553	43%	0.43	S	S	*	.			trans	65	117.3	167.5	-49.5	-75.1	0	0	0	120.5
67	P	26.2	Very low	32.5	Very low	29 Å²	29	77.3 Å²	77.3	19%	0.188	41%	0.405	C	S	.	.			trans	-103.7	111	147.1	33.4	-30.1	0	0	0	112.3	V334 L721 P722	P67-V334 HydrophobicContact CG-CG1 3.77Å; P67-V334 WeakPolarHBondContact O-CG1 3.29Å; P67-L721 HydrophobicContact CG-CD2 4.46Å; P67-P722 HydrophobicContact CB-CG 3.81Å
68	R	28.5	Very low	35	Very low	63 Å²	63	74.8 Å²	74.8	24%	0.238	39%	0.392	C	S	.	.			trans	-167.3	120.5	153.4	-102.8	-175.7	-154.9	-158	17.9	106.7	S332 Y333 V334	R68-S332 VanDerWaalsContact CD-OG 3.3Å; R68-S332 WeakPolarHBondContact CD-OG 3.37Å; R68-S332 VanDerWaalsContact CZ-O 3.24Å; R68-S332 PolarHBondContact NH1-O 3.09Å; R68-S332 PolarHBondContact NH1-OG 3.01Å; R68-Y333 VanDerWaalsContact CG-C 3.43Å; R68-Y333 VanDerWaalsContact CG-O 3.27Å; R68-Y333 WeakPolarHBondContact CG-O 3.18Å; R68-V334 HydrophobicContact CB-CG2 4.27Å; R68-V334 HydrophobicContact CG-CB 4.33Å; R68-V334 HydrophobicContact CG-CG2 3.64Å; R68-V334 VanDerWaalsContact CZ-N 3.33Å; R68-V334 VanDerWaalsContact NH2-N 3.14Å
69	S	28.6	Very low	37.7	Very low	18 Å²	18	70.3 Å²	70.3	13%	0.126	37%	0.371	C	S	.	.				101	124.9	70.5	-168.1	0	0	0	0	109.8	S332	S69-S332 WeakPolarHBondContact OG-CA 3.46Å; S69-S332 WeakPolarHBondContact OG-CB 3.24Å
70	D	26.7	Very low	40.7	Very low	21 Å²	21	67.3 Å²	67.3	11%	0.112	36%	0.355	C	S	.	.			trans	-59.7	142.8	-164.4	-59.5	-71.4	0	0	0	116.1	L72 S328 L917	D70-L72 HydrophobicContact CB-CB 4.17Å; D70-L72 HydrophobicContact CB-CD1 4.36Å; D70-L72 HydrophobicContact CB-CG 4.46Å; D70-S328 VanDerWaalsContact O-CB 3.27Å; D70-S328 WeakPolarHBondContact O-CB 3.26Å; D70-S328 PolarHBondContact O-OG 2.75Å; D70-L917 HydrophobicContact CB-CD2 3.87Å; D70-L917 WeakPolarHBondContact OD2-CA 3.29Å; D70-L917 WeakPolarHBondContact OD2-CD2 3.46Å
71	V	29.3	Very low	43.3	Very low	69 Å²	69	65 Å²	65	42%	0.418	35%	0.346	S	S	.	.			trans	-98.2	62	158.6	-170.9	0	0	0	0	108.7	N73 D325 N744	V71-N73 VanDerWaalsContact C-N 3.29Å; V71-N73 PolarHBondContact O-N 2.99Å; V71-D325 HydrophobicContact CG1-CB 4.12Å; V71-D325 HydrophobicContact CG2-CB 3.83Å; V71-N744 PolarHBondContact N-OD1 3.33Å
72	L	30.3	Very low	46.2	Very low	100 Å²	100	63.2 Å²	63.2	52%	0.524	34%	0.338	S	S	.	.			trans	-84.6	72.8	176.5	-105.2	165.5	0	0	0	112	D70 N74 L917	D70-L72 HydrophobicContact CB-CB 4.17Å; D70-L72 HydrophobicContact CB-CD1 4.36Å; D70-L72 HydrophobicContact CB-CG 4.46Å; L72-N74 VanDerWaalsContact C-N 3.29Å; L72-N74 PolarHBondContact O-N 3.16Å; L72-L917 HydrophobicContact CB-CD2 4.01Å; L72-L917 HydrophobicContact CD1-CD2 3.47Å; L72-L917 VanDerWaalsContact CD1-CD2 3.47Å; L72-L917 HydrophobicContact CG-CD2 4.36Å
73	N	30.7	Very low	48.4	Very low	157 Å²	157	64.2 Å²	64.2	84%	0.84	34%	0.343	S	S	*	.	S	Bend	trans	33.9	39.8	141.2	-142	11.2	0	0	0	119.7	V71	V71-N73 VanDerWaalsContact C-N 3.29Å; V71-N73 PolarHBondContact O-N 2.99Å
74	N	31.9	Very low	50.8	Low	163 Å²	163	61.2 Å²	61.2	87%	0.872	33%	0.332	S	S	*	.			trans	-136.3	77.4	177.9	-107.1	-21.9	0	0	0	111.3	L72	L72-N74 VanDerWaalsContact C-N 3.29Å; L72-N74 PolarHBondContact O-N 3.16Å
75	G	42.9	Very low	53.2	Low	49 Å²	49	61.2 Å²	61.2	51%	0.505	32%	0.323	S	S	.	.	S	Bend	trans	147.6	98	174.1	0	0	0	0	0	112.1	R77	G75-R77 VanDerWaalsContact C-N 3.27Å; G75-R77 PolarHBondContact O-N 2.89Å
76	T	54.4	Low	55.2	Low	134 Å²	134	59.6 Å²	59.6	82%	0.822	32%	0.319	S	S	*	.			trans	-70.7	69.5	-174.5	42.7	0	0	0	0	113.6
77	R	67.5	Low	57.4	Low	65 Å²	65	57 Å²	57	25%	0.245	31%	0.308	C	S	.	.			trans	-93.1	143.9	164.5	-66.8	-171.6	-174.2	-120.8	-2.2	110.1	G75 A275 S276 S324 S327	G75-R77 VanDerWaalsContact C-N 3.27Å; G75-R77 PolarHBondContact O-N 2.89Å; R77-A275 PolarHBondContact NH1-O 3.48Å; R77-A275 PolarHBondContact NH2-O 3.4Å; R77-S276 VanDerWaalsContact NH2-CA 3.28Å; R77-S324 PolarHBondContact O-N 3.09Å; R77-S327 WeakPolarHBondContact CD-OG 3.42Å; R77-S327 PolarHBondContact NE-OG 3.09Å
78	F	79.9	Confident	60.2	Low	72 Å²	72	55.7 Å²	55.7	32%	0.316	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	156.9	175.3	-62.3	-85.1	0	0	0	110.9	F290 L321 I322	F78-F290 HydrophobicContact CB-CB 4.22Å; F78-F290 VanDerWaalsContact CB-O 3.29Å; F78-F290 WeakPolarHBondContact CB-O 3.23Å; F78-L321 HydrophobicContact CB-CD1 3.86Å; F78-L321 HydrophobicContact CB-CD2 4.25Å; F78-L321 HydrophobicContact CB-CG 4.02Å; F78-L321 HydrophobicContact CD1-CD2 3.92Å; F78-L321 HydrophobicContact CD1-CG 4.02Å; F78-L321 HydrophobicContact CE1-CD2 4.48Å; F78-L321 HydrophobicContact CG-CD2 4.1Å; F78-L321 HydrophobicContact CG-CG 4.26Å; F78-I322 CarbonylContact C-O 3.58Å; F78-I322 VanDerWaalsContact CA-O 3.3Å; F78-I322 WeakPolarHBondContact CA-O 3.31Å
79	A	84.1	Confident	63	Low	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	148	171.8	0	0	0	0	0	109.7	W189 M252 V253 A254 I322	A79-W189 HydrophobicContact CB-CH2 4.28Å; A79-M252 HydrophobicContact CB-CB 4.13Å; A79-V253 VanDerWaalsContact CA-O 3.29Å; A79-V253 WeakPolarHBondContact CA-O 3.17Å; A79-V253 WeakPolarHBondContact CB-O 3.38Å; A79-A254 HydrophobicContact CB-CB 4.11Å; A79-I322 HydrophobicContact CB-CG1 4.45Å; A79-I322 PolarHBondContact N-O 3.06Å; A79-I322 PolarHBondContact O-N 3.12Å
80	F	88.7	Confident	65.7	Low	1 Å²	1	54.3 Å²	54.3	0%	0.004	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	130.7	161.8	-83.4	-54.2	0	0	0	109.2	F82 L233 M252 V253 F290 I293 W296 P319 L321	F80-F82 HydrophobicContact CB-CD2 4.38Å; F80-F82 HydrophobicContact CB-CE2 3.64Å; F80-F82 HydrophobicContact CB-CZ 3.94Å; F80-F82 HydrophobicContact CG-CZ 4.36Å; F80-L233 HydrophobicContact CD2-CD1 4.38Å; F80-M252 CarbonylContact O-C 3.26Å; F80-M252 VanDerWaalsContact O-CA 3.28Å; F80-M252 WeakPolarHBondContact O-CA 3.21Å; F80-V253 PolarHBondContact N-O 3.41Å; F80-V253 PolarHBondContact O-N 2.77Å; F80-F290 AromaticContact CD2-CD1 3.33Å; F80-F290 HydrophobicContact CD2-CD1 3.33Å; F80-F290 AromaticContact CD2-CE1 3.33Å; F80-F290 HydrophobicContact CD2-CE1 3.33Å; F80-F290 HydrophobicContact CD2-CG 4.05Å; F80-F290 HydrophobicContact CD2-CZ 4.04Å; F80-F290 AromaticContact CE2-CD1 3.31Å; F80-F290 HydrophobicContact CE2-CD1 3.31Å; F80-F290 AromaticContact CE2-CE1 3.48Å; F80-F290 HydrophobicContact CE2-CE1 3.48Å; F80-F290 VanDerWaalsContact CE2-CE1 3.48Å; F80-F290 HydrophobicContact CE2-CG 4.31Å; F80-F290 HydrophobicContact CG-CD1 4.29Å; F80-F290 HydrophobicContact CZ-CD1 4.26Å; F80-I293 HydrophobicContact CE1-CD1 4.13Å; F80-I293 HydrophobicContact CE1-CG1 4.06Å; F80-I293 HydrophobicContact CZ-CG1 4.13Å; F80-W296 HydrophobicContact CE2-CB 4.29Å; F80-W296 AromaticContact CE2-CD1 3.62Å; F80-W296 HydrophobicContact CE2-CD2 4.16Å; F80-W296 AromaticContact CE2-CG 3.76Å; F80-W296 HydrophobicContact CE2-CG 3.76Å; F80-W296 AromaticContact CE2-NE1 3.93Å; F80-W296 HydrophobicContact CZ-CB 4.05Å; F80-W296 AromaticContact CZ-CD1 3.87Å; F80-W296 AromaticContact CZ-CG 3.97Å; F80-W296 HydrophobicContact CZ-CG 3.97Å; F80-P319 HydrophobicContact CD1-CB 4.42Å; F80-P319 HydrophobicContact CD1-CG 4.22Å; F80-P319 HydrophobicContact CE1-CG 4.44Å; F80-L321 HydrophobicContact CD1-CD1 4.25Å; F80-L321 HydrophobicContact CE1-CD1 4.34Å
81	Y	86.4	Confident	68.4	Low	22 Å²	22	54.7 Å²	54.7	9%	0.086	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.4	166.5	170.1	-109.8	0	0	0	110.3	D83 E121 P319 T320 L856	Y81-D83 HydrophobicContact CE1-CB 3.91Å; Y81-E121 PolarHBondContact OH-OE2 2.79Å; Y81-P319 VanDerWaalsContact O-CB 3.24Å; Y81-P319 WeakPolarHBondContact O-CB 3.26Å; Y81-T320 PolarHBondContact N-O 3.46Å; Y81-T320 PolarHBondContact O-N 3.27Å; Y81-L856 HydrophobicContact CD2-CD1 3.75Å; Y81-L856 HydrophobicContact CE1-CB 4.26Å; Y81-L856 HydrophobicContact CE2-CB 3.95Å; Y81-L856 HydrophobicContact CE2-CD1 3.59Å; Y81-L856 HydrophobicContact CE2-CG 4.37Å; Y81-L856 HydrophobicContact CG-CD1 4.48Å
82	F	87.1	Confident	70.5	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.018	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	134.6	172.3	-59.6	-86.2	0	0	0	108.9	F80 V89 L233 G234 Y249 R250 G251 V253 P319	F80-F82 HydrophobicContact CB-CD2 4.38Å; F80-F82 HydrophobicContact CB-CE2 3.64Å; F80-F82 HydrophobicContact CB-CZ 3.94Å; F80-F82 HydrophobicContact CG-CZ 4.36Å; F82-V89 HydrophobicContact CE1-CG2 4.05Å; F82-V89 HydrophobicContact CZ-CG2 3.97Å; F82-L233 HydrophobicContact CE2-CB 4.36Å; F82-L233 HydrophobicContact CZ-CB 3.76Å; F82-G234 VanDerWaalsContact CD1-CA 3.44Å; F82-G234 VanDerWaalsContact CE1-CA 3.44Å; F82-Y249 HydrophobicContact CB-CD1 4.21Å; F82-Y249 WeakPolarHBondContact CB-O 3.33Å; F82-Y249 AromaticContact CD2-CD1 3.91Å; F82-Y249 HydrophobicContact CD2-CD1 3.91Å; F82-Y249 HydrophobicContact CD2-CE1 4.37Å; F82-Y249 HydrophobicContact CG-CD1 4.37Å; F82-R250 CarbonylContact O-C 3.54Å; F82-R250 WeakPolarHBondContact O-CA 3.4Å; F82-G251 PolarHBondContact N-O 2.85Å; F82-G251 PolarHBondContact O-N 2.73Å; F82-V253 HydrophobicContact CD2-CG2 4.11Å; F82-V253 HydrophobicContact CE2-CB 4.37Å; F82-V253 HydrophobicContact CE2-CG2 3.86Å; F82-P319 HydrophobicContact CD1-CB 3.77Å; F82-P319 HydrophobicContact CD1-CG 4.21Å; F82-P319 HydrophobicContact CE1-CB 3.76Å; F82-P319 HydrophobicContact CE1-CG 3.72Å; F82-P319 HydrophobicContact CG-CB 4.49Å; F82-P319 HydrophobicContact CZ-CB 4.46Å; F82-P319 HydrophobicContact CZ-CG 4.39Å
83	D	78.3	Confident	72	Confident	29 Å²	29	52 Å²	52	16%	0.155	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	11.3	-174	61.8	1.3	0	0	0	113.8	Y81 T85 R87 R250	Y81-D83 HydrophobicContact CE1-CB 3.91Å; D83-T85 VanDerWaalsContact C-N 3.29Å; D83-T85 PolarHBondContact O-N 2.94Å; D83-T85 WeakPolarHBondContact OD1-CB 3.36Å; D83-T85 WeakPolarHBondContact OD1-CG2 3.5Å; D83-T85 PolarHBondContact OD1-N 2.03Å; D83-T85 VanDerWaalsContact OD1-N 3.07Å; D83-T85 PolarHBondContact OD1-OG1 2.79Å; D83-R87 IonicContact OD1-NH1 2.68Å; D83-R87 IonicContact OD2-CZ 2.78Å; D83-R87 IonicContact OD2-NE 3.6Å; D83-R87 IonicContact OD2-NH1 2.7Å; D83-R87 PolarHBondContact OD2-NH1 2.76Å; D83-R87 IonicContact OD2-NH2 3.29Å; D83-R87 PolarHBondContact OD2-NH2 2.99Å; D83-R250 PolarHBondContact O-NH1 3.03Å; D83-R250 VanDerWaalsContact O-NH1 3.16Å; D83-R250 PolarHBondContact O-NH2 2.84Å
84	G	79	Confident	73	Confident	13 Å²	13	48.8 Å²	48.8	13%	0.134	26%	0.261	C	S	.	.	S	Bend	trans	77.3	2.2	-175.3	0	0	0	0	0	115.4	N248 Y249	G84-N248 WeakPolarHBondContact O-CB 3.47Å; G84-Y249 PolarHBondContact N-O 3.13Å
85	T	76	Confident	73.7	Confident	48 Å²	48	44.1 Å²	44.1	29%	0.294	24%	0.236	S	C	.	.	S	Bend	trans	-83.4	171.7	172.1	68.7	0	0	0	0	111.8	D83 R87 N248	D83-T85 VanDerWaalsContact C-N 3.29Å; D83-T85 PolarHBondContact O-N 2.94Å; D83-T85 WeakPolarHBondContact OD1-CB 3.36Å; D83-T85 WeakPolarHBondContact OD1-CG2 3.5Å; D83-T85 PolarHBondContact OD1-N 2.03Å; D83-T85 VanDerWaalsContact OD1-N 3.07Å; D83-T85 PolarHBondContact OD1-OG1 2.79Å; T85-R87 PolarHBondContact O-N 3.29Å; T85-R87 WeakPolarHBondContact OG1-CD 2.99Å; T85-R87 WeakPolarHBondContact OG1-CG 3.44Å; T85-R87 PolarHBondContact OG1-NE 2.93Å; T85-N248 WeakPolarHBondContact O-CB 3.41Å; T85-N248 PolarHBondContact O-ND2 3.47Å
86	E	73.1	Confident	73.3	Confident	54 Å²	54	47.1 Å²	47.1	25%	0.252	24%	0.24	S	C	.	.	S	Bend	trans	-69.5	49.6	-179.1	-64.6	-156.6	177.1	0	0	114.4	L246 R301	E86-L246 HydrophobicContact CG-CD2 3.66Å; E86-R301 IonicContact OE1-CZ 3.84Å; E86-R301 IonicContact OE1-NE 3.78Å; E86-R301 IonicContact OE1-NH2 2.81Å; E86-R301 PolarHBondContact OE1-NH2 3.32Å; E86-R301 IonicContact OE2-CZ 2.73Å; E86-R301 IonicContact OE2-NE 2.68Å; E86-R301 PolarHBondContact OE2-NE 2.91Å; E86-R301 IonicContact OE2-NH2 3.08Å; E86-R301 PolarHBondContact OE2-NH2 3.02Å
87	R	76.2	Confident	72.3	Confident	85 Å²	85	47.1 Å²	47.1	32%	0.321	24%	0.235	S	C	.	.			trans	-103.7	56.2	-178.6	-66.9	-178.2	-167.9	154.1	16.6	112.9	D83 T85 L298	D83-R87 IonicContact OD1-NH1 2.68Å; D83-R87 IonicContact OD2-CZ 2.78Å; D83-R87 IonicContact OD2-NE 3.6Å; D83-R87 IonicContact OD2-NH1 2.7Å; D83-R87 PolarHBondContact OD2-NH1 2.76Å; D83-R87 IonicContact OD2-NH2 3.29Å; D83-R87 PolarHBondContact OD2-NH2 2.99Å; T85-R87 PolarHBondContact O-N 3.29Å; T85-R87 WeakPolarHBondContact OG1-CD 2.99Å; T85-R87 WeakPolarHBondContact OG1-CG 3.44Å; T85-R87 PolarHBondContact OG1-NE 2.93Å; R87-L298 HydrophobicContact CB-CD1 4.18Å
88	T	84.1	Confident	70.8	Confident	2 Å²	2	49 Å²	49	1%	0.012	25%	0.253	C	S	.	.			trans	-70	128.5	175.4	-53.8	0	0	0	0	111	L232 G235 P236 N248 I299	T88-L232 HydrophobicContact CG2-CB 3.82Å; T88-L232 HydrophobicContact CG2-CD1 4.14Å; T88-L232 HydrophobicContact CG2-CD2 4.28Å; T88-L232 HydrophobicContact CG2-CG 4.3Å; T88-G235 WeakPolarHBondContact CG2-O 3.36Å; T88-P236 PolarHBondContact OG1-O 2.93Å; T88-P236 VanDerWaalsContact OG1-O 3.05Å; T88-N248 PolarHBondContact OG1-ND2 3.11Å; T88-I299 PolarHBondContact O-N 2.85Å
89	V	87.3	Confident	68.4	Low	4 Å²	4	55.9 Å²	55.9	2%	0.024	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	144.9	171.4	-66.9	0	0	0	0	111.9	F82 L232 L233 W296 K297 L298 P319	F82-V89 HydrophobicContact CE1-CG2 4.05Å; F82-V89 HydrophobicContact CZ-CG2 3.97Å; V89-L232 CarbonylContact O-C 3.55Å; V89-L232 VanDerWaalsContact O-CA 3.29Å; V89-L232 WeakPolarHBondContact O-CA 3.48Å; V89-L233 HydrophobicContact CG2-CB 3.9Å; V89-L233 PolarHBondContact N-O 2.87Å; V89-L233 PolarHBondContact O-N 2.02Å; V89-W296 HydrophobicContact CB-CB 4.38Å; V89-W296 HydrophobicContact CB-CE3 4.37Å; V89-W296 HydrophobicContact CG2-CD2 4.48Å; V89-W296 HydrophobicContact CG2-CE3 3.93Å; V89-K297 WeakPolarHBondContact CA-O 2.99Å; V89-L298 HydrophobicContact CG1-CD1 4.25Å; V89-P319 HydrophobicContact CG1-CG 3.41Å; V89-P319 VanDerWaalsContact CG1-CG 3.41Å; V89-P319 HydrophobicContact CG2-CG 4.41Å
90	R	86	Confident	65.8	Low	48 Å²	48	60.6 Å²	60.6	18%	0.181	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.1	179.5	172.4	-178.1	163.2	176.8	0.7	110.9	N92 D93 H230 L231 L232 W296 K297 I299	R90-N92 PolarHBondContact O-N 3.31Å; R90-D93 IonicContact CZ-OD1 3.22Å; R90-D93 IonicContact CZ-OD2 2.87Å; R90-D93 IonicContact NE-OD1 3.74Å; R90-D93 IonicContact NH2-OD1 3.95Å; R90-D93 PolarHBondContact NH2-OD1 3.48Å; R90-D93 IonicContact NH2-OD2 2.66Å; R90-D93 PolarHBondContact NH2-OD2 2.83Å; R90-H230 HydrophobicContact CG-CB 4.47Å; R90-H230 PolarHBondContact NH1-ND1 3Å; R90-H230 PolarHBondContact NH2-CE1 2.73Å; R90-H230 VanDerWaalsContact NH2-CE1 3.3Å; R90-H230 PolarHBondContact NH2-ND1 2.04Å; R90-L231 WeakPolarHBondContact CA-O 3.29Å; R90-L232 HydrophobicContact CB-CD2 3.62Å; R90-L232 HydrophobicContact CG-CD2 3.97Å; R90-W296 VanDerWaalsContact C-CE3 3.46Å; R90-W296 CarbonylContact O-C 3.56Å; R90-W296 WeakPolarHBondContact O-CA 3.4Å; R90-K297 PolarHBondContact N-O 3.31Å; R90-K297 PolarHBondContact O-N 3.32Å; R90-I299 HydrophobicContact CB-CD1 3.62Å; R90-I299 HydrophobicContact CB-CG1 3.96Å; R90-I299 HydrophobicContact CG-CD1 4.27Å
91	L	83.6	Confident	63	Low	29 Å²	29	66.9 Å²	66.9	15%	0.152	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	126	170.2	-173.1	71.3	0	0	0	110.4	F107 L231 L286 W296	L91-F107 HydrophobicContact CD2-CZ 4.2Å; L91-L231 HydrophobicContact CB-CB 4.32Å; L91-L231 PolarHBondContact N-O 2.8Å; L91-L286 HydrophobicContact CD1-CD1 4.02Å; L91-L286 HydrophobicContact CD1-CD2 4.26Å; L91-L286 HydrophobicContact CD2-CD2 4.29Å; L91-W296 HydrophobicContact CB-CE3 4.43Å; L91-W296 HydrophobicContact CB-CH2 4.35Å; L91-W296 HydrophobicContact CB-CZ3 4.09Å; L91-W296 HydrophobicContact CD1-CH2 4.33Å; L91-W296 HydrophobicContact CD1-CZ2 4.13Å
92	N	73.3	Confident	60.4	Low	36 Å²	36	74.4 Å²	74.4	19%	0.193	39%	0.385	C	S	.	.			trans	-70.7	129	-172	-169.5	11.1	0	0	0	112.1	R90 D94 E294 K295	R90-N92 PolarHBondContact O-N 3.31Å; N92-D94 VanDerWaalsContact C-N 3.31Å; N92-D94 PolarHBondContact O-N 2.81Å; N92-D94 PolarHBondContact OD1-N 2.88Å; N92-E294 PolarHBondContact ND2-O 2.97Å; N92-K295 WeakPolarHBondContact CB-O 3.28Å; N92-K295 PolarHBondContact N-O 2.96Å
93	D	61.4	Low	58	Low	78 Å²	78	79 Å²	79	42%	0.417	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-69.3	-29	-177.9	-61.2	-26.8	0	0	0	112.5	R90 L95 N96	R90-D93 IonicContact CZ-OD1 3.22Å; R90-D93 IonicContact CZ-OD2 2.87Å; R90-D93 IonicContact NE-OD1 3.74Å; R90-D93 IonicContact NH2-OD1 3.95Å; R90-D93 PolarHBondContact NH2-OD1 3.48Å; R90-D93 IonicContact NH2-OD2 2.66Å; R90-D93 PolarHBondContact NH2-OD2 2.83Å; D93-L95 PolarHBondContact O-N 2.89Å; D93-L95 VanDerWaalsContact O-N 3.13Å; D93-N96 VanDerWaalsContact O-CB 3.29Å; D93-N96 WeakPolarHBondContact O-CB 3.01Å; D93-N96 PolarHBondContact O-N 2.94Å; D93-N96 PolarHBondContact O-ND2 2.69Å; D93-N96 VanDerWaalsContact O-ND2 3.08Å
94	D	50.8	Low	56.4	Low	88 Å²	88	85.7 Å²	85.7	47%	0.471	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-68	-13.8	-171.7	-67.4	-47.8	0	0	0	113.4	N92 N96 N97	N92-D94 VanDerWaalsContact C-N 3.31Å; N92-D94 PolarHBondContact O-N 2.81Å; N92-D94 PolarHBondContact OD1-N 2.88Å; D94-N96 PolarHBondContact O-N 3.45Å; D94-N97 WeakPolarHBondContact O-CB 3.33Å; D94-N97 PolarHBondContact O-N 2.81Å
95	L	46.8	Very low	55.2	Low	66 Å²	66	91.8 Å²	91.8	35%	0.346	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-67.8	-16.1	168.8	-74.5	166.5	0	0	0	113.3	D93 N97 K295	D93-L95 PolarHBondContact O-N 2.89Å; D93-L95 VanDerWaalsContact O-N 3.13Å; L95-N97 PolarHBondContact O-N 3.13Å; L95-K295 HydrophobicContact CD1-CB 3.78Å; L95-K295 HydrophobicContact CD1-CD 4.47Å; L95-K295 HydrophobicContact CD1-CG 3.82Å
96	N	34.8	Very low	54.7	Low	111 Å²	111	93.2 Å²	93.2	59%	0.594	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-70.2	-20.1	168.9	-66	-49.6	0	0	0	112.5	D93 D94	D93-N96 VanDerWaalsContact O-CB 3.29Å; D93-N96 WeakPolarHBondContact O-CB 3.01Å; D93-N96 PolarHBondContact O-N 2.94Å; D93-N96 PolarHBondContact O-ND2 2.69Å; D93-N96 VanDerWaalsContact O-ND2 3.08Å; D94-N96 PolarHBondContact O-N 3.45Å
97	N	33.2	Very low	55	Low	134 Å²	134	92.2 Å²	92.2	72%	0.717	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-88.2	-2.5	179	-68.7	-30.9	0	0	0	113.7	D94 L95	D94-N97 WeakPolarHBondContact O-CB 3.33Å; D94-N97 PolarHBondContact O-N 2.81Å; L95-N97 PolarHBondContact O-N 3.13Å
98	V	36.2	Very low	55.5	Low	105 Å²	105	88.8 Å²	88.8	64%	0.636	46%	0.46	S	S	*	.	S	Bend	trans	-98.4	-13	178.4	-175.3	0	0	0	0	112.3
99	W	30.9	Very low	55.7	Low	216 Å²	216	91.1 Å²	91.1	82%	0.818	47%	0.469	S	S	*	.	S	Bend	trans	-101.7	74.3	173	-64.3	92.2	0	0	0	110.4
100	S	28.5	Very low	55.6	Low	100 Å²	100	93.4 Å²	93.4	70%	0.699	48%	0.482	S	S	*	.			trans	-62.2	138.3	172.5	49	0	0	0	0	111.4
101	T	30.9	Very low	55.8	Low	132 Å²	132	94.2 Å²	94.2	81%	0.81	49%	0.488	S	S	*	.	S	Bend	trans	64.2	117.3	170.4	54.6	0	0	0	0	118
102	E	31.7	Very low	56.3	Low	181 Å²	181	92.9 Å²	92.9	85%	0.846	48%	0.481	S	S	*	.	S	Bend	trans	100.4	-9	153.3	-54.4	-146.5	120.6	0	0	122.9
103	S	35.9	Very low	57.2	Low	100 Å²	100	91.2 Å²	91.2	70%	0.699	47%	0.472	S	S	*	.			trans	-152.4	119.6	164.1	59.3	0	0	0	0	116.8	K105	S103-K105 PolarHBondContact O-N 2.8Å
104	E	44.8	Very low	58.8	Low	170 Å²	170	87.6 Å²	87.6	79%	0.794	45%	0.453	S	S	*	.			trans	-66.9	98.5	167.1	-63.3	179.7	150.1	0	0	110.2	L106	E104-L106 HydrophobicContact CB-CG 4.15Å; E104-L106 PolarHBondContact O-N 2.78Å
105	K	54.1	Low	60.8	Low	141 Å²	141	83.4 Å²	83.4	61%	0.613	43%	0.431	S	S	*	.			trans	-74.9	71.3	168.3	-80.7	-171.1	177.2	-179.7	0	110.9	S103 F285	S103-K105 PolarHBondContact O-N 2.8Å; K105-F285 HydrophobicContact CB-CE2 4.28Å; K105-F285 WeakPolarHBondContact O-CE2 3.07Å
106	L	65.1	Low	63.1	Low	78 Å²	78	80.3 Å²	80.3	41%	0.408	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-58.9	143.5	168.2	-62.3	162.7	0	0	0	110	E104 A226 F285	E104-L106 HydrophobicContact CB-CG 4.15Å; E104-L106 PolarHBondContact O-N 2.78Å; L106-A226 HydrophobicContact CD2-CB 3.75Å; L106-F285 WeakPolarHBondContact O-CE2 3.49Å
107	F	79.4	Confident	65.8	Low	33 Å²	33	75.1 Å²	75.1	15%	0.145	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-50.5	146.1	174.4	-85.9	-75.7	0	0	0	111.7	L91 R109 L133 F221 K229 L231 F285	L91-F107 HydrophobicContact CD2-CZ 4.2Å; F107-R109 WeakPolarHBondContact O-CG 3.31Å; F107-R109 PolarHBondContact O-N 3.14Å; F107-L133 HydrophobicContact CD1-CD1 4.1Å; F107-L133 HydrophobicContact CE1-CD1 4.16Å; F107-L133 HydrophobicContact CG-CD1 4.34Å; F107-L133 HydrophobicContact CZ-CD1 4.44Å; F107-F221 HydrophobicContact CB-CZ 3.85Å; F107-K229 HydrophobicContact CD2-CB 3.97Å; F107-K229 HydrophobicContact CE2-CB 4.49Å; F107-K229 WeakPolarHBondContact CE2-O 3.45Å; F107-L231 HydrophobicContact CE1-CB 3.78Å; F107-L231 HydrophobicContact CE1-CD2 4.41Å; F107-L231 HydrophobicContact CZ-CB 3.76Å; F107-F285 HydrophobicContact CB-CZ 4.49Å; F107-F285 AromaticContact CD1-CE1 3.59Å; F107-F285 HydrophobicContact CD1-CE1 3.59Å; F107-F285 AromaticContact CD1-CZ 3.68Å; F107-F285 HydrophobicContact CD1-CZ 3.68Å; F107-F285 AromaticContact CE1-CE1 3.66Å; F107-F285 HydrophobicContact CE1-CE1 3.66Å; F107-F285 HydrophobicContact CE1-CZ 4.01Å; F107-F285 HydrophobicContact CG-CE1 4.41Å; F107-F285 HydrophobicContact CG-CZ 4.04Å
108	P	86.7	Confident	68.7	Low	13 Å²	13	68.7 Å²	68.7	8%	0.084	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-56.1	126.5	178.8	-25	34.9	0	0	0	111.9	Q111 F112 L258 N260 F285	P108-Q111 WeakPolarHBondContact CB-O 3.28Å; P108-F112 HydrophobicContact CB-CB 3.8Å; P108-F112 HydrophobicContact CG-CB 4.38Å; P108-L258 HydrophobicContact CG-CG 4.41Å; P108-N260 HydrophobicContact CB-CB 4.37Å; P108-N260 HydrophobicContact CG-CB 4.01Å; P108-F285 HydrophobicContact CG-CB 4.34Å; P108-F285 HydrophobicContact CG-CD2 4.29Å; P108-F285 HydrophobicContact CG-CG 4.14Å
109	R	88.5	Confident	71.3	Confident	51 Å²	51	65.1 Å²	65.1	19%	0.192	33%	0.327	C	S	.	.			trans	-109.3	-33.1	-171.1	-82.3	174.9	67.1	-101.4	-18.1	115.1	F107 P219 L220 F221	F107-R109 WeakPolarHBondContact O-CG 3.31Å; F107-R109 PolarHBondContact O-N 3.14Å; R109-P219 CarbonylContact O-C 3.54Å; R109-P219 WeakPolarHBondContact O-CA 3.48Å; R109-L220 WeakPolarHBondContact O-CB 3.23Å; R109-L220 WeakPolarHBondContact O-CG 2.97Å; R109-L220 PolarHBondContact O-N 2.03Å; R109-F221 HydrophobicContact CG-CD2 3.71Å; R109-F221 HydrophobicContact CG-CE1 4.1Å; R109-F221 HydrophobicContact CG-CE2 3.21Å; R109-F221 HydrophobicContact CG-CG 4.34Å; R109-F221 HydrophobicContact CG-CZ 3.41Å; R109-F221 VanDerWaalsContact CG-CZ 3.41Å; R109-F221 PolarHBondContact NE-O 2.86Å; R109-F221 PolarHBondContact NH2-O 3.07Å
110	T	85.6	Confident	74.2	Confident	51 Å²	51	54.8 Å²	54.8	31%	0.313	29%	0.288	S	S	.	.	S	Bend	trans	-107.9	-53.8	-171.3	49.4	0	0	0	0	110	Y196 E198	T110-Y196 WeakPolarHBondContact O-CD1 3.49Å; T110-E198 HydrophobicContact CG2-CG 4.37Å; T110-E198 VanDerWaalsContact CG2-OE1 3.31Å; T110-E198 WeakPolarHBondContact CG2-OE1 3.46Å; T110-E198 WeakPolarHBondContact O-CG 3.31Å; T110-E198 PolarHBondContact O-N 2.97Å
111	Q	90.6	Very high	77.1	Confident	66 Å²	66	50.1 Å²	50.1	31%	0.308	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150.7	177.7	48.9	166.8	-8.8	0	0	111.7	P108 Y196 N260 T262	P108-Q111 WeakPolarHBondContact CB-O 3.28Å; Q111-Y196 CarbonylContact C-O 3.57Å; Q111-Y196 WeakPolarHBondContact CA-O 3.45Å; Q111-Y196 WeakPolarHBondContact CB-O 3.06Å; Q111-N260 CarbonylContact O-C 3.51Å; Q111-T262 WeakPolarHBondContact CB-OG1 3.49Å; Q111-T262 VanDerWaalsContact OE1-N 3.07Å; Q111-T262 PolarHBondContact OE1-OG1 2.87Å; Q111-T262 VanDerWaalsContact OE1-OG1 3.1Å
112	F	92.7	Very high	79.6	Confident	1 Å²	1	43.9 Å²	43.9	0%	0.004	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	165.3	172.5	69.7	-80.4	0	0	0	112	P108 L114 W146 F165 M167 V194 T195 Y196 L220 L258 W259 V261	P108-F112 HydrophobicContact CB-CB 3.8Å; P108-F112 HydrophobicContact CG-CB 4.38Å; F112-L114 HydrophobicContact CD2-CB 4.34Å; F112-L114 HydrophobicContact CE2-CB 4.36Å; F112-W146 AromaticContact CZ-CD1 3.75Å; F112-W146 HydrophobicContact CZ-CG 4.23Å; F112-W146 AromaticContact CZ-NE1 3.76Å; F112-F165 HydrophobicContact CE2-CZ 4.32Å; F112-F165 AromaticContact CZ-CZ 3.98Å; F112-F165 HydrophobicContact CZ-CZ 3.98Å; F112-M167 HydrophobicContact CE1-SD 4.37Å; F112-V194 HydrophobicContact CE2-CG2 4.17Å; F112-T195 WeakPolarHBondContact O-CA 3.06Å; F112-Y196 HydrophobicContact CD1-CD1 4.48Å; F112-Y196 VanDerWaalsContact CE1-CB 3.41Å; F112-Y196 HydrophobicContact CE1-CD1 4.15Å; F112-Y196 HydrophobicContact CE1-CG 4.16Å; F112-Y196 PolarHBondContact N-O 3.29Å; F112-Y196 PolarHBondContact O-N 3.05Å; F112-L220 HydrophobicContact CD1-CD1 3.87Å; F112-L220 HydrophobicContact CE1-CD1 3.72Å; F112-L220 HydrophobicContact CE1-CD2 4.25Å; F112-L220 HydrophobicContact CE1-CG 4.49Å; F112-L258 HydrophobicContact CB-CD1 4.13Å; F112-L258 HydrophobicContact CD2-CD1 3.98Å; F112-L258 HydrophobicContact CG-CD1 4.46Å; F112-W259 WeakPolarHBondContact CA-O 3.34Å; F112-W259 WeakPolarHBondContact CB-O 3.36Å; F112-V261 CarbonylContact C-O 3.41Å
113	T	93.2	Very high	81.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	125.4	164.7	-59.1	0	0	0	0	107.2	V194 T195 L258 W259 V261 K263 I268	T113-V194 WeakPolarHBondContact CA-O 3.3Å; T113-T195 HydrophobicContact CG2-CG2 3.89Å; T113-L258 CarbonylContact O-C 3.25Å; T113-L258 WeakPolarHBondContact O-CA 3.21Å; T113-L258 WeakPolarHBondContact O-CD1 3.08Å; T113-W259 HydrophobicContact CG2-CE3 3.66Å; T113-W259 HydrophobicContact CG2-CZ3 3.99Å; T113-W259 PolarHBondContact N-O 3.1Å; T113-W259 VanDerWaalsContact N-O 3.15Å; T113-W259 PolarHBondContact O-N 2.99Å; T113-V261 WeakPolarHBondContact CB-O 3.39Å; T113-V261 PolarHBondContact N-O 3.27Å; T113-V261 VanDerWaalsContact N-O 3.08Å; T113-V261 PolarHBondContact OG1-O 3.34Å; T113-K263 HydrophobicContact CG2-CB 4.24Å; T113-K263 HydrophobicContact CG2-CG 4.24Å; T113-K263 PolarHBondContact OG1-N 2.84Å; T113-I268 HydrophobicContact CG2-CD1 3.68Å
114	L	94.5	Very high	84.3	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	135.2	168.3	173.6	73.3	0	0	0	107.5	F112 I131 W146 L148 A193 V194 V256 K257 L258	F112-L114 HydrophobicContact CD2-CB 4.34Å; F112-L114 HydrophobicContact CE2-CB 4.36Å; L114-I131 HydrophobicContact CD1-CD1 4.42Å; L114-I131 HydrophobicContact CD2-CB 4.5Å; L114-I131 HydrophobicContact CD2-CD1 4.24Å; L114-I131 HydrophobicContact CD2-CG2 4.24Å; L114-W146 HydrophobicContact CD2-CE3 4.5Å; L114-W146 HydrophobicContact CD2-CH2 3.61Å; L114-W146 HydrophobicContact CD2-CZ2 4.47Å; L114-W146 HydrophobicContact CD2-CZ3 3.62Å; L114-L148 HydrophobicContact CD2-CD2 4.37Å; L114-A193 CarbonylContact O-C 3.59Å; L114-A193 WeakPolarHBondContact O-CA 3.24Å; L114-A193 WeakPolarHBondContact O-CB 3.18Å; L114-V194 HydrophobicContact CB-CG2 3.73Å; L114-V194 HydrophobicContact CD2-CG2 4.07Å; L114-V194 HydrophobicContact CG-CG2 4.38Å; L114-V194 PolarHBondContact N-O 3.12Å; L114-V194 PolarHBondContact O-N 2.98Å; L114-V256 HydrophobicContact CD1-CG1 4Å; L114-K257 CarbonylContact C-O 3.55Å; L114-K257 WeakPolarHBondContact CA-O 3.45Å; L114-L258 HydrophobicContact CB-CD1 4.21Å; L114-L258 HydrophobicContact CD1-CB 4.32Å; L114-L258 HydrophobicContact CD1-CD1 4.46Å
115	A	93.8	Very high	86	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.008	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144.3	169.6	0	0	0	0	0	109.6	L192 A193 V256 K257 W259 I271	A115-L192 CarbonylContact C-O 3.47Å; A115-L192 VanDerWaalsContact CA-O 3.28Å; A115-L192 WeakPolarHBondContact CA-O 3.42Å; A115-A193 HydrophobicContact CB-CB 3.96Å; A115-V256 WeakPolarHBondContact O-CA 3.02Å; A115-K257 PolarHBondContact N-O 3.28Å; A115-K257 PolarHBondContact O-N 3.42Å; A115-W259 HydrophobicContact CB-CH2 4.42Å; A115-W259 HydrophobicContact CB-CZ3 3.89Å; A115-I271 HydrophobicContact CB-CD1 3.93Å
116	A	93.7	Very high	87.2	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	143.9	178.2	0	0	0	0	0	110.6	I131 L192 V256	A116-I131 HydrophobicContact CB-CD1 3.9Å; A116-L192 PolarHBondContact N-O 2.9Å; A116-L192 PolarHBondContact O-N 2.88Å; A116-V256 HydrophobicContact CB-CG2 3.93Å
117	W	92.9	Very high	88.2	Confident	2 Å²	2	16.5 Å²	16.5	1%	0.008	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	130.2	164.7	-76	91.3	0	0	0	109.1	W189 H191 A254 A272 A275 L326 F329 F330 L1001	W117-W189 HydrophobicContact CB-CE3 3.95Å; W117-W189 HydrophobicContact CB-CZ3 4.03Å; W117-W189 HydrophobicContact CE3-CB 4.16Å; W117-W189 HydrophobicContact CZ3-CB 4.29Å; W117-H191 AromaticContact CD1-CD2 3.96Å; W117-H191 HydrophobicContact CD2-CB 4Å; W117-H191 AromaticContact CE2-CD2 3.67Å; W117-H191 HydrophobicContact CE3-CB 3.98Å; W117-H191 HydrophobicContact CH2-CB 3.69Å; W117-H191 HydrophobicContact CZ2-CB 3.67Å; W117-H191 HydrophobicContact CZ3-CB 3.84Å; W117-H191 AromaticContact NE1-CD2 3.51Å; W117-A254 HydrophobicContact CB-CB 4.2Å; W117-A254 PolarHBondContact N-O 3.06Å; W117-A254 PolarHBondContact O-N 3.48Å; W117-A254 VanDerWaalsContact O-O 3.13Å; W117-A272 VanDerWaalsContact CH2-O 3.27Å; W117-A272 WeakPolarHBondContact CH2-O 3.13Å; W117-A272 WeakPolarHBondContact CZ2-O 3.48Å; W117-A275 HydrophobicContact CZ2-CB 4.45Å; W117-L326 HydrophobicContact CB-CD1 4.33Å; W117-L326 HydrophobicContact CB-CD2 3.74Å; W117-L326 HydrophobicContact CD2-CD1 3.56Å; W117-L326 HydrophobicContact CD2-CD2 4.07Å; W117-L326 HydrophobicContact CD2-CG 4.46Å; W117-L326 HydrophobicContact CE3-CD1 3.47Å; W117-L326 VanDerWaalsContact CE3-CD1 3.47Å; W117-L326 HydrophobicContact CG-CD1 3.96Å; W117-L326 HydrophobicContact CG-CD2 3.59Å; W117-L326 HydrophobicContact CG-CG 4.44Å; W117-L326 HydrophobicContact CZ3-CD1 3.98Å; W117-F329 HydrophobicContact CH2-CE1 4.31Å; W117-F329 HydrophobicContact CZ3-CD1 4.33Å; W117-F329 AromaticContact CZ3-CE1 3.88Å; W117-F329 HydrophobicContact CZ3-CE1 3.88Å; W117-F330 AromaticContact CH2-CE1 3.96Å; W117-F330 HydrophobicContact CH2-CE1 3.96Å; W117-F330 AromaticContact CH2-CZ 3.52Å; W117-F330 HydrophobicContact CH2-CZ 3.52Å; W117-F330 HydrophobicContact CZ2-CE1 4.2Å; W117-F330 HydrophobicContact CZ2-CE2 4.47Å; W117-F330 AromaticContact CZ2-CZ 3.49Å; W117-F330 HydrophobicContact CZ2-CZ 3.49Å; W117-F330 VanDerWaalsContact CZ2-CZ 3.49Å; W117-F330 HydrophobicContact CZ3-CZ 4.36Å; W117-L1001 HydrophobicContact CH2-CD1 4.31Å
118	I	93.8	Very high	88.7	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150.1	179.9	56.3	155.4	0	0	0	110.5	I130 Y163 W189 T190 L192 M252 V253	I118-I130 HydrophobicContact CD1-CD1 4.01Å; I118-I130 HydrophobicContact CG2-CG2 3.97Å; I118-Y163 HydrophobicContact CD1-CD1 4.07Å; I118-Y163 HydrophobicContact CD1-CE1 3.26Å; I118-W189 VanDerWaalsContact C-CE3 3.48Å; I118-W189 CarbonylContact O-C 3.6Å; I118-W189 WeakPolarHBondContact O-CA 3.46Å; I118-T190 WeakPolarHBondContact CG1-O 3.27Å; I118-T190 PolarHBondContact N-O 2.82Å; I118-T190 PolarHBondContact O-N 3.3Å; I118-L192 HydrophobicContact CD1-CD1 3.38Å; I118-L192 HydrophobicContact CD1-CG 3.75Å; I118-L192 HydrophobicContact CG1-CD1 4.1Å; I118-L192 HydrophobicContact CG1-CG 4.05Å; I118-M252 WeakPolarHBondContact CA-O 3.35Å; I118-V253 HydrophobicContact CG2-CG1 4.48Å; I118-V253 HydrophobicContact CG2-CG2 4.45Å
119	R	90.9	Very high	88.9	Confident	29 Å²	29	14.3 Å²	14.3	11%	0.109	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	86.7	171.4	-179.1	178.9	163.3	173.4	3	108	Q187 W189 Y249 G251 M252 D325	R119-Q187 PolarHBondContact NE-O 2.73Å; R119-W189 HydrophobicContact CB-CD2 3.85Å; R119-W189 HydrophobicContact CB-CE3 3.82Å; R119-W189 HydrophobicContact CB-CG 4.43Å; R119-W189 HydrophobicContact CB-CH2 4.12Å; R119-W189 HydrophobicContact CB-CZ2 4.16Å; R119-W189 HydrophobicContact CB-CZ3 3.96Å; R119-Y249 PolarHBondContact O-OH 2.95Å; R119-G251 WeakPolarHBondContact O-CA 3.36Å; R119-M252 HydrophobicContact CB-CB 4.11Å; R119-M252 HydrophobicContact CB-CG 4.36Å; R119-M252 PolarHBondContact N-O 2.87Å; R119-M252 PolarHBondContact O-N 2.82Å; R119-D325 IonicContact CZ-OD2 3.47Å; R119-D325 IonicContact NH1-OD1 3.87Å; R119-D325 PolarHBondContact NH1-OD1 2.77Å; R119-D325 IonicContact NH1-OD2 2.86Å; R119-D325 PolarHBondContact NH1-OD2 2.8Å
120	P	90.8	Very high	89.2	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	145.6	-178	29.3	-36.3	0	0	0	111.2	I150 Y184 A186 Q187 Y249	P120-I150 HydrophobicContact CB-CD1 3.79Å; P120-I150 HydrophobicContact CG-CD1 4.4Å; P120-Y184 HydrophobicContact CB-CD2 3.74Å; P120-Y184 HydrophobicContact CB-CE2 3.71Å; P120-Y184 HydrophobicContact CG-CD2 3.32Å; P120-Y184 HydrophobicContact CG-CE2 3.78Å; P120-Y184 HydrophobicContact CG-CG 4.2Å; P120-A186 CarbonylContact O-C 3.54Å; P120-A186 WeakPolarHBondContact O-CA 3.47Å; P120-Q187 PolarHBondContact O-N 3.18Å; P120-Y249 WeakPolarHBondContact CA-OH 3.16Å; P120-Y249 HydrophobicContact CB-CE2 3.97Å
121	E	88.7	Confident	89.7	Confident	2 Å²	2	9.5 Å²	9.5	1%	0.009	5%	0.052	C	C	.	.	P	Polyproline II helix	trans	-85.4	163.1	164.5	-47.8	-164.5	125	0	0	110.5	Y81 Q124 Y184 Q187 R250 L856	Y81-E121 PolarHBondContact OH-OE2 2.79Å; E121-Q124 PolarHBondContact O-NE2 2.97Å; E121-Y184 WeakPolarHBondContact O-CE2 3.4Å; E121-Y184 PolarHBondContact O-OH 3.21Å; E121-Q187 PolarHBondContact OE1-NE2 3.4Å; E121-R250 HydrophobicContact CB-CG 3.77Å; E121-R250 HydrophobicContact CG-CG 3.91Å; E121-R250 PolarHBondContact N-O 2.98Å; E121-R250 VanDerWaalsContact N-O 3.07Å; E121-R250 VanDerWaalsContact OE2-CD 3.32Å; E121-R250 WeakPolarHBondContact OE2-CD 3.22Å; E121-R250 WeakPolarHBondContact OE2-CG 3.06Å; E121-R250 IonicContact OE2-NH1 3.98Å; E121-L856 WeakPolarHBondContact OE1-CD1 3.48Å; E121-L856 WeakPolarHBondContact OE1-CG 3.29Å; E121-L856 PolarHBondContact OE1-N 2.77Å
122	G	84.7	Confident	89.8	Confident	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.037	C	C	.	.	S	Bend	trans	-71.2	149.6	169.4	0	0	0	0	0	111.8	Y184 P852 F853 S854	G122-Y184 WeakPolarHBondContact CA-OH 3.19Å; G122-P852 VanDerWaalsContact CA-O 3.28Å; G122-P852 WeakPolarHBondContact CA-O 3.31Å; G122-F853 WeakPolarHBondContact O-CD2 3.48Å; G122-S854 PolarHBondContact N-OG 3.26Å; G122-S854 PolarHBondContact O-N 2.88Å
123	G	80.3	Confident	89.8	Confident	1 Å²	1	6.4 Å²	6.4	1%	0.01	4%	0.037	C	C	.	.			trans	77.2	56	-174.9	0	0	0	0	0	113.6	Y184 T846	G123-Y184 PolarHBondContact N-OH 2.62Å; G123-T846 CarbonylContact C-O 3.59Å; G123-T846 VanDerWaalsContact C-O 3.26Å; G123-T846 WeakPolarHBondContact CA-O 3.39Å
124	Q	86.6	Confident	89.5	Confident	4 Å²	4	6.4 Å²	6.4	2%	0.019	4%	0.037	C	C	.	.			trans	-71.8	147.3	163.6	-60	-64.2	-49.6	0	0	109.9	E121 S128 I150 Y184 Y249 R250	E121-Q124 PolarHBondContact O-NE2 2.97Å; Q124-S128 PolarHBondContact OE1-OG 3.03Å; Q124-I150 HydrophobicContact CB-CG2 4.31Å; Q124-I150 HydrophobicContact CG-CB 4.27Å; Q124-I150 HydrophobicContact CG-CD1 3.88Å; Q124-I150 HydrophobicContact CG-CG2 4.03Å; Q124-Y184 HydrophobicContact CG-CE1 3.93Å; Q124-Y184 WeakPolarHBondContact CG-OH 3.45Å; Q124-Y249 VanDerWaalsContact OE1-CD2 3.3Å; Q124-R250 PolarHBondContact NE2-O 2.84Å; Q124-R250 VanDerWaalsContact OE1-N 3.14Å
125	G	79	Confident	89	Confident	14 Å²	14	7.2 Å²	7.2	14%	0.144	4%	0.042	C	C	.	.			trans	-62.2	150	161.7	0	0	0	0	0	111	P127 S128	G125-P127 CarbonylContact O-C 3.2Å; G125-P127 WeakPolarHBondContact O-CA 3.36Å; G125-S128 WeakPolarHBondContact O-CB 3.01Å; G125-S128 PolarHBondContact O-N 2.94Å
126	D	80.3	Confident	88.2	Confident	39 Å²	39	8.3 Å²	8.3	21%	0.209	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	103.5	178.8	-173.8	25.4	0	0	0	111.8	G151 T152	D126-G151 VanDerWaalsContact OD1-CA 3.23Å; D126-G151 WeakPolarHBondContact OD1-CA 3.49Å; D126-T152 PolarHBondContact OD1-N 3.45Å; D126-T152 WeakPolarHBondContact OD2-CB 3.33Å; D126-T152 WeakPolarHBondContact OD2-CG2 3.48Å; D126-T152 PolarHBondContact OD2-OG1 3.44Å
127	P	84.7	Confident	87.3	Confident	37 Å²	37	12 Å²	12	24%	0.24	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	cis	-94.8	147.6	-2.3	34.6	-29.5	0	0	0	113.6	G125 I150 Y164 M247	G125-P127 CarbonylContact O-C 3.2Å; G125-P127 WeakPolarHBondContact O-CA 3.36Å; P127-I150 CarbonylContact C-O 3.45Å; P127-I150 WeakPolarHBondContact CA-O 3.38Å; P127-Y164 HydrophobicContact CB-CE1 3.9Å; P127-M247 HydrophobicContact CG-CE 3.82Å; P127-M247 WeakPolarHBondContact O-CA 3.27Å; P127-M247 WeakPolarHBondContact O-CB 3.43Å; P127-M247 WeakPolarHBondContact O-CG 3.41Å
128	S	89.8	Confident	86.1	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	150.3	170.9	82.5	0	0	0	0	111.9	Q124 G125 G149 I150 Y164 M247 N248	Q124-S128 PolarHBondContact OE1-OG 3.03Å; G125-S128 WeakPolarHBondContact O-CB 3.01Å; G125-S128 PolarHBondContact O-N 2.94Å; S128-G149 CarbonylContact O-C 3.17Å; S128-G149 WeakPolarHBondContact O-CA 3.25Å; S128-I150 PolarHBondContact N-O 2.89Å; S128-I150 PolarHBondContact O-N 3.28Å; S128-Y164 PolarHBondContact O-OH 3.08Å; S128-M247 CarbonylContact C-O 3.53Å; S128-M247 WeakPolarHBondContact CA-O 3.45Å; S128-N248 WeakPolarHBondContact CB-O 3.29Å
129	V	92.3	Very high	84.5	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	116.9	-176.3	177.4	0	0	0	0	109.6	E132 R147 G234 G235 P236 M247 Y249	V129-E132 HydrophobicContact CG1-CB 3.81Å; V129-R147 HydrophobicContact CG1-CB 4.34Å; V129-G234 CarbonylContact O-C 3.48Å; V129-G235 WeakPolarHBondContact O-CA 3.44Å; V129-G235 PolarHBondContact O-N 2.86Å; V129-G235 VanDerWaalsContact O-N 3.12Å; V129-P236 HydrophobicContact CG2-CB 4.35Å; V129-M247 HydrophobicContact CG2-CB 4.5Å; V129-M247 HydrophobicContact CG2-CE 3.68Å; V129-M247 PolarHBondContact N-O 3.22Å; V129-Y249 WeakPolarHBondContact O-CB 3.39Å
130	I	95.2	Very high	82.8	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-51.4	179.3	-53.2	160.2	0	0	0	109.8	I118 L148 I150 L192 L233 G234 Y249 V253	I118-I130 HydrophobicContact CD1-CD1 4.01Å; I118-I130 HydrophobicContact CG2-CG2 3.97Å; I130-L148 WeakPolarHBondContact CB-O 3.06Å; I130-L148 PolarHBondContact N-O 3.49Å; I130-I150 HydrophobicContact CD1-CD1 4.43Å; I130-I150 HydrophobicContact CD1-CG1 4.24Å; I130-L192 HydrophobicContact CD1-CD1 4.1Å; I130-L233 WeakPolarHBondContact O-CA 3.39Å; I130-G234 PolarHBondContact O-N 3.02Å; I130-Y249 HydrophobicContact CB-CD2 4.46Å; I130-Y249 HydrophobicContact CB-CG 4.44Å; I130-Y249 HydrophobicContact CD1-CD2 4.43Å; I130-Y249 HydrophobicContact CD1-CE2 4.29Å; I130-Y249 HydrophobicContact CG1-CD2 3.52Å; I130-Y249 HydrophobicContact CG1-CE2 3.8Å; I130-Y249 HydrophobicContact CG1-CG 3.97Å; I130-Y249 HydrophobicContact CG2-CD1 4.39Å; I130-Y249 HydrophobicContact CG2-CE1 4.45Å; I130-Y249 HydrophobicContact CG2-CG 4.46Å; I130-V253 HydrophobicContact CG2-CG2 3.94Å
131	I	95.1	Very high	81	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	127.4	-176.2	-43.5	-168	0	0	0	109.2	L114 A116 W146 R147 L148 L231 L232 L233 V256	L114-I131 HydrophobicContact CD1-CD1 4.42Å; L114-I131 HydrophobicContact CD2-CB 4.5Å; L114-I131 HydrophobicContact CD2-CD1 4.24Å; L114-I131 HydrophobicContact CD2-CG2 4.24Å; A116-I131 HydrophobicContact CB-CD1 3.9Å; I131-W146 HydrophobicContact CB-CZ3 4.22Å; I131-W146 HydrophobicContact CG2-CH2 3.8Å; I131-W146 HydrophobicContact CG2-CZ3 3.69Å; I131-R147 CarbonylContact O-C 3.51Å; I131-R147 VanDerWaalsContact O-CA 3.28Å; I131-R147 WeakPolarHBondContact O-CA 3.17Å; I131-L148 HydrophobicContact CB-CB 4.48Å; I131-L148 PolarHBondContact N-O 2.94Å; I131-L148 VanDerWaalsContact N-O 3.13Å; I131-L148 PolarHBondContact O-N 2.71Å; I131-L231 HydrophobicContact CG2-CD1 3.81Å; I131-L232 WeakPolarHBondContact CA-O 3.4Å; I131-L233 HydrophobicContact CB-CD2 4.06Å; I131-L233 HydrophobicContact CD1-CD2 3.84Å; I131-L233 HydrophobicContact CG1-CD2 3.57Å; I131-L233 HydrophobicContact CG2-CD2 3.8Å; I131-V256 HydrophobicContact CD1-CG1 4.18Å; I131-V256 HydrophobicContact CD1-CG2 4.37Å
132	E	92.9	Very high	79.5	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	136.9	178.4	178.4	171.7	91.8	0	0	110.9	V129 A134 F144 R147 L232 P236 M237	V129-E132 HydrophobicContact CG1-CB 3.81Å; E132-A134 HydrophobicContact CG-CB 4.3Å; E132-F144 HydrophobicContact CG-CB 3.77Å; E132-R147 HydrophobicContact CB-CB 4.06Å; E132-R147 HydrophobicContact CG-CB 4.1Å; E132-L232 HydrophobicContact CB-CB 4.38Å; E132-L232 PolarHBondContact N-O 2.75Å; E132-L232 PolarHBondContact O-N 2.86Å; E132-P236 VanDerWaalsContact OE1-CA 3.26Å; E132-P236 WeakPolarHBondContact OE1-CA 3.38Å; E132-M237 PolarHBondContact OE1-N 3.29Å
133	L	92.6	Very high	78.9	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	91.8	162	-174.3	67.1	0	0	0	108.1	F107 V145 W146 F221 K229 L231	F107-L133 HydrophobicContact CD1-CD1 4.1Å; F107-L133 HydrophobicContact CE1-CD1 4.16Å; F107-L133 HydrophobicContact CG-CD1 4.34Å; F107-L133 HydrophobicContact CZ-CD1 4.44Å; L133-V145 HydrophobicContact CB-CB 4.46Å; L133-V145 HydrophobicContact CD2-CB 4.18Å; L133-V145 HydrophobicContact CD2-CG1 4.24Å; L133-V145 HydrophobicContact CG-CB 4.36Å; L133-V145 PolarHBondContact O-N 2.61Å; L133-W146 HydrophobicContact CB-CD2 3.81Å; L133-W146 VanDerWaalsContact CB-CE2 3.46Å; L133-W146 HydrophobicContact CB-CE3 4.37Å; L133-W146 HydrophobicContact CB-CG 4.2Å; L133-W146 HydrophobicContact CB-CH2 4.28Å; L133-W146 HydrophobicContact CB-CZ2 3.73Å; L133-W146 HydrophobicContact CD2-CZ2 4.44Å; L133-W146 PolarHBondContact N-O 2.8Å; L133-F221 HydrophobicContact CD2-CE1 3.95Å; L133-K229 HydrophobicContact CD1-CB 4.14Å; L133-L231 HydrophobicContact CD1-CB 4.46Å
134	A	87.5	Confident	78.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	148.5	-176.8	0	0	0	0	0	112	E132 P143 K229 H230 L232 M237	E132-A134 HydrophobicContact CG-CB 4.3Å; A134-P143 CarbonylContact C-O 3.59Å; A134-P143 VanDerWaalsContact CA-O 3.28Å; A134-P143 WeakPolarHBondContact CA-O 3.39Å; A134-K229 WeakPolarHBondContact O-CA 3.41Å; A134-H230 HydrophobicContact CB-CB 4.47Å; A134-H230 PolarHBondContact N-O 3.26Å; A134-H230 PolarHBondContact O-N 2.81Å; A134-H230 VanDerWaalsContact O-N 3.11Å; A134-L232 HydrophobicContact CB-CD1 3.7Å; A134-L232 HydrophobicContact CB-CG 4.25Å; A134-M237 HydrophobicContact CB-CB 4.17Å; A134-M237 HydrophobicContact CB-CE 3.76Å
135	D	84.3	Confident	78.9	Confident	19 Å²	19	33.4 Å²	33.4	10%	0.102	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	96.4	169.2	-162.7	-14.9	0	0	0	110.6	C137 S138 P143 V145 C228 K229	D135-C137 PolarHBondContact O-N 2.03Å; D135-C137 PolarHBondContact OD1-N 2.82Å; D135-C137 VanDerWaalsContact OD1-N 3.16Å; D135-S138 PolarHBondContact O-N 2.92Å; D135-P143 PolarHBondContact N-O 2.93Å; D135-V145 HydrophobicContact CB-CG2 4.49Å; D135-C228 WeakPolarHBondContact OD1-CB 3.48Å; D135-K229 IonicContact OD1-NZ 2.81Å; D135-K229 PolarHBondContact OD1-NZ 2.82Å; D135-K229 VanDerWaalsContact OD2-CE 3.32Å; D135-K229 WeakPolarHBondContact OD2-CE 3.03Å; D135-K229 IonicContact OD2-NZ 3.26Å; D135-K229 PolarHBondContact OD2-NZ 2.92Å
136	G	75.7	Confident	79.6	Confident	25 Å²	25	33 Å²	33	26%	0.258	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.3	179.5	0	0	0	0	0	114.2	C228 R240	G136-C228 PolarHBondContact N-O 2.91Å; G136-R240 PolarHBondContact O-NH2 2.94Å
137	C	75.6	Confident	80.3	Confident	77 Å²	77	32.4 Å²	32.4	52%	0.52	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	4.9	-177.8	-61.8	0	0	0	0	114	D135 E139 C228	D135-C137 PolarHBondContact O-N 2.03Å; D135-C137 PolarHBondContact OD1-N 2.82Å; D135-C137 VanDerWaalsContact OD1-N 3.16Å; C137-E139 PolarHBondContact O-N 2.83Å; C137-C228 HydrophobicContact CB-CB 3.52Å; C137-C228 WeakPolarHBondContact CB-SG 3.28Å; C137-C228 WeakPolarHBondContact SG-CB 3.06Å; C137-C228 CovalentContact SG-SG 2.03Å; C137-C228 PolarHBondContact SG-SG 3.14Å
138	S	68.3	Low	80.8	Confident	19 Å²	19	30.7 Å²	30.7	13%	0.133	18%	0.179	C	C	.	.			trans	-79.4	116.6	174.1	-173.6	0	0	0	0	110.1	D135 G141 R240	D135-S138 PolarHBondContact O-N 2.92Å; S138-G141 WeakPolarHBondContact OG-CA 3.21Å; S138-G141 PolarHBondContact OG-N 2.03Å; S138-G141 PolarHBondContact OG-O 2.92Å; S138-R240 PolarHBondContact O-NH1 3.13Å; S138-R240 PolarHBondContact O-NH2 2.87Å
139	E	59.5	Low	81	Confident	178 Å²	178	30.7 Å²	30.7	83%	0.832	18%	0.179	S	C	*	.	S	Bend	trans	-95	-43.4	170.5	-64	-168.6	159	0	0	111.3	C137	C137-E139 PolarHBondContact O-N 2.83Å
140	D	55.6	Low	81.1	Confident	172 Å²	172	30.7 Å²	30.7	92%	0.92	18%	0.179	S	C	*	.	S	Bend	trans	-105.5	-5.1	-176.5	-62.8	-50.7	0	0	0	115.4
141	G	51.6	Low	80.8	Confident	33 Å²	33	30.8 Å²	30.8	34%	0.34	18%	0.18	S	C	.	.	S	Bend	trans	-106.9	166.1	-177.8	0	0	0	0	0	113.5	S138	S138-G141 WeakPolarHBondContact OG-CA 3.21Å; S138-G141 PolarHBondContact OG-N 2.03Å; S138-G141 PolarHBondContact OG-O 2.92Å
142	P	58.8	Low	80.3	Confident	47 Å²	47	31.4 Å²	31.4	31%	0.305	19%	0.185	S	C	.	.			trans	-54.4	137.4	173.5	25.1	-33.7	0	0	0	109.8	F144 K168	P142-F144 HydrophobicContact CB-CD1 4.29Å; P142-F144 HydrophobicContact CB-CE1 3.9Å; P142-F144 HydrophobicContact CB-CZ 4.08Å; P142-F144 PolarHBondContact O-N 2.75Å; P142-K168 HydrophobicContact CG-CD 3.65Å
143	P	71.2	Confident	79.4	Confident	19 Å²	19	35.7 Å²	35.7	12%	0.123	20%	0.203	C	C	.	.	S	Bend	trans	-74.2	11.1	-169.3	31.6	-37.7	0	0	0	113.8	A134 D135 R240 Y241	A134-P143 CarbonylContact C-O 3.59Å; A134-P143 VanDerWaalsContact CA-O 3.28Å; A134-P143 WeakPolarHBondContact CA-O 3.39Å; D135-P143 PolarHBondContact N-O 2.93Å; P143-R240 HydrophobicContact CB-CB 4.03Å; P143-R240 HydrophobicContact CB-CG 4.02Å; P143-R240 HydrophobicContact CG-CB 4.2Å; P143-Y241 HydrophobicContact CG-CE1 4.39Å; P143-Y241 HydrophobicContact CG-CE2 3.75Å; P143-Y241 WeakPolarHBondContact CG-OH 3.04Å
144	F	80.1	Confident	77.7	Confident	14 Å²	14	41 Å²	41	6%	0.061	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	149.5	-177.7	64.4	-95.6	0	0	0	111.7	E132 P142 R147 Q166	E132-F144 HydrophobicContact CG-CB 3.77Å; P142-F144 HydrophobicContact CB-CD1 4.29Å; P142-F144 HydrophobicContact CB-CE1 3.9Å; P142-F144 HydrophobicContact CB-CZ 4.08Å; P142-F144 PolarHBondContact O-N 2.75Å; F144-R147 HydrophobicContact CD2-CG 4.24Å; F144-R147 HydrophobicContact CE2-CG 4.48Å; F144-R147 HydrophobicContact CG-CG 4.33Å; F144-Q166 HydrophobicContact CE2-CG 3.8Å; F144-Q166 HydrophobicContact CZ-CG 3.91Å
145	V	87.7	Confident	75.9	Confident	6 Å²	6	44.7 Å²	44.7	4%	0.036	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-49.5	165.6	175	0	0	0	0	109.6	L133 D135 M167 K168 L220 F221 K229	L133-V145 HydrophobicContact CB-CB 4.46Å; L133-V145 HydrophobicContact CD2-CB 4.18Å; L133-V145 HydrophobicContact CD2-CG1 4.24Å; L133-V145 HydrophobicContact CG-CB 4.36Å; L133-V145 PolarHBondContact O-N 2.61Å; D135-V145 HydrophobicContact CB-CG2 4.49Å; V145-M167 WeakPolarHBondContact O-CA 3.27Å; V145-K168 PolarHBondContact O-N 3.01Å; V145-L220 HydrophobicContact CG1-CB 3.68Å; V145-L220 HydrophobicContact CG1-CD1 4.21Å; V145-L220 HydrophobicContact CG1-CD2 4.02Å; V145-L220 HydrophobicContact CG1-CG 4.2Å; V145-F221 HydrophobicContact CG1-CD1 4.19Å; V145-F221 HydrophobicContact CG2-CD1 4.16Å; V145-K229 HydrophobicContact CG2-CD 3.63Å; V145-K229 VanDerWaalsContact CG2-CE 3.47Å
146	W	93.2	Very high	74.4	Confident	6 Å²	6	46.1 Å²	46.1	2%	0.023	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	156.9	170.4	56.9	-106	0	0	0	111.1	F112 L114 I131 L133 F165 Q166 M167 L231	F112-W146 AromaticContact CZ-CD1 3.75Å; F112-W146 HydrophobicContact CZ-CG 4.23Å; F112-W146 AromaticContact CZ-NE1 3.76Å; L114-W146 HydrophobicContact CD2-CE3 4.5Å; L114-W146 HydrophobicContact CD2-CH2 3.61Å; L114-W146 HydrophobicContact CD2-CZ2 4.47Å; L114-W146 HydrophobicContact CD2-CZ3 3.62Å; I131-W146 HydrophobicContact CB-CZ3 4.22Å; I131-W146 HydrophobicContact CG2-CH2 3.8Å; I131-W146 HydrophobicContact CG2-CZ3 3.69Å; L133-W146 HydrophobicContact CB-CD2 3.81Å; L133-W146 VanDerWaalsContact CB-CE2 3.46Å; L133-W146 HydrophobicContact CB-CE3 4.37Å; L133-W146 HydrophobicContact CB-CG 4.2Å; L133-W146 HydrophobicContact CB-CH2 4.28Å; L133-W146 HydrophobicContact CB-CZ2 3.73Å; L133-W146 HydrophobicContact CD2-CZ2 4.44Å; L133-W146 PolarHBondContact N-O 2.8Å; W146-F165 HydrophobicContact CB-CE2 3.86Å; W146-F165 HydrophobicContact CB-CZ 3.84Å; W146-F165 HydrophobicContact CD2-CE2 4.17Å; W146-F165 HydrophobicContact CD2-CZ 4.35Å; W146-F165 AromaticContact CE3-CE2 3.87Å; W146-F165 HydrophobicContact CE3-CE2 3.87Å; W146-F165 HydrophobicContact CE3-CZ 4.47Å; W146-F165 HydrophobicContact CG-CE2 4.21Å; W146-F165 HydrophobicContact CG-CZ 4.11Å; W146-Q166 CarbonylContact C-O 3.5Å; W146-Q166 WeakPolarHBondContact CA-O 3.38Å; W146-M167 HydrophobicContact CB-CB 3.96Å; W146-M167 HydrophobicContact CB-CG 3.92Å; W146-L231 HydrophobicContact CH2-CD1 3.7Å; W146-L231 HydrophobicContact CZ2-CD1 4.23Å
147	R	93.9	Very high	74	Confident	25 Å²	25	50 Å²	50	9%	0.094	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	142.3	173	62	-176	-172.8	171.7	10.2	111.9	V129 I131 E132 F144 Y164 F165 Q166 Y241	V129-R147 HydrophobicContact CG1-CB 4.34Å; I131-R147 CarbonylContact O-C 3.51Å; I131-R147 VanDerWaalsContact O-CA 3.28Å; I131-R147 WeakPolarHBondContact O-CA 3.17Å; E132-R147 HydrophobicContact CB-CB 4.06Å; E132-R147 HydrophobicContact CG-CB 4.1Å; F144-R147 HydrophobicContact CD2-CG 4.24Å; F144-R147 HydrophobicContact CE2-CG 4.48Å; F144-R147 HydrophobicContact CG-CG 4.33Å; R147-Y164 HydrophobicContact CG-CE2 4.15Å; R147-F165 WeakPolarHBondContact O-CD2 3.36Å; R147-Q166 HydrophobicContact CG-CB 4.06Å; R147-Q166 VanDerWaalsContact CZ-OE1 3.28Å; R147-Q166 PolarHBondContact N-O 2.82Å; R147-Q166 PolarHBondContact O-N 2.67Å; R147-Y241 PolarHBondContact NH1-OH 3.4Å; R147-Y241 VanDerWaalsContact NH1-OH 3.13Å
148	L	96	Very high	73.7	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129.5	175.8	-177.9	69	0	0	0	108	L114 I130 I131 Y164 F165 L192 V194 L203	L114-L148 HydrophobicContact CD2-CD2 4.37Å; I130-L148 WeakPolarHBondContact CB-O 3.06Å; I130-L148 PolarHBondContact N-O 3.49Å; I131-L148 HydrophobicContact CB-CB 4.48Å; I131-L148 PolarHBondContact N-O 2.94Å; I131-L148 VanDerWaalsContact N-O 3.13Å; I131-L148 PolarHBondContact O-N 2.71Å; L148-Y164 WeakPolarHBondContact CA-O 3.35Å; L148-F165 HydrophobicContact CB-CD2 4.09Å; L148-F165 HydrophobicContact CD1-CB 4.15Å; L148-F165 HydrophobicContact CD1-CD2 4.14Å; L148-L192 HydrophobicContact CD1-CD1 4.16Å; L148-L192 HydrophobicContact CD2-CB 4.08Å; L148-L192 HydrophobicContact CD2-CD1 3.93Å; L148-L192 HydrophobicContact CG-CD1 4.09Å; L148-V194 HydrophobicContact CD1-CG1 4.09Å; L148-L203 HydrophobicContact CD1-CD1 4.19Å
149	G	94.9	Very high	74.2	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	-170.8	-170.3	0	0	0	0	0	114.5	S128 Y163 Y164	S128-G149 CarbonylContact O-C 3.17Å; S128-G149 WeakPolarHBondContact O-CA 3.25Å; G149-Y163 CarbonylContact O-C 3.06Å; G149-Y163 WeakPolarHBondContact O-CA 3.35Å; G149-Y164 VanDerWaalsContact CA-CE1 3.49Å; G149-Y164 PolarHBondContact N-O 3.35Å; G149-Y164 WeakPolarHBondContact O-CD1 3.2Å; G149-Y164 PolarHBondContact O-N 3.41Å
150	I	93.2	Very high	74.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	142.1	174.7	-63.5	164.9	0	0	0	108.8	P120 Q124 P127 S128 I130 A161 H162 Y163 Y164 Y184 Y249	P120-I150 HydrophobicContact CB-CD1 3.79Å; P120-I150 HydrophobicContact CG-CD1 4.4Å; Q124-I150 HydrophobicContact CB-CG2 4.31Å; Q124-I150 HydrophobicContact CG-CB 4.27Å; Q124-I150 HydrophobicContact CG-CD1 3.88Å; Q124-I150 HydrophobicContact CG-CG2 4.03Å; P127-I150 CarbonylContact C-O 3.45Å; P127-I150 WeakPolarHBondContact CA-O 3.38Å; S128-I150 PolarHBondContact N-O 2.89Å; S128-I150 PolarHBondContact O-N 3.28Å; I130-I150 HydrophobicContact CD1-CD1 4.43Å; I130-I150 HydrophobicContact CD1-CG1 4.24Å; I150-A161 HydrophobicContact CG2-CB 3.88Å; I150-H162 CarbonylContact C-O 3.5Å; I150-H162 WeakPolarHBondContact CA-O 3.36Å; I150-Y163 HydrophobicContact CD1-CD1 4.24Å; I150-Y163 HydrophobicContact CD1-CE1 3.9Å; I150-Y163 HydrophobicContact CG1-CD1 3.63Å; I150-Y163 HydrophobicContact CG1-CE1 3.82Å; I150-Y164 WeakPolarHBondContact O-CE1 3.24Å; I150-Y184 HydrophobicContact CD1-CD1 4.2Å; I150-Y184 HydrophobicContact CD1-CE1 4.46Å; I150-Y184 HydrophobicContact CD1-CG 4.23Å; I150-Y184 HydrophobicContact CG2-CD1 3.48Å; I150-Y184 VanDerWaalsContact CG2-CD1 3.48Å; I150-Y184 HydrophobicContact CG2-CE1 3.64Å; I150-Y184 HydrophobicContact CG2-CG 4.44Å; I150-Y249 HydrophobicContact CD1-CD2 4.47Å; I150-Y249 HydrophobicContact CD1-CE2 4.15Å
151	G	89.3	Confident	76.4	Confident	2 Å²	2	40.5 Å²	40.5	2%	0.021	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.5	175.6	174.4	0	0	0	0	0	113.2	D126 A161 H162 W179	D126-G151 VanDerWaalsContact OD1-CA 3.23Å; D126-G151 WeakPolarHBondContact OD1-CA 3.49Å; G151-A161 CarbonylContact O-C 3.53Å; G151-A161 WeakPolarHBondContact O-CA 3.29Å; G151-H162 PolarHBondContact N-O 2.03Å; G151-H162 PolarHBondContact O-N 3.27Å; G151-W179 WeakPolarHBondContact O-CZ3 3.33Å
152	T	84.9	Confident	78.3	Confident	15 Å²	15	39.9 Å²	39.9	9%	0.092	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	141.3	178.3	71.2	0	0	0	0	111.5	D126 T154 W179	D126-T152 PolarHBondContact OD1-N 3.45Å; D126-T152 WeakPolarHBondContact OD2-CB 3.33Å; D126-T152 WeakPolarHBondContact OD2-CG2 3.48Å; D126-T152 PolarHBondContact OD2-OG1 3.44Å; T152-T154 VanDerWaalsContact C-N 3.31Å; T152-T154 PolarHBondContact O-N 2.77Å; T152-T154 PolarHBondContact OG1-O 3.17Å; T152-W179 VanDerWaalsContact O-CH2 3.25Å; T152-W179 WeakPolarHBondContact O-CH2 3.35Å
153	K	74.1	Confident	80	Confident	89 Å²	89	37.7 Å²	37.7	39%	0.387	22%	0.215	S	C	.	.	S	Bend	trans	-71.3	-26.9	-178.6	-76.3	170.4	174.4	164	0	113.4	H162 W179 S180 H181	K153-H162 WeakPolarHBondContact CE-CD2 3.32Å; K153-H162 PolarHBondContact NZ-CD2 2.94Å; K153-H162 PolarHBondContact NZ-NE2 2.9Å; K153-W179 HydrophobicContact CG-CD2 3.76Å; K153-W179 HydrophobicContact CG-CE3 3.8Å; K153-W179 HydrophobicContact CG-CG 4.14Å; K153-W179 HydrophobicContact CG-CZ3 4.22Å; K153-S180 WeakPolarHBondContact CE-O 3.06Å; K153-S180 PolarHBondContact NZ-O 2.84Å; K153-H181 PolarHBondContact NZ-O 3.11Å
154	T	56.9	Low	81	Confident	113 Å²	113	37.1 Å²	37.1	69%	0.693	21%	0.21	S	C	*	.	S	Bend	trans	-140.3	134.6	-173.8	48.3	0	0	0	0	106.4	T152 G156	T152-T154 VanDerWaalsContact C-N 3.31Å; T152-T154 PolarHBondContact O-N 2.77Å; T152-T154 PolarHBondContact OG1-O 3.17Å; T154-G156 PolarHBondContact O-N 3.26Å
155	G	49.6	Very low	81.7	Confident	78 Å²	78	36.4 Å²	36.4	80%	0.804	21%	0.207	S	C	*	.	S	Bend	trans	-64.5	20.1	-164.3	0	0	0	0	0	119.1	R157	G155-R157 PolarHBondContact O-N 2.83Å
156	G	53.1	Low	82	Confident	50 Å²	50	37.4 Å²	37.4	52%	0.515	21%	0.211	S	C	.	.			trans	-77.1	101.7	155.9	0	0	0	0	0	109	T154 E158	T154-G156 PolarHBondContact O-N 3.26Å; G156-E158 PolarHBondContact O-N 3Å; G156-E158 VanDerWaalsContact O-N 3.15Å
157	R	66.3	Low	82	Confident	106 Å²	106	37.1 Å²	37.1	40%	0.4	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-6.1	-172.9	-69.6	178.7	167.5	-172	-6.6	115.5	G155 A824 D825 L848	G155-R157 PolarHBondContact O-N 2.83Å; R157-A824 HydrophobicContact CB-CB 3.46Å; R157-A824 VanDerWaalsContact CB-CB 3.46Å; R157-D825 IonicContact CZ-OD2 2.82Å; R157-D825 IonicContact NH1-OD2 3.72Å; R157-D825 PolarHBondContact NH1-OD2 3.42Å; R157-L848 WeakPolarHBondContact O-CD2 2.99Å
158	E	70.6	Confident	81.8	Confident	61 Å²	61	38.4 Å²	38.4	29%	0.285	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-23.2	-162.3	-67.1	178.5	-175.1	0	0	114.7	G156 A824 L848 C849	G156-E158 PolarHBondContact O-N 3Å; G156-E158 VanDerWaalsContact O-N 3.15Å; E158-A824 HydrophobicContact CB-CB 4.41Å; E158-A824 HydrophobicContact CG-CB 3.49Å; E158-A824 VanDerWaalsContact CG-CB 3.49Å; E158-L848 CarbonylContact O-C 3.55Å; E158-L848 VanDerWaalsContact O-CA 3.27Å; E158-L848 WeakPolarHBondContact O-CA 3.37Å; E158-C849 PolarHBondContact O-N 2.74Å; E158-C849 PolarHBondContact O-SG 2.84Å
159	R	77.7	Confident	81.4	Confident	158 Å²	158	38.4 Å²	38.4	60%	0.596	22%	0.217	S	C	*	.	S	Bend	trans	-153.1	165.7	-175.5	69.9	-177.4	-175.3	178.2	-2.2	113.4	C780 D850	R159-C780 VanDerWaalsContact CB-SG 3.59Å; R159-C780 VanDerWaalsContact CD-SG 3.57Å; R159-D850 HydrophobicContact CB-CB 4.23Å
160	G	74	Confident	80.7	Confident	23 Å²	23	42.1 Å²	42.1	24%	0.237	23%	0.234	C	C	.	.			trans	67.5	47	174.7	0	0	0	0	0	111.9	H162 D850	G160-H162 PolarHBondContact O-CE1 3.09Å; G160-H162 PolarHBondContact O-N 3.18Å; G160-H162 PolarHBondContact O-ND1 3.19Å; G160-D850 PolarHBondContact N-OD2 2.87Å
161	A	87.1	Confident	80	Confident	4 Å²	4	48.1 Å²	48.1	3%	0.033	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	120.8	171	0	0	0	0	0	110.2	I150 G151 G183 Y184 L848	I150-A161 HydrophobicContact CG2-CB 3.88Å; G151-A161 CarbonylContact O-C 3.53Å; G151-A161 WeakPolarHBondContact O-CA 3.29Å; A161-G183 CarbonylContact O-C 3.53Å; A161-G183 WeakPolarHBondContact O-CA 3.36Å; A161-Y184 HydrophobicContact CB-CD1 3.77Å; A161-Y184 HydrophobicContact CB-CE1 3.58Å; A161-Y184 WeakPolarHBondContact O-CD1 3.46Å; A161-Y184 PolarHBondContact O-N 2.82Å; A161-L848 HydrophobicContact CB-CD1 3.55Å; A161-L848 HydrophobicContact CB-CD2 4.38Å
162	H	91.3	Very high	79.4	Confident	21 Å²	21	49.3 Å²	49.3	10%	0.097	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	153.2	-173.9	-74.3	74.9	0	0	0	111.4	I150 G151 K153 G160 W179 S180 H181 Y182 G183	I150-H162 CarbonylContact C-O 3.5Å; I150-H162 WeakPolarHBondContact CA-O 3.36Å; G151-H162 PolarHBondContact N-O 2.03Å; G151-H162 PolarHBondContact O-N 3.27Å; K153-H162 WeakPolarHBondContact CE-CD2 3.32Å; K153-H162 PolarHBondContact NZ-CD2 2.94Å; K153-H162 PolarHBondContact NZ-NE2 2.9Å; G160-H162 PolarHBondContact O-CE1 3.09Å; G160-H162 PolarHBondContact O-N 3.18Å; G160-H162 PolarHBondContact O-ND1 3.19Å; H162-W179 HydrophobicContact CB-CE3 3.86Å; H162-W179 HydrophobicContact CB-CZ3 4.31Å; H162-S180 WeakPolarHBondContact CB-OG 3.47Å; H162-S180 PolarHBondContact CD2-O 3.44Å; H162-S180 VanDerWaalsContact CD2-O 3.25Å; H162-H181 PolarHBondContact NE2-O 2.99Å; H162-Y182 PolarHBondContact CD2-O 3.32Å; H162-Y182 VanDerWaalsContact NE2-C 3.34Å; H162-G183 PolarHBondContact NE2-N 3.12Å
163	Y	94.2	Very high	78.8	Confident	1 Å²	1	53.6 Å²	53.6	0%	0.004	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	135.5	167.1	-59.6	-61.2	0	0	0	110	I118 G149 I150 W179 S180 Y184 T190 L192 V205	I118-Y163 HydrophobicContact CD1-CD1 4.07Å; I118-Y163 HydrophobicContact CD1-CE1 3.26Å; G149-Y163 CarbonylContact O-C 3.06Å; G149-Y163 WeakPolarHBondContact O-CA 3.35Å; I150-Y163 HydrophobicContact CD1-CD1 4.24Å; I150-Y163 HydrophobicContact CD1-CE1 3.9Å; I150-Y163 HydrophobicContact CG1-CD1 3.63Å; I150-Y163 HydrophobicContact CG1-CE1 3.82Å; Y163-W179 CarbonylContact O-C 3.57Å; Y163-W179 WeakPolarHBondContact O-CA 3.41Å; Y163-S180 PolarHBondContact N-OG 3.46Å; Y163-S180 VanDerWaalsContact N-OG 3.07Å; Y163-S180 PolarHBondContact O-N 2.89Å; Y163-S180 PolarHBondContact O-OG 3.42Å; Y163-Y184 VanDerWaalsContact CZ-CB 3.46Å; Y163-T190 HydrophobicContact CE2-CG2 3.75Å; Y163-T190 WeakPolarHBondContact OH-CB 3.5Å; Y163-T190 PolarHBondContact OH-OG1 2.71Å; Y163-L192 HydrophobicContact CD1-CD1 3.81Å; Y163-L192 HydrophobicContact CD1-CD2 4.18Å; Y163-L192 HydrophobicContact CD2-CD2 3.86Å; Y163-L192 HydrophobicContact CE1-CD1 4.16Å; Y163-L192 HydrophobicContact CE2-CD2 4.18Å; Y163-L192 HydrophobicContact CG-CD1 4.21Å; Y163-L192 HydrophobicContact CG-CD2 3.84Å; Y163-V205 HydrophobicContact CD2-CG1 4.33Å; Y163-V205 HydrophobicContact CD2-CG2 4.41Å; Y163-V205 HydrophobicContact CE2-CG1 4.32Å
164	Y	93.5	Very high	79	Confident	6 Å²	6	58.6 Å²	58.6	2%	0.024	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	148.8	175.8	78.9	-90.7	0	0	0	112.2	P127 S128 R147 L148 G149 I150 Q166 V177 L178 W179	P127-Y164 HydrophobicContact CB-CE1 3.9Å; S128-Y164 PolarHBondContact O-OH 3.08Å; R147-Y164 HydrophobicContact CG-CE2 4.15Å; L148-Y164 WeakPolarHBondContact CA-O 3.35Å; G149-Y164 VanDerWaalsContact CA-CE1 3.49Å; G149-Y164 PolarHBondContact N-O 3.35Å; G149-Y164 WeakPolarHBondContact O-CD1 3.2Å; G149-Y164 PolarHBondContact O-N 3.41Å; I150-Y164 WeakPolarHBondContact O-CE1 3.24Å; Y164-Q166 HydrophobicContact CD2-CB 4.07Å; Y164-Q166 HydrophobicContact CE2-CB 4.04Å; Y164-V177 HydrophobicContact CD2-CG1 4.27Å; Y164-L178 CarbonylContact C-O 3.52Å; Y164-L178 WeakPolarHBondContact CA-O 3.17Å; Y164-W179 HydrophobicContact CD1-CZ3 4.29Å; Y164-W179 HydrophobicContact CG-CZ3 4.29Å
165	F	95.2	Very high	80.3	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	117.8	169	-173.6	-131.6	0	0	0	110.6	F112 W146 R147 L148 V177 L178 V194 L201 L203	F112-F165 HydrophobicContact CE2-CZ 4.32Å; F112-F165 AromaticContact CZ-CZ 3.98Å; F112-F165 HydrophobicContact CZ-CZ 3.98Å; W146-F165 HydrophobicContact CB-CE2 3.86Å; W146-F165 HydrophobicContact CB-CZ 3.84Å; W146-F165 HydrophobicContact CD2-CE2 4.17Å; W146-F165 HydrophobicContact CD2-CZ 4.35Å; W146-F165 AromaticContact CE3-CE2 3.87Å; W146-F165 HydrophobicContact CE3-CE2 3.87Å; W146-F165 HydrophobicContact CE3-CZ 4.47Å; W146-F165 HydrophobicContact CG-CE2 4.21Å; W146-F165 HydrophobicContact CG-CZ 4.11Å; R147-F165 WeakPolarHBondContact O-CD2 3.36Å; L148-F165 HydrophobicContact CB-CD2 4.09Å; L148-F165 HydrophobicContact CD1-CB 4.15Å; L148-F165 HydrophobicContact CD1-CD2 4.14Å; F165-V177 CarbonylContact O-C 3.58Å; F165-V177 WeakPolarHBondContact O-CA 3.49Å; F165-L178 HydrophobicContact CB-CB 4.49Å; F165-L178 PolarHBondContact N-O 2.88Å; F165-L178 PolarHBondContact O-N 3.36Å; F165-V194 HydrophobicContact CB-CG1 3.91Å; F165-V194 HydrophobicContact CD1-CB 3.76Å; F165-V194 HydrophobicContact CD1-CG1 3.53Å; F165-V194 HydrophobicContact CD1-CG2 4.3Å; F165-V194 HydrophobicContact CD2-CB 4.43Å; F165-V194 HydrophobicContact CD2-CG1 3.9Å; F165-V194 HydrophobicContact CD2-CG2 4.27Å; F165-V194 HydrophobicContact CE1-CB 3.63Å; F165-V194 HydrophobicContact CE1-CG1 3.93Å; F165-V194 HydrophobicContact CE1-CG2 3.83Å; F165-V194 HydrophobicContact CE2-CB 4.37Å; F165-V194 HydrophobicContact CE2-CG1 4.32Å; F165-V194 HydrophobicContact CE2-CG2 3.87Å; F165-V194 HydrophobicContact CG-CB 4.18Å; F165-V194 HydrophobicContact CG-CG1 3.52Å; F165-V194 HydrophobicContact CZ-CB 3.99Å; F165-V194 HydrophobicContact CZ-CG1 4.34Å; F165-V194 HydrophobicContact CZ-CG2 3.64Å; F165-L201 HydrophobicContact CD1-CD1 3.96Å; F165-L201 HydrophobicContact CD1-CD2 4.26Å; F165-L201 HydrophobicContact CD1-CG 4.14Å; F165-L201 HydrophobicContact CE1-CD1 3.46Å; F165-L201 VanDerWaalsContact CE1-CD1 3.46Å; F165-L201 HydrophobicContact CE1-CD2 4.46Å; F165-L201 HydrophobicContact CE1-CG 4.16Å; F165-L203 HydrophobicContact CB-CD1 4.26Å; F165-L203 HydrophobicContact CB-CD2 4.47Å
166	Q	93.3	Very high	82.1	Confident	26 Å²	26	52.4 Å²	52.4	12%	0.121	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.8	-178.6	-176.6	172	17.1	0	0	110.5	F144 W146 R147 Y164 S175 S176 V177	F144-Q166 HydrophobicContact CE2-CG 3.8Å; F144-Q166 HydrophobicContact CZ-CG 3.91Å; W146-Q166 CarbonylContact C-O 3.5Å; W146-Q166 WeakPolarHBondContact CA-O 3.38Å; R147-Q166 HydrophobicContact CG-CB 4.06Å; R147-Q166 VanDerWaalsContact CZ-OE1 3.28Å; R147-Q166 PolarHBondContact N-O 2.82Å; R147-Q166 PolarHBondContact O-N 2.67Å; Y164-Q166 HydrophobicContact CD2-CB 4.07Å; Y164-Q166 HydrophobicContact CE2-CB 4.04Å; Q166-S175 PolarHBondContact NE2-OG 3.2Å; Q166-S176 VanDerWaalsContact CA-O 3.29Å; Q166-S176 WeakPolarHBondContact CA-O 3.27Å; Q166-V177 HydrophobicContact CB-CG2 4.14Å; Q166-V177 HydrophobicContact CG-CG2 3.81Å
167	M	92.2	Very high	83.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	146.1	-179.5	-177	178.7	85.7	0	0	112.1	F112 V145 W146 T169 S175 S176 Y196 L201 Q216 L220	F112-M167 HydrophobicContact CE1-SD 4.37Å; V145-M167 WeakPolarHBondContact O-CA 3.27Å; W146-M167 HydrophobicContact CB-CB 3.96Å; W146-M167 HydrophobicContact CB-CG 3.92Å; M167-T169 HydrophobicContact CE-CG2 4.07Å; M167-S175 CarbonylContact O-C 3.59Å; M167-S175 VanDerWaalsContact O-CA 3.23Å; M167-S175 WeakPolarHBondContact O-CA 3.38Å; M167-S175 WeakPolarHBondContact O-CB 3.49Å; M167-S176 PolarHBondContact N-O 2.97Å; M167-S176 PolarHBondContact O-N 2.89Å; M167-Y196 HydrophobicContact CE-CD1 4.15Å; M167-Y196 HydrophobicContact CE-CD2 3.59Å; M167-Y196 HydrophobicContact CE-CE1 4.07Å; M167-Y196 HydrophobicContact CE-CE2 3.54Å; M167-Y196 HydrophobicContact CE-CG 3.91Å; M167-Y196 HydrophobicContact SD-CD1 4.25Å; M167-Y196 HydrophobicContact SD-CD2 4.35Å; M167-Y196 HydrophobicContact SD-CG 4.1Å; M167-L201 HydrophobicContact CB-CD1 4.43Å; M167-L201 HydrophobicContact CB-CD2 4.15Å; M167-L201 HydrophobicContact CE-CD1 3.48Å; M167-L201 VanDerWaalsContact CE-CD1 3.48Å; M167-L201 HydrophobicContact CE-CD2 4.21Å; M167-L201 HydrophobicContact CE-CG 4.31Å; M167-L201 HydrophobicContact SD-CD1 3.59Å; M167-L201 VanDerWaalsContact SD-CD1 3.59Å; M167-Q216 HydrophobicContact CE-CB 3.45Å; M167-Q216 VanDerWaalsContact CE-CB 3.45Å; M167-Q216 HydrophobicContact CE-CG 3.81Å; M167-L220 HydrophobicContact CE-CD2 4.34Å; M167-L220 HydrophobicContact CG-CD2 4.12Å; M167-L220 HydrophobicContact SD-CD2 3.49Å; M167-L220 WeakPolarHBondContact SD-CD2 3.26Å
168	K	89.8	Confident	85	Confident	52 Å²	52	48.2 Å²	48.2	23%	0.226	24%	0.243	C	C	.	.			trans	-134.3	119.5	170.2	-175.6	-178	177.1	179.4	0	109.5	P142 V145 S172 S173	P142-K168 HydrophobicContact CG-CD 3.65Å; V145-K168 PolarHBondContact O-N 3.01Å; K168-S172 WeakPolarHBondContact CE-O 3.27Å; K168-S173 WeakPolarHBondContact CE-O 3.27Å; K168-S173 PolarHBondContact NZ-O 2.75Å
169	T	88	Confident	85.9	Confident	2 Å²	2	49 Å²	49	1%	0.012	24%	0.243	C	C	.	.			trans	-77.3	159.3	170.5	65.5	0	0	0	0	111	M167 M171 S172 Y196 Q216 V217 L220	M167-T169 HydrophobicContact CE-CG2 4.07Å; T169-M171 PolarHBondContact O-N 2.93Å; T169-S172 PolarHBondContact O-N 2.95Å; T169-S172 PolarHBondContact OG1-N 3.33Å; T169-Y196 HydrophobicContact CG2-CE1 4.11Å; T169-Y196 WeakPolarHBondContact CG2-OH 3.41Å; T169-Q216 HydrophobicContact CG2-CB 4.11Å; T169-V217 WeakPolarHBondContact CB-O 3.35Å; T169-V217 PolarHBondContact OG1-O 3.24Å; T169-L220 HydrophobicContact CG2-CD2 4.33Å
170	E	80.2	Confident	86.5	Confident	78 Å²	78	41.6 Å²	41.6	36%	0.364	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.9	175.8	-174.5	167.9	-139.4	0	0	112.6	P219 L220 S222 K225	E170-P219 PolarHBondContact N-O 3.42Å; E170-L220 PolarHBondContact N-O 3.16Å; E170-S222 PolarHBondContact OE1-OG 2.65Å; E170-S222 VanDerWaalsContact OE1-OG 3.11Å; E170-S222 WeakPolarHBondContact OE2-CA 3.4Å; E170-S222 WeakPolarHBondContact OE2-CB 3.3Å; E170-S222 PolarHBondContact OE2-N 2.8Å; E170-S222 PolarHBondContact OE2-OG 2.76Å; E170-S222 VanDerWaalsContact OE2-OG 3.1Å; E170-K225 VanDerWaalsContact OE1-CD 3.31Å; E170-K225 WeakPolarHBondContact OE1-CD 3.4Å; E170-K225 VanDerWaalsContact OE1-CE 3.25Å; E170-K225 WeakPolarHBondContact OE1-CE 3.46Å; E170-K225 IonicContact OE1-NZ 3.35Å; E170-K225 PolarHBondContact OE1-NZ 3.08Å
171	M	79.5	Confident	86.6	Confident	125 Å²	125	42.4 Å²	42.4	62%	0.616	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-6.8	176.6	-49.3	-158	-38.9	0	0	114	T169 V217	T169-M171 PolarHBondContact O-N 2.93Å; M171-V217 HydrophobicContact CE-CB 4.43Å; M171-V217 HydrophobicContact CE-CG1 4.08Å
172	S	75.2	Confident	86.1	Confident	27 Å²	27	44 Å²	44	19%	0.189	22%	0.219	C	C	.	.			trans	-107.4	136	-177.3	-167.5	0	0	0	0	112.3	K168 T169 R174 Q216	K168-S172 WeakPolarHBondContact CE-O 3.27Å; T169-S172 PolarHBondContact O-N 2.95Å; T169-S172 PolarHBondContact OG1-N 3.33Å; S172-R174 PolarHBondContact OG-O 2.92Å; S172-Q216 VanDerWaalsContact CB-OE1 3.28Å; S172-Q216 PolarHBondContact OG-NE2 2.67Å
173	S	72.4	Confident	85.7	Confident	105 Å²	105	44.2 Å²	44.2	73%	0.734	23%	0.227	S	C	*	.	S	Bend	trans	-77.9	-28.3	177	60	0	0	0	0	112.9	K168	K168-S173 WeakPolarHBondContact CE-O 3.27Å; K168-S173 PolarHBondContact NZ-O 2.75Å
174	R	78.4	Confident	85.4	Confident	195 Å²	195	44.5 Å²	44.5	74%	0.736	23%	0.228	S	C	*	.	S	Bend	trans	-117.4	146.7	-177.1	-64.4	-177.1	177.1	-175.7	-0.5	111	S172 Q216	S172-R174 PolarHBondContact OG-O 2.92Å; R174-Q216 PolarHBondContact O-NE2 3.24Å
175	S	85.4	Confident	84.8	Confident	47 Å²	47	46.4 Å²	46.4	33%	0.329	24%	0.242	S	C	.	.			trans	-78.1	144.7	169	61.3	0	0	0	0	111.3	Q166 M167	Q166-S175 PolarHBondContact NE2-OG 3.2Å; M167-S175 CarbonylContact O-C 3.59Å; M167-S175 VanDerWaalsContact O-CA 3.23Å; M167-S175 WeakPolarHBondContact O-CA 3.38Å; M167-S175 WeakPolarHBondContact O-CB 3.49Å
176	S	86.4	Confident	84.1	Confident	14 Å²	14	47.5 Å²	47.5	10%	0.098	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	143.9	164.8	-64	0	0	0	0	110.1	Q166 M167 N215 Q216	Q166-S176 VanDerWaalsContact CA-O 3.29Å; Q166-S176 WeakPolarHBondContact CA-O 3.27Å; M167-S176 PolarHBondContact N-O 2.97Å; M167-S176 PolarHBondContact O-N 2.89Å; S176-N215 VanDerWaalsContact OG-CB 3.31Å; S176-N215 WeakPolarHBondContact OG-CB 3.48Å; S176-Q216 VanDerWaalsContact N-NE2 3.15Å; S176-Q216 WeakPolarHBondContact OG-CG 3.32Å; S176-Q216 PolarHBondContact OG-NE2 2.85Å
177	V	90	Very high	83.2	Confident	57 Å²	57	47.6 Å²	47.6	35%	0.345	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	124.9	173	-172	0	0	0	0	108.6	Y164 F165 Q166 W179	Y164-V177 HydrophobicContact CD2-CG1 4.27Å; F165-V177 CarbonylContact O-C 3.58Å; F165-V177 WeakPolarHBondContact O-CA 3.49Å; Q166-V177 HydrophobicContact CB-CG2 4.14Å; Q166-V177 HydrophobicContact CG-CG2 3.81Å; V177-W179 HydrophobicContact CG1-CD2 4.33Å; V177-W179 HydrophobicContact CG1-CZ2 4.11Å
178	L	91	Very high	82.6	Confident	11 Å²	11	49.4 Å²	49.4	6%	0.058	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	146.1	166.2	-59.2	-175.5	0	0	0	108.8	Y164 F165 L201 L203 A211	Y164-L178 CarbonylContact C-O 3.52Å; Y164-L178 WeakPolarHBondContact CA-O 3.17Å; F165-L178 HydrophobicContact CB-CB 4.49Å; F165-L178 PolarHBondContact N-O 2.88Å; F165-L178 PolarHBondContact O-N 3.36Å; L178-L201 HydrophobicContact CD1-CB 4.3Å; L178-L201 HydrophobicContact CD1-CD2 4.02Å; L178-L201 HydrophobicContact CD1-CG 3.82Å; L178-L201 HydrophobicContact CG-CD2 4.08Å; L178-L201 HydrophobicContact CG-CG 4.43Å; L178-L203 HydrophobicContact CB-CB 4.07Å; L178-L203 HydrophobicContact CB-CD2 4.16Å; L178-L203 HydrophobicContact CD1-CB 3.9Å; L178-A211 HydrophobicContact CB-CB 3.98Å; L178-A211 HydrophobicContact CD1-CB 4.5Å; L178-A211 HydrophobicContact CD2-CB 4.24Å; L178-A211 HydrophobicContact CG-CB 4.47Å
179	W	89.9	Confident	82.4	Confident	77 Å²	77	47.2 Å²	47.2	29%	0.292	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	148.7	179.5	-65.9	95.5	0	0	0	110.5	G151 T152 K153 H162 Y163 Y164 V177 A211	G151-W179 WeakPolarHBondContact O-CZ3 3.33Å; T152-W179 VanDerWaalsContact O-CH2 3.25Å; T152-W179 WeakPolarHBondContact O-CH2 3.35Å; K153-W179 HydrophobicContact CG-CD2 3.76Å; K153-W179 HydrophobicContact CG-CE3 3.8Å; K153-W179 HydrophobicContact CG-CG 4.14Å; K153-W179 HydrophobicContact CG-CZ3 4.22Å; H162-W179 HydrophobicContact CB-CE3 3.86Å; H162-W179 HydrophobicContact CB-CZ3 4.31Å; Y163-W179 CarbonylContact O-C 3.57Å; Y163-W179 WeakPolarHBondContact O-CA 3.41Å; Y164-W179 HydrophobicContact CD1-CZ3 4.29Å; Y164-W179 HydrophobicContact CG-CZ3 4.29Å; V177-W179 HydrophobicContact CG1-CD2 4.33Å; V177-W179 HydrophobicContact CG1-CZ2 4.11Å; W179-A211 WeakPolarHBondContact O-CB 3.19Å
180	S	88.5	Confident	82.5	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.014	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	161.5	161.5	61.2	0	0	0	0	110.6	K153 H162 Y163 Y182	K153-S180 WeakPolarHBondContact CE-O 3.06Å; K153-S180 PolarHBondContact NZ-O 2.84Å; H162-S180 WeakPolarHBondContact CB-OG 3.47Å; H162-S180 PolarHBondContact CD2-O 3.44Å; H162-S180 VanDerWaalsContact CD2-O 3.25Å; Y163-S180 PolarHBondContact N-OG 3.46Å; Y163-S180 VanDerWaalsContact N-OG 3.07Å; Y163-S180 PolarHBondContact O-N 2.89Å; Y163-S180 PolarHBondContact O-OG 3.42Å; S180-Y182 WeakPolarHBondContact CB-O 3.36Å; S180-Y182 PolarHBondContact OG-O 3.1Å
181	H	76.2	Confident	83.1	Confident	41 Å²	41	43.9 Å²	43.9	19%	0.19	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	-34.7	178.1	61.3	-75.5	0	0	0	112	K153 H162 F1016 S1027	K153-H181 PolarHBondContact NZ-O 3.11Å; H162-H181 PolarHBondContact NE2-O 2.99Å; H181-F1016 AromaticContact CE1-CE1 3.72Å; H181-F1016 AromaticContact CE1-CE2 3.61Å; H181-F1016 AromaticContact CE1-CZ 3.12Å; H181-F1016 WeakPolarHBondContact CE1-CZ 3.36Å; H181-F1016 AromaticContact NE2-CD2 4Å; H181-F1016 AromaticContact NE2-CE2 3.1Å; H181-F1016 WeakPolarHBondContact NE2-CE2 3.5Å; H181-F1016 AromaticContact NE2-CZ 3.17Å; H181-F1016 WeakPolarHBondContact NE2-CZ 3.29Å; H181-S1027 WeakPolarHBondContact CB-OG 3.29Å; H181-S1027 VanDerWaalsContact CG-OG 3.3Å
182	Y	77.3	Confident	83.9	Confident	38 Å²	38	38 Å²	38	15%	0.149	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	157.5	166.1	53.2	-113.6	0	0	0	113.1	H162 S180 V205 Y1003 F1016	H162-Y182 PolarHBondContact CD2-O 3.32Å; H162-Y182 VanDerWaalsContact NE2-C 3.34Å; S180-Y182 WeakPolarHBondContact CB-O 3.36Å; S180-Y182 PolarHBondContact OG-O 3.1Å; Y182-V205 HydrophobicContact CE2-CG1 4.04Å; Y182-V205 WeakPolarHBondContact OH-CB 3.36Å; Y182-V205 WeakPolarHBondContact OH-CG1 3.44Å; Y182-Y1003 AromaticContact CD1-CD1 3.97Å; Y182-Y1003 HydrophobicContact CD1-CD1 3.97Å; Y182-Y1003 HydrophobicContact CE1-CD1 4.14Å; Y182-Y1003 HydrophobicContact CE1-CG 4.33Å; Y182-Y1003 WeakPolarHBondContact CE1-O 3.45Å; Y182-Y1003 HydrophobicContact CG-CD1 4.42Å; Y182-Y1003 VanDerWaalsContact CZ-O 3.3Å; Y182-Y1003 PolarHBondContact OH-O 2.82Å; Y182-F1016 HydrophobicContact CE1-CZ 4.26Å
183	G	83.1	Confident	84.8	Confident	25 Å²	25	36.7 Å²	36.7	26%	0.258	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	160.2	170.4	0	0	0	0	0	112.6	A161 H162	A161-G183 CarbonylContact O-C 3.53Å; A161-G183 WeakPolarHBondContact O-CA 3.36Å; H162-G183 PolarHBondContact NE2-N 3.12Å
184	Y	87.1	Confident	85.9	Confident	6 Å²	6	31.7 Å²	31.7	2%	0.024	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-72.3	149.8	-179.2	84.2	-91.1	0	0	0	111.9	P120 E121 G122 G123 Q124 I150 A161 Y163 A186 L848 M851	P120-Y184 HydrophobicContact CB-CD2 3.74Å; P120-Y184 HydrophobicContact CB-CE2 3.71Å; P120-Y184 HydrophobicContact CG-CD2 3.32Å; P120-Y184 HydrophobicContact CG-CE2 3.78Å; P120-Y184 HydrophobicContact CG-CG 4.2Å; E121-Y184 WeakPolarHBondContact O-CE2 3.4Å; E121-Y184 PolarHBondContact O-OH 3.21Å; G122-Y184 WeakPolarHBondContact CA-OH 3.19Å; G123-Y184 PolarHBondContact N-OH 2.62Å; Q124-Y184 HydrophobicContact CG-CE1 3.93Å; Q124-Y184 WeakPolarHBondContact CG-OH 3.45Å; I150-Y184 HydrophobicContact CD1-CD1 4.2Å; I150-Y184 HydrophobicContact CD1-CE1 4.46Å; I150-Y184 HydrophobicContact CD1-CG 4.23Å; I150-Y184 HydrophobicContact CG2-CD1 3.48Å; I150-Y184 VanDerWaalsContact CG2-CD1 3.48Å; I150-Y184 HydrophobicContact CG2-CE1 3.64Å; I150-Y184 HydrophobicContact CG2-CG 4.44Å; A161-Y184 HydrophobicContact CB-CD1 3.77Å; A161-Y184 HydrophobicContact CB-CE1 3.58Å; A161-Y184 WeakPolarHBondContact O-CD1 3.46Å; A161-Y184 PolarHBondContact O-N 2.82Å; Y163-Y184 VanDerWaalsContact CZ-CB 3.46Å; Y184-A186 HydrophobicContact CE2-CB 4.28Å; Y184-L848 HydrophobicContact CE1-CD1 3.91Å; Y184-M851 HydrophobicContact CD1-CE 4.2Å; Y184-M851 HydrophobicContact CD2-SD 4.33Å; Y184-M851 HydrophobicContact CE1-CE 3.87Å; Y184-M851 HydrophobicContact CE1-SD 3.8Å; Y184-M851 HydrophobicContact CE2-CE 4.38Å; Y184-M851 HydrophobicContact CE2-SD 3.6Å; Y184-M851 VanDerWaalsContact CE2-SD 3.6Å; Y184-M851 WeakPolarHBondContact O-CE 3.12Å; Y184-M851 PolarHBondContact OH-SD 2.86Å
185	S	80.9	Confident	86.7	Confident	47 Å²	47	22.6 Å²	22.6	33%	0.329	13%	0.126	S	C	.	.	P	Polyproline II helix	trans	-98.4	121.5	171.3	-50.1	0	0	0	0	110.4
186	A	80.7	Confident	87	Confident	22 Å²	22	20.3 Å²	20.3	18%	0.182	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	144.6	174	0	0	0	0	0	111.9	P120 Y184 R188 M851	P120-A186 CarbonylContact O-C 3.54Å; P120-A186 WeakPolarHBondContact O-CA 3.47Å; Y184-A186 HydrophobicContact CE2-CB 4.28Å; A186-R188 PolarHBondContact O-N 3.1Å; A186-M851 HydrophobicContact CB-SD 4.16Å
187	Q	74.3	Confident	87	Confident	29 Å²	29	21.7 Å²	21.7	14%	0.136	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	7.1	177.8	-63.1	-66.1	-14.4	0	0	116.6	R119 P120 E121 E814	R119-Q187 PolarHBondContact NE-O 2.73Å; P120-Q187 PolarHBondContact O-N 3.18Å; E121-Q187 PolarHBondContact OE1-NE2 3.4Å; Q187-E814 PolarHBondContact NE2-OE1 3Å
188	R	79.4	Confident	86.9	Confident	37 Å²	37	22.6 Å²	22.6	14%	0.14	12%	0.117	C	C	.	.			trans	-100.8	134.8	175.2	-172.9	171.3	174.5	150.6	-2.5	111.1	A186 T190 F329 D1002	A186-R188 PolarHBondContact O-N 3.1Å; R188-T190 PolarHBondContact O-N 3.45Å; R188-F329 HydrophobicContact CG-CE2 4.36Å; R188-D1002 IonicContact CZ-OD2 2.74Å; R188-D1002 IonicContact NH1-OD2 2.75Å; R188-D1002 PolarHBondContact NH1-OD2 2.76Å; R188-D1002 IonicContact NH2-OD2 2.79Å; R188-D1002 PolarHBondContact NH2-OD2 2.04Å
189	W	86.5	Confident	86.4	Confident	6 Å²	6	27.4 Å²	27.4	2%	0.023	14%	0.138	C	C	.	.			trans	-64.4	131.4	170.4	-77.6	107.3	0	0	0	110.5	A79 W117 I118 R119 M252 A254 S324 D325 L326 F329	A79-W189 HydrophobicContact CB-CH2 4.28Å; W117-W189 HydrophobicContact CB-CE3 3.95Å; W117-W189 HydrophobicContact CB-CZ3 4.03Å; W117-W189 HydrophobicContact CE3-CB 4.16Å; W117-W189 HydrophobicContact CZ3-CB 4.29Å; I118-W189 VanDerWaalsContact C-CE3 3.48Å; I118-W189 CarbonylContact O-C 3.6Å; I118-W189 WeakPolarHBondContact O-CA 3.46Å; R119-W189 HydrophobicContact CB-CD2 3.85Å; R119-W189 HydrophobicContact CB-CE3 3.82Å; R119-W189 HydrophobicContact CB-CG 4.43Å; R119-W189 HydrophobicContact CB-CH2 4.12Å; R119-W189 HydrophobicContact CB-CZ2 4.16Å; R119-W189 HydrophobicContact CB-CZ3 3.96Å; W189-M252 HydrophobicContact CH2-CB 3.89Å; W189-M252 HydrophobicContact CH2-SD 4.43Å; W189-M252 HydrophobicContact CZ2-CB 4.46Å; W189-M252 HydrophobicContact CZ2-SD 4.1Å; W189-A254 HydrophobicContact CH2-CB 3.64Å; W189-A254 HydrophobicContact CZ3-CB 3.69Å; W189-S324 WeakPolarHBondContact CZ2-OG 3.04Å; W189-D325 PolarHBondContact NE1-OD1 3.21Å; W189-L326 HydrophobicContact CB-CD1 4.29Å; W189-L326 HydrophobicContact CD2-CB 4.29Å; W189-L326 HydrophobicContact CD2-CD1 3.92Å; W189-L326 HydrophobicContact CE3-CD1 4.18Å; W189-L326 HydrophobicContact CG-CD1 3.97Å; W189-L326 HydrophobicContact CZ2-CB 4.21Å; W189-F329 HydrophobicContact CB-CD1 3.98Å; W189-F329 HydrophobicContact CB-CD2 3.99Å; W189-F329 HydrophobicContact CB-CE1 3.97Å; W189-F329 HydrophobicContact CB-CE2 3.99Å; W189-F329 HydrophobicContact CB-CG 3.97Å; W189-F329 HydrophobicContact CB-CZ 3.96Å; W189-F329 HydrophobicContact CG-CD2 4.49Å; W189-F329 HydrophobicContact CG-CG 4.33Å; W189-F329 WeakPolarHBondContact O-CZ 3.46Å
190	T	90.3	Very high	86	Confident	8 Å²	8	25 Å²	25	5%	0.049	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	135.3	177.3	-56.8	0	0	0	0	109.1	I118 Y163 R188 L192 V205 N206	I118-T190 WeakPolarHBondContact CG1-O 3.27Å; I118-T190 PolarHBondContact N-O 2.82Å; I118-T190 PolarHBondContact O-N 3.3Å; Y163-T190 HydrophobicContact CE2-CG2 3.75Å; Y163-T190 WeakPolarHBondContact OH-CB 3.5Å; Y163-T190 PolarHBondContact OH-OG1 2.71Å; R188-T190 PolarHBondContact O-N 3.45Å; T190-L192 HydrophobicContact CG2-CD2 4.04Å; T190-L192 HydrophobicContact CG2-CG 4.47Å; T190-V205 HydrophobicContact CG2-CG1 3.43Å; T190-V205 VanDerWaalsContact CG2-CG1 3.43Å; T190-N206 WeakPolarHBondContact CG2-OD1 3.21Å
191	H	93.3	Very high	86	Confident	3 Å²	3	25 Å²	25	1%	0.014	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	109.9	172.9	177	-101.8	0	0	0	110.1	W117 V205 N206 A272	W117-H191 AromaticContact CD1-CD2 3.96Å; W117-H191 HydrophobicContact CD2-CB 4Å; W117-H191 AromaticContact CE2-CD2 3.67Å; W117-H191 HydrophobicContact CE3-CB 3.98Å; W117-H191 HydrophobicContact CH2-CB 3.69Å; W117-H191 HydrophobicContact CZ2-CB 3.67Å; W117-H191 HydrophobicContact CZ3-CB 3.84Å; W117-H191 AromaticContact NE1-CD2 3.51Å; H191-V205 CarbonylContact O-C 3.58Å; H191-V205 WeakPolarHBondContact O-CA 3.39Å; H191-N206 PolarHBondContact N-OD1 3.03Å; H191-N206 PolarHBondContact O-N 2.92Å; H191-A272 HydrophobicContact CB-CB 4.21Å; H191-A272 WeakPolarHBondContact ND1-CB 3.25Å
192	L	95.2	Very high	86.7	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	134.7	173	-64.1	-174.7	0	0	0	110.1	A115 A116 I118 I130 L148 Y163 T190 V205	A115-L192 CarbonylContact C-O 3.47Å; A115-L192 VanDerWaalsContact CA-O 3.28Å; A115-L192 WeakPolarHBondContact CA-O 3.42Å; A116-L192 PolarHBondContact N-O 2.9Å; A116-L192 PolarHBondContact O-N 2.88Å; I118-L192 HydrophobicContact CD1-CD1 3.38Å; I118-L192 HydrophobicContact CD1-CG 3.75Å; I118-L192 HydrophobicContact CG1-CD1 4.1Å; I118-L192 HydrophobicContact CG1-CG 4.05Å; I130-L192 HydrophobicContact CD1-CD1 4.1Å; L148-L192 HydrophobicContact CD1-CD1 4.16Å; L148-L192 HydrophobicContact CD2-CB 4.08Å; L148-L192 HydrophobicContact CD2-CD1 3.93Å; L148-L192 HydrophobicContact CG-CD1 4.09Å; Y163-L192 HydrophobicContact CD1-CD1 3.81Å; Y163-L192 HydrophobicContact CD1-CD2 4.18Å; Y163-L192 HydrophobicContact CD2-CD2 3.86Å; Y163-L192 HydrophobicContact CE1-CD1 4.16Å; Y163-L192 HydrophobicContact CE2-CD2 4.18Å; Y163-L192 HydrophobicContact CG-CD1 4.21Å; Y163-L192 HydrophobicContact CG-CD2 3.84Å; T190-L192 HydrophobicContact CG2-CD2 4.04Å; T190-L192 HydrophobicContact CG2-CG 4.47Å; L192-V205 HydrophobicContact CD2-CB 4.32Å; L192-V205 HydrophobicContact CD2-CG1 3.92Å; L192-V205 HydrophobicContact CD2-CG2 3.79Å
193	A	95.5	Very high	87.4	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.008	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	147.9	167.9	0	0	0	0	0	112.4	L114 A115 F204 I268	L114-A193 CarbonylContact O-C 3.59Å; L114-A193 WeakPolarHBondContact O-CA 3.24Å; L114-A193 WeakPolarHBondContact O-CB 3.18Å; A115-A193 HydrophobicContact CB-CB 3.96Å; A193-F204 HydrophobicContact CB-CB 4.25Å; A193-F204 PolarHBondContact N-O 3.37Å; A193-F204 WeakPolarHBondContact O-CA 3.41Å; A193-F204 PolarHBondContact O-N 2.67Å; A193-I268 HydrophobicContact CB-CD1 4.18Å; A193-I268 HydrophobicContact CB-CG2 3.76Å
194	V	95.4	Very high	87.9	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	142.7	177.6	-65.1	0	0	0	0	110.2	F112 T113 L114 L148 F165 K202 L203	F112-V194 HydrophobicContact CE2-CG2 4.17Å; T113-V194 WeakPolarHBondContact CA-O 3.3Å; L114-V194 HydrophobicContact CB-CG2 3.73Å; L114-V194 HydrophobicContact CD2-CG2 4.07Å; L114-V194 HydrophobicContact CG-CG2 4.38Å; L114-V194 PolarHBondContact N-O 3.12Å; L114-V194 PolarHBondContact O-N 2.98Å; L148-V194 HydrophobicContact CD1-CG1 4.09Å; F165-V194 HydrophobicContact CB-CG1 3.91Å; F165-V194 HydrophobicContact CD1-CB 3.76Å; F165-V194 HydrophobicContact CD1-CG1 3.53Å; F165-V194 HydrophobicContact CD1-CG2 4.3Å; F165-V194 HydrophobicContact CD2-CB 4.43Å; F165-V194 HydrophobicContact CD2-CG1 3.9Å; F165-V194 HydrophobicContact CD2-CG2 4.27Å; F165-V194 HydrophobicContact CE1-CB 3.63Å; F165-V194 HydrophobicContact CE1-CG1 3.93Å; F165-V194 HydrophobicContact CE1-CG2 3.83Å; F165-V194 HydrophobicContact CE2-CB 4.37Å; F165-V194 HydrophobicContact CE2-CG1 4.32Å; F165-V194 HydrophobicContact CE2-CG2 3.87Å; F165-V194 HydrophobicContact CG-CB 4.18Å; F165-V194 HydrophobicContact CG-CG1 3.52Å; F165-V194 HydrophobicContact CZ-CB 3.99Å; F165-V194 HydrophobicContact CZ-CG1 4.34Å; F165-V194 HydrophobicContact CZ-CG2 3.64Å; V194-K202 VanDerWaalsContact CA-O 3.24Å; V194-K202 WeakPolarHBondContact CA-O 3.38Å; V194-L203 HydrophobicContact CG1-CB 4.43Å; V194-L203 HydrophobicContact CG1-CD1 3.54Å
195	T	93.5	Very high	88.1	Confident	3 Å²	3	21 Å²	21	2%	0.018	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.5	179	71.2	0	0	0	0	111.9	F112 T113 K202 F204 I268	F112-T195 WeakPolarHBondContact O-CA 3.06Å; T113-T195 HydrophobicContact CG2-CG2 3.89Å; T195-K202 PolarHBondContact N-O 3.25Å; T195-K202 PolarHBondContact O-N 3.16Å; T195-F204 HydrophobicContact CG2-CE2 4.01Å; T195-I268 HydrophobicContact CG2-CD1 4.27Å
196	Y	92.5	Very high	88.5	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	139.4	174.6	-173.1	-122.5	0	0	0	111.1	T110 Q111 F112 M167 T169 E198 T200 L201 Q216 V217 G218 L220 T262	T110-Y196 WeakPolarHBondContact O-CD1 3.49Å; Q111-Y196 CarbonylContact C-O 3.57Å; Q111-Y196 WeakPolarHBondContact CA-O 3.45Å; Q111-Y196 WeakPolarHBondContact CB-O 3.06Å; F112-Y196 HydrophobicContact CD1-CD1 4.48Å; F112-Y196 VanDerWaalsContact CE1-CB 3.41Å; F112-Y196 HydrophobicContact CE1-CD1 4.15Å; F112-Y196 HydrophobicContact CE1-CG 4.16Å; F112-Y196 PolarHBondContact N-O 3.29Å; F112-Y196 PolarHBondContact O-N 3.05Å; M167-Y196 HydrophobicContact CE-CD1 4.15Å; M167-Y196 HydrophobicContact CE-CD2 3.59Å; M167-Y196 HydrophobicContact CE-CE1 4.07Å; M167-Y196 HydrophobicContact CE-CE2 3.54Å; M167-Y196 HydrophobicContact CE-CG 3.91Å; M167-Y196 HydrophobicContact SD-CD1 4.25Å; M167-Y196 HydrophobicContact SD-CD2 4.35Å; M167-Y196 HydrophobicContact SD-CG 4.1Å; T169-Y196 HydrophobicContact CG2-CE1 4.11Å; T169-Y196 WeakPolarHBondContact CG2-OH 3.41Å; Y196-E198 VanDerWaalsContact CZ-CA 3.41Å; Y196-E198 VanDerWaalsContact OH-C 3.29Å; Y196-E198 WeakPolarHBondContact OH-CA 3.44Å; Y196-E198 PolarHBondContact OH-O 3.3Å; Y196-T200 WeakPolarHBondContact CA-O 3.44Å; Y196-T200 VanDerWaalsContact CD2-O 3.27Å; Y196-T200 WeakPolarHBondContact CD2-O 3.19Å; Y196-L201 HydrophobicContact CD2-CB 4.4Å; Y196-L201 HydrophobicContact CD2-CD1 3.96Å; Y196-L201 HydrophobicContact CG-CD1 4.37Å; Y196-Q216 HydrophobicContact CE2-CB 4.36Å; Y196-Q216 WeakPolarHBondContact CE2-O 3.49Å; Y196-Q216 VanDerWaalsContact OH-C 3.27Å; Y196-Q216 PolarHBondContact OH-O 3.47Å; Y196-V217 VanDerWaalsContact OH-C 3.26Å; Y196-V217 WeakPolarHBondContact OH-CA 3.49Å; Y196-V217 PolarHBondContact OH-N 3.23Å; Y196-G218 WeakPolarHBondContact CE1-O 3.45Å; Y196-G218 PolarHBondContact OH-N 3.19Å; Y196-G218 PolarHBondContact OH-O 2.98Å; Y196-G218 VanDerWaalsContact OH-O 3.09Å; Y196-L220 HydrophobicContact CD1-CD2 3.92Å; Y196-L220 HydrophobicContact CD1-CG 4.37Å; Y196-L220 HydrophobicContact CE1-CD2 3.99Å; Y196-L220 HydrophobicContact CE1-CG 4.49Å; Y196-T262 PolarHBondContact O-OG1 3.04Å; Y196-T262 VanDerWaalsContact O-OG1 3.04Å
197	N	87.1	Confident	88.9	Confident	43 Å²	43	18.3 Å²	18.3	23%	0.23	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	39.3	-175.8	67.6	-0.3	0	0	0	113.7	K199 T200 T262 Y1045	N197-K199 PolarHBondContact O-N 2.78Å; N197-K199 PolarHBondContact OD1-N 3.41Å; N197-T200 VanDerWaalsContact CG-OG1 3.29Å; N197-T200 PolarHBondContact N-O 3Å; N197-T200 PolarHBondContact ND2-OG1 3.47Å; N197-T200 VanDerWaalsContact ND2-OG1 3.11Å; N197-T200 WeakPolarHBondContact OD1-CA 3.44Å; N197-T200 PolarHBondContact OD1-N 2.79Å; N197-T200 PolarHBondContact OD1-O 2.98Å; N197-T200 PolarHBondContact OD1-OG1 3.14Å; N197-T262 HydrophobicContact CB-CG2 3.88Å; N197-T262 WeakPolarHBondContact CB-OG1 3.47Å; N197-Y1045 PolarHBondContact ND2-OH 3.05Å
198	E	86.4	Confident	89.7	Confident	76 Å²	76	17 Å²	17	36%	0.355	8%	0.083	S	C	.	.	S	Bend	trans	59.9	-4.9	-172.2	-58.5	-167	102.1	0	0	116.5	T110 Y196 V217 G218	T110-E198 HydrophobicContact CG2-CG 4.37Å; T110-E198 VanDerWaalsContact CG2-OE1 3.31Å; T110-E198 WeakPolarHBondContact CG2-OE1 3.46Å; T110-E198 WeakPolarHBondContact O-CG 3.31Å; T110-E198 PolarHBondContact O-N 2.97Å; Y196-E198 VanDerWaalsContact CZ-CA 3.41Å; Y196-E198 VanDerWaalsContact OH-C 3.29Å; Y196-E198 WeakPolarHBondContact OH-CA 3.44Å; Y196-E198 PolarHBondContact OH-O 3.3Å; E198-V217 CarbonylContact O-C 3.6Å; E198-V217 VanDerWaalsContact O-CA 3.3Å; E198-V217 WeakPolarHBondContact O-CA 3.36Å; E198-G218 PolarHBondContact O-N 3.24Å
199	K	81.5	Confident	90.1	Very high	112 Å²	112	15.5 Å²	15.5	49%	0.487	8%	0.077	S	C	.	.	S	Bend	trans	-133.3	-38.1	-178.6	-174.5	178.3	178.7	179.5	0	113.9	N197 D214	N197-K199 PolarHBondContact O-N 2.78Å; N197-K199 PolarHBondContact OD1-N 3.41Å; K199-D214 WeakPolarHBondContact O-CA 3.34Å
200	T	82.3	Confident	90.2	Very high	27 Å²	27	15.2 Å²	15.2	17%	0.166	8%	0.076	C	C	.	.			trans	-129.4	133	-174.4	62.1	0	0	0	0	110.7	Y196 N197 S213	Y196-T200 WeakPolarHBondContact CA-O 3.44Å; Y196-T200 VanDerWaalsContact CD2-O 3.27Å; Y196-T200 WeakPolarHBondContact CD2-O 3.19Å; N197-T200 VanDerWaalsContact CG-OG1 3.29Å; N197-T200 PolarHBondContact N-O 3Å; N197-T200 PolarHBondContact ND2-OG1 3.47Å; N197-T200 VanDerWaalsContact ND2-OG1 3.11Å; N197-T200 WeakPolarHBondContact OD1-CA 3.44Å; N197-T200 PolarHBondContact OD1-N 2.79Å; N197-T200 PolarHBondContact OD1-O 2.98Å; N197-T200 PolarHBondContact OD1-OG1 3.14Å; T200-S213 WeakPolarHBondContact CA-O 3.29Å
201	L	87.6	Confident	90.1	Very high	1 Å²	1	15 Å²	15	1%	0.005	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	133.1	174.5	-167	65.1	0	0	0	108.5	F165 M167 L178 Y196 A212 S213	F165-L201 HydrophobicContact CD1-CD1 3.96Å; F165-L201 HydrophobicContact CD1-CD2 4.26Å; F165-L201 HydrophobicContact CD1-CG 4.14Å; F165-L201 HydrophobicContact CE1-CD1 3.46Å; F165-L201 VanDerWaalsContact CE1-CD1 3.46Å; F165-L201 HydrophobicContact CE1-CD2 4.46Å; F165-L201 HydrophobicContact CE1-CG 4.16Å; M167-L201 HydrophobicContact CB-CD1 4.43Å; M167-L201 HydrophobicContact CB-CD2 4.15Å; M167-L201 HydrophobicContact CE-CD1 3.48Å; M167-L201 VanDerWaalsContact CE-CD1 3.48Å; M167-L201 HydrophobicContact CE-CD2 4.21Å; M167-L201 HydrophobicContact CE-CG 4.31Å; M167-L201 HydrophobicContact SD-CD1 3.59Å; M167-L201 VanDerWaalsContact SD-CD1 3.59Å; L178-L201 HydrophobicContact CD1-CB 4.3Å; L178-L201 HydrophobicContact CD1-CD2 4.02Å; L178-L201 HydrophobicContact CD1-CG 3.82Å; L178-L201 HydrophobicContact CG-CD2 4.08Å; L178-L201 HydrophobicContact CG-CG 4.43Å; Y196-L201 HydrophobicContact CD2-CB 4.4Å; Y196-L201 HydrophobicContact CD2-CD1 3.96Å; Y196-L201 HydrophobicContact CG-CD1 4.37Å; L201-A212 CarbonylContact O-C 3.58Å; L201-A212 VanDerWaalsContact O-CA 3.26Å; L201-A212 WeakPolarHBondContact O-CA 3.42Å; L201-S213 PolarHBondContact N-O 2.93Å; L201-S213 PolarHBondContact O-N 3.37Å
202	K	90.8	Very high	89.7	Confident	25 Å²	25	15.9 Å²	15.9	11%	0.109	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	142.4	179.3	-64.2	-179.9	177	-178.4	0	111.1	V194 T195 F204 L209 A212 L1042	V194-K202 VanDerWaalsContact CA-O 3.24Å; V194-K202 WeakPolarHBondContact CA-O 3.38Å; T195-K202 PolarHBondContact N-O 3.25Å; T195-K202 PolarHBondContact O-N 3.16Å; K202-F204 HydrophobicContact CB-CD2 4.38Å; K202-F204 HydrophobicContact CB-CE2 3.68Å; K202-F204 HydrophobicContact CB-CZ 4.28Å; K202-F204 HydrophobicContact CD-CE2 4.4Å; K202-F204 HydrophobicContact CD-CZ 4.25Å; K202-L209 HydrophobicContact CB-CD1 3.78Å; K202-L209 HydrophobicContact CD-CD1 4.09Å; K202-L209 HydrophobicContact CG-CD1 4.04Å; K202-A212 HydrophobicContact CG-CB 4.1Å; K202-L1042 PolarHBondContact NZ-O 3.46Å
203	L	93.2	Very high	89	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.7	173.2	172.8	63.6	0	0	0	109	L148 F165 L178 V194 V210 A211	L148-L203 HydrophobicContact CD1-CD1 4.19Å; F165-L203 HydrophobicContact CB-CD1 4.26Å; F165-L203 HydrophobicContact CB-CD2 4.47Å; L178-L203 HydrophobicContact CB-CB 4.07Å; L178-L203 HydrophobicContact CB-CD2 4.16Å; L178-L203 HydrophobicContact CD1-CB 3.9Å; V194-L203 HydrophobicContact CG1-CB 4.43Å; V194-L203 HydrophobicContact CG1-CD1 3.54Å; L203-V210 HydrophobicContact CB-CG2 4.3Å; L203-V210 HydrophobicContact CD2-CG2 3.98Å; L203-V210 HydrophobicContact CG-CG2 3.73Å; L203-V210 WeakPolarHBondContact O-CG2 3.27Å; L203-V210 PolarHBondContact O-N 2.88Å; L203-A211 HydrophobicContact CB-CB 4.43Å; L203-A211 PolarHBondContact N-O 2.03Å; L203-A211 PolarHBondContact O-N 3.45Å
204	F	92.9	Very high	88.2	Confident	2 Å²	2	19.6 Å²	19.6	1%	0.009	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143	178.2	-59.1	-102.1	0	0	0	110.7	A193 T195 K202 A208 L209 A265 I268	A193-F204 HydrophobicContact CB-CB 4.25Å; A193-F204 PolarHBondContact N-O 3.37Å; A193-F204 WeakPolarHBondContact O-CA 3.41Å; A193-F204 PolarHBondContact O-N 2.67Å; T195-F204 HydrophobicContact CG2-CE2 4.01Å; K202-F204 HydrophobicContact CB-CD2 4.38Å; K202-F204 HydrophobicContact CB-CE2 3.68Å; K202-F204 HydrophobicContact CB-CZ 4.28Å; K202-F204 HydrophobicContact CD-CE2 4.4Å; K202-F204 HydrophobicContact CD-CZ 4.25Å; F204-A208 CarbonylContact C-O 3.48Å; F204-A208 WeakPolarHBondContact CA-O 3.42Å; F204-A208 WeakPolarHBondContact CB-O 3.37Å; F204-L209 HydrophobicContact CD1-CB 4.03Å; F204-L209 HydrophobicContact CD1-CD1 4.2Å; F204-L209 HydrophobicContact CD2-CD1 4.45Å; F204-L209 HydrophobicContact CE1-CB 3.83Å; F204-L209 HydrophobicContact CE1-CD1 3.83Å; F204-L209 HydrophobicContact CE1-CG 4.37Å; F204-L209 HydrophobicContact CE2-CD1 4.11Å; F204-L209 HydrophobicContact CG-CD1 4.5Å; F204-L209 HydrophobicContact CZ-CD1 3.79Å; F204-A265 HydrophobicContact CE1-CB 3.81Å; F204-A265 HydrophobicContact CZ-CB 4.28Å; F204-I268 HydrophobicContact CB-CG2 3.91Å; F204-I268 HydrophobicContact CD1-CB 4.41Å; F204-I268 HydrophobicContact CD1-CG2 4Å; F204-I268 HydrophobicContact CD2-CG2 4.36Å; F204-I268 HydrophobicContact CE2-CG1 4.38Å; F204-I268 HydrophobicContact CG-CG2 3.87Å; F204-I268 HydrophobicContact CZ-CG1 4.42Å
205	V	91.8	Very high	87.4	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	130.5	172.9	-168.7	0	0	0	0	107.8	Y163 Y182 T190 H191 L192 G207 A208 V210	Y163-V205 HydrophobicContact CD2-CG1 4.33Å; Y163-V205 HydrophobicContact CD2-CG2 4.41Å; Y163-V205 HydrophobicContact CE2-CG1 4.32Å; Y182-V205 HydrophobicContact CE2-CG1 4.04Å; Y182-V205 WeakPolarHBondContact OH-CB 3.36Å; Y182-V205 WeakPolarHBondContact OH-CG1 3.44Å; T190-V205 HydrophobicContact CG2-CG1 3.43Å; T190-V205 VanDerWaalsContact CG2-CG1 3.43Å; H191-V205 CarbonylContact O-C 3.58Å; H191-V205 WeakPolarHBondContact O-CA 3.39Å; L192-V205 HydrophobicContact CD2-CB 4.32Å; L192-V205 HydrophobicContact CD2-CG1 3.92Å; L192-V205 HydrophobicContact CD2-CG2 3.79Å; V205-G207 PolarHBondContact O-N 3.29Å; V205-A208 PolarHBondContact N-O 3.25Å; V205-A208 VanDerWaalsContact N-O 3.08Å; V205-A208 WeakPolarHBondContact O-CB 2.98Å; V205-A208 PolarHBondContact O-N 3.16Å; V205-V210 HydrophobicContact CB-CG1 4.01Å; V205-V210 HydrophobicContact CG2-CB 4.49Å; V205-V210 HydrophobicContact CG2-CG1 3.97Å; V205-V210 HydrophobicContact CG2-CG2 3.72Å
206	N	89.3	Confident	86.8	Confident	4 Å²	4	24.9 Å²	24.9	2%	0.021	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	15.2	-173.8	-64.1	-9.8	0	0	0	115.6	T190 H191 A272 D1002 D1004	T190-N206 WeakPolarHBondContact CG2-OD1 3.21Å; H191-N206 PolarHBondContact N-OD1 3.03Å; H191-N206 PolarHBondContact O-N 2.92Å; N206-A272 VanDerWaalsContact O-CB 3.3Å; N206-A272 WeakPolarHBondContact O-CB 3.46Å; N206-D1002 PolarHBondContact ND2-O 2.86Å; N206-D1004 HydrophobicContact CB-CB 3.7Å
207	G	89	Confident	86.3	Confident	8 Å²	8	28.5 Å²	28.5	8%	0.082	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	110.1	-22.5	-177.6	0	0	0	0	0	113.7	V205	V205-G207 PolarHBondContact O-N 3.29Å
208	A	89.4	Confident	86.1	Confident	2 Å²	2	26.8 Å²	26.8	2%	0.017	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	143.5	-179.7	0	0	0	0	0	113	F204 V205 V210 D1004 F1016 C1025	F204-A208 CarbonylContact C-O 3.48Å; F204-A208 WeakPolarHBondContact CA-O 3.42Å; F204-A208 WeakPolarHBondContact CB-O 3.37Å; V205-A208 PolarHBondContact N-O 3.25Å; V205-A208 VanDerWaalsContact N-O 3.08Å; V205-A208 WeakPolarHBondContact O-CB 2.98Å; V205-A208 PolarHBondContact O-N 3.16Å; A208-V210 HydrophobicContact CB-CG1 4.43Å; A208-V210 PolarHBondContact O-N 2.83Å; A208-D1004 HydrophobicContact CB-CB 4.32Å; A208-D1004 WeakPolarHBondContact CB-O 3.44Å; A208-F1016 HydrophobicContact CB-CE1 3.73Å; A208-F1016 HydrophobicContact CB-CZ 4.49Å; A208-C1025 WeakPolarHBondContact CA-O 3.41Å
209	L	89.7	Confident	86.1	Confident	4 Å²	4	24.7 Å²	24.7	2%	0.021	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	98.2	172.5	179.7	63.8	0	0	0	110.2	K202 F204 C1025 F1026 S1027 I1031 I1043	K202-L209 HydrophobicContact CB-CD1 3.78Å; K202-L209 HydrophobicContact CD-CD1 4.09Å; K202-L209 HydrophobicContact CG-CD1 4.04Å; F204-L209 HydrophobicContact CD1-CB 4.03Å; F204-L209 HydrophobicContact CD1-CD1 4.2Å; F204-L209 HydrophobicContact CD2-CD1 4.45Å; F204-L209 HydrophobicContact CE1-CB 3.83Å; F204-L209 HydrophobicContact CE1-CD1 3.83Å; F204-L209 HydrophobicContact CE1-CG 4.37Å; F204-L209 HydrophobicContact CE2-CD1 4.11Å; F204-L209 HydrophobicContact CG-CD1 4.5Å; F204-L209 HydrophobicContact CZ-CD1 3.79Å; L209-C1025 PolarHBondContact N-O 3.4Å; L209-F1026 HydrophobicContact CB-CB 3.97Å; L209-F1026 CarbonylContact O-C 3.53Å; L209-F1026 WeakPolarHBondContact O-CA 3.46Å; L209-F1026 WeakPolarHBondContact O-CB 3.05Å; L209-S1027 PolarHBondContact O-N 2.86Å; L209-I1031 HydrophobicContact CD2-CD1 3.61Å; L209-I1031 HydrophobicContact CG-CD1 3.82Å; L209-I1043 HydrophobicContact CD2-CG1 4.32Å
210	V	88.3	Confident	86.4	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-27.1	-175.8	-57.4	0	0	0	0	113.8	L203 V205 A208 G1030	L203-V210 HydrophobicContact CB-CG2 4.3Å; L203-V210 HydrophobicContact CD2-CG2 3.98Å; L203-V210 HydrophobicContact CG-CG2 3.73Å; L203-V210 WeakPolarHBondContact O-CG2 3.27Å; L203-V210 PolarHBondContact O-N 2.88Å; V205-V210 HydrophobicContact CB-CG1 4.01Å; V205-V210 HydrophobicContact CG2-CB 4.49Å; V205-V210 HydrophobicContact CG2-CG1 3.97Å; V205-V210 HydrophobicContact CG2-CG2 3.72Å; A208-V210 HydrophobicContact CB-CG1 4.43Å; A208-V210 PolarHBondContact O-N 2.83Å; V210-G1030 WeakPolarHBondContact O-CA 3.47Å
211	A	86.7	Confident	86.5	Confident	4 Å²	4	18.3 Å²	18.3	3%	0.033	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	151.6	177.9	0	0	0	0	0	112.6	L178 W179 L203	L178-A211 HydrophobicContact CB-CB 3.98Å; L178-A211 HydrophobicContact CD1-CB 4.5Å; L178-A211 HydrophobicContact CD2-CB 4.24Å; L178-A211 HydrophobicContact CG-CB 4.47Å; W179-A211 WeakPolarHBondContact O-CB 3.19Å; L203-A211 HydrophobicContact CB-CB 4.43Å; L203-A211 PolarHBondContact N-O 2.03Å; L203-A211 PolarHBondContact O-N 3.45Å
212	A	85.4	Confident	86.2	Confident	21 Å²	21	19.9 Å²	19.9	17%	0.174	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	152.9	176.9	0	0	0	0	0	112.2	L201 K202	L201-A212 CarbonylContact O-C 3.58Å; L201-A212 VanDerWaalsContact O-CA 3.26Å; L201-A212 WeakPolarHBondContact O-CA 3.42Å; K202-A212 HydrophobicContact CG-CB 4.1Å
213	S	81.2	Confident	85.7	Confident	15 Å²	15	26.2 Å²	26.2	11%	0.105	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	148	174.3	-178.7	0	0	0	0	111.9	T200 L201 N215	T200-S213 WeakPolarHBondContact CA-O 3.29Å; L201-S213 PolarHBondContact N-O 2.93Å; L201-S213 PolarHBondContact O-N 3.37Å; S213-N215 WeakPolarHBondContact OG-CB 3.32Å; S213-N215 PolarHBondContact OG-N 2.82Å; S213-N215 PolarHBondContact OG-ND2 2.83Å; S213-N215 VanDerWaalsContact OG-ND2 3.07Å
214	D	78.1	Confident	84.8	Confident	65 Å²	65	33.7 Å²	33.7	35%	0.348	19%	0.186	S	C	.	.			trans	-105.6	8.7	172.8	52.6	-2.6	0	0	0	113.2	K199 Q216 T1034	K199-D214 WeakPolarHBondContact O-CA 3.34Å; D214-Q216 PolarHBondContact O-N 2.93Å; D214-Q216 VanDerWaalsContact O-N 3.12Å; D214-T1034 VanDerWaalsContact OD1-CG2 3.32Å; D214-T1034 WeakPolarHBondContact OD1-CG2 3.24Å
215	N	78.6	Confident	84.1	Confident	111 Å²	111	37.6 Å²	37.6	59%	0.594	20%	0.203	S	C	*	.			trans	-72.5	1.3	-177.3	-70.1	-36.2	0	0	0	114.9	S176 S213	S176-N215 VanDerWaalsContact OG-CB 3.31Å; S176-N215 WeakPolarHBondContact OG-CB 3.48Å; S213-N215 WeakPolarHBondContact OG-CB 3.32Å; S213-N215 PolarHBondContact OG-N 2.82Å; S213-N215 PolarHBondContact OG-ND2 2.83Å; S213-N215 VanDerWaalsContact OG-ND2 3.07Å
216	Q	81.6	Confident	83.3	Confident	3 Å²	3	38 Å²	38	1%	0.014	21%	0.206	C	C	.	.			trans	-129.2	118.3	-178.7	-66.7	-63.9	-41.7	0	0	109.7	M167 T169 S172 R174 S176 Y196 D214	M167-Q216 HydrophobicContact CE-CB 3.45Å; M167-Q216 VanDerWaalsContact CE-CB 3.45Å; M167-Q216 HydrophobicContact CE-CG 3.81Å; T169-Q216 HydrophobicContact CG2-CB 4.11Å; S172-Q216 VanDerWaalsContact CB-OE1 3.28Å; S172-Q216 PolarHBondContact OG-NE2 2.67Å; R174-Q216 PolarHBondContact O-NE2 3.24Å; S176-Q216 VanDerWaalsContact N-NE2 3.15Å; S176-Q216 WeakPolarHBondContact OG-CG 3.32Å; S176-Q216 PolarHBondContact OG-NE2 2.85Å; Y196-Q216 HydrophobicContact CE2-CB 4.36Å; Y196-Q216 WeakPolarHBondContact CE2-O 3.49Å; Y196-Q216 VanDerWaalsContact OH-C 3.27Å; Y196-Q216 PolarHBondContact OH-O 3.47Å; D214-Q216 PolarHBondContact O-N 2.93Å; D214-Q216 VanDerWaalsContact O-N 3.12Å
217	V	81.7	Confident	82.6	Confident	76 Å²	76	42.1 Å²	42.1	46%	0.461	24%	0.241	S	C	.	.			trans	-123.8	146.4	-172.2	-175.8	0	0	0	0	111.2	T169 M171 Y196 E198	T169-V217 WeakPolarHBondContact CB-O 3.35Å; T169-V217 PolarHBondContact OG1-O 3.24Å; M171-V217 HydrophobicContact CE-CB 4.43Å; M171-V217 HydrophobicContact CE-CG1 4.08Å; Y196-V217 VanDerWaalsContact OH-C 3.26Å; Y196-V217 WeakPolarHBondContact OH-CA 3.49Å; Y196-V217 PolarHBondContact OH-N 3.23Å; E198-V217 CarbonylContact O-C 3.6Å; E198-V217 VanDerWaalsContact O-CA 3.3Å; E198-V217 WeakPolarHBondContact O-CA 3.36Å
218	G	83.4	Confident	82.1	Confident	6 Å²	6	42.6 Å²	42.6	6%	0.062	24%	0.243	C	C	.	.	S	Bend	trans	76.1	-165.8	172.5	0	0	0	0	0	115.3	Y196 E198	Y196-G218 WeakPolarHBondContact CE1-O 3.45Å; Y196-G218 PolarHBondContact OH-N 3.19Å; Y196-G218 PolarHBondContact OH-O 2.98Å; Y196-G218 VanDerWaalsContact OH-O 3.09Å; E198-G218 PolarHBondContact O-N 3.24Å
219	P	85.4	Confident	82	Confident	32 Å²	32	42.8 Å²	42.8	21%	0.208	24%	0.243	C	C	.	.			trans	-67.5	141.6	-173.5	26.6	-34.8	0	0	0	112	R109 E170 F221	R109-P219 CarbonylContact O-C 3.54Å; R109-P219 WeakPolarHBondContact O-CA 3.48Å; E170-P219 PolarHBondContact N-O 3.42Å; P219-F221 VanDerWaalsContact C-N 3.27Å; P219-F221 PolarHBondContact O-N 3.19Å
220	L	87.7	Confident	81.7	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.021	25%	0.247	C	C	.	.	S	Bend	trans	-56.4	-41.6	173.8	-65.2	-179.5	0	0	0	112.2	R109 F112 V145 M167 T169 E170 Y196	R109-L220 WeakPolarHBondContact O-CB 3.23Å; R109-L220 WeakPolarHBondContact O-CG 2.97Å; R109-L220 PolarHBondContact O-N 2.03Å; F112-L220 HydrophobicContact CD1-CD1 3.87Å; F112-L220 HydrophobicContact CE1-CD1 3.72Å; F112-L220 HydrophobicContact CE1-CD2 4.25Å; F112-L220 HydrophobicContact CE1-CG 4.49Å; V145-L220 HydrophobicContact CG1-CB 3.68Å; V145-L220 HydrophobicContact CG1-CD1 4.21Å; V145-L220 HydrophobicContact CG1-CD2 4.02Å; V145-L220 HydrophobicContact CG1-CG 4.2Å; M167-L220 HydrophobicContact CE-CD2 4.34Å; M167-L220 HydrophobicContact CG-CD2 4.12Å; M167-L220 HydrophobicContact SD-CD2 3.49Å; M167-L220 WeakPolarHBondContact SD-CD2 3.26Å; T169-L220 HydrophobicContact CG2-CD2 4.33Å; E170-L220 PolarHBondContact N-O 3.16Å; Y196-L220 HydrophobicContact CD1-CD2 3.92Å; Y196-L220 HydrophobicContact CD1-CG 4.37Å; Y196-L220 HydrophobicContact CE1-CD2 3.99Å; Y196-L220 HydrophobicContact CE1-CG 4.49Å
221	F	85.5	Confident	81.8	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.009	25%	0.247	C	C	.	.	S	Bend	trans	-159.3	156.2	179.2	50.1	-85.3	0	0	0	111.2	F107 R109 L133 V145 P219 K225 A226 K229	F107-F221 HydrophobicContact CB-CZ 3.85Å; R109-F221 HydrophobicContact CG-CD2 3.71Å; R109-F221 HydrophobicContact CG-CE1 4.1Å; R109-F221 HydrophobicContact CG-CE2 3.21Å; R109-F221 HydrophobicContact CG-CG 4.34Å; R109-F221 HydrophobicContact CG-CZ 3.41Å; R109-F221 VanDerWaalsContact CG-CZ 3.41Å; R109-F221 PolarHBondContact NE-O 2.86Å; R109-F221 PolarHBondContact NH2-O 3.07Å; L133-F221 HydrophobicContact CD2-CE1 3.95Å; V145-F221 HydrophobicContact CG1-CD1 4.19Å; V145-F221 HydrophobicContact CG2-CD1 4.16Å; P219-F221 VanDerWaalsContact C-N 3.27Å; P219-F221 PolarHBondContact O-N 3.19Å; F221-K225 HydrophobicContact CB-CB 4.23Å; F221-A226 HydrophobicContact CD2-CB 4.25Å; F221-A226 HydrophobicContact CE2-CB 3.84Å; F221-K229 HydrophobicContact CD1-CD 3.96Å; F221-K229 HydrophobicContact CD1-CG 4.18Å; F221-K229 HydrophobicContact CD2-CD 4.39Å; F221-K229 HydrophobicContact CD2-CG 3.92Å; F221-K229 HydrophobicContact CE1-CD 4.17Å; F221-K229 HydrophobicContact CE1-CG 4.06Å; F221-K229 HydrophobicContact CE2-CG 3.75Å; F221-K229 HydrophobicContact CG-CD 4.12Å; F221-K229 HydrophobicContact CG-CG 4.16Å; F221-K229 HydrophobicContact CZ-CD 4.47Å; F221-K229 HydrophobicContact CZ-CG 3.85Å
222	S	81.1	Confident	81.9	Confident	33 Å²	33	43.6 Å²	43.6	23%	0.231	25%	0.246	C	C	.	.			trans	-68.8	158.2	175.9	45	0	0	0	0	112.3	E170 I224 K225 A226	E170-S222 PolarHBondContact OE1-OG 2.65Å; E170-S222 VanDerWaalsContact OE1-OG 3.11Å; E170-S222 WeakPolarHBondContact OE2-CA 3.4Å; E170-S222 WeakPolarHBondContact OE2-CB 3.3Å; E170-S222 PolarHBondContact OE2-N 2.8Å; E170-S222 PolarHBondContact OE2-OG 2.76Å; E170-S222 VanDerWaalsContact OE2-OG 3.1Å; S222-I224 VanDerWaalsContact C-N 3.26Å; S222-I224 PolarHBondContact O-N 3.42Å; S222-K225 PolarHBondContact O-N 3.5Å; S222-K225 VanDerWaalsContact O-N 3.14Å; S222-A226 PolarHBondContact O-N 2.79Å
223	K	79	Confident	82.2	Confident	159 Å²	159	42.6 Å²	42.6	69%	0.691	24%	0.238	S	C	*	.	S	Bend	trans	-56.7	-42	180	-72.7	-175.4	176.3	179.3	0	111.5	K225 A226	K223-K225 VanDerWaalsContact C-N 3.3Å; K223-K225 PolarHBondContact O-N 3.41Å; K223-A226 WeakPolarHBondContact O-CB 2.99Å; K223-A226 PolarHBondContact O-N 3.28Å; K223-A226 VanDerWaalsContact O-N 3.12Å
224	I	75.9	Confident	82.6	Confident	156 Å²	156	41.9 Å²	41.9	80%	0.8	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-59.5	-40.4	179	-57.6	169.4	0	0	0	111.2	S222 A226	S222-I224 VanDerWaalsContact C-N 3.26Å; S222-I224 PolarHBondContact O-N 3.42Å; I224-A226 PolarHBondContact O-N 3.43Å
225	K	76.8	Confident	83.1	Confident	85 Å²	85	38.8 Å²	38.8	37%	0.37	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-76.8	0.5	179.3	-75.5	-174	-176.6	166.9	0	114.6	E170 F221 S222 K223 C228 K229	E170-K225 VanDerWaalsContact OE1-CD 3.31Å; E170-K225 WeakPolarHBondContact OE1-CD 3.4Å; E170-K225 VanDerWaalsContact OE1-CE 3.25Å; E170-K225 WeakPolarHBondContact OE1-CE 3.46Å; E170-K225 IonicContact OE1-NZ 3.35Å; E170-K225 PolarHBondContact OE1-NZ 3.08Å; F221-K225 HydrophobicContact CB-CB 4.23Å; S222-K225 PolarHBondContact O-N 3.5Å; S222-K225 VanDerWaalsContact O-N 3.14Å; K223-K225 VanDerWaalsContact C-N 3.3Å; K223-K225 PolarHBondContact O-N 3.41Å; K225-C228 WeakPolarHBondContact O-CB 2.97Å; K225-C228 PolarHBondContact O-N 2.86Å; K225-K229 WeakPolarHBondContact O-CG 3.42Å; K225-K229 PolarHBondContact O-NZ 3.22Å
226	A	76	Confident	83.5	Confident	7 Å²	7	34 Å²	34	6%	0.058	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-68.2	-36.2	-176.8	0	0	0	0	0	113.3	L106 F221 S222 K223 I224 C228 K229	L106-A226 HydrophobicContact CD2-CB 3.75Å; F221-A226 HydrophobicContact CD2-CB 4.25Å; F221-A226 HydrophobicContact CE2-CB 3.84Å; S222-A226 PolarHBondContact O-N 2.79Å; K223-A226 WeakPolarHBondContact O-CB 2.99Å; K223-A226 PolarHBondContact O-N 3.28Å; K223-A226 VanDerWaalsContact O-N 3.12Å; I224-A226 PolarHBondContact O-N 3.43Å; A226-C228 PolarHBondContact O-N 3.48Å; A226-K229 WeakPolarHBondContact O-CB 3.35Å; A226-K229 PolarHBondContact O-N 2.73Å
227	A	73.1	Confident	83.4	Confident	92 Å²	92	35 Å²	35	76%	0.76	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-64	-20.3	175.2	0	0	0	0	0	113.4	K229	A227-K229 VanDerWaalsContact C-N 3.29Å; A227-K229 PolarHBondContact O-N 3.48Å
228	C	79.8	Confident	83.1	Confident	18 Å²	18	32.6 Å²	32.6	12%	0.122	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-85	6.6	178	-56.1	0	0	0	0	113.8	D135 G136 C137 K225 A226	D135-C228 WeakPolarHBondContact OD1-CB 3.48Å; G136-C228 PolarHBondContact N-O 2.91Å; C137-C228 HydrophobicContact CB-CB 3.52Å; C137-C228 WeakPolarHBondContact CB-SG 3.28Å; C137-C228 WeakPolarHBondContact SG-CB 3.06Å; C137-C228 CovalentContact SG-SG 2.03Å; C137-C228 PolarHBondContact SG-SG 3.14Å; K225-C228 WeakPolarHBondContact O-CB 2.97Å; K225-C228 PolarHBondContact O-N 2.86Å; A226-C228 PolarHBondContact O-N 3.48Å
229	K	86.1	Confident	82.3	Confident	5 Å²	5	34.7 Å²	34.7	2%	0.022	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	128.8	-170.7	-60.4	-66.8	163.4	-69.4	0	111.3	F107 L133 A134 D135 V145 F221 K225 A226 A227	F107-K229 HydrophobicContact CD2-CB 3.97Å; F107-K229 HydrophobicContact CE2-CB 4.49Å; F107-K229 WeakPolarHBondContact CE2-O 3.45Å; L133-K229 HydrophobicContact CD1-CB 4.14Å; A134-K229 WeakPolarHBondContact O-CA 3.41Å; D135-K229 IonicContact OD1-NZ 2.81Å; D135-K229 PolarHBondContact OD1-NZ 2.82Å; D135-K229 VanDerWaalsContact OD2-CE 3.32Å; D135-K229 WeakPolarHBondContact OD2-CE 3.03Å; D135-K229 IonicContact OD2-NZ 3.26Å; D135-K229 PolarHBondContact OD2-NZ 2.92Å; V145-K229 HydrophobicContact CG2-CD 3.63Å; V145-K229 VanDerWaalsContact CG2-CE 3.47Å; F221-K229 HydrophobicContact CD1-CD 3.96Å; F221-K229 HydrophobicContact CD1-CG 4.18Å; F221-K229 HydrophobicContact CD2-CD 4.39Å; F221-K229 HydrophobicContact CD2-CG 3.92Å; F221-K229 HydrophobicContact CE1-CD 4.17Å; F221-K229 HydrophobicContact CE1-CG 4.06Å; F221-K229 HydrophobicContact CE2-CG 3.75Å; F221-K229 HydrophobicContact CG-CD 4.12Å; F221-K229 HydrophobicContact CG-CG 4.16Å; F221-K229 HydrophobicContact CZ-CD 4.47Å; F221-K229 HydrophobicContact CZ-CG 3.85Å; K225-K229 WeakPolarHBondContact O-CG 3.42Å; K225-K229 PolarHBondContact O-NZ 3.22Å; A226-K229 WeakPolarHBondContact O-CB 3.35Å; A226-K229 PolarHBondContact O-N 2.73Å; A227-K229 VanDerWaalsContact C-N 3.29Å; A227-K229 PolarHBondContact O-N 3.48Å
230	H	84.8	Confident	81.5	Confident	23 Å²	23	37.8 Å²	37.8	11%	0.106	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	117	-172.7	-51	-44.4	0	0	0	109	R90 A134 L232	R90-H230 HydrophobicContact CG-CB 4.47Å; R90-H230 PolarHBondContact NH1-ND1 3Å; R90-H230 PolarHBondContact NH2-CE1 2.73Å; R90-H230 VanDerWaalsContact NH2-CE1 3.3Å; R90-H230 PolarHBondContact NH2-ND1 2.04Å; A134-H230 HydrophobicContact CB-CB 4.47Å; A134-H230 PolarHBondContact N-O 3.26Å; A134-H230 PolarHBondContact O-N 2.81Å; A134-H230 VanDerWaalsContact O-N 3.11Å; H230-L232 HydrophobicContact CB-CD2 4.3Å
231	L	89.5	Confident	80.5	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	121.2	173.8	-178.2	66.7	0	0	0	109.1	R90 L91 F107 I131 L133 W146 L286 W296	R90-L231 WeakPolarHBondContact CA-O 3.29Å; L91-L231 HydrophobicContact CB-CB 4.32Å; L91-L231 PolarHBondContact N-O 2.8Å; F107-L231 HydrophobicContact CE1-CB 3.78Å; F107-L231 HydrophobicContact CE1-CD2 4.41Å; F107-L231 HydrophobicContact CZ-CB 3.76Å; I131-L231 HydrophobicContact CG2-CD1 3.81Å; L133-L231 HydrophobicContact CD1-CB 4.46Å; W146-L231 HydrophobicContact CH2-CD1 3.7Å; W146-L231 HydrophobicContact CZ2-CD1 4.23Å; L231-L286 HydrophobicContact CD2-CD2 3.48Å; L231-L286 VanDerWaalsContact CD2-CD2 3.48Å; L231-W296 HydrophobicContact CD2-CH2 4.23Å
232	L	90	Very high	79.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	144.5	-175.9	-53.3	-177.4	0	0	0	110.7	T88 V89 R90 I131 E132 A134 H230 M237 I299	T88-L232 HydrophobicContact CG2-CB 3.82Å; T88-L232 HydrophobicContact CG2-CD1 4.14Å; T88-L232 HydrophobicContact CG2-CD2 4.28Å; T88-L232 HydrophobicContact CG2-CG 4.3Å; V89-L232 CarbonylContact O-C 3.55Å; V89-L232 VanDerWaalsContact O-CA 3.29Å; V89-L232 WeakPolarHBondContact O-CA 3.48Å; R90-L232 HydrophobicContact CB-CD2 3.62Å; R90-L232 HydrophobicContact CG-CD2 3.97Å; I131-L232 WeakPolarHBondContact CA-O 3.4Å; E132-L232 HydrophobicContact CB-CB 4.38Å; E132-L232 PolarHBondContact N-O 2.75Å; E132-L232 PolarHBondContact O-N 2.86Å; A134-L232 HydrophobicContact CB-CD1 3.7Å; A134-L232 HydrophobicContact CB-CG 4.25Å; H230-L232 HydrophobicContact CB-CD2 4.3Å; L232-M237 HydrophobicContact CD1-CB 3.87Å; L232-M237 VanDerWaalsContact CD1-N 3.35Å; L232-I299 HydrophobicContact CD2-CD1 3.87Å
233	L	92	Very high	77.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	145.9	169.2	-61.3	176.6	0	0	0	110.4	F80 F82 V89 I130 I131 F290 W296	F80-L233 HydrophobicContact CD2-CD1 4.38Å; F82-L233 HydrophobicContact CE2-CB 4.36Å; F82-L233 HydrophobicContact CZ-CB 3.76Å; V89-L233 HydrophobicContact CG2-CB 3.9Å; V89-L233 PolarHBondContact N-O 2.87Å; V89-L233 PolarHBondContact O-N 2.02Å; I130-L233 WeakPolarHBondContact O-CA 3.39Å; I131-L233 HydrophobicContact CB-CD2 4.06Å; I131-L233 HydrophobicContact CD1-CD2 3.84Å; I131-L233 HydrophobicContact CG1-CD2 3.57Å; I131-L233 HydrophobicContact CG2-CD2 3.8Å; L233-F290 HydrophobicContact CD1-CE1 3.96Å; L233-F290 HydrophobicContact CD1-CZ 3.96Å; L233-W296 HydrophobicContact CB-CZ3 4.42Å; L233-W296 HydrophobicContact CD1-CD2 4.42Å; L233-W296 HydrophobicContact CD1-CE3 4.13Å; L233-W296 HydrophobicContact CD1-CH2 3.34Å; L233-W296 HydrophobicContact CD1-CZ2 3.63Å; L233-W296 HydrophobicContact CD1-CZ3 3.61Å; L233-W296 HydrophobicContact CD2-CH2 4.5Å; L233-W296 HydrophobicContact CG-CE3 4.42Å; L233-W296 HydrophobicContact CG-CH2 3.65Å; L233-W296 HydrophobicContact CG-CZ2 4.43Å; L233-W296 HydrophobicContact CG-CZ3 3.63Å
234	G	88.4	Confident	76	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.01	29%	0.289	C	S	.	.	S	Bend	trans	87.9	-4.6	172.2	0	0	0	0	0	116.1	F82 V129 I130 N248 Y249	F82-G234 VanDerWaalsContact CD1-CA 3.44Å; F82-G234 VanDerWaalsContact CE1-CA 3.44Å; V129-G234 CarbonylContact O-C 3.48Å; I130-G234 PolarHBondContact O-N 3.02Å; G234-N248 WeakPolarHBondContact O-CA 3.4Å; G234-N248 PolarHBondContact O-ND2 3.01Å; G234-Y249 PolarHBondContact O-N 3.49Å
235	G	88.8	Confident	75.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	170.1	176.7	177.6	0	0	0	0	0	111.8	T88 V129	T88-G235 WeakPolarHBondContact CG2-O 3.36Å; V129-G235 WeakPolarHBondContact O-CA 3.44Å; V129-G235 PolarHBondContact O-N 2.86Å; V129-G235 VanDerWaalsContact O-N 3.12Å
236	P	86.3	Confident	74.7	Confident	10 Å²	10	48.2 Å²	48.2	7%	0.065	28%	0.278	C	S	.	.	S	Bend	trans	-78.1	178.5	173.8	36.3	-36.9	0	0	0	111.5	T88 V129 E132 P238 Y241 M247	T88-P236 PolarHBondContact OG1-O 2.93Å; T88-P236 VanDerWaalsContact OG1-O 3.05Å; V129-P236 HydrophobicContact CG2-CB 4.35Å; E132-P236 VanDerWaalsContact OE1-CA 3.26Å; E132-P236 WeakPolarHBondContact OE1-CA 3.38Å; P236-P238 VanDerWaalsContact O-CD 3.24Å; P236-P238 WeakPolarHBondContact O-CD 3.03Å; P236-Y241 HydrophobicContact CB-CD2 4.29Å; P236-Y241 HydrophobicContact CB-CE2 3.6Å; P236-Y241 HydrophobicContact CG-CD2 4.18Å; P236-Y241 HydrophobicContact CG-CE2 3.97Å; P236-M247 HydrophobicContact CG-CB 3.79Å; P236-M247 HydrophobicContact CG-SD 4.49Å
237	M	81	Confident	75	Confident	24 Å²	24	48.4 Å²	48.4	12%	0.118	28%	0.278	C	S	.	.			trans	-57.6	117.9	171.8	-179.7	168.3	-77.5	0	0	112.2	E132 A134 L232 R240	E132-M237 PolarHBondContact OE1-N 3.29Å; A134-M237 HydrophobicContact CB-CB 4.17Å; A134-M237 HydrophobicContact CB-CE 3.76Å; L232-M237 HydrophobicContact CD1-CB 3.87Å; L232-M237 VanDerWaalsContact CD1-N 3.35Å; M237-R240 HydrophobicContact CB-CG 4Å; M237-R240 HydrophobicContact CG-CG 3.68Å; M237-R240 PolarHBondContact O-N 3.01Å; M237-R240 HydrophobicContact SD-CG 3.78Å
238	P	74.5	Confident	75.6	Confident	25 Å²	25	44.5 Å²	44.5	16%	0.162	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	142.1	-179.6	-27.1	37.1	0	0	0	113.4	P236 R240 I299 R301	P236-P238 VanDerWaalsContact O-CD 3.24Å; P236-P238 WeakPolarHBondContact O-CD 3.03Å; P238-R240 VanDerWaalsContact C-N 3.29Å; P238-R240 PolarHBondContact O-N 3.24Å; P238-I299 HydrophobicContact CB-CG2 4.38Å; P238-I299 HydrophobicContact CG-CB 4.17Å; P238-I299 HydrophobicContact CG-CG2 3.81Å; P238-R301 HydrophobicContact CB-CG 4.33Å
239	G	66.5	Low	76.1	Confident	51 Å²	51	43.6 Å²	43.6	53%	0.526	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	6.9	177.9	0	0	0	0	0	116.1
240	R	69.5	Low	76.2	Confident	96 Å²	96	44.2 Å²	44.2	36%	0.362	24%	0.24	S	C	.	.	S	Bend	trans	-91.3	-7.8	173.5	-73.5	-68	-166.4	166.2	4.9	114.7	G136 S138 P143 M237 P238	G136-R240 PolarHBondContact O-NH2 2.94Å; S138-R240 PolarHBondContact O-NH1 3.13Å; S138-R240 PolarHBondContact O-NH2 2.87Å; P143-R240 HydrophobicContact CB-CB 4.03Å; P143-R240 HydrophobicContact CB-CG 4.02Å; P143-R240 HydrophobicContact CG-CB 4.2Å; M237-R240 HydrophobicContact CB-CG 4Å; M237-R240 HydrophobicContact CG-CG 3.68Å; M237-R240 PolarHBondContact O-N 3.01Å; M237-R240 HydrophobicContact SD-CG 3.78Å; P238-R240 VanDerWaalsContact C-N 3.29Å; P238-R240 PolarHBondContact O-N 3.24Å
241	Y	67.1	Low	76.4	Confident	57 Å²	57	43.1 Å²	43.1	22%	0.224	24%	0.236	C	C	.	.	S	Bend	trans	-124.6	156.7	-175.7	-62.8	-97.3	0	0	0	109.9	P143 R147 P236 M247	P143-Y241 HydrophobicContact CG-CE1 4.39Å; P143-Y241 HydrophobicContact CG-CE2 3.75Å; P143-Y241 WeakPolarHBondContact CG-OH 3.04Å; R147-Y241 PolarHBondContact NH1-OH 3.4Å; R147-Y241 VanDerWaalsContact NH1-OH 3.13Å; P236-Y241 HydrophobicContact CB-CD2 4.29Å; P236-Y241 HydrophobicContact CB-CE2 3.6Å; P236-Y241 HydrophobicContact CG-CD2 4.18Å; P236-Y241 HydrophobicContact CG-CE2 3.97Å; Y241-M247 HydrophobicContact CD1-SD 3.78Å; Y241-M247 HydrophobicContact CE1-CE 4.47Å; Y241-M247 HydrophobicContact CE1-SD 3.81Å; Y241-M247 HydrophobicContact CG-SD 4.24Å
242	E	57.6	Low	76.5	Confident	158 Å²	158	43.7 Å²	43.7	74%	0.738	24%	0.239	S	C	*	.			trans	-60.6	145.1	-177.6	-66.8	-174.4	161	0	0	112.1	G244	E242-G244 PolarHBondContact O-N 3.23Å
243	E	45.2	Very low	76.6	Confident	175 Å²	175	43.7 Å²	43.7	82%	0.818	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	122.7	176.9	-77	178.4	155.3	0	0	110.9	R301	E243-R301 IonicContact OE1-NH1 3.18Å
244	G	48	Very low	76.4	Confident	77 Å²	77	43.8 Å²	43.8	79%	0.794	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	116.4	-8.5	178.8	0	0	0	0	0	115.8	E242	E242-G244 PolarHBondContact O-N 3.23Å
245	Q	57.2	Low	76.4	Confident	105 Å²	105	44.1 Å²	44.1	49%	0.491	24%	0.241	S	C	.	.			trans	-103.5	90.1	174.1	-67.7	-173.7	3.5	0	0	111.6	M247	Q245-M247 PolarHBondContact O-N 3.04Å; Q245-M247 VanDerWaalsContact O-N 3.14Å
246	L	67.2	Low	76.4	Confident	87 Å²	87	44.2 Å²	44.2	46%	0.455	24%	0.241	S	C	.	.			trans	-70.4	103.3	172.8	-75.1	168.5	0	0	0	110.2	E86	E86-L246 HydrophobicContact CG-CD2 3.66Å
247	M	82	Confident	76.5	Confident	10 Å²	10	44.2 Å²	44.2	5%	0.049	24%	0.24	C	C	.	.			trans	-99.5	16.6	179.1	-67.7	-171.1	60.9	0	0	112.9	P127 S128 V129 P236 Y241 Q245	P127-M247 HydrophobicContact CG-CE 3.82Å; P127-M247 WeakPolarHBondContact O-CA 3.27Å; P127-M247 WeakPolarHBondContact O-CB 3.43Å; P127-M247 WeakPolarHBondContact O-CG 3.41Å; S128-M247 CarbonylContact C-O 3.53Å; S128-M247 WeakPolarHBondContact CA-O 3.45Å; V129-M247 HydrophobicContact CG2-CB 4.5Å; V129-M247 HydrophobicContact CG2-CE 3.68Å; V129-M247 PolarHBondContact N-O 3.22Å; P236-M247 HydrophobicContact CG-CB 3.79Å; P236-M247 HydrophobicContact CG-SD 4.49Å; Y241-M247 HydrophobicContact CD1-SD 3.78Å; Y241-M247 HydrophobicContact CE1-CE 4.47Å; Y241-M247 HydrophobicContact CE1-SD 3.81Å; Y241-M247 HydrophobicContact CG-SD 4.24Å; Q245-M247 PolarHBondContact O-N 3.04Å; Q245-M247 VanDerWaalsContact O-N 3.14Å
248	N	86.5	Confident	77	Confident	10 Å²	10	43.2 Å²	43.2	5%	0.053	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-80.5	143.8	-174.5	-72	85.7	0	0	0	111.8	G84 T85 T88 S128 G234	G84-N248 WeakPolarHBondContact O-CB 3.47Å; T85-N248 WeakPolarHBondContact O-CB 3.41Å; T85-N248 PolarHBondContact O-ND2 3.47Å; T88-N248 PolarHBondContact OG1-ND2 3.11Å; S128-N248 WeakPolarHBondContact CB-O 3.29Å; G234-N248 WeakPolarHBondContact O-CA 3.4Å; G234-N248 PolarHBondContact O-ND2 3.01Å
249	Y	90.9	Very high	77.6	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.228	C	C	.	.			trans	-78.2	145	178.3	170.6	-109.8	0	0	0	111.1	F82 G84 R119 P120 Q124 V129 I130 I150 G234 G251 M252 V253	F82-Y249 HydrophobicContact CB-CD1 4.21Å; F82-Y249 WeakPolarHBondContact CB-O 3.33Å; F82-Y249 AromaticContact CD2-CD1 3.91Å; F82-Y249 HydrophobicContact CD2-CD1 3.91Å; F82-Y249 HydrophobicContact CD2-CE1 4.37Å; F82-Y249 HydrophobicContact CG-CD1 4.37Å; G84-Y249 PolarHBondContact N-O 3.13Å; R119-Y249 PolarHBondContact O-OH 2.95Å; P120-Y249 WeakPolarHBondContact CA-OH 3.16Å; P120-Y249 HydrophobicContact CB-CE2 3.97Å; Q124-Y249 VanDerWaalsContact OE1-CD2 3.3Å; V129-Y249 WeakPolarHBondContact O-CB 3.39Å; I130-Y249 HydrophobicContact CB-CD2 4.46Å; I130-Y249 HydrophobicContact CB-CG 4.44Å; I130-Y249 HydrophobicContact CD1-CD2 4.43Å; I130-Y249 HydrophobicContact CD1-CE2 4.29Å; I130-Y249 HydrophobicContact CG1-CD2 3.52Å; I130-Y249 HydrophobicContact CG1-CE2 3.8Å; I130-Y249 HydrophobicContact CG1-CG 3.97Å; I130-Y249 HydrophobicContact CG2-CD1 4.39Å; I130-Y249 HydrophobicContact CG2-CE1 4.45Å; I130-Y249 HydrophobicContact CG2-CG 4.46Å; I150-Y249 HydrophobicContact CD1-CD2 4.47Å; I150-Y249 HydrophobicContact CD1-CE2 4.15Å; G234-Y249 PolarHBondContact O-N 3.49Å; Y249-G251 WeakPolarHBondContact CE1-O 3.29Å; Y249-M252 PolarHBondContact OH-O 2.66Å; Y249-V253 HydrophobicContact CD1-CG2 4.03Å; Y249-V253 HydrophobicContact CE1-CG2 3.54Å
250	R	87.9	Confident	78.6	Confident	17 Å²	17	43.4 Å²	43.4	6%	0.064	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	124.2	174.9	-178.6	-168.9	-76.2	-71.8	-7.2	110.3	F82 D83 E121 Q124	F82-R250 CarbonylContact O-C 3.54Å; F82-R250 WeakPolarHBondContact O-CA 3.4Å; D83-R250 PolarHBondContact O-NH1 3.03Å; D83-R250 VanDerWaalsContact O-NH1 3.16Å; D83-R250 PolarHBondContact O-NH2 2.84Å; E121-R250 HydrophobicContact CB-CG 3.77Å; E121-R250 HydrophobicContact CG-CG 3.91Å; E121-R250 PolarHBondContact N-O 2.98Å; E121-R250 VanDerWaalsContact N-O 3.07Å; E121-R250 VanDerWaalsContact OE2-CD 3.32Å; E121-R250 WeakPolarHBondContact OE2-CD 3.22Å; E121-R250 WeakPolarHBondContact OE2-CG 3.06Å; E121-R250 IonicContact OE2-NH1 3.98Å; Q124-R250 PolarHBondContact NE2-O 2.84Å; Q124-R250 VanDerWaalsContact OE1-N 3.14Å
251	G	89.4	Confident	79.4	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	120	-163.8	179.7	0	0	0	0	0	113.9	F82 R119 Y249	F82-G251 PolarHBondContact N-O 2.85Å; F82-G251 PolarHBondContact O-N 2.73Å; R119-G251 WeakPolarHBondContact O-CA 3.36Å; Y249-G251 WeakPolarHBondContact CE1-O 3.29Å
252	M	90.5	Very high	80.4	Confident	14 Å²	14	37.8 Å²	37.8	7%	0.069	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	148.6	-169	-41.8	-176.6	-178.2	0	0	112.6	A79 F80 I118 R119 W189 Y249 I322 L856	A79-M252 HydrophobicContact CB-CB 4.13Å; F80-M252 CarbonylContact O-C 3.26Å; F80-M252 VanDerWaalsContact O-CA 3.28Å; F80-M252 WeakPolarHBondContact O-CA 3.21Å; I118-M252 WeakPolarHBondContact CA-O 3.35Å; R119-M252 HydrophobicContact CB-CB 4.11Å; R119-M252 HydrophobicContact CB-CG 4.36Å; R119-M252 PolarHBondContact N-O 2.87Å; R119-M252 PolarHBondContact O-N 2.82Å; W189-M252 HydrophobicContact CH2-CB 3.89Å; W189-M252 HydrophobicContact CH2-SD 4.43Å; W189-M252 HydrophobicContact CZ2-CB 4.46Å; W189-M252 HydrophobicContact CZ2-SD 4.1Å; Y249-M252 PolarHBondContact OH-O 2.66Å; M252-I322 HydrophobicContact CE-CD1 3.49Å; M252-I322 VanDerWaalsContact CE-CD1 3.49Å; M252-I322 HydrophobicContact CG-CD1 3.97Å; M252-I322 HydrophobicContact SD-CD1 3.61Å; M252-L856 HydrophobicContact CE-CD1 3.75Å
253	V	91.9	Very high	81.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	127.4	169.5	-173	0	0	0	0	109.4	A79 F80 F82 I118 I130 Y249 V256 F290	A79-V253 VanDerWaalsContact CA-O 3.29Å; A79-V253 WeakPolarHBondContact CA-O 3.17Å; A79-V253 WeakPolarHBondContact CB-O 3.38Å; F80-V253 PolarHBondContact N-O 3.41Å; F80-V253 PolarHBondContact O-N 2.77Å; F82-V253 HydrophobicContact CD2-CG2 4.11Å; F82-V253 HydrophobicContact CE2-CB 4.37Å; F82-V253 HydrophobicContact CE2-CG2 3.86Å; I118-V253 HydrophobicContact CG2-CG1 4.48Å; I118-V253 HydrophobicContact CG2-CG2 4.45Å; I130-V253 HydrophobicContact CG2-CG2 3.94Å; Y249-V253 HydrophobicContact CD1-CG2 4.03Å; Y249-V253 HydrophobicContact CE1-CG2 3.54Å; V253-V256 HydrophobicContact CG1-CG2 3.52Å; V253-F290 HydrophobicContact CG1-CE2 4.45Å; V253-F290 HydrophobicContact CG1-CZ 4.47Å; V253-F290 VanDerWaalsContact O-CE2 3.29Å; V253-F290 WeakPolarHBondContact O-CE2 3.49Å
254	A	89.2	Confident	83.7	Confident	2 Å²	2	24.4 Å²	24.4	2%	0.017	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	155.3	-178.5	0	0	0	0	0	112.1	A79 W117 W189 V256 L326	A79-A254 HydrophobicContact CB-CB 4.11Å; W117-A254 HydrophobicContact CB-CB 4.2Å; W117-A254 PolarHBondContact N-O 3.06Å; W117-A254 PolarHBondContact O-N 3.48Å; W117-A254 VanDerWaalsContact O-O 3.13Å; W189-A254 HydrophobicContact CH2-CB 3.64Å; W189-A254 HydrophobicContact CZ3-CB 3.69Å; A254-V256 PolarHBondContact O-N 2.65Å; A254-L326 HydrophobicContact CB-CD2 4.15Å
255	D	86.5	Confident	85.4	Confident	8 Å²	8	21.4 Å²	21.4	4%	0.043	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	48.7	47.9	167.5	-166.3	41.4	0	0	0	115	K257 W287 A288 L326	D255-K257 PolarHBondContact O-N 3.16Å; D255-K257 WeakPolarHBondContact OD1-CE 3.06Å; D255-K257 IonicContact OD1-NZ 3.7Å; D255-K257 PolarHBondContact OD1-NZ 3.19Å; D255-K257 WeakPolarHBondContact OD2-CE 3.23Å; D255-K257 IonicContact OD2-NZ 2.73Å; D255-K257 PolarHBondContact OD2-NZ 3.11Å; D255-W287 PolarHBondContact OD1-NE1 2.77Å; D255-A288 WeakPolarHBondContact CA-O 3.44Å; D255-L326 HydrophobicContact CB-CD2 4.47Å
256	V	89.6	Confident	86.7	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.006	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	120.9	-178.8	-179.2	0	0	0	0	110	L114 A115 A116 I131 V253 A254 W287 A288 F290	L114-V256 HydrophobicContact CD1-CG1 4Å; A115-V256 WeakPolarHBondContact O-CA 3.02Å; A116-V256 HydrophobicContact CB-CG2 3.93Å; I131-V256 HydrophobicContact CD1-CG1 4.18Å; I131-V256 HydrophobicContact CD1-CG2 4.37Å; V253-V256 HydrophobicContact CG1-CG2 3.52Å; A254-V256 PolarHBondContact O-N 2.65Å; V256-W287 CarbonylContact O-C 3.59Å; V256-W287 WeakPolarHBondContact O-CA 3.39Å; V256-A288 HydrophobicContact CB-CB 4.34Å; V256-A288 PolarHBondContact N-O 3.08Å; V256-A288 VanDerWaalsContact N-O 3.11Å; V256-A288 PolarHBondContact O-N 2.81Å; V256-F290 HydrophobicContact CB-CZ 4.25Å; V256-F290 HydrophobicContact CG2-CE2 4.01Å; V256-F290 HydrophobicContact CG2-CZ 3.7Å
257	K	88.8	Confident	87.7	Confident	10 Å²	10	16.4 Å²	16.4	4%	0.043	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.2	-178.5	-68.9	159.8	174.8	155.8	0	110	L114 A115 D255 W259 L286 W287	L114-K257 CarbonylContact C-O 3.55Å; L114-K257 WeakPolarHBondContact CA-O 3.45Å; A115-K257 PolarHBondContact N-O 3.28Å; A115-K257 PolarHBondContact O-N 3.42Å; D255-K257 PolarHBondContact O-N 3.16Å; D255-K257 WeakPolarHBondContact OD1-CE 3.06Å; D255-K257 IonicContact OD1-NZ 3.7Å; D255-K257 PolarHBondContact OD1-NZ 3.19Å; D255-K257 WeakPolarHBondContact OD2-CE 3.23Å; D255-K257 IonicContact OD2-NZ 2.73Å; D255-K257 PolarHBondContact OD2-NZ 3.11Å; K257-W259 HydrophobicContact CB-CE3 4.22Å; K257-W259 HydrophobicContact CB-CH2 3.47Å; K257-W259 VanDerWaalsContact CB-CH2 3.47Å; K257-W259 HydrophobicContact CB-CZ2 4.18Å; K257-W259 HydrophobicContact CB-CZ3 3.49Å; K257-W259 VanDerWaalsContact CB-CZ3 3.49Å; K257-W259 HydrophobicContact CD-CH2 3.78Å; K257-W259 HydrophobicContact CD-CZ2 4.29Å; K257-W259 HydrophobicContact CG-CH2 4.15Å; K257-L286 WeakPolarHBondContact CA-O 3.48Å; K257-W287 VanDerWaalsContact CE-NE1 3.3Å; K257-W287 HydrophobicContact CG-CG 4.08Å
258	L	90.4	Very high	88	Confident	4 Å²	4	15.9 Å²	15.9	2%	0.021	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	117.9	174.8	176.8	59.2	0	0	0	108.5	P108 F112 T113 L114 F285 L286	P108-L258 HydrophobicContact CG-CG 4.41Å; F112-L258 HydrophobicContact CB-CD1 4.13Å; F112-L258 HydrophobicContact CD2-CD1 3.98Å; F112-L258 HydrophobicContact CG-CD1 4.46Å; T113-L258 CarbonylContact O-C 3.25Å; T113-L258 WeakPolarHBondContact O-CA 3.21Å; T113-L258 WeakPolarHBondContact O-CD1 3.08Å; L114-L258 HydrophobicContact CB-CD1 4.21Å; L114-L258 HydrophobicContact CD1-CB 4.32Å; L114-L258 HydrophobicContact CD1-CD1 4.46Å; L258-F285 HydrophobicContact CD2-CD1 3.74Å; L258-F285 HydrophobicContact CD2-CE1 4.24Å; L258-F285 HydrophobicContact CG-CB 4.44Å; L258-F285 HydrophobicContact CG-CD1 4.16Å; L258-F285 WeakPolarHBondContact O-CA 2.94Å; L258-F285 WeakPolarHBondContact O-CB 3.44Å; L258-F285 PolarHBondContact O-N 3.15Å; L258-L286 HydrophobicContact CB-CB 4.23Å; L258-L286 PolarHBondContact N-O 3.02Å; L258-L286 PolarHBondContact O-N 2.03Å
259	W	88.9	Confident	88.1	Confident	3 Å²	3	16.7 Å²	16.7	1%	0.011	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	147.3	171.3	-63.6	-98.8	0	0	0	110.3	F112 T113 A115 K257 V261 K263 F267 I271 G280 E283 I284	F112-W259 WeakPolarHBondContact CA-O 3.34Å; F112-W259 WeakPolarHBondContact CB-O 3.36Å; T113-W259 HydrophobicContact CG2-CE3 3.66Å; T113-W259 HydrophobicContact CG2-CZ3 3.99Å; T113-W259 PolarHBondContact N-O 3.1Å; T113-W259 VanDerWaalsContact N-O 3.15Å; T113-W259 PolarHBondContact O-N 2.99Å; A115-W259 HydrophobicContact CB-CH2 4.42Å; A115-W259 HydrophobicContact CB-CZ3 3.89Å; K257-W259 HydrophobicContact CB-CE3 4.22Å; K257-W259 HydrophobicContact CB-CH2 3.47Å; K257-W259 VanDerWaalsContact CB-CH2 3.47Å; K257-W259 HydrophobicContact CB-CZ2 4.18Å; K257-W259 HydrophobicContact CB-CZ3 3.49Å; K257-W259 VanDerWaalsContact CB-CZ3 3.49Å; K257-W259 HydrophobicContact CD-CH2 3.78Å; K257-W259 HydrophobicContact CD-CZ2 4.29Å; K257-W259 HydrophobicContact CG-CH2 4.15Å; W259-V261 HydrophobicContact CB-CG2 4.25Å; W259-V261 PolarHBondContact O-N 2.92Å; W259-K263 HydrophobicContact CD2-CG 4.44Å; W259-K263 HydrophobicContact CG-CG 4.39Å; W259-F267 AromaticContact CE2-CE1 3.98Å; W259-F267 AromaticContact CH2-CE1 3.95Å; W259-F267 HydrophobicContact CH2-CE1 3.95Å; W259-F267 HydrophobicContact CH2-CZ 4.45Å; W259-F267 AromaticContact CZ2-CE1 3.62Å; W259-F267 HydrophobicContact CZ2-CE1 3.62Å; W259-F267 AromaticContact CZ2-CZ 3.71Å; W259-F267 HydrophobicContact CZ2-CZ 3.71Å; W259-I271 HydrophobicContact CH2-CD1 3.67Å; W259-I271 HydrophobicContact CZ3-CD1 4.19Å; W259-G280 PolarHBondContact NE1-O 3.48Å; W259-G280 VanDerWaalsContact NE1-O 3.08Å; W259-E283 WeakPolarHBondContact CA-O 3.15Å; W259-I284 HydrophobicContact CD2-CG1 4.44Å; W259-I284 HydrophobicContact CG-CG1 4.3Å; W259-I284 HydrophobicContact CZ2-CD1 4.45Å; W259-I284 HydrophobicContact CZ2-CG1 4.47Å
260	N	86.4	Confident	87.8	Confident	76 Å²	76	21.7 Å²	21.7	41%	0.406	12%	0.115	S	C	.	.	S	Bend	trans	-82.2	14.4	174.1	68.8	-6.1	0	0	0	113.8	P108 Q111 E283 F285	P108-N260 HydrophobicContact CB-CB 4.37Å; P108-N260 HydrophobicContact CG-CB 4.01Å; Q111-N260 CarbonylContact O-C 3.51Å; N260-E283 PolarHBondContact N-O 2.86Å; N260-E283 VanDerWaalsContact N-O 3.12Å; N260-E283 WeakPolarHBondContact OD1-CB 3.35Å; N260-E283 PolarHBondContact OD1-O 2.64Å; N260-E283 VanDerWaalsContact OD1-O 3.07Å; N260-F285 HydrophobicContact CB-CB 4.44Å
261	V	87.3	Confident	87.7	Confident	14 Å²	14	21 Å²	21	9%	0.085	11%	0.113	C	C	.	.	S	Bend	trans	-135.6	161.8	178.2	-61.2	0	0	0	0	111.8	F112 T113 W259 K263 E283	F112-V261 CarbonylContact C-O 3.41Å; T113-V261 WeakPolarHBondContact CB-O 3.39Å; T113-V261 PolarHBondContact N-O 3.27Å; T113-V261 VanDerWaalsContact N-O 3.08Å; T113-V261 PolarHBondContact OG1-O 3.34Å; W259-V261 HydrophobicContact CB-CG2 4.25Å; W259-V261 PolarHBondContact O-N 2.92Å; V261-K263 HydrophobicContact CG2-CD 3.93Å; V261-E283 HydrophobicContact CG1-CB 4.36Å; V261-E283 HydrophobicContact CG1-CG 4.4Å; V261-E283 HydrophobicContact CG2-CB 4Å; V261-E283 HydrophobicContact CG2-CG 4.47Å; V261-E283 VanDerWaalsContact CG2-OE2 3.25Å; V261-E283 WeakPolarHBondContact CG2-OE2 3.21Å
262	T	88.1	Confident	87.5	Confident	21 Å²	21	21 Å²	21	13%	0.129	11%	0.113	C	C	.	.	P	Polyproline II helix	trans	-79.5	120.2	170.4	-34.1	0	0	0	0	110.2	Q111 Y196 N197	Q111-T262 WeakPolarHBondContact CB-OG1 3.49Å; Q111-T262 VanDerWaalsContact OE1-N 3.07Å; Q111-T262 PolarHBondContact OE1-OG1 2.87Å; Q111-T262 VanDerWaalsContact OE1-OG1 3.1Å; Y196-T262 PolarHBondContact O-OG1 3.04Å; Y196-T262 VanDerWaalsContact O-OG1 3.04Å; N197-T262 HydrophobicContact CB-CG2 3.88Å; N197-T262 WeakPolarHBondContact CB-OG1 3.47Å
263	K	88.6	Confident	86.7	Confident	25 Å²	25	21.2 Å²	21.2	11%	0.109	12%	0.118	C	C	.	.	P	Polyproline II helix	trans	-94.9	146	170.4	-55.9	-66.1	-171.1	-176.9	0	109.7	T113 W259 V261 F267 I268 E283	T113-K263 HydrophobicContact CG2-CB 4.24Å; T113-K263 HydrophobicContact CG2-CG 4.24Å; T113-K263 PolarHBondContact OG1-N 2.84Å; W259-K263 HydrophobicContact CD2-CG 4.44Å; W259-K263 HydrophobicContact CG-CG 4.39Å; V261-K263 HydrophobicContact CG2-CD 3.93Å; K263-F267 HydrophobicContact CB-CB 4.14Å; K263-F267 HydrophobicContact CB-CD1 3.51Å; K263-F267 HydrophobicContact CB-CE1 4.13Å; K263-F267 HydrophobicContact CB-CG 3.97Å; K263-F267 HydrophobicContact CD-CD1 4.21Å; K263-F267 HydrophobicContact CD-CE1 4.2Å; K263-F267 HydrophobicContact CD-CG 4.4Å; K263-F267 HydrophobicContact CD-CZ 4.4Å; K263-F267 HydrophobicContact CG-CD1 3.69Å; K263-F267 HydrophobicContact CG-CE1 3.78Å; K263-F267 HydrophobicContact CG-CG 4.28Å; K263-F267 HydrophobicContact CG-CZ 4.45Å; K263-I268 HydrophobicContact CB-CD1 4.34Å; K263-E283 IonicContact NZ-OE2 3.15Å; K263-E283 PolarHBondContact NZ-OE2 2.02Å
264	G	81.9	Confident	85.7	Confident	27 Å²	27	23.4 Å²	23.4	28%	0.278	13%	0.13	S	C	.	.	P	Polyproline II helix	trans	-81.8	163.7	-179.9	0	0	0	0	0	113.5	P266 F267 I268	G264-P266 VanDerWaalsContact C-CD 3.43Å; G264-P266 VanDerWaalsContact C-N 3.34Å; G264-F267 WeakPolarHBondContact O-CA 3.35Å; G264-F267 WeakPolarHBondContact O-CB 3.05Å; G264-F267 PolarHBondContact O-N 3.47Å; G264-I268 PolarHBondContact O-N 3.2Å
265	A	84.7	Confident	84.3	Confident	15 Å²	15	23.5 Å²	23.5	12%	0.124	13%	0.131	C	C	.	.	H	α-helix	trans	-51.6	-40.4	179.4	0	0	0	0	0	114.6	F204 F267 I268 R269 L1024 I1043	F204-A265 HydrophobicContact CE1-CB 3.81Å; F204-A265 HydrophobicContact CZ-CB 4.28Å; A265-F267 PolarHBondContact O-N 2.87Å; A265-I268 PolarHBondContact O-N 3.49Å; A265-I268 VanDerWaalsContact O-N 3.17Å; A265-R269 PolarHBondContact O-N 3.39Å; A265-L1024 HydrophobicContact CB-CD2 4.3Å; A265-I1043 HydrophobicContact CB-CG2 4.4Å
266	P	85.3	Confident	83	Confident	63 Å²	63	26.6 Å²	26.6	41%	0.409	15%	0.153	S	C	.	.	H	α-helix	trans	-64.6	-18.5	175.4	-21.1	32.4	0	0	0	115.1	G264 R270 L1024	G264-P266 VanDerWaalsContact C-CD 3.43Å; G264-P266 VanDerWaalsContact C-N 3.34Å; P266-R270 WeakPolarHBondContact O-CG 3.25Å; P266-R270 PolarHBondContact O-NE 2.87Å; P266-L1024 HydrophobicContact CB-CD2 4.41Å; P266-L1024 HydrophobicContact CG-CD1 3.94Å; P266-L1024 HydrophobicContact CG-CD2 4.13Å
267	F	87.3	Confident	81.6	Confident	23 Å²	23	29.2 Å²	29.2	10%	0.101	17%	0.167	C	C	.	.	H	α-helix	trans	-83.3	-46.8	171.2	-178.2	-87.6	0	0	0	110.4	W259 K263 G264 A265 R269 R270 I271 L279	W259-F267 AromaticContact CE2-CE1 3.98Å; W259-F267 AromaticContact CH2-CE1 3.95Å; W259-F267 HydrophobicContact CH2-CE1 3.95Å; W259-F267 HydrophobicContact CH2-CZ 4.45Å; W259-F267 AromaticContact CZ2-CE1 3.62Å; W259-F267 HydrophobicContact CZ2-CE1 3.62Å; W259-F267 AromaticContact CZ2-CZ 3.71Å; W259-F267 HydrophobicContact CZ2-CZ 3.71Å; K263-F267 HydrophobicContact CB-CB 4.14Å; K263-F267 HydrophobicContact CB-CD1 3.51Å; K263-F267 HydrophobicContact CB-CE1 4.13Å; K263-F267 HydrophobicContact CB-CG 3.97Å; K263-F267 HydrophobicContact CD-CD1 4.21Å; K263-F267 HydrophobicContact CD-CE1 4.2Å; K263-F267 HydrophobicContact CD-CG 4.4Å; K263-F267 HydrophobicContact CD-CZ 4.4Å; K263-F267 HydrophobicContact CG-CD1 3.69Å; K263-F267 HydrophobicContact CG-CE1 3.78Å; K263-F267 HydrophobicContact CG-CG 4.28Å; K263-F267 HydrophobicContact CG-CZ 4.45Å; G264-F267 WeakPolarHBondContact O-CA 3.35Å; G264-F267 WeakPolarHBondContact O-CB 3.05Å; G264-F267 PolarHBondContact O-N 3.47Å; A265-F267 PolarHBondContact O-N 2.87Å; F267-R269 PolarHBondContact O-N 3.32Å; F267-R270 PolarHBondContact O-N 2.9Å; F267-R270 VanDerWaalsContact O-N 3.17Å; F267-I271 HydrophobicContact CD1-CD1 4.37Å; F267-I271 HydrophobicContact CE1-CD1 4.05Å; F267-I271 HydrophobicContact CE1-CG2 4.08Å; F267-I271 HydrophobicContact CZ-CG2 4.2Å; F267-I271 PolarHBondContact O-N 3.12Å; F267-L279 HydrophobicContact CE2-CB 4.25Å
268	I	88.3	Confident	80.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.1	-44.9	179.1	-56.9	-58.7	0	0	0	111.7	T113 A193 T195 F204 K263 G264 A265 R270 I271 A272	T113-I268 HydrophobicContact CG2-CD1 3.68Å; A193-I268 HydrophobicContact CB-CD1 4.18Å; A193-I268 HydrophobicContact CB-CG2 3.76Å; T195-I268 HydrophobicContact CG2-CD1 4.27Å; F204-I268 HydrophobicContact CB-CG2 3.91Å; F204-I268 HydrophobicContact CD1-CB 4.41Å; F204-I268 HydrophobicContact CD1-CG2 4Å; F204-I268 HydrophobicContact CD2-CG2 4.36Å; F204-I268 HydrophobicContact CE2-CG1 4.38Å; F204-I268 HydrophobicContact CG-CG2 3.87Å; F204-I268 HydrophobicContact CZ-CG1 4.42Å; K263-I268 HydrophobicContact CB-CD1 4.34Å; G264-I268 PolarHBondContact O-N 3.2Å; A265-I268 PolarHBondContact O-N 3.49Å; A265-I268 VanDerWaalsContact O-N 3.17Å; I268-R270 PolarHBondContact O-N 3.22Å; I268-I271 HydrophobicContact CD1-CD1 4.41Å; I268-I271 WeakPolarHBondContact O-CG1 3.45Å; I268-I271 PolarHBondContact O-N 3.31Å; I268-A272 PolarHBondContact O-N 2.87Å; I268-A272 VanDerWaalsContact O-N 3.13Å
269	R	88	Confident	78.5	Confident	26 Å²	26	35.4 Å²	35.4	10%	0.098	21%	0.207	C	C	.	.	H	α-helix	trans	-56	-47.1	174.7	-170	-162.6	66.7	58.5	-4.9	112.6	A265 F267 I271 A272 G273 D997 S1023	A265-R269 PolarHBondContact O-N 3.39Å; F267-R269 PolarHBondContact O-N 3.32Å; R269-I271 PolarHBondContact O-N 2.87Å; R269-A272 WeakPolarHBondContact O-CB 3.07Å; R269-A272 PolarHBondContact O-N 2.99Å; R269-A272 VanDerWaalsContact O-N 3.15Å; R269-G273 PolarHBondContact O-N 3.26Å; R269-G273 VanDerWaalsContact O-N 3.09Å; R269-D997 WeakPolarHBondContact CD-O 3.22Å; R269-D997 WeakPolarHBondContact CG-OD2 3.07Å; R269-D997 PolarHBondContact NE-O 3.13Å; R269-D997 PolarHBondContact NH1-O 2.9Å; R269-S1023 WeakPolarHBondContact CD-O 3.01Å
270	R	84.5	Confident	77	Confident	105 Å²	105	36.9 Å²	36.9	40%	0.396	22%	0.222	S	C	.	.	H	α-helix	trans	-64.8	-34.2	-178.1	-76.9	-175.9	-69	168.5	2.4	113.8	P266 F267 I268	P266-R270 WeakPolarHBondContact O-CG 3.25Å; P266-R270 PolarHBondContact O-NE 2.87Å; F267-R270 PolarHBondContact O-N 2.9Å; F267-R270 VanDerWaalsContact O-N 3.17Å; I268-R270 PolarHBondContact O-N 3.22Å
271	I	86	Confident	75.8	Confident	4 Å²	4	37 Å²	37	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-82.7	-15	176.6	63.2	168.8	0	0	0	113.1	A115 W259 F267 I268 R269	A115-I271 HydrophobicContact CB-CD1 3.93Å; W259-I271 HydrophobicContact CH2-CD1 3.67Å; W259-I271 HydrophobicContact CZ3-CD1 4.19Å; F267-I271 HydrophobicContact CD1-CD1 4.37Å; F267-I271 HydrophobicContact CE1-CD1 4.05Å; F267-I271 HydrophobicContact CE1-CG2 4.08Å; F267-I271 HydrophobicContact CZ-CG2 4.2Å; F267-I271 PolarHBondContact O-N 3.12Å; I268-I271 HydrophobicContact CD1-CD1 4.41Å; I268-I271 WeakPolarHBondContact O-CG1 3.45Å; I268-I271 PolarHBondContact O-N 3.31Å; R269-I271 PolarHBondContact O-N 2.87Å
272	A	84.9	Confident	74.6	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-79.8	-36.5	171.3	0	0	0	0	0	112.1	W117 H191 N206 I268 R269 D274	W117-A272 VanDerWaalsContact CH2-O 3.27Å; W117-A272 WeakPolarHBondContact CH2-O 3.13Å; W117-A272 WeakPolarHBondContact CZ2-O 3.48Å; H191-A272 HydrophobicContact CB-CB 4.21Å; H191-A272 WeakPolarHBondContact ND1-CB 3.25Å; N206-A272 VanDerWaalsContact O-CB 3.3Å; N206-A272 WeakPolarHBondContact O-CB 3.46Å; I268-A272 PolarHBondContact O-N 2.87Å; I268-A272 VanDerWaalsContact O-N 3.13Å; R269-A272 WeakPolarHBondContact O-CB 3.07Å; R269-A272 PolarHBondContact O-N 2.99Å; R269-A272 VanDerWaalsContact O-N 3.15Å; A272-D274 PolarHBondContact O-N 3.4Å
273	G	74.5	Confident	73.7	Confident	18 Å²	18	46.9 Å²	46.9	19%	0.186	27%	0.27	C	S	.	.	H	α-helix	trans	-71.8	-22.8	-178.4	0	0	0	0	0	115.7	R269 F330	R269-G273 PolarHBondContact O-N 3.26Å; R269-G273 VanDerWaalsContact O-N 3.09Å; G273-F330 WeakPolarHBondContact O-CD1 3.47Å; G273-F330 WeakPolarHBondContact O-CE1 3.36Å
274	D	71.6	Confident	73	Confident	47 Å²	47	47.3 Å²	47.3	25%	0.251	27%	0.273	S	S	.	.			trans	-157.3	121.7	171.4	158	27.3	0	0	0	111	A272 S276 L277	A272-D274 PolarHBondContact O-N 3.4Å; D274-S276 PolarHBondContact O-N 3.23Å; D274-S276 WeakPolarHBondContact OD1-CA 3.49Å; D274-S276 WeakPolarHBondContact OD1-CB 2.99Å; D274-S276 PolarHBondContact OD1-N 3.27Å; D274-S276 PolarHBondContact OD1-OG 3.44Å; D274-S276 PolarHBondContact OD2-OG 3.21Å; D274-L277 HydrophobicContact CB-CD1 3.38Å; D274-L277 VanDerWaalsContact CG-CD1 3.46Å; D274-L277 VanDerWaalsContact O-CD1 3.31Å; D274-L277 WeakPolarHBondContact O-CD1 3.26Å; D274-L277 PolarHBondContact O-N 3.41Å; D274-L277 WeakPolarHBondContact OD2-CD1 3.29Å
275	A	60.1	Low	73	Confident	3 Å²	3	47.9 Å²	47.9	3%	0.025	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-1.1	-177.7	0	0	0	0	0	113.9	R77 W117 L326 F330	R77-A275 PolarHBondContact NH1-O 3.48Å; R77-A275 PolarHBondContact NH2-O 3.4Å; W117-A275 HydrophobicContact CZ2-CB 4.45Å; A275-L326 HydrophobicContact CB-CD2 3.87Å; A275-L326 HydrophobicContact CB-CG 4.13Å; A275-F330 HydrophobicContact CB-CE2 3.7Å; A275-F330 HydrophobicContact CB-CZ 3.97Å
276	S	58.4	Low	72.9	Confident	74 Å²	74	48.4 Å²	48.4	52%	0.517	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-17.5	177.6	85	0	0	0	0	114.2	R77 D274 S278	R77-S276 VanDerWaalsContact NH2-CA 3.28Å; D274-S276 PolarHBondContact O-N 3.23Å; D274-S276 WeakPolarHBondContact OD1-CA 3.49Å; D274-S276 WeakPolarHBondContact OD1-CB 2.99Å; D274-S276 PolarHBondContact OD1-N 3.27Å; D274-S276 PolarHBondContact OD1-OG 3.44Å; D274-S276 PolarHBondContact OD2-OG 3.21Å; S276-S278 PolarHBondContact O-N 2.86Å; S276-S278 VanDerWaalsContact O-N 3.09Å
277	L	60.7	Low	72.9	Confident	56 Å²	56	48.8 Å²	48.8	29%	0.293	26%	0.262	S	S	.	.			trans	-63.8	114.5	178.9	-71.4	106.5	0	0	0	111.9	D274 L279	D274-L277 HydrophobicContact CB-CD1 3.38Å; D274-L277 VanDerWaalsContact CG-CD1 3.46Å; D274-L277 VanDerWaalsContact O-CD1 3.31Å; D274-L277 WeakPolarHBondContact O-CD1 3.26Å; D274-L277 PolarHBondContact O-N 3.41Å; D274-L277 WeakPolarHBondContact OD2-CD1 3.29Å; L277-L279 HydrophobicContact CB-CD1 4.04Å; L277-L279 HydrophobicContact CD2-CD1 3.34Å; L277-L279 HydrophobicContact CG-CD1 4.26Å; L277-L279 PolarHBondContact O-N 3.07Å; L277-L279 VanDerWaalsContact O-N 3.16Å
278	S	55.6	Low	72.7	Confident	82 Å²	82	48 Å²	48	57%	0.573	26%	0.259	S	S	*	.			trans	-81.8	36.6	170	51.3	0	0	0	0	112.6	S276 G280	S276-S278 PolarHBondContact O-N 2.86Å; S276-S278 VanDerWaalsContact O-N 3.09Å; S278-G280 PolarHBondContact O-N 2.82Å
279	L	57.7	Low	72.1	Confident	62 Å²	62	52.5 Å²	52.5	33%	0.325	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	130.8	179.9	-106.8	101.2	0	0	0	112	F267 L277	F267-L279 HydrophobicContact CE2-CB 4.25Å; L277-L279 HydrophobicContact CB-CD1 4.04Å; L277-L279 HydrophobicContact CD2-CD1 3.34Å; L277-L279 HydrophobicContact CG-CD1 4.26Å; L277-L279 PolarHBondContact O-N 3.07Å; L277-L279 VanDerWaalsContact O-N 3.16Å
280	G	57.2	Low	71.6	Confident	33 Å²	33	51.4 Å²	51.4	34%	0.34	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	53.3	172.8	0	0	0	0	0	112.6	W259 S278 E282	W259-G280 PolarHBondContact NE1-O 3.48Å; W259-G280 VanDerWaalsContact NE1-O 3.08Å; S278-G280 PolarHBondContact O-N 2.82Å; G280-E282 CarbonylContact C-O 3.59Å; G280-E282 VanDerWaalsContact O-O 3.06Å
281	T	62.4	Low	71	Confident	80 Å²	80	50.9 Å²	50.9	49%	0.491	28%	0.28	S	S	.	.			trans	-64	-29.3	169.6	44.6	0	0	0	0	112.2	I284 W287	T281-I284 WeakPolarHBondContact O-CB 3.43Å; T281-I284 PolarHBondContact O-N 2.81Å; T281-W287 HydrophobicContact CG2-CZ3 4.27Å
282	E	60.1	Low	69.9	Low	160 Å²	160	52.4 Å²	52.4	75%	0.748	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	139.4	165.1	-60.8	-179.7	-170.6	0	0	110.3	G280 I284	G280-E282 CarbonylContact C-O 3.59Å; G280-E282 VanDerWaalsContact O-O 3.06Å; E282-I284 VanDerWaalsContact C-N 3.28Å; E282-I284 PolarHBondContact O-N 3.14Å
283	E	70.6	Confident	69	Low	81 Å²	81	55.9 Å²	55.9	38%	0.379	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	3.5	-175.4	-46.7	173	133.2	0	0	116.1	W259 N260 V261 K263 F285	W259-E283 WeakPolarHBondContact CA-O 3.15Å; N260-E283 PolarHBondContact N-O 2.86Å; N260-E283 VanDerWaalsContact N-O 3.12Å; N260-E283 WeakPolarHBondContact OD1-CB 3.35Å; N260-E283 PolarHBondContact OD1-O 2.64Å; N260-E283 VanDerWaalsContact OD1-O 3.07Å; V261-E283 HydrophobicContact CG1-CB 4.36Å; V261-E283 HydrophobicContact CG1-CG 4.4Å; V261-E283 HydrophobicContact CG2-CB 4Å; V261-E283 HydrophobicContact CG2-CG 4.47Å; V261-E283 VanDerWaalsContact CG2-OE2 3.25Å; V261-E283 WeakPolarHBondContact CG2-OE2 3.21Å; K263-E283 IonicContact NZ-OE2 3.15Å; K263-E283 PolarHBondContact NZ-OE2 2.02Å; E283-F285 PolarHBondContact O-N 3.15Å
284	I	74.4	Confident	68.6	Low	34 Å²	34	62.2 Å²	62.2	17%	0.174	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	124.3	167.9	-69.1	-176.6	0	0	0	109.8	W259 T281 E282 L286 W287	W259-I284 HydrophobicContact CD2-CG1 4.44Å; W259-I284 HydrophobicContact CG-CG1 4.3Å; W259-I284 HydrophobicContact CZ2-CD1 4.45Å; W259-I284 HydrophobicContact CZ2-CG1 4.47Å; T281-I284 WeakPolarHBondContact O-CB 3.43Å; T281-I284 PolarHBondContact O-N 2.81Å; E282-I284 VanDerWaalsContact C-N 3.28Å; E282-I284 PolarHBondContact O-N 3.14Å; I284-L286 WeakPolarHBondContact CG2-O 2.96Å; I284-W287 HydrophobicContact CD1-CE3 4.3Å; I284-W287 HydrophobicContact CG2-CB 3.94Å
285	F	81	Confident	68.5	Low	40 Å²	40	63.6 Å²	63.6	18%	0.175	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-46.3	170.7	174.8	-89.3	0	0	0	111.1	K105 L106 F107 P108 L258 N260 E283	K105-F285 HydrophobicContact CB-CE2 4.28Å; K105-F285 WeakPolarHBondContact O-CE2 3.07Å; L106-F285 WeakPolarHBondContact O-CE2 3.49Å; F107-F285 HydrophobicContact CB-CZ 4.49Å; F107-F285 AromaticContact CD1-CE1 3.59Å; F107-F285 HydrophobicContact CD1-CE1 3.59Å; F107-F285 AromaticContact CD1-CZ 3.68Å; F107-F285 HydrophobicContact CD1-CZ 3.68Å; F107-F285 AromaticContact CE1-CE1 3.66Å; F107-F285 HydrophobicContact CE1-CE1 3.66Å; F107-F285 HydrophobicContact CE1-CZ 4.01Å; F107-F285 HydrophobicContact CG-CE1 4.41Å; F107-F285 HydrophobicContact CG-CZ 4.04Å; P108-F285 HydrophobicContact CG-CB 4.34Å; P108-F285 HydrophobicContact CG-CD2 4.29Å; P108-F285 HydrophobicContact CG-CG 4.14Å; L258-F285 HydrophobicContact CD2-CD1 3.74Å; L258-F285 HydrophobicContact CD2-CE1 4.24Å; L258-F285 HydrophobicContact CG-CB 4.44Å; L258-F285 HydrophobicContact CG-CD1 4.16Å; L258-F285 WeakPolarHBondContact O-CA 2.94Å; L258-F285 WeakPolarHBondContact O-CB 3.44Å; L258-F285 PolarHBondContact O-N 3.15Å; N260-F285 HydrophobicContact CB-CB 4.44Å; E283-F285 PolarHBondContact O-N 3.15Å
286	L	83.4	Confident	69.4	Low	25 Å²	25	64.4 Å²	64.4	13%	0.131	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	135.9	176.9	173.3	68.2	0	0	0	110	L91 L231 K257 L258 I284 W296	L91-L286 HydrophobicContact CD1-CD1 4.02Å; L91-L286 HydrophobicContact CD1-CD2 4.26Å; L91-L286 HydrophobicContact CD2-CD2 4.29Å; L231-L286 HydrophobicContact CD2-CD2 3.48Å; L231-L286 VanDerWaalsContact CD2-CD2 3.48Å; K257-L286 WeakPolarHBondContact CA-O 3.48Å; L258-L286 HydrophobicContact CB-CB 4.23Å; L258-L286 PolarHBondContact N-O 3.02Å; L258-L286 PolarHBondContact O-N 2.03Å; I284-L286 WeakPolarHBondContact CG2-O 2.96Å; L286-W296 HydrophobicContact CD2-CZ2 4.41Å
287	W	84	Confident	70.4	Confident	72 Å²	72	66.7 Å²	66.7	27%	0.273	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	108.7	165.5	-175.8	10	0	0	0	108.8	D255 V256 K257 T281 I284 K289	D255-W287 PolarHBondContact OD1-NE1 2.77Å; V256-W287 CarbonylContact O-C 3.59Å; V256-W287 WeakPolarHBondContact O-CA 3.39Å; K257-W287 VanDerWaalsContact CE-NE1 3.3Å; K257-W287 HydrophobicContact CG-CG 4.08Å; T281-W287 HydrophobicContact CG2-CZ3 4.27Å; I284-W287 HydrophobicContact CD1-CE3 4.3Å; I284-W287 HydrophobicContact CG2-CB 3.94Å; W287-K289 HydrophobicContact CD2-CG 4.43Å; W287-K289 HydrophobicContact CG-CG 4.48Å; W287-K289 VanDerWaalsContact CH2-CE 3.48Å; W287-K289 HydrophobicContact CZ2-CD 4.42Å; W287-K289 HydrophobicContact CZ2-CG 4.49Å
288	A	82.9	Confident	71.2	Confident	5 Å²	5	66.7 Å²	66.7	4%	0.041	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	101.9	177.2	0	0	0	0	0	109.9	D255 V256 F290 W296	D255-A288 WeakPolarHBondContact CA-O 3.44Å; V256-A288 HydrophobicContact CB-CB 4.34Å; V256-A288 PolarHBondContact N-O 3.08Å; V256-A288 VanDerWaalsContact N-O 3.11Å; V256-A288 PolarHBondContact O-N 2.81Å; A288-F290 VanDerWaalsContact C-N 3.29Å; A288-F290 HydrophobicContact CB-CD1 4.09Å; A288-F290 HydrophobicContact CB-CE1 3.59Å; A288-F290 HydrophobicContact CB-CE2 4.48Å; A288-F290 HydrophobicContact CB-CZ 3.82Å; A288-W296 HydrophobicContact CB-CZ2 4.13Å
289	K	75.4	Confident	71.9	Confident	96 Å²	96	64.8 Å²	64.8	42%	0.417	32%	0.323	S	S	.	.			trans	-84.2	-6.1	169.5	-63	179.5	179.3	178.7	0	113.2	W287 D291	W287-K289 HydrophobicContact CD2-CG 4.43Å; W287-K289 HydrophobicContact CG-CG 4.48Å; W287-K289 VanDerWaalsContact CH2-CE 3.48Å; W287-K289 HydrophobicContact CZ2-CD 4.42Å; W287-K289 HydrophobicContact CZ2-CG 4.49Å; K289-D291 PolarHBondContact O-N 2.79Å
290	F	79.2	Confident	72.2	Confident	3 Å²	3	64.6 Å²	64.6	1%	0.013	32%	0.324	C	S	.	.			trans	57.7	31.7	-175.6	-49.8	-63.8	0	0	0	114.2	F78 F80 L233 V253 V256 A288 W296 L321	F78-F290 HydrophobicContact CB-CB 4.22Å; F78-F290 VanDerWaalsContact CB-O 3.29Å; F78-F290 WeakPolarHBondContact CB-O 3.23Å; F80-F290 AromaticContact CD2-CD1 3.33Å; F80-F290 HydrophobicContact CD2-CD1 3.33Å; F80-F290 AromaticContact CD2-CE1 3.33Å; F80-F290 HydrophobicContact CD2-CE1 3.33Å; F80-F290 HydrophobicContact CD2-CG 4.05Å; F80-F290 HydrophobicContact CD2-CZ 4.04Å; F80-F290 AromaticContact CE2-CD1 3.31Å; F80-F290 HydrophobicContact CE2-CD1 3.31Å; F80-F290 AromaticContact CE2-CE1 3.48Å; F80-F290 HydrophobicContact CE2-CE1 3.48Å; F80-F290 VanDerWaalsContact CE2-CE1 3.48Å; F80-F290 HydrophobicContact CE2-CG 4.31Å; F80-F290 HydrophobicContact CG-CD1 4.29Å; F80-F290 HydrophobicContact CZ-CD1 4.26Å; L233-F290 HydrophobicContact CD1-CE1 3.96Å; L233-F290 HydrophobicContact CD1-CZ 3.96Å; V253-F290 HydrophobicContact CG1-CE2 4.45Å; V253-F290 HydrophobicContact CG1-CZ 4.47Å; V253-F290 VanDerWaalsContact O-CE2 3.29Å; V253-F290 WeakPolarHBondContact O-CE2 3.49Å; V256-F290 HydrophobicContact CB-CZ 4.25Å; V256-F290 HydrophobicContact CG2-CE2 4.01Å; V256-F290 HydrophobicContact CG2-CZ 3.7Å; A288-F290 VanDerWaalsContact C-N 3.29Å; A288-F290 HydrophobicContact CB-CD1 4.09Å; A288-F290 HydrophobicContact CB-CE1 3.59Å; A288-F290 HydrophobicContact CB-CE2 4.48Å; A288-F290 HydrophobicContact CB-CZ 3.82Å; F290-W296 HydrophobicContact CE1-CZ2 4.18Å; F290-W296 AromaticContact CE1-NE1 3.8Å; F290-L321 HydrophobicContact CB-CD1 3.73Å; F290-L321 WeakPolarHBondContact O-CD1 3.4Å; F290-L321 WeakPolarHBondContact O-CD2 3.31Å
291	D	70.2	Confident	72.4	Confident	94 Å²	94	65.3 Å²	65.3	50%	0.503	32%	0.317	S	S	.	.	S	Bend	trans	-71.7	-24.1	175	49	1.8	0	0	0	114.4	K289 K295	K289-D291 PolarHBondContact O-N 2.79Å; D291-K295 IonicContact OD1-NZ 3.27Å
292	S	63.3	Low	71.7	Confident	36 Å²	36	72.4 Å²	72.4	25%	0.252	34%	0.335	S	S	.	.			trans	-143.5	137.7	169.2	169.2	0	0	0	0	110.9	E294	S292-E294 VanDerWaalsContact C-N 3.33Å; S292-E294 WeakPolarHBondContact OG-CG 3.43Å; S292-E294 PolarHBondContact OG-N 3.27Å; S292-E294 PolarHBondContact OG-OE2 2.84Å
293	I	66.3	Low	71.2	Confident	72 Å²	72	70.4 Å²	70.4	37%	0.369	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-74.2	-20.5	179.1	-164.8	164.2	0	0	0	113	F80 K295 W296 A318	F80-I293 HydrophobicContact CE1-CD1 4.13Å; F80-I293 HydrophobicContact CE1-CG1 4.06Å; F80-I293 HydrophobicContact CZ-CG1 4.13Å; I293-K295 PolarHBondContact O-N 3.01Å; I293-W296 PolarHBondContact O-N 2.89Å; I293-A318 HydrophobicContact CD1-CB 4.02Å
294	E	65.3	Low	70.2	Confident	152 Å²	152	70.6 Å²	70.6	71%	0.71	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-59.9	-19.8	-172	-62.2	168.5	151.9	0	0	114.2	N92 S292 W296	N92-E294 PolarHBondContact ND2-O 2.97Å; S292-E294 VanDerWaalsContact C-N 3.33Å; S292-E294 WeakPolarHBondContact OG-CG 3.43Å; S292-E294 PolarHBondContact OG-N 3.27Å; S292-E294 PolarHBondContact OG-OE2 2.84Å; E294-W296 PolarHBondContact O-N 3.29Å
295	K	70	Confident	68.8	Low	75 Å²	75	74.3 Å²	74.3	33%	0.326	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-76.4	-7.5	175.5	-49.7	-175	179.4	151.3	0	113.3	N92 L95 D291 I293	N92-K295 WeakPolarHBondContact CB-O 3.28Å; N92-K295 PolarHBondContact N-O 2.96Å; L95-K295 HydrophobicContact CD1-CB 3.78Å; L95-K295 HydrophobicContact CD1-CD 4.47Å; L95-K295 HydrophobicContact CD1-CG 3.82Å; D291-K295 IonicContact OD1-NZ 3.27Å; I293-K295 PolarHBondContact O-N 3.01Å
296	W	78.3	Confident	67	Low	20 Å²	20	78.7 Å²	78.7	8%	0.076	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	140.6	-174.3	-63.7	91.6	0	0	0	111.5	F80 V89 R90 L91 L231 L233 L286 A288 F290 I293 E294	F80-W296 HydrophobicContact CE2-CB 4.29Å; F80-W296 AromaticContact CE2-CD1 3.62Å; F80-W296 HydrophobicContact CE2-CD2 4.16Å; F80-W296 AromaticContact CE2-CG 3.76Å; F80-W296 HydrophobicContact CE2-CG 3.76Å; F80-W296 AromaticContact CE2-NE1 3.93Å; F80-W296 HydrophobicContact CZ-CB 4.05Å; F80-W296 AromaticContact CZ-CD1 3.87Å; F80-W296 AromaticContact CZ-CG 3.97Å; F80-W296 HydrophobicContact CZ-CG 3.97Å; V89-W296 HydrophobicContact CB-CB 4.38Å; V89-W296 HydrophobicContact CB-CE3 4.37Å; V89-W296 HydrophobicContact CG2-CD2 4.48Å; V89-W296 HydrophobicContact CG2-CE3 3.93Å; R90-W296 VanDerWaalsContact C-CE3 3.46Å; R90-W296 CarbonylContact O-C 3.56Å; R90-W296 WeakPolarHBondContact O-CA 3.4Å; L91-W296 HydrophobicContact CB-CE3 4.43Å; L91-W296 HydrophobicContact CB-CH2 4.35Å; L91-W296 HydrophobicContact CB-CZ3 4.09Å; L91-W296 HydrophobicContact CD1-CH2 4.33Å; L91-W296 HydrophobicContact CD1-CZ2 4.13Å; L231-W296 HydrophobicContact CD2-CH2 4.23Å; L233-W296 HydrophobicContact CB-CZ3 4.42Å; L233-W296 HydrophobicContact CD1-CD2 4.42Å; L233-W296 HydrophobicContact CD1-CE3 4.13Å; L233-W296 HydrophobicContact CD1-CH2 3.34Å; L233-W296 HydrophobicContact CD1-CZ2 3.63Å; L233-W296 HydrophobicContact CD1-CZ3 3.61Å; L233-W296 HydrophobicContact CD2-CH2 4.5Å; L233-W296 HydrophobicContact CG-CE3 4.42Å; L233-W296 HydrophobicContact CG-CH2 3.65Å; L233-W296 HydrophobicContact CG-CZ2 4.43Å; L233-W296 HydrophobicContact CG-CZ3 3.63Å; L286-W296 HydrophobicContact CD2-CZ2 4.41Å; A288-W296 HydrophobicContact CB-CZ2 4.13Å; F290-W296 HydrophobicContact CE1-CZ2 4.18Å; F290-W296 AromaticContact CE1-NE1 3.8Å; I293-W296 PolarHBondContact O-N 2.89Å; E294-W296 PolarHBondContact O-N 3.29Å
297	K	79.6	Confident	65.2	Low	123 Å²	123	85.2 Å²	85.2	54%	0.535	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.5	-176	-173.4	172.5	-172.8	166.1	0	110.2	V89 R90	V89-K297 WeakPolarHBondContact CA-O 2.99Å; R90-K297 PolarHBondContact N-O 3.31Å; R90-K297 PolarHBondContact O-N 3.32Å
298	L	77.4	Confident	63.3	Low	56 Å²	56	84 Å²	84	29%	0.293	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	136.7	175.3	-173.2	67.5	0	0	0	110.7	R87 V89	R87-L298 HydrophobicContact CB-CD1 4.18Å; V89-L298 HydrophobicContact CG1-CD1 4.25Å
299	I	72	Confident	61.2	Low	41 Å²	41	89.4 Å²	89.4	21%	0.21	42%	0.424	C	S	.	.			trans	-109.3	134.2	169.2	-56.4	-175.1	0	0	0	109	T88 R90 L232 P238	T88-I299 PolarHBondContact O-N 2.85Å; R90-I299 HydrophobicContact CB-CD1 3.62Å; R90-I299 HydrophobicContact CB-CG1 3.96Å; R90-I299 HydrophobicContact CG-CD1 4.27Å; L232-I299 HydrophobicContact CD2-CD1 3.87Å; P238-I299 HydrophobicContact CB-CG2 4.38Å; P238-I299 HydrophobicContact CG-CB 4.17Å; P238-I299 HydrophobicContact CG-CG2 3.81Å
300	V	62.9	Low	59.5	Low	58 Å²	58	95.5 Å²	95.5	35%	0.352	44%	0.444	S	S	.	.			trans	-136.7	155.1	-179.6	-101	0	0	0	0	110	L308	V300-L308 HydrophobicContact CB-CD1 3.76Å; V300-L308 HydrophobicContact CG1-CD1 3.71Å; V300-L308 HydrophobicContact CG2-CD1 3.91Å
301	R	61.4	Low	57.4	Low	49 Å²	49	96.9 Å²	96.9	19%	0.185	46%	0.456	C	S	.	.			trans	-66.8	146.8	-172.7	-64.2	-177.4	179.3	-142.3	0.1	111.4	E86 P238 E243 V303 E304 K305	E86-R301 IonicContact OE1-CZ 3.84Å; E86-R301 IonicContact OE1-NE 3.78Å; E86-R301 IonicContact OE1-NH2 2.81Å; E86-R301 PolarHBondContact OE1-NH2 3.32Å; E86-R301 IonicContact OE2-CZ 2.73Å; E86-R301 IonicContact OE2-NE 2.68Å; E86-R301 PolarHBondContact OE2-NE 2.91Å; E86-R301 IonicContact OE2-NH2 3.08Å; E86-R301 PolarHBondContact OE2-NH2 3.02Å; P238-R301 HydrophobicContact CB-CG 4.33Å; E243-R301 IonicContact OE1-NH1 3.18Å; R301-V303 PolarHBondContact O-N 3.06Å; R301-V303 VanDerWaalsContact O-N 3.15Å; R301-E304 HydrophobicContact CB-CG 4.2Å; R301-E304 WeakPolarHBondContact CB-OE2 3.39Å; R301-E304 PolarHBondContact N-OE2 3.1Å; R301-E304 PolarHBondContact O-N 2.98Å; R301-E304 VanDerWaalsContact O-N 3.1Å; R301-K305 PolarHBondContact O-N 2.88Å
302	R	48.2	Very low	55.7	Low	229 Å²	229	98.1 Å²	98.1	86%	0.864	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-26.1	-177.1	-150.8	-179.4	-162.6	177.1	6.2	113.6
303	V	48.8	Very low	54.1	Low	118 Å²	118	101.4 Å²	101.4	72%	0.715	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-41.4	176.4	-173.9	0	0	0	0	111	R301 K305	R301-V303 PolarHBondContact O-N 3.06Å; R301-V303 VanDerWaalsContact O-N 3.15Å; V303-K305 VanDerWaalsContact C-N 3.29Å; V303-K305 PolarHBondContact O-N 3Å
304	E	50.9	Low	52.3	Low	84 Å²	84	105.3 Å²	105.3	39%	0.393	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-27.1	175.7	-63	176.5	129.1	0	0	112.2	R301 L306 F307 L308	R301-E304 HydrophobicContact CB-CG 4.2Å; R301-E304 WeakPolarHBondContact CB-OE2 3.39Å; R301-E304 PolarHBondContact N-OE2 3.1Å; R301-E304 PolarHBondContact O-N 2.98Å; R301-E304 VanDerWaalsContact O-N 3.1Å; E304-L306 PolarHBondContact O-N 3.13Å; E304-L306 VanDerWaalsContact O-N 3.13Å; E304-F307 CarbonylContact O-C 3.55Å; E304-F307 WeakPolarHBondContact O-CA 3.28Å; E304-F307 PolarHBondContact O-N 3.13Å; E304-L308 HydrophobicContact CB-CD1 3.9Å; E304-L308 WeakPolarHBondContact O-CB 2.98Å; E304-L308 PolarHBondContact O-N 3.14Å
305	K	44.8	Very low	50.7	Low	113 Å²	113	100 Å²	100	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-54	-36.2	-180	-157.4	-175.2	-176.4	-124.4	0	113	R301 V303 F307 E309	R301-K305 PolarHBondContact O-N 2.88Å; V303-K305 VanDerWaalsContact C-N 3.29Å; V303-K305 PolarHBondContact O-N 3Å; K305-F307 VanDerWaalsContact C-N 3.32Å; K305-F307 PolarHBondContact O-N 3.48Å; K305-E309 WeakPolarHBondContact CE-OE1 3.12Å; K305-E309 IonicContact NZ-OE1 3.61Å; K305-E309 PolarHBondContact NZ-OE1 3.3Å; K305-E309 WeakPolarHBondContact O-CB 3.38Å; K305-E309 VanDerWaalsContact O-CG 3.32Å; K305-E309 WeakPolarHBondContact O-CG 3.11Å; K305-E309 PolarHBondContact O-N 2.99Å
306	L	43	Very low	49.2	Very low	131 Å²	131	99.4 Å²	99.4	69%	0.686	51%	0.506	S	S	*	.	H	α-helix	trans	-71	-21.2	175.1	-85.5	148.8	0	0	0	114.3	E304	E304-L306 PolarHBondContact O-N 3.13Å; E304-L306 VanDerWaalsContact O-N 3.13Å
307	F	44.8	Very low	48	Very low	163 Å²	163	104.9 Å²	104.9	72%	0.715	53%	0.532	S	S	*	.	H	α-helix	trans	-92.3	-40.7	172.4	-83.7	-92.4	0	0	0	111.8	E304 K305 E309 R310 A311	E304-F307 CarbonylContact O-C 3.55Å; E304-F307 WeakPolarHBondContact O-CA 3.28Å; E304-F307 PolarHBondContact O-N 3.13Å; K305-F307 VanDerWaalsContact C-N 3.32Å; K305-F307 PolarHBondContact O-N 3.48Å; F307-E309 PolarHBondContact O-N 3.16Å; F307-R310 CarbonylContact O-C 3.59Å; F307-R310 WeakPolarHBondContact O-CA 2.99Å; F307-R310 PolarHBondContact O-N 2.85Å; F307-A311 WeakPolarHBondContact O-CB 3.39Å; F307-A311 PolarHBondContact O-N 3.11Å
308	L	44.2	Very low	47	Very low	45 Å²	45	100.8 Å²	100.8	24%	0.236	52%	0.521	C	S	.	.	H	α-helix	trans	-61.9	-41	177.4	-82	157.9	0	0	0	112.3	V300 E304 R310 A311 V312 A316	V300-L308 HydrophobicContact CB-CD1 3.76Å; V300-L308 HydrophobicContact CG1-CD1 3.71Å; V300-L308 HydrophobicContact CG2-CD1 3.91Å; E304-L308 HydrophobicContact CB-CD1 3.9Å; E304-L308 WeakPolarHBondContact O-CB 2.98Å; E304-L308 PolarHBondContact O-N 3.14Å; L308-R310 PolarHBondContact O-N 3.22Å; L308-R310 VanDerWaalsContact O-N 3.08Å; L308-A311 CarbonylContact O-C 3.5Å; L308-A311 PolarHBondContact O-N 3.02Å; L308-V312 WeakPolarHBondContact O-CG2 3.46Å; L308-V312 PolarHBondContact O-N 3.26Å; L308-A316 HydrophobicContact CD2-CB 3.47Å; L308-A316 VanDerWaalsContact CD2-CB 3.47Å
309	E	39.6	Very low	46.7	Very low	120 Å²	120	98.2 Å²	98.2	56%	0.561	51%	0.508	S	S	*	.	H	α-helix	trans	-62.7	-13.3	173.7	-73.1	171.8	-171.2	0	0	112.8	K305 F307	K305-E309 WeakPolarHBondContact CE-OE1 3.12Å; K305-E309 IonicContact NZ-OE1 3.61Å; K305-E309 PolarHBondContact NZ-OE1 3.3Å; K305-E309 WeakPolarHBondContact O-CB 3.38Å; K305-E309 VanDerWaalsContact O-CG 3.32Å; K305-E309 WeakPolarHBondContact O-CG 3.11Å; K305-E309 PolarHBondContact O-N 2.99Å; F307-E309 PolarHBondContact O-N 3.16Å
310	R	38.5	Very low	46.8	Very low	223 Å²	223	99 Å²	99	84%	0.842	51%	0.514	S	S	*	.	H	α-helix	trans	-105.8	-13.2	168.1	-77	-179.1	170	-179.6	-3.1	114.7	F307 L308	F307-R310 CarbonylContact O-C 3.59Å; F307-R310 WeakPolarHBondContact O-CA 2.99Å; F307-R310 PolarHBondContact O-N 2.85Å; L308-R310 PolarHBondContact O-N 3.22Å; L308-R310 VanDerWaalsContact O-N 3.08Å
311	A	35.1	Very low	47.5	Very low	33 Å²	33	98.9 Å²	98.9	27%	0.273	51%	0.512	S	S	.	.	H	α-helix	trans	-105.5	7.5	-178.2	0	0	0	0	0	113.6	F307 L308 S313 L314	F307-A311 WeakPolarHBondContact O-CB 3.39Å; F307-A311 PolarHBondContact O-N 3.11Å; L308-A311 CarbonylContact O-C 3.5Å; L308-A311 PolarHBondContact O-N 3.02Å; A311-S313 PolarHBondContact O-N 2.04Å; A311-S313 VanDerWaalsContact O-N 3.1Å; A311-L314 PolarHBondContact O-N 3.32Å
312	V	34.6	Very low	48.1	Very low	119 Å²	119	98.6 Å²	98.6	72%	0.721	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-55.5	-25.9	172.5	-172.5	0	0	0	0	111.9	L308 L314	L308-V312 WeakPolarHBondContact O-CG2 3.46Å; L308-V312 PolarHBondContact O-N 3.26Å; V312-L314 PolarHBondContact O-N 3.17Å
313	S	29.5	Very low	49.2	Very low	106 Å²	106	91.5 Å²	91.5	74%	0.741	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-77.1	3.4	173.3	56.8	0	0	0	0	115.3	A311	A311-S313 PolarHBondContact O-N 2.04Å; A311-S313 VanDerWaalsContact O-N 3.1Å
314	L	29	Very low	50.5	Low	153 Å²	153	86.4 Å²	86.4	80%	0.801	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-131.2	20.3	-174.9	-88.3	161.7	0	0	0	114.2	A311 V312	A311-L314 PolarHBondContact O-N 3.32Å; V312-L314 PolarHBondContact O-N 3.17Å
315	G	32.8	Very low	51.4	Low	42 Å²	42	84.1 Å²	84.1	43%	0.433	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	30.5	157.5	0	0	0	0	0	117.8	H317	G315-H317 VanDerWaalsContact C-N 3.32Å; G315-H317 PolarHBondContact O-N 2.72Å; G315-H317 PolarHBondContact O-ND1 3.2Å
316	A	38.3	Very low	52.9	Low	61 Å²	61	78.7 Å²	78.7	50%	0.504	44%	0.44	S	S	.	.			trans	-70	84.6	170.7	0	0	0	0	0	111.4	L308	L308-A316 HydrophobicContact CD2-CB 3.47Å; L308-A316 VanDerWaalsContact CD2-CB 3.47Å
317	H	53.1	Low	54.3	Low	136 Å²	136	74.5 Å²	74.5	63%	0.63	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-88.2	153.6	-174.8	-64.9	-8.1	0	0	0	113.4	G315	G315-H317 VanDerWaalsContact C-N 3.32Å; G315-H317 PolarHBondContact O-N 2.72Å; G315-H317 PolarHBondContact O-ND1 3.2Å
318	A	59.1	Low	55.3	Low	36 Å²	36	68.2 Å²	68.2	30%	0.298	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-61.2	161.7	168.8	0	0	0	0	0	111.1	I293 T320	I293-A318 HydrophobicContact CD1-CB 4.02Å; A318-T320 PolarHBondContact O-N 3.24Å
319	P	69.8	Low	56.5	Low	3 Å²	3	67.1 Å²	67.1	2%	0.019	39%	0.391	C	S	.	.	S	Bend	trans	-52.2	133.5	173.3	22.7	-35.3	0	0	0	111.3	F80 Y81 F82 V89 L321	F80-P319 HydrophobicContact CD1-CB 4.42Å; F80-P319 HydrophobicContact CD1-CG 4.22Å; F80-P319 HydrophobicContact CE1-CG 4.44Å; Y81-P319 VanDerWaalsContact O-CB 3.24Å; Y81-P319 WeakPolarHBondContact O-CB 3.26Å; F82-P319 HydrophobicContact CD1-CB 3.77Å; F82-P319 HydrophobicContact CD1-CG 4.21Å; F82-P319 HydrophobicContact CE1-CB 3.76Å; F82-P319 HydrophobicContact CE1-CG 3.72Å; F82-P319 HydrophobicContact CG-CB 4.49Å; F82-P319 HydrophobicContact CZ-CB 4.46Å; F82-P319 HydrophobicContact CZ-CG 4.39Å; V89-P319 HydrophobicContact CG1-CG 3.41Å; V89-P319 VanDerWaalsContact CG1-CG 3.41Å; V89-P319 HydrophobicContact CG2-CG 4.41Å; P319-L321 PolarHBondContact O-N 3.32Å
320	T	73.8	Confident	58	Low	56 Å²	56	62.9 Å²	62.9	34%	0.344	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-67.1	131.9	-168.9	-46.8	0	0	0	0	110.6	Y81 A318 I322	Y81-T320 PolarHBondContact N-O 3.46Å; Y81-T320 PolarHBondContact O-N 3.27Å; A318-T320 PolarHBondContact O-N 3.24Å; T320-I322 HydrophobicContact CG2-CG2 3.86Å
321	L	77.4	Confident	59.4	Low	57 Å²	57	54 Å²	54	30%	0.298	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	120.8	169.1	-168.2	74.6	0	0	0	108.9	F78 F80 F290 P319	F78-L321 HydrophobicContact CB-CD1 3.86Å; F78-L321 HydrophobicContact CB-CD2 4.25Å; F78-L321 HydrophobicContact CB-CG 4.02Å; F78-L321 HydrophobicContact CD1-CD2 3.92Å; F78-L321 HydrophobicContact CD1-CG 4.02Å; F78-L321 HydrophobicContact CE1-CD2 4.48Å; F78-L321 HydrophobicContact CG-CD2 4.1Å; F78-L321 HydrophobicContact CG-CG 4.26Å; F80-L321 HydrophobicContact CD1-CD1 4.25Å; F80-L321 HydrophobicContact CE1-CD1 4.34Å; F290-L321 HydrophobicContact CB-CD1 3.73Å; F290-L321 WeakPolarHBondContact O-CD1 3.4Å; F290-L321 WeakPolarHBondContact O-CD2 3.31Å; P319-L321 PolarHBondContact O-N 3.32Å
322	I	75.7	Confident	60.7	Low	42 Å²	42	53.2 Å²	53.2	22%	0.215	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	156.5	-176.9	59	167.2	0	0	0	111.4	F78 A79 M252 T320	F78-I322 CarbonylContact C-O 3.58Å; F78-I322 VanDerWaalsContact CA-O 3.3Å; F78-I322 WeakPolarHBondContact CA-O 3.31Å; A79-I322 HydrophobicContact CB-CG1 4.45Å; A79-I322 PolarHBondContact N-O 3.06Å; A79-I322 PolarHBondContact O-N 3.12Å; M252-I322 HydrophobicContact CE-CD1 3.49Å; M252-I322 VanDerWaalsContact CE-CD1 3.49Å; M252-I322 HydrophobicContact CG-CD1 3.97Å; M252-I322 HydrophobicContact SD-CD1 3.61Å; T320-I322 HydrophobicContact CG2-CG2 3.86Å
323	A	71.3	Confident	62.2	Low	81 Å²	81	48.3 Å²	48.3	67%	0.669	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.7	135.4	172.1	0	0	0	0	0	110.3
324	S	74.1	Confident	63.8	Low	11 Å²	11	44.4 Å²	44.4	8%	0.077	27%	0.273	C	S	.	.			trans	-100.2	126.3	-178.6	178.9	0	0	0	0	111.3	R77 W189 L326	R77-S324 PolarHBondContact O-N 3.09Å; W189-S324 WeakPolarHBondContact CZ2-OG 3.04Å; S324-L326 PolarHBondContact O-N 2.75Å; S324-L326 VanDerWaalsContact OG-CB 3.27Å; S324-L326 WeakPolarHBondContact OG-CB 3.34Å; S324-L326 PolarHBondContact OG-N 2.89Å
325	D	71.4	Confident	65.5	Low	35 Å²	35	37.4 Å²	37.4	19%	0.187	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	13.5	171.9	62	-8.8	0	0	0	113.5	V71 R119 W189 S327 S328 F329	V71-D325 HydrophobicContact CG1-CB 4.12Å; V71-D325 HydrophobicContact CG2-CB 3.83Å; R119-D325 IonicContact CZ-OD2 3.47Å; R119-D325 IonicContact NH1-OD1 3.87Å; R119-D325 PolarHBondContact NH1-OD1 2.77Å; R119-D325 IonicContact NH1-OD2 2.86Å; R119-D325 PolarHBondContact NH1-OD2 2.8Å; W189-D325 PolarHBondContact NE1-OD1 3.21Å; D325-S327 PolarHBondContact O-N 3.23Å; D325-S327 VanDerWaalsContact O-N 3.13Å; D325-S328 PolarHBondContact O-N 3.25Å; D325-S328 VanDerWaalsContact O-N 3.12Å; D325-S328 PolarHBondContact O-OG 2.9Å; D325-S328 VanDerWaalsContact O-OG 3.11Å; D325-F329 PolarHBondContact O-N 2.76Å
326	L	75.8	Confident	66.8	Low	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.1	-27	176.7	178.3	60.9	0	0	0	112.9	W117 W189 A254 D255 A275 S324 F329 F330	W117-L326 HydrophobicContact CB-CD1 4.33Å; W117-L326 HydrophobicContact CB-CD2 3.74Å; W117-L326 HydrophobicContact CD2-CD1 3.56Å; W117-L326 HydrophobicContact CD2-CD2 4.07Å; W117-L326 HydrophobicContact CD2-CG 4.46Å; W117-L326 HydrophobicContact CE3-CD1 3.47Å; W117-L326 VanDerWaalsContact CE3-CD1 3.47Å; W117-L326 HydrophobicContact CG-CD1 3.96Å; W117-L326 HydrophobicContact CG-CD2 3.59Å; W117-L326 HydrophobicContact CG-CG 4.44Å; W117-L326 HydrophobicContact CZ3-CD1 3.98Å; W189-L326 HydrophobicContact CB-CD1 4.29Å; W189-L326 HydrophobicContact CD2-CB 4.29Å; W189-L326 HydrophobicContact CD2-CD1 3.92Å; W189-L326 HydrophobicContact CE3-CD1 4.18Å; W189-L326 HydrophobicContact CG-CD1 3.97Å; W189-L326 HydrophobicContact CZ2-CB 4.21Å; A254-L326 HydrophobicContact CB-CD2 4.15Å; D255-L326 HydrophobicContact CB-CD2 4.47Å; A275-L326 HydrophobicContact CB-CD2 3.87Å; A275-L326 HydrophobicContact CB-CG 4.13Å; S324-L326 PolarHBondContact O-N 2.75Å; S324-L326 VanDerWaalsContact OG-CB 3.27Å; S324-L326 WeakPolarHBondContact OG-CB 3.34Å; S324-L326 PolarHBondContact OG-N 2.89Å; L326-F329 HydrophobicContact CD1-CD1 4.41Å; L326-F330 HydrophobicContact CD1-CE2 3.98Å; L326-F330 HydrophobicContact CD1-CZ 4.47Å; L326-F330 HydrophobicContact CG-CE2 4.3Å; L326-F330 WeakPolarHBondContact O-CD2 3.26Å; L326-F330 WeakPolarHBondContact O-CE2 3Å
327	S	71.9	Confident	68	Low	42 Å²	42	38.4 Å²	38.4	29%	0.294	23%	0.228	S	C	.	.	H	α-helix	trans	-70.5	-44.4	175.4	-56.6	0	0	0	0	112.1	R77 D325 F329	R77-S327 WeakPolarHBondContact CD-OG 3.42Å; R77-S327 PolarHBondContact NE-OG 3.09Å; D325-S327 PolarHBondContact O-N 3.23Å; D325-S327 VanDerWaalsContact O-N 3.13Å; S327-F329 VanDerWaalsContact C-N 3.32Å
328	S	65.3	Low	68.6	Low	31 Å²	31	32.4 Å²	32.4	22%	0.217	20%	0.201	C	C	.	.	H	α-helix	trans	-76.5	-20.4	-179.8	54.2	0	0	0	0	112.8	D70 D325 F330 D331 S332	D70-S328 VanDerWaalsContact O-CB 3.27Å; D70-S328 WeakPolarHBondContact O-CB 3.26Å; D70-S328 PolarHBondContact O-OG 2.75Å; D325-S328 PolarHBondContact O-N 3.25Å; D325-S328 VanDerWaalsContact O-N 3.12Å; D325-S328 PolarHBondContact O-OG 2.9Å; D325-S328 VanDerWaalsContact O-OG 3.11Å; S328-F330 VanDerWaalsContact C-N 3.26Å; S328-F330 PolarHBondContact O-N 3.07Å; S328-D331 CarbonylContact O-C 3.56Å; S328-D331 PolarHBondContact O-N 2.62Å; S328-S332 WeakPolarHBondContact O-CB 3.4Å; S328-S332 PolarHBondContact O-N 2.73Å
329	F	70.6	Confident	68.9	Low	22 Å²	22	36.9 Å²	36.9	10%	0.096	23%	0.227	C	C	.	.	H	α-helix	trans	-51.7	-41.3	171.1	175.8	-109.3	0	0	0	113.2	W117 R188 W189 D325 L326 S327 D331 S332 L1001	W117-F329 HydrophobicContact CH2-CE1 4.31Å; W117-F329 HydrophobicContact CZ3-CD1 4.33Å; W117-F329 AromaticContact CZ3-CE1 3.88Å; W117-F329 HydrophobicContact CZ3-CE1 3.88Å; R188-F329 HydrophobicContact CG-CE2 4.36Å; W189-F329 HydrophobicContact CB-CD1 3.98Å; W189-F329 HydrophobicContact CB-CD2 3.99Å; W189-F329 HydrophobicContact CB-CE1 3.97Å; W189-F329 HydrophobicContact CB-CE2 3.99Å; W189-F329 HydrophobicContact CB-CG 3.97Å; W189-F329 HydrophobicContact CB-CZ 3.96Å; W189-F329 HydrophobicContact CG-CD2 4.49Å; W189-F329 HydrophobicContact CG-CG 4.33Å; W189-F329 WeakPolarHBondContact O-CZ 3.46Å; D325-F329 PolarHBondContact O-N 2.76Å; L326-F329 HydrophobicContact CD1-CD1 4.41Å; S327-F329 VanDerWaalsContact C-N 3.32Å; F329-D331 VanDerWaalsContact C-N 3.28Å; F329-D331 PolarHBondContact O-N 2.78Å; F329-S332 PolarHBondContact O-OG 3.16Å; F329-L1001 HydrophobicContact CD1-CD2 4.41Å; F329-L1001 HydrophobicContact CE1-CD1 4.07Å; F329-L1001 HydrophobicContact CE1-CD2 3.47Å; F329-L1001 VanDerWaalsContact CE1-CD2 3.47Å; F329-L1001 HydrophobicContact CE1-CG 4.43Å; F329-L1001 HydrophobicContact CE2-CD2 4.45Å; F329-L1001 HydrophobicContact CZ-CD2 3.5Å
330	F	70.6	Confident	69.2	Low	32 Å²	32	37.8 Å²	37.8	14%	0.14	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-15.5	177.3	-62.8	-80	0	0	0	114.2	W117 G273 A275 L326 S328 L1001	W117-F330 AromaticContact CH2-CE1 3.96Å; W117-F330 HydrophobicContact CH2-CE1 3.96Å; W117-F330 AromaticContact CH2-CZ 3.52Å; W117-F330 HydrophobicContact CH2-CZ 3.52Å; W117-F330 HydrophobicContact CZ2-CE1 4.2Å; W117-F330 HydrophobicContact CZ2-CE2 4.47Å; W117-F330 AromaticContact CZ2-CZ 3.49Å; W117-F330 HydrophobicContact CZ2-CZ 3.49Å; W117-F330 VanDerWaalsContact CZ2-CZ 3.49Å; W117-F330 HydrophobicContact CZ3-CZ 4.36Å; G273-F330 WeakPolarHBondContact O-CD1 3.47Å; G273-F330 WeakPolarHBondContact O-CE1 3.36Å; A275-F330 HydrophobicContact CB-CE2 3.7Å; A275-F330 HydrophobicContact CB-CZ 3.97Å; L326-F330 HydrophobicContact CD1-CE2 3.98Å; L326-F330 HydrophobicContact CD1-CZ 4.47Å; L326-F330 HydrophobicContact CG-CE2 4.3Å; L326-F330 WeakPolarHBondContact O-CD2 3.26Å; L326-F330 WeakPolarHBondContact O-CE2 3Å; S328-F330 VanDerWaalsContact C-N 3.26Å; S328-F330 PolarHBondContact O-N 3.07Å; F330-L1001 HydrophobicContact CE1-CD1 4.43Å
331	D	68.7	Low	69.4	Low	37 Å²	37	35.7 Å²	35.7	20%	0.198	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	21.9	-179.1	-81.4	-45.9	0	0	0	112.5	S328 F329 I709 R710 V919	S328-D331 CarbonylContact O-C 3.56Å; S328-D331 PolarHBondContact O-N 2.62Å; F329-D331 VanDerWaalsContact C-N 3.28Å; F329-D331 PolarHBondContact O-N 2.78Å; D331-I709 VanDerWaalsContact OD1-CD1 3.27Å; D331-I709 WeakPolarHBondContact OD1-CD1 3.3Å; D331-R710 IonicContact OD1-CZ 3.53Å; D331-R710 IonicContact OD1-NE 2.69Å; D331-R710 IonicContact OD1-NH2 3.65Å; D331-R710 PolarHBondContact OD1-NH2 3.26Å; D331-R710 IonicContact OD2-CZ 3.42Å; D331-R710 IonicContact OD2-NH2 2.75Å; D331-R710 PolarHBondContact OD2-NH2 3.02Å; D331-V919 HydrophobicContact CB-CG1 4.48Å; D331-V919 HydrophobicContact CB-CG2 4.44Å
332	S	61.4	Low	69.2	Low	16 Å²	16	37.1 Å²	37.1	11%	0.112	23%	0.228	C	C	.	.			trans	-128.2	148.4	-166.8	72.7	0	0	0	0	114.2	R68 S69 S328 F329	R68-S332 VanDerWaalsContact CD-OG 3.3Å; R68-S332 WeakPolarHBondContact CD-OG 3.37Å; R68-S332 VanDerWaalsContact CZ-O 3.24Å; R68-S332 PolarHBondContact NH1-O 3.09Å; R68-S332 PolarHBondContact NH1-OG 3.01Å; S69-S332 WeakPolarHBondContact OG-CA 3.46Å; S69-S332 WeakPolarHBondContact OG-CB 3.24Å; S328-S332 WeakPolarHBondContact O-CB 3.4Å; S328-S332 PolarHBondContact O-N 2.73Å; F329-S332 PolarHBondContact O-OG 3.16Å
333	Y	67.2	Low	69.1	Low	16 Å²	16	35.6 Å²	35.6	6%	0.063	22%	0.22	C	C	.	.			trans	-136.7	121.8	-176.5	-169.1	-123.7	0	0	0	112.1	R68 L335 R707 V719 L721 M1008	R68-Y333 VanDerWaalsContact CG-C 3.43Å; R68-Y333 VanDerWaalsContact CG-O 3.27Å; R68-Y333 WeakPolarHBondContact CG-O 3.18Å; Y333-L335 HydrophobicContact CE2-CD2 4.25Å; Y333-L335 WeakPolarHBondContact OH-CD2 3.49Å; Y333-R707 PolarHBondContact OH-NH1 3.27Å; Y333-V719 HydrophobicContact CG-CG2 4.16Å; Y333-L721 HydrophobicContact CD1-CD2 3.49Å; Y333-L721 VanDerWaalsContact CD1-CD2 3.49Å; Y333-L721 HydrophobicContact CD1-CG 3.56Å; Y333-L721 HydrophobicContact CE1-CD1 4.16Å; Y333-L721 HydrophobicContact CE1-CD2 3.92Å; Y333-L721 HydrophobicContact CE1-CG 3.65Å; Y333-L721 HydrophobicContact CG-CD2 4.28Å; Y333-L721 WeakPolarHBondContact O-CD2 3.4Å; Y333-M1008 HydrophobicContact CD2-CE 4.01Å; Y333-M1008 HydrophobicContact CE2-CE 3.62Å; Y333-M1008 HydrophobicContact CE2-SD 3.57Å; Y333-M1008 VanDerWaalsContact CE2-SD 3.57Å
334	V	61.8	Low	69.2	Low	24 Å²	24	32.7 Å²	32.7	15%	0.145	19%	0.193	C	C	.	.			trans	-120	164.3	167.5	-150.9	0	0	0	0	102.8	P67 R68	P67-V334 HydrophobicContact CG-CG1 3.77Å; P67-V334 WeakPolarHBondContact O-CG1 3.29Å; R68-V334 HydrophobicContact CB-CG2 4.27Å; R68-V334 HydrophobicContact CG-CB 4.33Å; R68-V334 HydrophobicContact CG-CG2 3.64Å; R68-V334 VanDerWaalsContact CZ-N 3.33Å; R68-V334 VanDerWaalsContact NH2-N 3.14Å
335	L	64.4	Low	69.8	Low	5 Å²	5	32.1 Å²	32.1	3%	0.026	19%	0.19	C	C	.	.			trans	-110.7	139.5	145.8	-60.2	169.4	0	0	0	107.7	Y333 I344 D349 I350 T704 L721 M1008	Y333-L335 HydrophobicContact CE2-CD2 4.25Å; Y333-L335 WeakPolarHBondContact OH-CD2 3.49Å; L335-I344 HydrophobicContact CB-CD1 3.59Å; L335-I344 WeakPolarHBondContact O-CD1 3.48Å; L335-D349 HydrophobicContact CD1-CB 4.44Å; L335-I350 HydrophobicContact CD1-CD1 3.81Å; L335-I350 HydrophobicContact CD1-CG1 3.72Å; L335-T704 HydrophobicContact CD1-CG2 4.48Å; L335-L721 HydrophobicContact CD1-CD1 3.77Å; L335-L721 HydrophobicContact CG-CD1 4.2Å; L335-M1008 HydrophobicContact CD2-CE 4.48Å; L335-M1008 HydrophobicContact CD2-SD 3.75Å
336	T	60.6	Low	70.5	Confident	58 Å²	58	30.5 Å²	30.5	36%	0.356	18%	0.181	S	C	.	.	P	Polyproline II helix	trans	-81.3	146.6	171.1	44.1	0	0	0	0	109.6	H347	T336-H347 PolarHBondContact O-CD2 2.91Å
337	V	63.8	Low	70.9	Confident	66 Å²	66	31.8 Å²	31.8	40%	0.4	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-63.4	133.2	169.9	-177.2	0	0	0	0	108.1	G341	V337-G341 VanDerWaalsContact CG1-C 3.49Å; V337-G341 WeakPolarHBondContact CG1-O 3.38Å
338	P	65.7	Low	71.6	Confident	10 Å²	10	30.5 Å²	30.5	7%	0.065	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-58.5	152.8	174.3	-24.4	35	0	0	0	111.7	C340 G341 L609	P338-C340 PolarHBondContact O-N 3.5Å; P338-C340 VanDerWaalsContact O-N 3.07Å; P338-G341 PolarHBondContact O-N 2.86Å; P338-L609 HydrophobicContact CB-CD2 3.91Å; P338-L609 HydrophobicContact CG-CD2 4.15Å
339	P	64.6	Low	72.4	Confident	131 Å²	131	30.8 Å²	30.8	85%	0.851	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-29.5	-177.2	-28.2	36.1	0	0	0	115.4
340	C	78	Confident	73.1	Confident	21 Å²	21	29.8 Å²	29.8	14%	0.142	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	2.8	177.8	-50.5	0	0	0	0	113.4	P338 C601 L609 L613	P338-C340 PolarHBondContact O-N 3.5Å; P338-C340 VanDerWaalsContact O-N 3.07Å; C340-C601 VanDerWaalsContact CA-SG 3.52Å; C340-C601 HydrophobicContact CB-CB 3.74Å; C340-C601 WeakPolarHBondContact CB-SG 3.3Å; C340-C601 WeakPolarHBondContact SG-CA 3.14Å; C340-C601 WeakPolarHBondContact SG-CB 3.47Å; C340-C601 CovalentContact SG-SG 2.03Å; C340-C601 PolarHBondContact SG-SG 3.33Å; C340-L609 VanDerWaalsContact CB-O 3.31Å; C340-L609 WeakPolarHBondContact CB-O 3.11Å; C340-L609 PolarHBondContact SG-O 3.29Å; C340-L609 VanDerWaalsContact SG-O 3.34Å; C340-L613 HydrophobicContact CB-CD2 4.15Å
341	G	76.8	Confident	74	Confident	12 Å²	12	28.3 Å²	28.3	12%	0.124	17%	0.166	C	C	.	.			trans	-93.2	157.6	178.2	0	0	0	0	0	112.3	V337 P338	V337-G341 VanDerWaalsContact CG1-C 3.49Å; V337-G341 WeakPolarHBondContact CG1-O 3.38Å; P338-G341 PolarHBondContact O-N 2.86Å
342	Q	73.9	Confident	74.8	Confident	88 Å²	88	30 Å²	30	41%	0.411	17%	0.171	S	C	.	.	S	Bend	trans	-102.3	-34	179.5	-64.7	-67.3	-26.1	0	0	111.3	D346 W548 W586	Q342-D346 PolarHBondContact N-OD2 3.48Å; Q342-W548 HydrophobicContact CB-CD2 3.62Å; Q342-W548 HydrophobicContact CB-CE3 3.89Å; Q342-W548 HydrophobicContact CB-CG 3.94Å; Q342-W548 HydrophobicContact CB-CH2 4.48Å; Q342-W548 HydrophobicContact CB-CZ2 4.28Å; Q342-W548 HydrophobicContact CB-CZ3 4.31Å; Q342-W548 HydrophobicContact CG-CD2 4.01Å; Q342-W548 HydrophobicContact CG-CG 4.42Å; Q342-W548 HydrophobicContact CG-CH2 4.37Å; Q342-W548 HydrophobicContact CG-CZ2 3.86Å; Q342-W586 HydrophobicContact CG-CZ2 4.12Å
343	T	73.1	Confident	76.1	Confident	9 Å²	9	29.6 Å²	29.6	6%	0.055	17%	0.169	C	C	.	.	S	Bend	trans	-140.5	176.6	178.7	82.6	0	0	0	0	113.3	C345 D346 W548 Y683	T343-C345 PolarHBondContact O-N 2.9Å; T343-C345 PolarHBondContact OG1-N 2.86Å; T343-C345 VanDerWaalsContact OG1-N 3.17Å; T343-D346 PolarHBondContact N-OD2 3.04Å; T343-D346 WeakPolarHBondContact O-CB 3.25Å; T343-D346 PolarHBondContact O-N 3.37Å; T343-W548 HydrophobicContact CG2-CB 4.04Å; T343-W548 HydrophobicContact CG2-CE3 4.26Å; T343-Y683 HydrophobicContact CG2-CE1 3.77Å; T343-Y683 WeakPolarHBondContact OG1-CE1 3.32Å; T343-Y683 VanDerWaalsContact OG1-CZ 3.26Å; T343-Y683 PolarHBondContact OG1-OH 2.83Å
344	I	73.8	Confident	77.3	Confident	20 Å²	20	28.9 Å²	28.9	10%	0.103	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-61.3	-21.8	175	-157.4	62.5	0	0	0	113.4	L335 D346 H347 I350 L686 L724	L335-I344 HydrophobicContact CB-CD1 3.59Å; L335-I344 WeakPolarHBondContact O-CD1 3.48Å; I344-D346 PolarHBondContact O-N 2.86Å; I344-H347 HydrophobicContact CD1-CB 4.43Å; I344-H347 WeakPolarHBondContact O-CB 3.39Å; I344-H347 PolarHBondContact O-N 2.79Å; I344-H347 VanDerWaalsContact O-N 3.15Å; I344-I350 HydrophobicContact CG1-CG1 4.43Å; I344-L686 HydrophobicContact CG2-CD1 4.22Å; I344-L686 HydrophobicContact CG2-CD2 3.97Å; I344-L724 HydrophobicContact CG2-CD2 3.91Å
345	C	85.9	Confident	78.6	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-69.7	-11.4	174	-70.4	0	0	0	0	113.6	T343 V351 C682 Y683 L686	T343-C345 PolarHBondContact O-N 2.9Å; T343-C345 PolarHBondContact OG1-N 2.86Å; T343-C345 VanDerWaalsContact OG1-N 3.17Å; C345-V351 WeakPolarHBondContact O-CG2 3.48Å; C345-C682 WeakPolarHBondContact CA-SG 3.48Å; C345-C682 HydrophobicContact CB-CB 3.75Å; C345-C682 WeakPolarHBondContact CB-SG 3.37Å; C345-C682 WeakPolarHBondContact SG-CB 3.07Å; C345-C682 PolarHBondContact SG-O 3.5Å; C345-C682 CovalentContact SG-SG 2.04Å; C345-C682 PolarHBondContact SG-SG 3.22Å; C345-Y683 HydrophobicContact CB-CD1 4.37Å; C345-Y683 HydrophobicContact CB-CD2 4.04Å; C345-Y683 HydrophobicContact CB-CE1 4.07Å; C345-Y683 HydrophobicContact CB-CE2 3.7Å; C345-Y683 HydrophobicContact CB-CG 4.34Å; C345-L686 VanDerWaalsContact SG-CD2 3.59Å
346	D	87.4	Confident	79.5	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-93.7	-3	174.4	-48.5	-44.8	0	0	0	112	Q342 T343 I344 L613 R679 Y683	Q342-D346 PolarHBondContact N-OD2 3.48Å; T343-D346 PolarHBondContact N-OD2 3.04Å; T343-D346 WeakPolarHBondContact O-CB 3.25Å; T343-D346 PolarHBondContact O-N 3.37Å; I344-D346 PolarHBondContact O-N 2.86Å; D346-L613 HydrophobicContact CB-CD1 3.78Å; D346-R679 IonicContact OD1-CZ 2.66Å; D346-R679 IonicContact OD1-NE 3.4Å; D346-R679 PolarHBondContact OD1-NE 3.49Å; D346-R679 VanDerWaalsContact OD1-NE 3.1Å; D346-R679 IonicContact OD1-NH2 3.54Å; D346-R679 PolarHBondContact OD1-NH2 2.8Å; D346-Y683 VanDerWaalsContact CG-OH 3.31Å; D346-Y683 PolarHBondContact OD1-OH 2.79Å; D346-Y683 PolarHBondContact OD2-OH 3.09Å; D346-Y683 VanDerWaalsContact OD2-OH 3.06Å
347	H	84.3	Confident	80.7	Confident	26 Å²	26	32 Å²	32	12%	0.12	18%	0.182	C	C	.	.	S	Bend	trans	-71.6	129.9	177.3	-170.7	-88.3	0	0	0	111.4	T336 I344 D349 I350 V351	T336-H347 PolarHBondContact O-CD2 2.91Å; I344-H347 HydrophobicContact CD1-CB 4.43Å; I344-H347 WeakPolarHBondContact O-CB 3.39Å; I344-H347 PolarHBondContact O-N 2.79Å; I344-H347 VanDerWaalsContact O-N 3.15Å; H347-D349 VanDerWaalsContact C-N 3.31Å; H347-D349 IonicContact CE1-OD2 3.88Å; H347-D349 PolarHBondContact CE1-OD2 3.37Å; H347-D349 PolarHBondContact ND1-N 3.09Å; H347-D349 PolarHBondContact O-N 3.37Å; H347-D349 VanDerWaalsContact O-N 3.13Å; H347-I350 HydrophobicContact CB-CB 4.46Å; H347-I350 HydrophobicContact CB-CG1 4.13Å; H347-I350 WeakPolarHBondContact O-CB 3.25Å; H347-I350 PolarHBondContact O-N 3.49Å; H347-V351 PolarHBondContact O-N 2.98Å
348	P	85	Confident	81.6	Confident	15 Å²	15	36.5 Å²	36.5	10%	0.097	19%	0.192	C	C	.	.	H	α-helix	trans	-53	-41.8	-173.8	-27.4	31.9	0	0	0	114.6	I350 V351 K352 M608 L609	P348-I350 VanDerWaalsContact C-N 3.31Å; P348-I350 PolarHBondContact O-N 3.12Å; P348-V351 PolarHBondContact O-N 3.43Å; P348-K352 VanDerWaalsContact O-CB 3.27Å; P348-K352 WeakPolarHBondContact O-CB 3.23Å; P348-K352 WeakPolarHBondContact O-CG 3.39Å; P348-K352 PolarHBondContact O-N 2.73Å; P348-M608 HydrophobicContact CB-CB 4.09Å; P348-M608 HydrophobicContact CG-CB 3.92Å; P348-L609 HydrophobicContact CG-CD2 3.66Å; P348-L609 HydrophobicContact CG-CG 4.27Å
349	D	82	Confident	82.3	Confident	38 Å²	38	37.6 Å²	37.6	20%	0.203	20%	0.196	C	C	.	.	H	α-helix	trans	-66.8	-30.8	-179.9	-65.5	-17.1	0	0	0	113.2	L335 H347 S353 N1009	L335-D349 HydrophobicContact CD1-CB 4.44Å; H347-D349 VanDerWaalsContact C-N 3.31Å; H347-D349 IonicContact CE1-OD2 3.88Å; H347-D349 PolarHBondContact CE1-OD2 3.37Å; H347-D349 PolarHBondContact ND1-N 3.09Å; H347-D349 PolarHBondContact O-N 3.37Å; H347-D349 VanDerWaalsContact O-N 3.13Å; D349-S353 WeakPolarHBondContact O-CB 3.38Å; D349-S353 PolarHBondContact O-N 2.04Å; D349-N1009 PolarHBondContact OD1-ND2 3Å; D349-N1009 PolarHBondContact OD2-ND2 2.9Å
350	I	85.5	Confident	83.3	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-71.9	-51.1	176.8	-64.2	-71.3	0	0	0	109	L335 I344 H347 P348 K352 S353 Y354 C682 P703 T704 L721	L335-I350 HydrophobicContact CD1-CD1 3.81Å; L335-I350 HydrophobicContact CD1-CG1 3.72Å; I344-I350 HydrophobicContact CG1-CG1 4.43Å; H347-I350 HydrophobicContact CB-CB 4.46Å; H347-I350 HydrophobicContact CB-CG1 4.13Å; H347-I350 WeakPolarHBondContact O-CB 3.25Å; H347-I350 PolarHBondContact O-N 3.49Å; P348-I350 VanDerWaalsContact C-N 3.31Å; P348-I350 PolarHBondContact O-N 3.12Å; I350-K352 PolarHBondContact O-N 3.35Å; I350-S353 WeakPolarHBondContact O-CB 3.3Å; I350-S353 PolarHBondContact O-N 3.32Å; I350-S353 VanDerWaalsContact O-N 3.15Å; I350-Y354 HydrophobicContact CG2-CD2 3.98Å; I350-Y354 HydrophobicContact CG2-CE2 4.13Å; I350-Y354 WeakPolarHBondContact O-CD2 3.41Å; I350-Y354 PolarHBondContact O-N 2.95Å; I350-C682 HydrophobicContact CG2-CB 4.49Å; I350-C682 VanDerWaalsContact CG2-SG 3.54Å; I350-P703 HydrophobicContact CD1-CB 3.83Å; I350-P703 HydrophobicContact CD1-CG 3.92Å; I350-T704 HydrophobicContact CD1-CG2 3.67Å; I350-L721 HydrophobicContact CD1-CD1 3.98Å
351	V	89.2	Confident	83.7	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-60.8	-45.4	179.2	-173.6	0	0	0	0	111	C345 H347 P348 S353 Y354 N355 M608 Q675 A678 R679	C345-V351 WeakPolarHBondContact O-CG2 3.48Å; H347-V351 PolarHBondContact O-N 2.98Å; P348-V351 PolarHBondContact O-N 3.43Å; V351-S353 VanDerWaalsContact C-N 3.32Å; V351-S353 PolarHBondContact O-N 3.13Å; V351-Y354 PolarHBondContact O-N 3.24Å; V351-N355 VanDerWaalsContact O-CB 3.26Å; V351-N355 WeakPolarHBondContact O-CB 3.49Å; V351-N355 PolarHBondContact O-N 3.29Å; V351-M608 HydrophobicContact CB-CE 3.65Å; V351-M608 HydrophobicContact CG1-CE 3.8Å; V351-M608 HydrophobicContact CG2-CE 3.72Å; V351-Q675 HydrophobicContact CG1-CB 3.86Å; V351-Q675 HydrophobicContact CG1-CG 4.11Å; V351-A678 HydrophobicContact CG1-CB 3.81Å; V351-A678 WeakPolarHBondContact O-CB 2.92Å; V351-R679 HydrophobicContact CG1-CG 4.12Å; V351-R679 HydrophobicContact CG2-CG 3.67Å
352	K	87.2	Confident	84.1	Confident	72 Å²	72	33.5 Å²	33.5	31%	0.313	16%	0.158	S	C	.	.	H	α-helix	trans	-61	-39.7	175.5	-73.2	170.3	-178.7	174	0	112	P348 I350 N355 V356 E615	P348-K352 VanDerWaalsContact O-CB 3.27Å; P348-K352 WeakPolarHBondContact O-CB 3.23Å; P348-K352 WeakPolarHBondContact O-CG 3.39Å; P348-K352 PolarHBondContact O-N 2.73Å; I350-K352 PolarHBondContact O-N 3.35Å; K352-N355 PolarHBondContact O-N 3.17Å; K352-V356 WeakPolarHBondContact O-CG2 3.25Å; K352-V356 PolarHBondContact O-N 2.84Å; K352-V356 VanDerWaalsContact O-N 3.07Å; K352-E615 WeakPolarHBondContact CE-OE1 3.21Å
353	S	88.4	Confident	84.8	Confident	8 Å²	8	33.5 Å²	33.5	6%	0.056	17%	0.165	C	C	.	.	H	α-helix	trans	-64.7	-48.9	176.7	-172.5	0	0	0	0	112.2	D349 I350 V351 N355 V356 H357 P703	D349-S353 WeakPolarHBondContact O-CB 3.38Å; D349-S353 PolarHBondContact O-N 2.04Å; I350-S353 WeakPolarHBondContact O-CB 3.3Å; I350-S353 PolarHBondContact O-N 3.32Å; I350-S353 VanDerWaalsContact O-N 3.15Å; V351-S353 VanDerWaalsContact C-N 3.32Å; V351-S353 PolarHBondContact O-N 3.13Å; S353-N355 VanDerWaalsContact C-N 3.29Å; S353-N355 PolarHBondContact O-N 2.76Å; S353-V356 PolarHBondContact O-N 2.92Å; S353-H357 WeakPolarHBondContact O-CB 3.08Å; S353-H357 PolarHBondContact O-N 3.03Å; S353-H357 PolarHBondContact O-ND1 2.8Å; S353-H357 PolarHBondContact OG-ND1 2.92Å; S353-P703 WeakPolarHBondContact CB-O 3.39Å; S353-P703 PolarHBondContact OG-O 3.4Å
354	Y	91.1	Very high	85.5	Confident	1 Å²	1	33.1 Å²	33.1	0%	0.004	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-36.4	174.8	-90.9	-96.3	0	0	0	112.3	I350 V351 L360 R361 H681 C682 D685 P703 L724	I350-Y354 HydrophobicContact CG2-CD2 3.98Å; I350-Y354 HydrophobicContact CG2-CE2 4.13Å; I350-Y354 WeakPolarHBondContact O-CD2 3.41Å; I350-Y354 PolarHBondContact O-N 2.95Å; V351-Y354 PolarHBondContact O-N 3.24Å; Y354-L360 HydrophobicContact CD1-CB 3.65Å; Y354-L360 HydrophobicContact CD2-CD1 4.02Å; Y354-L360 HydrophobicContact CE1-CB 3.7Å; Y354-L360 WeakPolarHBondContact CE1-O 3.46Å; Y354-L360 HydrophobicContact CE2-CD1 4.24Å; Y354-L360 HydrophobicContact CG-CB 4.09Å; Y354-L360 HydrophobicContact CG-CD1 4.18Å; Y354-R361 HydrophobicContact CD1-CG 4.39Å; Y354-R361 WeakPolarHBondContact O-CD 3.39Å; Y354-R361 WeakPolarHBondContact O-CG 3.45Å; Y354-R361 PolarHBondContact O-NE 2.84Å; Y354-H681 HydrophobicContact CD1-CB 3.68Å; Y354-H681 HydrophobicContact CE1-CB 3.88Å; Y354-C682 HydrophobicContact CD1-CB 4.46Å; Y354-C682 HydrophobicContact CD2-CB 4.14Å; Y354-C682 HydrophobicContact CE1-CB 4.27Å; Y354-C682 HydrophobicContact CE2-CB 3.94Å; Y354-C682 HydrophobicContact CG-CB 4.4Å; Y354-D685 VanDerWaalsContact CE1-OD2 3.27Å; Y354-D685 WeakPolarHBondContact CE1-OD2 3.4Å; Y354-D685 PolarHBondContact OH-OD2 2.71Å; Y354-P703 HydrophobicContact CE2-CB 4.06Å; Y354-L724 HydrophobicContact CE2-CD1 4.13Å
355	N	89.1	Confident	86.3	Confident	41 Å²	41	35.2 Å²	35.2	22%	0.219	18%	0.176	C	C	.	.	H	α-helix	trans	-65.1	-43.4	178.1	-165.1	1.5	0	0	0	111.6	V351 K352 S353 R361 A674 A678	V351-N355 VanDerWaalsContact O-CB 3.26Å; V351-N355 WeakPolarHBondContact O-CB 3.49Å; V351-N355 PolarHBondContact O-N 3.29Å; K352-N355 PolarHBondContact O-N 3.17Å; S353-N355 VanDerWaalsContact C-N 3.29Å; S353-N355 PolarHBondContact O-N 2.76Å; N355-R361 PolarHBondContact O-NH2 2.8Å; N355-A674 WeakPolarHBondContact OD1-CB 3.34Å; N355-A678 HydrophobicContact CB-CB 4.09Å
356	V	84.4	Confident	86.6	Confident	87 Å²	87	35.2 Å²	35.2	53%	0.527	18%	0.176	S	C	.	.	H	α-helix	trans	-83.7	-34.5	-175.9	177.2	0	0	0	0	113.9	K352 S353	K352-V356 WeakPolarHBondContact O-CG2 3.25Å; K352-V356 PolarHBondContact O-N 2.84Å; K352-V356 VanDerWaalsContact O-N 3.07Å; S353-V356 PolarHBondContact O-N 2.92Å
357	H	85.6	Confident	86.9	Confident	24 Å²	24	39 Å²	39	11%	0.111	19%	0.19	C	C	.	.			trans	-101.1	109.2	-171.4	-55.2	93.6	0	0	0	112	S353 E359 L360 P952 Y988	S353-H357 WeakPolarHBondContact O-CB 3.08Å; S353-H357 PolarHBondContact O-N 3.03Å; S353-H357 PolarHBondContact O-ND1 2.8Å; S353-H357 PolarHBondContact OG-ND1 2.92Å; H357-E359 PolarHBondContact O-N 2.8Å; H357-L360 HydrophobicContact CB-CD1 4.19Å; H357-L360 HydrophobicContact CB-CG 4.28Å; H357-L360 PolarHBondContact O-N 2.86Å; H357-P952 HydrophobicContact CB-CG 4.26Å; H357-Y988 PolarHBondContact NE2-OH 2.8Å
358	W	83.6	Confident	87.4	Confident	161 Å²	161	37.8 Å²	37.8	61%	0.61	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-63.4	-25.3	-177.9	73	-92.3	0	0	0	112.7	L360 R361 H362	W358-L360 PolarHBondContact O-N 2.69Å; W358-R361 CarbonylContact O-C 3.52Å; W358-R361 WeakPolarHBondContact O-CA 3.37Å; W358-R361 PolarHBondContact O-N 2.9Å; W358-H362 PolarHBondContact O-N 3.31Å
359	E	79.8	Confident	87.9	Confident	34 Å²	34	38.5 Å²	38.5	16%	0.159	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-62.1	-30.5	178.4	-58.9	99.5	134.9	0	0	112.7	H357 R361 R934	H357-E359 PolarHBondContact O-N 2.8Å; E359-R361 VanDerWaalsContact C-N 3.34Å; E359-R934 IonicContact OE1-CZ 3.84Å; E359-R934 IonicContact OE1-NH1 3.35Å; E359-R934 PolarHBondContact OE1-NH1 3.45Å; E359-R934 IonicContact OE1-NH2 3.46Å; E359-R934 PolarHBondContact OE1-NH2 3.27Å
360	L	85.1	Confident	88.5	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-78.9	-21.7	175.2	-57.4	178	0	0	0	112.2	Y354 H357 W358 K364 C701 P703 P952	Y354-L360 HydrophobicContact CD1-CB 3.65Å; Y354-L360 HydrophobicContact CD2-CD1 4.02Å; Y354-L360 HydrophobicContact CE1-CB 3.7Å; Y354-L360 WeakPolarHBondContact CE1-O 3.46Å; Y354-L360 HydrophobicContact CE2-CD1 4.24Å; Y354-L360 HydrophobicContact CG-CB 4.09Å; Y354-L360 HydrophobicContact CG-CD1 4.18Å; H357-L360 HydrophobicContact CB-CD1 4.19Å; H357-L360 HydrophobicContact CB-CG 4.28Å; H357-L360 PolarHBondContact O-N 2.86Å; W358-L360 PolarHBondContact O-N 2.69Å; L360-K364 PolarHBondContact O-NZ 3.05Å; L360-C701 HydrophobicContact CD2-CB 4.08Å; L360-P703 WeakPolarHBondContact CD1-O 3.2Å; L360-P952 HydrophobicContact CD1-CG 4.2Å
361	R	87.1	Confident	89	Confident	61 Å²	61	36.8 Å²	36.8	23%	0.23	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-106.2	33.7	178.1	-62	-165	-74.4	131.8	-4.9	112.5	Y354 N355 W358 E359 N403 H681	Y354-R361 HydrophobicContact CD1-CG 4.39Å; Y354-R361 WeakPolarHBondContact O-CD 3.39Å; Y354-R361 WeakPolarHBondContact O-CG 3.45Å; Y354-R361 PolarHBondContact O-NE 2.84Å; N355-R361 PolarHBondContact O-NH2 2.8Å; W358-R361 CarbonylContact O-C 3.52Å; W358-R361 WeakPolarHBondContact O-CA 3.37Å; W358-R361 PolarHBondContact O-N 2.9Å; E359-R361 VanDerWaalsContact C-N 3.34Å; R361-N403 WeakPolarHBondContact O-CB 3.42Å; R361-N403 PolarHBondContact O-ND2 3.42Å; R361-H681 HydrophobicContact CG-CB 4.2Å
362	H	84.1	Confident	89.2	Confident	16 Å²	16	36.8 Å²	36.8	7%	0.074	18%	0.177	C	C	.	.			trans	-58.2	157.3	172.5	72.4	76.4	0	0	0	111.5	W358 K364 M697	W358-H362 PolarHBondContact O-N 3.31Å; H362-K364 WeakPolarHBondContact NE2-CE 3.38Å; H362-K364 WeakPolarHBondContact O-CG 2.99Å; H362-K364 PolarHBondContact O-N 3.29Å; H362-M697 HydrophobicContact CB-CE 4.07Å
363	P	88.5	Confident	89.4	Confident	87 Å²	87	33.6 Å²	33.6	57%	0.565	16%	0.164	S	C	*	.			trans	-52.5	125.3	174	-29.4	37.2	0	0	0	112.9	N403	P363-N403 CarbonylContact C-O 3.51Å; P363-N403 WeakPolarHBondContact CA-O 3.33Å
364	K	87.8	Confident	89.5	Confident	1 Å²	1	35.2 Å²	35.2	0%	0.004	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	126.4	179.3	-71	167.5	-162.3	-175.7	0	108.5	L360 H362 N403 I404 S405 H681 V684 D685 L692	L360-K364 PolarHBondContact O-NZ 3.05Å; H362-K364 WeakPolarHBondContact NE2-CE 3.38Å; H362-K364 WeakPolarHBondContact O-CG 2.99Å; H362-K364 PolarHBondContact O-N 3.29Å; K364-N403 PolarHBondContact N-O 3.12Å; K364-I404 WeakPolarHBondContact O-CA 3.4Å; K364-S405 PolarHBondContact O-N 2.94Å; K364-S405 PolarHBondContact O-OG 2.66Å; K364-H681 PolarHBondContact NZ-ND1 3.46Å; K364-H681 PolarHBondContact NZ-O 3.13Å; K364-V684 HydrophobicContact CD-CB 4.27Å; K364-V684 HydrophobicContact CD-CG1 3.78Å; K364-V684 HydrophobicContact CG-CG1 4.47Å; K364-D685 WeakPolarHBondContact CE-OD1 3.3Å; K364-D685 IonicContact NZ-OD1 3.04Å; K364-D685 PolarHBondContact NZ-OD1 3.15Å; K364-D685 IonicContact NZ-OD2 2.71Å; K364-D685 PolarHBondContact NZ-OD2 3.28Å; K364-L692 HydrophobicContact CB-CD2 4.04Å; K364-L692 HydrophobicContact CG-CD2 4.26Å
365	V	91.4	Very high	89.1	Confident	64 Å²	64	36.4 Å²	36.4	39%	0.388	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	112.4	176.8	-170.2	0	0	0	0	107.6	S405 Q407 L692 A693	V365-S405 CarbonylContact C-O 3.49Å; V365-S405 WeakPolarHBondContact CA-O 3.23Å; V365-Q407 HydrophobicContact CG1-CB 4.33Å; V365-L692 CarbonylContact O-C 3.59Å; V365-L692 WeakPolarHBondContact O-CA 3.22Å; V365-A693 HydrophobicContact CB-CB 3.97Å; V365-A693 HydrophobicContact CG1-CB 3.72Å; V365-A693 WeakPolarHBondContact O-CB 3.38Å; V365-A693 PolarHBondContact O-N 2.86Å
366	L	91.5	Very high	88.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	139.7	-176.8	-63.7	173	0	0	0	110.8	I404 S405 W406 Q407 L583 V684 W691 L692	L366-I404 HydrophobicContact CD1-CG2 3.93Å; L366-S405 PolarHBondContact N-O 3Å; L366-W406 HydrophobicContact CB-CD2 4.25Å; L366-W406 HydrophobicContact CB-CE3 3.61Å; L366-W406 HydrophobicContact CB-CH2 4.33Å; L366-W406 HydrophobicContact CB-CZ3 3.67Å; L366-W406 HydrophobicContact CD1-CE3 4.42Å; L366-W406 HydrophobicContact CD1-CH2 3.73Å; L366-W406 HydrophobicContact CD1-CZ2 4.01Å; L366-W406 HydrophobicContact CD1-CZ3 3.94Å; L366-W406 HydrophobicContact CG-CZ3 4.47Å; L366-W406 CarbonylContact O-C 3.28Å; L366-W406 VanDerWaalsContact O-CA 3.29Å; L366-W406 WeakPolarHBondContact O-CA 3.12Å; L366-Q407 PolarHBondContact O-N 2.73Å; L366-L583 HydrophobicContact CD1-CD2 4.17Å; L366-V684 HydrophobicContact CD1-CG2 3.92Å; L366-V684 HydrophobicContact CD2-CG1 3.86Å; L366-V684 HydrophobicContact CD2-CG2 4.27Å; L366-W691 CarbonylContact C-O 3.55Å; L366-W691 HydrophobicContact CD2-CB 4.07Å; L366-L692 HydrophobicContact CD2-CD2 3.95Å; L366-L692 HydrophobicContact CD2-CG 4.47Å
367	R	93.6	Very high	88.1	Confident	81 Å²	81	42 Å²	42	31%	0.306	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	132.9	172	-64.3	176.3	-172.4	141.8	4.6	110.3	S527 L528 W691 A693	R367-S527 VanDerWaalsContact O-CA 3.28Å; R367-S527 WeakPolarHBondContact O-CA 3.06Å; R367-L528 PolarHBondContact O-N 3.08Å; R367-W691 WeakPolarHBondContact CG-O 3.37Å; R367-W691 PolarHBondContact N-O 2.83Å; R367-A693 HydrophobicContact CG-CB 4.02Å; R367-A693 PolarHBondContact NH2-O 3.23Å
368	Y	95.4	Very high	88	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	155.8	163.7	84.2	-64.5	0	0	0	109.9	V370 H392 L395 W406 Q407 L408 T409 L528 V530	Y368-V370 HydrophobicContact CD2-CG2 4.39Å; Y368-V370 HydrophobicContact CE2-CG2 3.82Å; Y368-H392 AromaticContact CE1-CE1 3.84Å; Y368-H392 AromaticContact CE1-ND1 3.58Å; Y368-H392 AromaticContact CZ-ND1 3.69Å; Y368-H392 WeakPolarHBondContact OH-CB 3.46Å; Y368-H392 PolarHBondContact OH-ND1 2.86Å; Y368-L395 HydrophobicContact CE1-CD2 4.16Å; Y368-L395 HydrophobicContact CE2-CD2 4.22Å; Y368-W406 HydrophobicContact CD1-CB 3.83Å; Y368-W406 HydrophobicContact CD1-CE3 4.22Å; Y368-W406 HydrophobicContact CE1-CB 3.93Å; Y368-W406 HydrophobicContact CG-CE3 4.28Å; Y368-Q407 WeakPolarHBondContact CD1-O 3.05Å; Y368-Q407 PolarHBondContact N-O 3.12Å; Y368-Q407 VanDerWaalsContact O-O 3.1Å; Y368-L408 HydrophobicContact CD1-CB 4.48Å; Y368-L408 VanDerWaalsContact CE1-CA 3.47Å; Y368-L408 HydrophobicContact CE1-CB 3.63Å; Y368-L408 HydrophobicContact CE1-CD1 4.03Å; Y368-L408 HydrophobicContact CE1-CG 4.41Å; Y368-L408 HydrophobicContact CE2-CD1 3.93Å; Y368-L408 CarbonylContact O-C 3.46Å; Y368-T409 PolarHBondContact O-N 2.85Å; Y368-L528 CarbonylContact C-O 3.56Å; Y368-L528 WeakPolarHBondContact CA-O 3.3Å; Y368-L528 WeakPolarHBondContact CB-O 3.27Å; Y368-V530 HydrophobicContact CD2-CG2 4.08Å
369	K	94.7	Very high	87.9	Confident	30 Å²	30	40 Å²	40	13%	0.13	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	137.1	179.9	61.1	-175.1	167.6	-174.5	0	112	T409 V411 V522 S523 S527 L528 S529 V530	K369-T409 CarbonylContact C-O 3.57Å; K369-T409 WeakPolarHBondContact CA-O 3.38Å; K369-T409 WeakPolarHBondContact CB-O 3.34Å; K369-V411 HydrophobicContact CB-CG2 4.33Å; K369-V411 HydrophobicContact CD-CG2 4.33Å; K369-V522 HydrophobicContact CD-CG1 4Å; K369-V522 VanDerWaalsContact NZ-CG1 3.27Å; K369-S523 WeakPolarHBondContact CE-O 3.37Å; K369-S523 PolarHBondContact NZ-O 3.16Å; K369-S527 WeakPolarHBondContact CD-OG 3.39Å; K369-S527 WeakPolarHBondContact CE-OG 3.43Å; K369-L528 PolarHBondContact N-O 2.64Å; K369-S529 WeakPolarHBondContact CE-OG 3.31Å; K369-V530 PolarHBondContact O-N 2.95Å
370	V	96.1	Very high	88.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	118	175.7	175.8	0	0	0	0	108.2	Y368 I388 L408 T409 V411 V530 F532 F566	Y368-V370 HydrophobicContact CD2-CG2 4.39Å; Y368-V370 HydrophobicContact CE2-CG2 3.82Å; V370-I388 HydrophobicContact CG1-CD1 4.12Å; V370-I388 HydrophobicContact CG1-CG1 4.33Å; V370-L408 HydrophobicContact CB-CD1 4.22Å; V370-L408 HydrophobicContact CG2-CD1 3.67Å; V370-T409 PolarHBondContact N-O 3.46Å; V370-V411 PolarHBondContact O-N 2.8Å; V370-V530 WeakPolarHBondContact CA-O 3.02Å; V370-F532 HydrophobicContact CG1-CE2 3.55Å; V370-F532 HydrophobicContact CG1-CZ 3.59Å; V370-F566 HydrophobicContact CG1-CZ 4.46Å; V370-F566 HydrophobicContact CG2-CZ 4.29Å
371	V	94.6	Very high	88.4	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	102.8	177.2	-173.5	0	0	0	0	108	V411 M413 L520 V522 V530 A531 F532	V371-V411 WeakPolarHBondContact CA-O 3.36Å; V371-M413 HydrophobicContact CG1-SD 3.93Å; V371-L520 HydrophobicContact CG1-CD1 4.17Å; V371-L520 HydrophobicContact CG1-CD2 4.13Å; V371-V522 HydrophobicContact CG1-CG2 4.32Å; V371-V522 HydrophobicContact CG2-CB 4.36Å; V371-V522 HydrophobicContact CG2-CG1 3.96Å; V371-V522 HydrophobicContact CG2-CG2 4.1Å; V371-V530 PolarHBondContact N-O 3.07Å; V371-A531 HydrophobicContact CB-CB 4.16Å; V371-F532 WeakPolarHBondContact O-CD2 3.47Å
372	N	93.7	Very high	88.6	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.011	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	124.1	-174.3	-159.2	-0.5	0	0	0	109.9	A381 T382 V383 V411 E412 M413 F532	N372-A381 WeakPolarHBondContact ND2-CB 3.37Å; N372-T382 WeakPolarHBondContact OD1-CB 3.48Å; N372-T382 PolarHBondContact OD1-N 3.32Å; N372-T382 VanDerWaalsContact OD1-N 3.07Å; N372-V383 PolarHBondContact ND2-O 3.13Å; N372-V383 PolarHBondContact OD1-N 3.08Å; N372-V411 PolarHBondContact N-O 3.12Å; N372-E412 WeakPolarHBondContact O-CA 3.37Å; N372-M413 PolarHBondContact O-N 3.3Å; N372-F532 HydrophobicContact CB-CE2 4.42Å
373	L	91.9	Very high	89	Confident	5 Å²	5	44 Å²	44	3%	0.026	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128.5	-177.1	-66.1	-179.9	0	0	0	111.1	A381 T382 M413 V415 L418 R419 Y516 L520	L373-A381 CarbonylContact O-C 3.53Å; L373-A381 WeakPolarHBondContact O-CA 3.5Å; L373-T382 PolarHBondContact O-N 3.46Å; L373-T382 PolarHBondContact O-OG1 2.78Å; L373-T382 VanDerWaalsContact O-OG1 3.05Å; L373-M413 WeakPolarHBondContact CA-O 3.49Å; L373-M413 HydrophobicContact CD2-CB 4.14Å; L373-V415 HydrophobicContact CD2-CB 4.25Å; L373-V415 HydrophobicContact CD2-CG2 3.99Å; L373-L418 HydrophobicContact CD1-CB 4.33Å; L373-L418 HydrophobicContact CD1-CD2 4.23Å; L373-L418 HydrophobicContact CD1-CG 4.3Å; L373-R419 HydrophobicContact CB-CB 3.86Å; L373-R419 HydrophobicContact CD1-CB 3.87Å; L373-Y516 HydrophobicContact CD1-CE2 4.41Å; L373-L520 HydrophobicContact CD1-CD2 4.49Å; L373-L520 HydrophobicContact CD2-CD2 3.78Å; L373-L520 HydrophobicContact CG-CD2 4.49Å
374	L	90.1	Very high	89.2	Confident	41 Å²	41	42.9 Å²	42.9	22%	0.215	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-89.8	146.2	177.5	-58	-178	0	0	0	111.1	A381 E412 M413	L374-A381 HydrophobicContact CD2-CB 3.67Å; L374-E412 HydrophobicContact CD1-CB 4.07Å; L374-E412 HydrophobicContact CD2-CB 4.28Å; L374-E412 HydrophobicContact CG-CB 4.16Å; L374-M413 PolarHBondContact N-O 3.28Å
375	D	83.2	Confident	89.4	Confident	27 Å²	27	49.6 Å²	49.6	14%	0.144	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-71.8	130.2	165.5	-162.8	-95.2	0	0	0	111.6	K377 T378 G379 Q380 R419	D375-K377 VanDerWaalsContact C-N 3.25Å; D375-K377 PolarHBondContact O-N 2.68Å; D375-K377 VanDerWaalsContact OD1-CA 3.31Å; D375-K377 WeakPolarHBondContact OD1-CA 3.45Å; D375-K377 WeakPolarHBondContact OD1-CB 3.4Å; D375-K377 PolarHBondContact OD1-N 2.88Å; D375-T378 VanDerWaalsContact CB-OG1 3.23Å; D375-T378 WeakPolarHBondContact CB-OG1 3.41Å; D375-T378 PolarHBondContact OD1-N 3.26Å; D375-G379 VanDerWaalsContact O-CA 3.3Å; D375-G379 WeakPolarHBondContact O-CA 3.49Å; D375-G379 PolarHBondContact O-N 3.48Å; D375-Q380 PolarHBondContact N-O 2.93Å; D375-R419 VanDerWaalsContact CG-NH2 3.33Å; D375-R419 IonicContact OD2-CZ 2.85Å; D375-R419 IonicContact OD2-NE 3.24Å; D375-R419 PolarHBondContact OD2-NE 3.5Å; D375-R419 IonicContact OD2-NH2 3.96Å; D375-R419 PolarHBondContact OD2-NH2 2.77Å
376	G	75	Confident	89.5	Confident	62 Å²	62	51.8 Å²	51.8	64%	0.639	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-15.9	177.6	0	0	0	0	0	115.4
377	K	76.2	Confident	89.7	Confident	182 Å²	182	53.5 Å²	53.5	79%	0.791	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-41.1	179.6	-59.8	179.9	-179.2	176.8	0	112.5	D375	D375-K377 VanDerWaalsContact C-N 3.25Å; D375-K377 PolarHBondContact O-N 2.68Å; D375-K377 VanDerWaalsContact OD1-CA 3.31Å; D375-K377 WeakPolarHBondContact OD1-CA 3.45Å; D375-K377 WeakPolarHBondContact OD1-CB 3.4Å; D375-K377 PolarHBondContact OD1-N 2.88Å
378	T	84.2	Confident	89.8	Confident	94 Å²	94	49.9 Å²	49.9	58%	0.577	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-14.8	-176.9	71.3	0	0	0	0	114.4	D375 Q380	D375-T378 VanDerWaalsContact CB-OG1 3.23Å; D375-T378 WeakPolarHBondContact CB-OG1 3.41Å; D375-T378 PolarHBondContact OD1-N 3.26Å; T378-Q380 PolarHBondContact O-N 2.91Å; T378-Q380 VanDerWaalsContact OG1-CB 3.25Å; T378-Q380 WeakPolarHBondContact OG1-CB 3.22Å; T378-Q380 PolarHBondContact OG1-N 2.76Å
379	G	81.9	Confident	89.8	Confident	50 Å²	50	53.1 Å²	53.1	52%	0.515	30%	0.295	S	S	.	.			trans	68.2	2.4	-171.2	0	0	0	0	0	114.3	D375	D375-G379 VanDerWaalsContact O-CA 3.3Å; D375-G379 WeakPolarHBondContact O-CA 3.49Å; D375-G379 PolarHBondContact O-N 3.48Å
380	Q	86.2	Confident	89.8	Confident	130 Å²	130	54.7 Å²	54.7	61%	0.607	30%	0.303	S	S	*	.			trans	-75.4	127.6	-177.2	-171.1	-179.2	3.5	0	0	110.9	D375 T378 R419	D375-Q380 PolarHBondContact N-O 2.93Å; T378-Q380 PolarHBondContact O-N 2.91Å; T378-Q380 VanDerWaalsContact OG1-CB 3.25Å; T378-Q380 WeakPolarHBondContact OG1-CB 3.22Å; T378-Q380 PolarHBondContact OG1-N 2.76Å; Q380-R419 PolarHBondContact O-NH1 2.02Å; Q380-R419 VanDerWaalsContact O-NH1 3.09Å
381	A	88.4	Confident	89.7	Confident	24 Å²	24	54.7 Å²	54.7	20%	0.198	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-73.3	160	176.7	0	0	0	0	0	112.9	N372 L373 L374	N372-A381 WeakPolarHBondContact ND2-CB 3.37Å; L373-A381 CarbonylContact O-C 3.53Å; L373-A381 WeakPolarHBondContact O-CA 3.5Å; L374-A381 HydrophobicContact CD2-CB 3.67Å
382	T	90.9	Very high	89.8	Confident	40 Å²	40	56.6 Å²	56.6	25%	0.245	31%	0.312	C	S	.	.	S	Bend	trans	-66.4	-37	179.9	-62.4	0	0	0	0	113	N372 L373 F532 P563	N372-T382 WeakPolarHBondContact OD1-CB 3.48Å; N372-T382 PolarHBondContact OD1-N 3.32Å; N372-T382 VanDerWaalsContact OD1-N 3.07Å; L373-T382 PolarHBondContact O-N 3.46Å; L373-T382 PolarHBondContact O-OG1 2.78Å; L373-T382 VanDerWaalsContact O-OG1 3.05Å; T382-F532 HydrophobicContact CG2-CB 3.93Å; T382-F532 HydrophobicContact CG2-CG 4.37Å; T382-P563 HydrophobicContact CG2-CB 3.81Å; T382-P563 HydrophobicContact CG2-CG 4.18Å
383	V	92.8	Very high	89.8	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.012	34%	0.34	C	S	.	.	S	Bend	trans	-124.9	149.8	168.8	-62.8	0	0	0	0	110	N372 Q387 I388 F532 P563 F566	N372-V383 PolarHBondContact ND2-O 3.13Å; N372-V383 PolarHBondContact OD1-N 3.08Å; V383-Q387 HydrophobicContact CB-CB 4.39Å; V383-I388 HydrophobicContact CG2-CD1 4.05Å; V383-I388 HydrophobicContact CG2-CG1 3.87Å; V383-F532 HydrophobicContact CB-CZ 4.42Å; V383-F532 HydrophobicContact CG1-CD1 4.06Å; V383-F532 HydrophobicContact CG1-CE1 3.91Å; V383-F532 HydrophobicContact CG1-CE2 4.36Å; V383-F532 HydrophobicContact CG1-CG 4.37Å; V383-F532 HydrophobicContact CG1-CZ 4.06Å; V383-F532 HydrophobicContact CG2-CD2 4.29Å; V383-F532 HydrophobicContact CG2-CE1 4.16Å; V383-F532 HydrophobicContact CG2-CE2 3.53Å; V383-F532 HydrophobicContact CG2-CZ 3.46Å; V383-F532 VanDerWaalsContact CG2-CZ 3.46Å; V383-P563 HydrophobicContact CG1-CB 3.74Å; V383-F566 HydrophobicContact CB-CD1 4.48Å; V383-F566 HydrophobicContact CG1-CD1 4.26Å; V383-F566 HydrophobicContact CG2-CD1 4.36Å; V383-F566 HydrophobicContact CG2-CE1 4.18Å
384	T	94.2	Very high	89.9	Confident	63 Å²	63	63.4 Å²	63.4	39%	0.387	35%	0.348	S	S	.	.			trans	-76	162.4	179.9	89	0	0	0	0	112	E386 Q387 I388	T384-E386 WeakPolarHBondContact CB-OE2 3.32Å; T384-E386 PolarHBondContact O-N 3.46Å; T384-E386 PolarHBondContact OG1-N 2.83Å; T384-E386 PolarHBondContact OG1-OE2 2.81Å; T384-Q387 PolarHBondContact O-N 2.94Å; T384-Q387 PolarHBondContact OG1-N 3.17Å; T384-I388 PolarHBondContact O-N 2.92Å
385	K	92.2	Very high	90	Very high	143 Å²	143	61.4 Å²	61.4	62%	0.622	34%	0.338	S	S	*	.	H	α-helix	trans	-61	-37.8	175.4	-176	178.1	175.3	-177.5	0	111.5	Q387 I388 D389	K385-Q387 VanDerWaalsContact C-N 3.33Å; K385-Q387 PolarHBondContact O-N 3.29Å; K385-I388 WeakPolarHBondContact O-CB 3.26Å; K385-I388 PolarHBondContact O-N 2.83Å; K385-I388 VanDerWaalsContact O-N 3.14Å; K385-D389 PolarHBondContact O-N 3.29Å
386	E	93.6	Very high	90.6	Very high	110 Å²	110	62 Å²	62	51%	0.514	34%	0.34	S	S	.	.	H	α-helix	trans	-62.8	-39.3	178.3	-58.3	68.2	-148.5	0	0	111.3	T384 D389 Q390	T384-E386 WeakPolarHBondContact CB-OE2 3.32Å; T384-E386 PolarHBondContact O-N 3.46Å; T384-E386 PolarHBondContact OG1-N 2.83Å; T384-E386 PolarHBondContact OG1-OE2 2.81Å; E386-D389 PolarHBondContact O-N 3.17Å; E386-Q390 VanDerWaalsContact O-CB 3.29Å; E386-Q390 WeakPolarHBondContact O-CB 3.37Å; E386-Q390 WeakPolarHBondContact O-CG 3.45Å; E386-Q390 PolarHBondContact O-N 3.24Å
387	Q	94.7	Very high	91.5	Very high	35 Å²	35	62.1 Å²	62.1	16%	0.164	34%	0.336	C	S	.	.	H	α-helix	trans	-62.4	-43.7	172.8	-67.5	178.7	-93.3	0	0	111.5	V383 T384 K385 Q391 P563 F566 G567	V383-Q387 HydrophobicContact CB-CB 4.39Å; T384-Q387 PolarHBondContact O-N 2.94Å; T384-Q387 PolarHBondContact OG1-N 3.17Å; K385-Q387 VanDerWaalsContact C-N 3.33Å; K385-Q387 PolarHBondContact O-N 3.29Å; Q387-Q391 VanDerWaalsContact O-CB 3.22Å; Q387-Q391 WeakPolarHBondContact O-CB 3.41Å; Q387-Q391 PolarHBondContact O-N 2.83Å; Q387-P563 PolarHBondContact NE2-O 2.84Å; Q387-F566 HydrophobicContact CB-CD1 4.35Å; Q387-F566 PolarHBondContact NE2-O 3.13Å; Q387-G567 WeakPolarHBondContact O-CA 3.26Å
388	I	95.8	Very high	92.3	Very high	6 Å²	6	53.5 Å²	53.5	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-48.2	177.9	-64.1	171.7	0	0	0	110.7	V370 V383 T384 K385 Q391 H392 L408 V410 F566	V370-I388 HydrophobicContact CG1-CD1 4.12Å; V370-I388 HydrophobicContact CG1-CG1 4.33Å; V383-I388 HydrophobicContact CG2-CD1 4.05Å; V383-I388 HydrophobicContact CG2-CG1 3.87Å; T384-I388 PolarHBondContact O-N 2.92Å; K385-I388 WeakPolarHBondContact O-CB 3.26Å; K385-I388 PolarHBondContact O-N 2.83Å; K385-I388 VanDerWaalsContact O-N 3.14Å; I388-Q391 PolarHBondContact O-N 2.86Å; I388-H392 VanDerWaalsContact O-CB 3.27Å; I388-H392 WeakPolarHBondContact O-CB 3.46Å; I388-H392 PolarHBondContact O-N 3Å; I388-L408 HydrophobicContact CG2-CD1 4.38Å; I388-L408 HydrophobicContact CG2-CD2 3.6Å; I388-V410 HydrophobicContact CD1-CG1 4.33Å; I388-V410 HydrophobicContact CD1-CG2 4.46Å; I388-V410 HydrophobicContact CG2-CG2 4.22Å; I388-F566 HydrophobicContact CB-CE1 4.48Å; I388-F566 HydrophobicContact CG1-CE1 3.9Å; I388-F566 HydrophobicContact CG1-CZ 4.31Å
389	D	95.2	Very high	92.9	Very high	68 Å²	68	49 Å²	49	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-64.2	-43.1	-179.7	-72	-22.9	0	0	0	111.1	K385 E386 H392 M393	K385-D389 PolarHBondContact O-N 3.29Å; E386-D389 PolarHBondContact O-N 3.17Å; D389-H392 PolarHBondContact O-N 3.23Å; D389-M393 WeakPolarHBondContact O-CG 3.48Å; D389-M393 PolarHBondContact O-N 2.87Å
390	Q	94.2	Very high	93.5	Very high	63 Å²	63	49.7 Å²	49.7	29%	0.294	27%	0.268	S	S	.	.	H	α-helix	trans	-63.1	-45.5	174.9	-73.6	-179	33.7	0	0	112.5	E386 H392 M393 S394 G567 R572	E386-Q390 VanDerWaalsContact O-CB 3.29Å; E386-Q390 WeakPolarHBondContact O-CB 3.37Å; E386-Q390 WeakPolarHBondContact O-CG 3.45Å; E386-Q390 PolarHBondContact O-N 3.24Å; Q390-H392 VanDerWaalsContact C-N 3.32Å; Q390-H392 PolarHBondContact O-N 3.26Å; Q390-M393 HydrophobicContact CG-CE 4.34Å; Q390-M393 PolarHBondContact O-N 3.02Å; Q390-S394 PolarHBondContact O-N 2.81Å; Q390-G567 PolarHBondContact OE1-O 3.29Å; Q390-R572 VanDerWaalsContact OE1-NH2 3.16Å
391	Q	95.1	Very high	93.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-38.3	177.8	-172.3	58.7	70.7	0	0	111.7	Q387 I388 S394 L395 F566 R572 L575	Q387-Q391 VanDerWaalsContact O-CB 3.22Å; Q387-Q391 WeakPolarHBondContact O-CB 3.41Å; Q387-Q391 PolarHBondContact O-N 2.83Å; I388-Q391 PolarHBondContact O-N 2.86Å; Q391-S394 PolarHBondContact O-N 3Å; Q391-L395 VanDerWaalsContact O-CB 3.26Å; Q391-L395 WeakPolarHBondContact O-CB 3.37Å; Q391-L395 PolarHBondContact O-N 2.54Å; Q391-F566 HydrophobicContact CB-CD1 4.42Å; Q391-F566 HydrophobicContact CB-CE1 4Å; Q391-F566 HydrophobicContact CB-CE2 4.24Å; Q391-F566 HydrophobicContact CB-CZ 3.91Å; Q391-F566 HydrophobicContact CG-CD2 3.9Å; Q391-F566 HydrophobicContact CG-CE1 4.28Å; Q391-F566 HydrophobicContact CG-CE2 3.64Å; Q391-F566 HydrophobicContact CG-CG 4.37Å; Q391-F566 HydrophobicContact CG-CZ 3.83Å; Q391-R572 PolarHBondContact NE2-O 3.43Å; Q391-R572 PolarHBondContact OE1-O 3.32Å; Q391-L575 HydrophobicContact CG-CB 4.37Å; Q391-L575 HydrophobicContact CG-CD2 3.53Å
392	H	96.2	Very high	94.1	Very high	41 Å²	41	49.3 Å²	49.3	19%	0.19	26%	0.259	C	S	.	.	H	α-helix	trans	-66	-41.6	177.3	-175.2	42.3	0	0	0	112.3	Y368 I388 D389 Q390 L395 N396 W406 L408	Y368-H392 AromaticContact CE1-CE1 3.84Å; Y368-H392 AromaticContact CE1-ND1 3.58Å; Y368-H392 AromaticContact CZ-ND1 3.69Å; Y368-H392 WeakPolarHBondContact OH-CB 3.46Å; Y368-H392 PolarHBondContact OH-ND1 2.86Å; I388-H392 VanDerWaalsContact O-CB 3.27Å; I388-H392 WeakPolarHBondContact O-CB 3.46Å; I388-H392 PolarHBondContact O-N 3Å; D389-H392 PolarHBondContact O-N 3.23Å; Q390-H392 VanDerWaalsContact C-N 3.32Å; Q390-H392 PolarHBondContact O-N 3.26Å; H392-L395 PolarHBondContact O-N 3.2Å; H392-N396 PolarHBondContact CE1-ND2 2.89Å; H392-N396 PolarHBondContact O-N 3.24Å; H392-W406 PolarHBondContact CE1-O 3.29Å; H392-W406 VanDerWaalsContact CE1-O 3.29Å; H392-L408 HydrophobicContact CB-CD2 4.44Å
393	M	94.6	Very high	94.2	Very high	123 Å²	123	50.9 Å²	50.9	61%	0.606	27%	0.266	S	S	*	.	H	α-helix	trans	-62.1	-48.1	173.3	-73.8	-173.7	-70.7	0	0	111.5	D389 Q390 L395 N396 A397	D389-M393 WeakPolarHBondContact O-CG 3.48Å; D389-M393 PolarHBondContact O-N 2.87Å; Q390-M393 HydrophobicContact CG-CE 4.34Å; Q390-M393 PolarHBondContact O-N 3.02Å; M393-L395 VanDerWaalsContact C-N 3.33Å; M393-L395 PolarHBondContact O-N 2.6Å; M393-N396 PolarHBondContact O-N 3.33Å; M393-A397 WeakPolarHBondContact O-CB 3.25Å; M393-A397 PolarHBondContact O-N 2.85Å
394	S	92.2	Very high	94.2	Very high	27 Å²	27	50.8 Å²	50.8	19%	0.189	27%	0.265	C	S	.	.	H	α-helix	trans	-60.7	-40.7	175.9	-76	0	0	0	0	112.4	Q390 Q391 A397 A398 R572	Q390-S394 PolarHBondContact O-N 2.81Å; Q391-S394 PolarHBondContact O-N 3Å; S394-A397 PolarHBondContact O-N 2.79Å; S394-A398 WeakPolarHBondContact O-CB 3.43Å; S394-A398 PolarHBondContact O-N 3.48Å; S394-R572 VanDerWaalsContact OG-CD 3.28Å; S394-R572 WeakPolarHBondContact OG-CD 3.41Å
395	L	94.2	Very high	94.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63	-49.5	177.9	-175.4	69.5	0	0	0	111.7	Y368 Q391 H392 M393 A397 A398 F399 W406 V576 L579	Y368-L395 HydrophobicContact CE1-CD2 4.16Å; Y368-L395 HydrophobicContact CE2-CD2 4.22Å; Q391-L395 VanDerWaalsContact O-CB 3.26Å; Q391-L395 WeakPolarHBondContact O-CB 3.37Å; Q391-L395 PolarHBondContact O-N 2.54Å; H392-L395 PolarHBondContact O-N 3.2Å; M393-L395 VanDerWaalsContact C-N 3.33Å; M393-L395 PolarHBondContact O-N 2.6Å; L395-A397 VanDerWaalsContact C-N 3.33Å; L395-A397 PolarHBondContact O-N 3.02Å; L395-A398 PolarHBondContact O-N 2.67Å; L395-F399 HydrophobicContact CD1-CD2 3.65Å; L395-F399 HydrophobicContact CD1-CE2 3.51Å; L395-F399 HydrophobicContact CG-CD2 4.24Å; L395-F399 WeakPolarHBondContact O-CD2 3.49Å; L395-F399 PolarHBondContact O-N 2.03Å; L395-F399 VanDerWaalsContact O-N 3.11Å; L395-W406 HydrophobicContact CD2-CB 3.91Å; L395-W406 HydrophobicContact CD2-CD2 4.13Å; L395-W406 HydrophobicContact CD2-CG 3.63Å; L395-W406 HydrophobicContact CG-CG 4.08Å; L395-V576 HydrophobicContact CD1-CG2 4.31Å; L395-L579 HydrophobicContact CD1-CD2 3.49Å; L395-L579 VanDerWaalsContact CD1-CD2 3.49Å; L395-L579 HydrophobicContact CD2-CD2 3.73Å; L395-L579 HydrophobicContact CG-CD2 4.22Å
396	N	95.7	Very high	94.4	Very high	38 Å²	38	42.9 Å²	42.9	20%	0.203	23%	0.229	C	C	.	.	H	α-helix	trans	-66.3	-34.2	177	-89.9	-38.3	0	0	0	112.1	H392 M393 A398 S400 W406	H392-N396 PolarHBondContact CE1-ND2 2.89Å; H392-N396 PolarHBondContact O-N 3.24Å; M393-N396 PolarHBondContact O-N 3.33Å; N396-A398 PolarHBondContact O-N 3.2Å; N396-S400 WeakPolarHBondContact O-CB 3.27Å; N396-S400 PolarHBondContact O-N 3.4Å; N396-S400 PolarHBondContact O-OG 3.36Å; N396-W406 PolarHBondContact ND2-O 2.04Å; N396-W406 VanDerWaalsContact ND2-O 3.16Å; N396-W406 PolarHBondContact OD1-N 3.02Å
397	A	93.5	Very high	94.4	Very high	65 Å²	65	41.9 Å²	41.9	54%	0.537	22%	0.224	S	C	.	.	H	α-helix	trans	-64	-37.3	172.8	0	0	0	0	0	113	M393 S394 L395	M393-A397 WeakPolarHBondContact O-CB 3.25Å; M393-A397 PolarHBondContact O-N 2.85Å; S394-A397 PolarHBondContact O-N 2.79Å; L395-A397 VanDerWaalsContact C-N 3.33Å; L395-A397 PolarHBondContact O-N 3.02Å
398	A	93.5	Very high	94.4	Very high	2 Å²	2	42 Å²	42	2%	0.017	23%	0.226	C	C	.	.	H	α-helix	trans	-70.7	-42.3	178.7	0	0	0	0	0	113.1	S394 L395 N396 K401 Y402 V576 Y660	S394-A398 WeakPolarHBondContact O-CB 3.43Å; S394-A398 PolarHBondContact O-N 3.48Å; L395-A398 PolarHBondContact O-N 2.67Å; N396-A398 PolarHBondContact O-N 3.2Å; A398-K401 WeakPolarHBondContact O-CE 3.41Å; A398-K401 WeakPolarHBondContact O-CG 3.3Å; A398-Y402 WeakPolarHBondContact O-CD2 3.4Å; A398-Y402 WeakPolarHBondContact O-CE2 3.36Å; A398-V576 HydrophobicContact CB-CG1 3.76Å; A398-V576 HydrophobicContact CB-CG2 3.92Å; A398-Y660 HydrophobicContact CB-CE2 4.16Å
399	F	95.5	Very high	94.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-94.7	-31.6	-173	-75	-85.4	0	0	0	115	L395 K401 Y402 I404 W406 V576 L579 L583 F672 M680	L395-F399 HydrophobicContact CD1-CD2 3.65Å; L395-F399 HydrophobicContact CD1-CE2 3.51Å; L395-F399 HydrophobicContact CG-CD2 4.24Å; L395-F399 WeakPolarHBondContact O-CD2 3.49Å; L395-F399 PolarHBondContact O-N 2.03Å; L395-F399 VanDerWaalsContact O-N 3.11Å; F399-K401 VanDerWaalsContact C-N 3.29Å; F399-K401 PolarHBondContact O-N 2.96Å; F399-Y402 WeakPolarHBondContact O-CA 3.33Å; F399-Y402 WeakPolarHBondContact O-CB 3.14Å; F399-Y402 PolarHBondContact O-N 2.97Å; F399-I404 CarbonylContact C-O 3.46Å; F399-I404 HydrophobicContact CB-CB 4.27Å; F399-I404 HydrophobicContact CB-CG2 4.31Å; F399-I404 VanDerWaalsContact CB-O 3.28Å; F399-I404 WeakPolarHBondContact CB-O 3.48Å; F399-I404 HydrophobicContact CD1-CB 4.4Å; F399-I404 HydrophobicContact CD1-CG2 4.19Å; F399-I404 PolarHBondContact O-N 3.32Å; F399-W406 AromaticContact CD2-NE1 3.4Å; F399-W406 AromaticContact CE2-NE1 3.94Å; F399-W406 AromaticContact CG-NE1 3.49Å; F399-V576 HydrophobicContact CE2-CG1 3.91Å; F399-V576 HydrophobicContact CZ-CG1 4.36Å; F399-L579 HydrophobicContact CE2-CB 4.21Å; F399-L579 HydrophobicContact CZ-CB 4.02Å; F399-L583 HydrophobicContact CD1-CD1 4.35Å; F399-L583 HydrophobicContact CE1-CD1 3.66Å; F399-L583 HydrophobicContact CZ-CD1 4.31Å; F399-F672 HydrophobicContact CD1-CE2 4.26Å; F399-F672 AromaticContact CE1-CE2 3.71Å; F399-F672 HydrophobicContact CE1-CE2 3.71Å; F399-F672 HydrophobicContact CE1-CZ 4.14Å; F399-F672 HydrophobicContact CE2-CE2 4.39Å; F399-F672 AromaticContact CZ-CE2 3.79Å; F399-F672 HydrophobicContact CZ-CE2 3.79Å; F399-F672 AromaticContact CZ-CZ 3.9Å; F399-F672 HydrophobicContact CZ-CZ 3.9Å; F399-M680 HydrophobicContact CD1-SD 4.3Å; F399-M680 HydrophobicContact CE1-CE 3.74Å; F399-M680 HydrophobicContact CE1-SD 3.84Å; F399-M680 HydrophobicContact CZ-CE 4.45Å
400	S	93.9	Very high	94.4	Very high	63 Å²	63	44.9 Å²	44.9	44%	0.441	25%	0.246	S	C	.	.	H	α-helix	trans	-62.8	-32.3	-171.2	58.7	0	0	0	0	114.2	N396 Y402 N403 I404	N396-S400 WeakPolarHBondContact O-CB 3.27Å; N396-S400 PolarHBondContact O-N 3.4Å; N396-S400 PolarHBondContact O-OG 3.36Å; S400-Y402 PolarHBondContact O-N 2.86Å; S400-Y402 VanDerWaalsContact O-N 3.07Å; S400-N403 PolarHBondContact O-N 3.39Å; S400-I404 WeakPolarHBondContact CA-O 3.4Å; S400-I404 PolarHBondContact N-O 3.14Å; S400-I404 VanDerWaalsContact N-O 3.07Å
401	K	94	Very high	94.3	Very high	105 Å²	105	44 Å²	44	46%	0.457	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-14.3	171.1	54.7	166.4	167.9	164	0	114.3	A398 F399 N670	A398-K401 WeakPolarHBondContact O-CE 3.41Å; A398-K401 WeakPolarHBondContact O-CG 3.3Å; F399-K401 VanDerWaalsContact C-N 3.29Å; F399-K401 PolarHBondContact O-N 2.96Å; K401-N670 PolarHBondContact NZ-O 2.94Å
402	Y	94.2	Very high	94.1	Very high	41 Å²	41	49.6 Å²	49.6	16%	0.161	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	24.5	177.2	-52.5	-60	0	0	0	112.3	A398 F399 S400 I404 H671 F672 V677 H681	A398-Y402 WeakPolarHBondContact O-CD2 3.4Å; A398-Y402 WeakPolarHBondContact O-CE2 3.36Å; F399-Y402 WeakPolarHBondContact O-CA 3.33Å; F399-Y402 WeakPolarHBondContact O-CB 3.14Å; F399-Y402 PolarHBondContact O-N 2.97Å; S400-Y402 PolarHBondContact O-N 2.86Å; S400-Y402 VanDerWaalsContact O-N 3.07Å; Y402-I404 PolarHBondContact O-N 2.58Å; Y402-I404 VanDerWaalsContact O-N 3.08Å; Y402-H671 WeakPolarHBondContact OH-CA 3.32Å; Y402-H671 WeakPolarHBondContact OH-CB 3.5Å; Y402-F672 HydrophobicContact CD2-CD2 4.14Å; Y402-F672 HydrophobicContact CE2-CB 4.17Å; Y402-F672 AromaticContact CE2-CD2 3.74Å; Y402-F672 HydrophobicContact CE2-CD2 3.74Å; Y402-F672 HydrophobicContact CE2-CG 4.44Å; Y402-F672 PolarHBondContact OH-N 3.23Å; Y402-F672 PolarHBondContact OH-O 3.3Å; Y402-F672 VanDerWaalsContact OH-O 3.13Å; Y402-V677 HydrophobicContact CD1-CG1 4.32Å; Y402-V677 HydrophobicContact CD1-CG2 3.52Å; Y402-V677 HydrophobicContact CD2-CG2 4.04Å; Y402-V677 HydrophobicContact CE1-CG2 3.86Å; Y402-V677 HydrophobicContact CE2-CG2 4.37Å; Y402-V677 HydrophobicContact CG-CG1 4.34Å; Y402-V677 HydrophobicContact CG-CG2 3.59Å; Y402-H681 PolarHBondContact O-NE2 3.07Å
403	N	93.1	Very high	93.7	Very high	74 Å²	74	50 Å²	50	40%	0.396	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	17.4	-178.5	-71.2	-14.6	0	0	0	114.9	R361 P363 K364 S400	R361-N403 WeakPolarHBondContact O-CB 3.42Å; R361-N403 PolarHBondContact O-ND2 3.42Å; P363-N403 CarbonylContact C-O 3.51Å; P363-N403 WeakPolarHBondContact CA-O 3.33Å; K364-N403 PolarHBondContact N-O 3.12Å; S400-N403 PolarHBondContact O-N 3.39Å
404	I	93.1	Very high	93.1	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	129.7	172.1	-61.8	175.7	0	0	0	108	K364 L366 F399 S400 Y402 M680	K364-I404 WeakPolarHBondContact O-CA 3.4Å; L366-I404 HydrophobicContact CD1-CG2 3.93Å; F399-I404 CarbonylContact C-O 3.46Å; F399-I404 HydrophobicContact CB-CB 4.27Å; F399-I404 HydrophobicContact CB-CG2 4.31Å; F399-I404 VanDerWaalsContact CB-O 3.28Å; F399-I404 WeakPolarHBondContact CB-O 3.48Å; F399-I404 HydrophobicContact CD1-CB 4.4Å; F399-I404 HydrophobicContact CD1-CG2 4.19Å; F399-I404 PolarHBondContact O-N 3.32Å; S400-I404 WeakPolarHBondContact CA-O 3.4Å; S400-I404 PolarHBondContact N-O 3.14Å; S400-I404 VanDerWaalsContact N-O 3.07Å; Y402-I404 PolarHBondContact O-N 2.58Å; Y402-I404 VanDerWaalsContact O-N 3.08Å; I404-M680 HydrophobicContact CD1-CB 3.9Å; I404-M680 HydrophobicContact CD1-SD 4.28Å
405	S	94.7	Very high	92.4	Very high	32 Å²	32	48.4 Å²	48.4	22%	0.224	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	157.9	179.3	54.8	0	0	0	0	110.4	K364 V365 L366	K364-S405 PolarHBondContact O-N 2.94Å; K364-S405 PolarHBondContact O-OG 2.66Å; V365-S405 CarbonylContact C-O 3.49Å; V365-S405 WeakPolarHBondContact CA-O 3.23Å; L366-S405 PolarHBondContact N-O 3Å
406	W	94.6	Very high	91.4	Very high	8 Å²	8	51.3 Å²	51.3	3%	0.03	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	136.3	-170.9	-63.2	94.5	0	0	0	111	L366 Y368 H392 L395 N396 F399 L528 L579 L583	L366-W406 HydrophobicContact CB-CD2 4.25Å; L366-W406 HydrophobicContact CB-CE3 3.61Å; L366-W406 HydrophobicContact CB-CH2 4.33Å; L366-W406 HydrophobicContact CB-CZ3 3.67Å; L366-W406 HydrophobicContact CD1-CE3 4.42Å; L366-W406 HydrophobicContact CD1-CH2 3.73Å; L366-W406 HydrophobicContact CD1-CZ2 4.01Å; L366-W406 HydrophobicContact CD1-CZ3 3.94Å; L366-W406 HydrophobicContact CG-CZ3 4.47Å; L366-W406 CarbonylContact O-C 3.28Å; L366-W406 VanDerWaalsContact O-CA 3.29Å; L366-W406 WeakPolarHBondContact O-CA 3.12Å; Y368-W406 HydrophobicContact CD1-CB 3.83Å; Y368-W406 HydrophobicContact CD1-CE3 4.22Å; Y368-W406 HydrophobicContact CE1-CB 3.93Å; Y368-W406 HydrophobicContact CG-CE3 4.28Å; H392-W406 PolarHBondContact CE1-O 3.29Å; H392-W406 VanDerWaalsContact CE1-O 3.29Å; L395-W406 HydrophobicContact CD2-CB 3.91Å; L395-W406 HydrophobicContact CD2-CD2 4.13Å; L395-W406 HydrophobicContact CD2-CG 3.63Å; L395-W406 HydrophobicContact CG-CG 4.08Å; N396-W406 PolarHBondContact ND2-O 2.04Å; N396-W406 VanDerWaalsContact ND2-O 3.16Å; N396-W406 PolarHBondContact OD1-N 3.02Å; F399-W406 AromaticContact CD2-NE1 3.4Å; F399-W406 AromaticContact CE2-NE1 3.94Å; F399-W406 AromaticContact CG-NE1 3.49Å; W406-L528 HydrophobicContact CH2-CD2 3.99Å; W406-L528 HydrophobicContact CZ3-CB 4.33Å; W406-L528 HydrophobicContact CZ3-CD2 4.06Å; W406-L579 HydrophobicContact CD2-CD2 4.25Å; W406-L579 HydrophobicContact CE3-CD2 4.48Å; W406-L579 HydrophobicContact CH2-CD2 3.88Å; W406-L579 HydrophobicContact CH2-CG 4.16Å; W406-L579 HydrophobicContact CZ2-CB 4.36Å; W406-L579 HydrophobicContact CZ2-CD2 3.61Å; W406-L579 HydrophobicContact CZ2-CG 4.08Å; W406-L579 HydrophobicContact CZ3-CD2 4.31Å; W406-L583 HydrophobicContact CZ2-CD1 4.01Å
407	Q	94.6	Very high	90.7	Very high	88 Å²	88	53 Å²	53	41%	0.411	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	117.3	170.1	-177.3	-177.9	32.2	0	0	108.5	V365 L366 Y368 A693	V365-Q407 HydrophobicContact CG1-CB 4.33Å; L366-Q407 PolarHBondContact O-N 2.73Å; Y368-Q407 WeakPolarHBondContact CD1-O 3.05Å; Y368-Q407 PolarHBondContact N-O 3.12Å; Y368-Q407 VanDerWaalsContact O-O 3.1Å; Q407-A693 HydrophobicContact CB-CB 4.46Å; Q407-A693 VanDerWaalsContact OE1-CB 3.29Å
408	L	95	Very high	90.4	Very high	38 Å²	38	50.5 Å²	50.5	20%	0.199	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	144.1	178.6	173.5	62	0	0	0	112	Y368 V370 I388 H392 V410	Y368-L408 HydrophobicContact CD1-CB 4.48Å; Y368-L408 VanDerWaalsContact CE1-CA 3.47Å; Y368-L408 HydrophobicContact CE1-CB 3.63Å; Y368-L408 HydrophobicContact CE1-CD1 4.03Å; Y368-L408 HydrophobicContact CE1-CG 4.41Å; Y368-L408 HydrophobicContact CE2-CD1 3.93Å; Y368-L408 CarbonylContact O-C 3.46Å; V370-L408 HydrophobicContact CB-CD1 4.22Å; V370-L408 HydrophobicContact CG2-CD1 3.67Å; I388-L408 HydrophobicContact CG2-CD1 4.38Å; I388-L408 HydrophobicContact CG2-CD2 3.6Å; H392-L408 HydrophobicContact CB-CD2 4.44Å; L408-V410 HydrophobicContact CD1-CG2 4.08Å; L408-V410 HydrophobicContact CD2-CG2 4.06Å; L408-V410 HydrophobicContact CG-CG2 4.12Å
409	T	94.9	Very high	90	Very high	72 Å²	72	53.5 Å²	53.5	44%	0.442	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	135	157.4	-60.2	0	0	0	0	108.4	Y368 K369 V370 V411	Y368-T409 PolarHBondContact O-N 2.85Å; K369-T409 CarbonylContact C-O 3.57Å; K369-T409 WeakPolarHBondContact CA-O 3.38Å; K369-T409 WeakPolarHBondContact CB-O 3.34Å; V370-T409 PolarHBondContact N-O 3.46Å; T409-V411 HydrophobicContact CG2-CG2 4.47Å
410	V	95	Very high	89.5	Confident	62 Å²	62	56.7 Å²	56.7	38%	0.376	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	131.9	174.6	-174.4	0	0	0	0	108.5	I388 L408 E412	I388-V410 HydrophobicContact CD1-CG1 4.33Å; I388-V410 HydrophobicContact CD1-CG2 4.46Å; I388-V410 HydrophobicContact CG2-CG2 4.22Å; L408-V410 HydrophobicContact CD1-CG2 4.08Å; L408-V410 HydrophobicContact CD2-CG2 4.06Å; L408-V410 HydrophobicContact CG-CG2 4.12Å; V410-E412 HydrophobicContact CG1-CG 3.97Å
411	V	92.3	Very high	89.2	Confident	44 Å²	44	55 Å²	55	27%	0.267	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	103.2	177.3	-177.6	0	0	0	0	107.3	K369 V370 V371 N372 T409 M413	K369-V411 HydrophobicContact CB-CG2 4.33Å; K369-V411 HydrophobicContact CD-CG2 4.33Å; V370-V411 PolarHBondContact O-N 2.8Å; V371-V411 WeakPolarHBondContact CA-O 3.36Å; N372-V411 PolarHBondContact N-O 3.12Å; T409-V411 HydrophobicContact CG2-CG2 4.47Å; V411-M413 HydrophobicContact CG1-CG 3.98Å; V411-M413 HydrophobicContact CG1-SD 4.18Å
412	E	91.4	Very high	89	Confident	119 Å²	119	53.5 Å²	53.5	56%	0.556	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	131	178.4	-60.4	-172.6	149.7	0	0	110.1	N372 L374 V410	N372-E412 WeakPolarHBondContact O-CA 3.37Å; L374-E412 HydrophobicContact CD1-CB 4.07Å; L374-E412 HydrophobicContact CD2-CB 4.28Å; L374-E412 HydrophobicContact CG-CB 4.16Å; V410-E412 HydrophobicContact CG1-CG 3.97Å
413	M	87.3	Confident	88.7	Confident	50 Å²	50	51.6 Å²	51.6	25%	0.246	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	134.2	-175.9	-56.1	179.4	71.1	0	0	112	V371 N372 L373 L374 V411 V415 L520 V522	V371-M413 HydrophobicContact CG1-SD 3.93Å; N372-M413 PolarHBondContact O-N 3.3Å; L373-M413 WeakPolarHBondContact CA-O 3.49Å; L373-M413 HydrophobicContact CD2-CB 4.14Å; L374-M413 PolarHBondContact N-O 3.28Å; V411-M413 HydrophobicContact CG1-CG 3.98Å; V411-M413 HydrophobicContact CG1-SD 4.18Å; M413-V415 HydrophobicContact CB-CG2 3.67Å; M413-V415 HydrophobicContact CE-CG2 3.95Å; M413-L520 WeakPolarHBondContact CE-O 3.47Å; M413-V522 HydrophobicContact SD-CG2 4.01Å
414	S	83.2	Confident	88.2	Confident	79 Å²	79	48.3 Å²	48.3	55%	0.552	27%	0.265	S	S	*	.			trans	-99.8	79.7	174	-169.5	0	0	0	0	110	G416	S414-G416 PolarHBondContact O-N 3.35Å
415	V	75.8	Confident	87.3	Confident	36 Å²	36	53.5 Å²	53.5	22%	0.218	29%	0.288	C	S	.	.			trans	-100.7	74.1	-173.7	-165.1	0	0	0	0	110.9	L373 M413 R417 L418 T519	L373-V415 HydrophobicContact CD2-CB 4.25Å; L373-V415 HydrophobicContact CD2-CG2 3.99Å; M413-V415 HydrophobicContact CB-CG2 3.67Å; M413-V415 HydrophobicContact CE-CG2 3.95Å; V415-R417 PolarHBondContact O-N 3.16Å; V415-L418 HydrophobicContact CB-CD2 4.42Å; V415-L418 HydrophobicContact CG1-CD2 4.19Å; V415-L418 WeakPolarHBondContact O-CB 3.3Å; V415-L418 PolarHBondContact O-N 3.1Å; V415-L418 VanDerWaalsContact O-N 3.1Å; V415-T519 HydrophobicContact CG1-CG2 3.79Å
416	G	74.2	Confident	86	Confident	61 Å²	61	53 Å²	53	63%	0.629	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	-131.5	175.3	0	0	0	0	0	113.4	S414	S414-G416 PolarHBondContact O-N 3.35Å
417	R	80.9	Confident	85.2	Confident	75 Å²	75	52.8 Å²	52.8	28%	0.283	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	16.8	174.4	-64.5	-174.6	66.1	162	-4.8	113.1	V415 R419 L420 E491	V415-R417 PolarHBondContact O-N 3.16Å; R417-R419 PolarHBondContact O-N 3.4Å; R417-R419 VanDerWaalsContact O-N 3.16Å; R417-L420 PolarHBondContact O-N 2.83Å; R417-E491 IonicContact CZ-OE2 3.37Å; R417-E491 IonicContact NH1-OE2 3.82Å; R417-E491 PolarHBondContact NH1-OE2 3.37Å
418	L	86.8	Confident	84.4	Confident	12 Å²	12	49.7 Å²	49.7	6%	0.063	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-55.8	-37.1	-173.5	-173.8	66.3	0	0	0	112.7	L373 V415 L420 K421 V511 Y516 T519 L520	L373-L418 HydrophobicContact CD1-CB 4.33Å; L373-L418 HydrophobicContact CD1-CD2 4.23Å; L373-L418 HydrophobicContact CD1-CG 4.3Å; V415-L418 HydrophobicContact CB-CD2 4.42Å; V415-L418 HydrophobicContact CG1-CD2 4.19Å; V415-L418 WeakPolarHBondContact O-CB 3.3Å; V415-L418 PolarHBondContact O-N 3.1Å; V415-L418 VanDerWaalsContact O-N 3.1Å; L418-L420 PolarHBondContact O-N 3.27Å; L418-L420 VanDerWaalsContact O-N 3.09Å; L418-K421 PolarHBondContact O-N 2.87Å; L418-K421 VanDerWaalsContact O-N 3.14Å; L418-V511 HydrophobicContact CD1-CG2 4.39Å; L418-Y516 HydrophobicContact CD1-CD2 3.78Å; L418-Y516 HydrophobicContact CD1-CE2 4.29Å; L418-Y516 HydrophobicContact CD2-CD2 4.04Å; L418-Y516 HydrophobicContact CD2-CE2 3.99Å; L418-Y516 HydrophobicContact CG-CD2 3.82Å; L418-Y516 HydrophobicContact CG-CE2 3.8Å; L418-T519 HydrophobicContact CD1-CG2 4.41Å; L418-T519 HydrophobicContact CD2-CG2 3.93Å; L418-L520 HydrophobicContact CD2-CD2 3.9Å; L418-L520 HydrophobicContact CD2-CG 4.36Å
419	R	84.8	Confident	83.7	Confident	64 Å²	64	48.8 Å²	48.8	24%	0.242	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-62.1	-13	177.8	79.4	-170	-152.5	113.9	12.4	115.4	L373 D375 Q380 R417	L373-R419 HydrophobicContact CB-CB 3.86Å; L373-R419 HydrophobicContact CD1-CB 3.87Å; D375-R419 VanDerWaalsContact CG-NH2 3.33Å; D375-R419 IonicContact OD2-CZ 2.85Å; D375-R419 IonicContact OD2-NE 3.24Å; D375-R419 PolarHBondContact OD2-NE 3.5Å; D375-R419 IonicContact OD2-NH2 3.96Å; D375-R419 PolarHBondContact OD2-NH2 2.77Å; Q380-R419 PolarHBondContact O-NH1 2.02Å; Q380-R419 VanDerWaalsContact O-NH1 3.09Å; R417-R419 PolarHBondContact O-N 3.4Å; R417-R419 VanDerWaalsContact O-N 3.16Å
420	L	85.4	Confident	82.9	Confident	68 Å²	68	48.8 Å²	48.8	36%	0.356	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-105.5	-0.1	-179.4	-58.2	176.5	0	0	0	112.8	R417 L418 T497	R417-L420 PolarHBondContact O-N 2.83Å; L418-L420 PolarHBondContact O-N 3.27Å; L418-L420 VanDerWaalsContact O-N 3.09Å; L420-T497 HydrophobicContact CB-CG2 3.98Å; L420-T497 HydrophobicContact CD1-CG2 4.23Å
421	K	89	Confident	82	Confident	27 Å²	27	47 Å²	47	12%	0.117	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-92.8	140.1	178.9	-59.1	-164.5	177	-162.3	0	110.3	L418 P506 R508 A509 V511	L418-K421 PolarHBondContact O-N 2.87Å; L418-K421 VanDerWaalsContact O-N 3.14Å; K421-P506 WeakPolarHBondContact CE-O 3.21Å; K421-P506 PolarHBondContact NZ-O 2.93Å; K421-R508 WeakPolarHBondContact CD-O 3.4Å; K421-R508 WeakPolarHBondContact CE-O 2.98Å; K421-R508 PolarHBondContact NZ-O 3.39Å; K421-A509 WeakPolarHBondContact CA-O 3.5Å; K421-V511 HydrophobicContact CB-CB 4.22Å; K421-V511 HydrophobicContact CB-CG1 3.95Å; K421-V511 HydrophobicContact CD-CB 4.23Å
422	K	89.2	Confident	81.4	Confident	74 Å²	74	45 Å²	45	32%	0.322	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	139.5	173.4	-53.4	-160.9	-179.6	-161.8	0	111.1	I445 A509 Y510 V511 E534	K422-I445 HydrophobicContact CB-CD1 3.73Å; K422-I445 HydrophobicContact CD-CD1 3.94Å; K422-I445 HydrophobicContact CG-CD1 3.85Å; K422-A509 PolarHBondContact N-O 3.31Å; K422-Y510 VanDerWaalsContact O-CA 3.3Å; K422-Y510 WeakPolarHBondContact O-CA 3.44Å; K422-V511 PolarHBondContact O-N 3.26Å; K422-E534 CarbonylContact C-O 3.54Å; K422-E534 VanDerWaalsContact CA-O 3.31Å; K422-E534 WeakPolarHBondContact CA-O 3.38Å; K422-E534 HydrophobicContact CD-CB 4.48Å; K422-E534 WeakPolarHBondContact CE-OE2 3.42Å; K422-E534 HydrophobicContact CG-CB 4.15Å; K422-E534 IonicContact NZ-OE2 2.67Å; K422-E534 PolarHBondContact NZ-OE2 2.72Å
423	V	87.9	Confident	80.6	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.8	175.7	178.1	0	0	0	0	109.3	V511 I513 V533 E534 W535 S536	V423-V511 WeakPolarHBondContact CA-O 3.31Å; V423-V511 HydrophobicContact CG2-CG1 4.03Å; V423-I513 HydrophobicContact CG1-CB 3.91Å; V423-I513 HydrophobicContact CG1-CD1 4.34Å; V423-V533 HydrophobicContact CG2-CB 3.81Å; V423-V533 HydrophobicContact CG2-CG1 3.79Å; V423-E534 PolarHBondContact N-O 2.98Å; V423-W535 HydrophobicContact CB-CE3 4.02Å; V423-W535 HydrophobicContact CB-CZ3 4.22Å; V423-W535 HydrophobicContact CG1-CE3 3.89Å; V423-W535 HydrophobicContact CG1-CZ3 3.63Å; V423-S536 WeakPolarHBondContact O-CB 3.26Å; V423-S536 PolarHBondContact O-N 3.09Å; V423-S536 PolarHBondContact O-OG 2.84Å
424	V	83.1	Confident	80.1	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.024	24%	0.24	C	C	.	.			trans	-100.3	114.8	168.9	-173	0	0	0	0	107.1	G426 C427 H443 I445 T446 V511	V424-G426 PolarHBondContact O-N 2.6Å; V424-C427 HydrophobicContact CB-CB 4.13Å; V424-C427 HydrophobicContact CG1-CB 3.57Å; V424-H443 HydrophobicContact CG1-CB 4.29Å; V424-I445 HydrophobicContact CG2-CG2 3.69Å; V424-T446 HydrophobicContact CG2-CG2 4.05Å; V424-V511 PolarHBondContact N-O 3.35Å; V424-V511 VanDerWaalsContact N-O 3.08Å
425	F	72.9	Confident	79.8	Confident	109 Å²	109	45.9 Å²	45.9	48%	0.478	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	128.8	-176	-172.6	-94.4	0	0	0	110.6	C427 W535 M540 L543	F425-C427 VanDerWaalsContact C-N 3.26Å; F425-C427 PolarHBondContact O-N 3.29Å; F425-W535 HydrophobicContact CB-CZ3 4.33Å; F425-W535 HydrophobicContact CD2-CH2 4.46Å; F425-W535 HydrophobicContact CD2-CZ3 4.08Å; F425-M540 HydrophobicContact CB-CE 3.76Å; F425-M540 HydrophobicContact CD2-CE 4.18Å; F425-M540 HydrophobicContact CG-CE 4Å; F425-L543 HydrophobicContact CD2-CD2 4.4Å; F425-L543 HydrophobicContact CE2-CD2 3.8Å
426	G	67.9	Low	79.8	Confident	21 Å²	21	48.2 Å²	48.2	22%	0.216	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	-13.7	179.4	0	0	0	0	0	116.5	V424 Y765	V424-G426 PolarHBondContact O-N 2.6Å; G426-Y765 WeakPolarHBondContact CA-OH 3.09Å; G426-Y765 PolarHBondContact O-OH 3.26Å
427	C	77.3	Confident	80.1	Confident	4 Å²	4	45.8 Å²	45.8	3%	0.027	23%	0.232	C	C	.	.			trans	-94.3	118.2	178.2	-179.7	0	0	0	0	111.4	V424 F425 I432 C441 S512	V424-C427 HydrophobicContact CB-CB 4.13Å; V424-C427 HydrophobicContact CG1-CB 3.57Å; F425-C427 VanDerWaalsContact C-N 3.26Å; F425-C427 PolarHBondContact O-N 3.29Å; C427-I432 VanDerWaalsContact SG-CD1 3.5Å; C427-I432 WeakPolarHBondContact SG-CG1 3.39Å; C427-C441 VanDerWaalsContact CA-SG 3.55Å; C427-C441 HydrophobicContact CB-CB 4.03Å; C427-C441 WeakPolarHBondContact CB-SG 3.36Å; C427-C441 WeakPolarHBondContact SG-CA 3.29Å; C427-C441 WeakPolarHBondContact SG-CB 3.01Å; C427-C441 CovalentContact SG-SG 2.04Å; C427-C441 PolarHBondContact SG-SG 2.65Å; C427-S512 WeakPolarHBondContact O-CB 2.96Å
428	D	78.2	Confident	79.8	Confident	24 Å²	24	42.7 Å²	42.7	13%	0.128	22%	0.221	C	C	.	.			trans	-83.8	144.8	169.7	-172.8	-93.3	0	0	0	111.3	S430 K431 S763	D428-S430 PolarHBondContact O-N 2.04Å; D428-S430 VanDerWaalsContact O-N 3.16Å; D428-S430 WeakPolarHBondContact OD1-CB 3.35Å; D428-S430 PolarHBondContact OD1-N 3.16Å; D428-S430 PolarHBondContact OD1-OG 3.03Å; D428-K431 WeakPolarHBondContact O-CB 3.4Å; D428-K431 PolarHBondContact O-N 3.23Å; D428-K431 VanDerWaalsContact O-N 3.12Å; D428-S763 PolarHBondContact OD1-OG 3.2Å
429	S	79.6	Confident	79.3	Confident	19 Å²	19	44.8 Å²	44.8	13%	0.133	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.7	-177	64.9	0	0	0	0	114.8	P503	S429-P503 VanDerWaalsContact O-CB 3.3Å; S429-P503 WeakPolarHBondContact O-CB 3.48Å
430	S	78.6	Confident	78.6	Confident	72 Å²	72	43.4 Å²	43.4	50%	0.503	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-11.3	176.4	67.4	0	0	0	0	114.7	D428 S763	D428-S430 PolarHBondContact O-N 2.04Å; D428-S430 VanDerWaalsContact O-N 3.16Å; D428-S430 WeakPolarHBondContact OD1-CB 3.35Å; D428-S430 PolarHBondContact OD1-N 3.16Å; D428-S430 PolarHBondContact OD1-OG 3.03Å; S430-S763 PolarHBondContact OG-OG 3.4Å
431	K	77	Confident	78.4	Confident	23 Å²	23	40.1 Å²	40.1	10%	0.1	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-35.9	171	-73.5	-176.6	171.5	-177.6	0	111.9	D428 G433 N434 D438 E440	D428-K431 WeakPolarHBondContact O-CB 3.4Å; D428-K431 PolarHBondContact O-N 3.23Å; D428-K431 VanDerWaalsContact O-N 3.12Å; K431-G433 PolarHBondContact O-N 3.14Å; K431-G433 VanDerWaalsContact O-N 3.14Å; K431-N434 VanDerWaalsContact O-CB 3.25Å; K431-N434 WeakPolarHBondContact O-CB 3.23Å; K431-N434 PolarHBondContact O-N 3.09Å; K431-N434 VanDerWaalsContact O-N 3.13Å; K431-N434 PolarHBondContact O-ND2 2.99Å; K431-N434 VanDerWaalsContact O-ND2 3.12Å; K431-N434 PolarHBondContact O-OD1 3.02Å; K431-D438 HydrophobicContact CB-CB 4.31Å; K431-D438 VanDerWaalsContact CB-OD2 3.27Å; K431-D438 WeakPolarHBondContact CB-OD2 3Å; K431-D438 HydrophobicContact CD-CB 4.33Å; K431-D438 WeakPolarHBondContact CG-OD2 3Å; K431-E440 HydrophobicContact CD-CG 4.48Å; K431-E440 IonicContact NZ-OE1 2.75Å; K431-E440 PolarHBondContact NZ-OE1 3.15Å
432	I	79.4	Confident	78.1	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.021	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	113.5	-174.9	-61.6	164.9	0	0	0	111.6	C427 C441 T446 D449 N450 P503 Y510	C427-I432 VanDerWaalsContact SG-CD1 3.5Å; C427-I432 WeakPolarHBondContact SG-CG1 3.39Å; I432-C441 HydrophobicContact CG1-CB 4.11Å; I432-T446 HydrophobicContact CD1-CG2 3.49Å; I432-T446 VanDerWaalsContact CD1-CG2 3.49Å; I432-T446 HydrophobicContact CG1-CG2 4.25Å; I432-D449 WeakPolarHBondContact CA-OD1 3.47Å; I432-N450 HydrophobicContact CG2-CB 3.71Å; I432-P503 WeakPolarHBondContact O-CG 3.37Å; I432-Y510 HydrophobicContact CD1-CD2 3.72Å; I432-Y510 HydrophobicContact CD1-CE1 4.21Å; I432-Y510 HydrophobicContact CD1-CE2 3.18Å; I432-Y510 HydrophobicContact CD1-CG 4.46Å; I432-Y510 VanDerWaalsContact CD1-CZ 3.45Å; I432-Y510 WeakPolarHBondContact CG2-OH 3.35Å
433	G	74.2	Confident	77.7	Confident	27 Å²	27	41.6 Å²	41.6	28%	0.278	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	20.9	-179.3	0	0	0	0	0	114.1	K431 K435 D452	K431-G433 PolarHBondContact O-N 3.14Å; K431-G433 VanDerWaalsContact O-N 3.14Å; G433-K435 VanDerWaalsContact C-N 3.28Å; G433-D452 WeakPolarHBondContact CA-OD2 3.49Å; G433-D452 PolarHBondContact N-OD2 3.49Å
434	N	77.8	Confident	77.4	Confident	66 Å²	66	46.8 Å²	46.8	35%	0.353	26%	0.255	S	S	.	.	S	Bend	trans	-80.3	-4.5	177.3	70.1	7.5	0	0	0	113.8	K431 Q436 D438 D452	K431-N434 VanDerWaalsContact O-CB 3.25Å; K431-N434 WeakPolarHBondContact O-CB 3.23Å; K431-N434 PolarHBondContact O-N 3.09Å; K431-N434 VanDerWaalsContact O-N 3.13Å; K431-N434 PolarHBondContact O-ND2 2.99Å; K431-N434 VanDerWaalsContact O-ND2 3.12Å; K431-N434 PolarHBondContact O-OD1 3.02Å; N434-Q436 WeakPolarHBondContact OD1-CA 3.28Å; N434-Q436 WeakPolarHBondContact OD1-CB 3.38Å; N434-Q436 PolarHBondContact OD1-N 2.69Å; N434-Q436 PolarHBondContact OD1-O 3.19Å; N434-D438 PolarHBondContact ND2-OD2 2.62Å; N434-D452 PolarHBondContact N-OD2 3.32Å
435	K	75.5	Confident	77.5	Confident	173 Å²	173	47.7 Å²	47.7	75%	0.752	26%	0.26	S	S	*	.	S	Bend	trans	75.8	17.5	-174.3	-50.7	-175.2	177.3	-168.8	0	115.8	G433 D452	G433-K435 VanDerWaalsContact C-N 3.28Å; K435-D452 VanDerWaalsContact CA-CG 3.48Å; K435-D452 WeakPolarHBondContact CA-OD1 3.46Å; K435-D452 WeakPolarHBondContact CA-OD2 3.21Å; K435-D452 PolarHBondContact N-OD2 3.12Å
436	Q	75.3	Confident	78.1	Confident	85 Å²	85	42.5 Å²	42.5	40%	0.397	24%	0.237	S	C	.	.	S	Bend	trans	-128.2	121.6	175.2	177	170.7	2	0	0	107.9	N434 D438 D449	N434-Q436 WeakPolarHBondContact OD1-CA 3.28Å; N434-Q436 WeakPolarHBondContact OD1-CB 3.38Å; N434-Q436 PolarHBondContact OD1-N 2.69Å; N434-Q436 PolarHBondContact OD1-O 3.19Å; Q436-D438 PolarHBondContact O-N 3.41Å; Q436-D449 VanDerWaalsContact O-OD2 3.09Å
437	C	82	Confident	78.7	Confident	10 Å²	10	42.2 Å²	42.2	7%	0.068	23%	0.234	C	C	.	.			trans	-66.9	95.2	-177.8	171.6	0	0	0	0	111.5	D449 C453 F1573	C437-D449 WeakPolarHBondContact CA-OD2 3.39Å; C437-C453 WeakPolarHBondContact CA-SG 3.41Å; C437-C453 HydrophobicContact CB-CB 4Å; C437-C453 WeakPolarHBondContact CB-SG 3.14Å; C437-C453 WeakPolarHBondContact SG-CA 3.33Å; C437-C453 WeakPolarHBondContact SG-CB 3.15Å; C437-C453 CovalentContact SG-SG 2.04Å; C437-C453 PolarHBondContact SG-SG 2.93Å; C437-F1573 HydrophobicContact CB-CE2 4.33Å; C437-F1573 HydrophobicContact CB-CZ 4.22Å
438	D	74	Confident	79	Confident	10 Å²	10	44.2 Å²	44.2	5%	0.053	25%	0.248	C	C	.	.			trans	-84.1	111.1	177.3	-81.3	-47.5	0	0	0	109.3	K431 N434 Q436 E440 C441 L442 D449	K431-D438 HydrophobicContact CB-CB 4.31Å; K431-D438 VanDerWaalsContact CB-OD2 3.27Å; K431-D438 WeakPolarHBondContact CB-OD2 3Å; K431-D438 HydrophobicContact CD-CB 4.33Å; K431-D438 WeakPolarHBondContact CG-OD2 3Å; N434-D438 PolarHBondContact ND2-OD2 2.62Å; Q436-D438 PolarHBondContact O-N 3.41Å; D438-E440 VanDerWaalsContact C-N 3.28Å; D438-E440 HydrophobicContact CB-CG 4.46Å; D438-E440 PolarHBondContact O-N 2.76Å; D438-C441 HydrophobicContact CB-CB 4.12Å; D438-C441 CarbonylContact O-C 3.56Å; D438-C441 WeakPolarHBondContact O-CA 3.34Å; D438-C441 WeakPolarHBondContact O-CB 3.36Å; D438-C441 PolarHBondContact O-N 2.88Å; D438-L442 PolarHBondContact O-N 2.68Å; D438-D449 PolarHBondContact N-OD2 3.03Å
439	I	76.7	Confident	79.3	Confident	55 Å²	55	43 Å²	43	28%	0.282	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-66.5	-27.2	-169.8	56.1	93.5	0	0	0	113.6	C441 L442 F1609 L1612	I439-C441 VanDerWaalsContact C-N 3.27Å; I439-L442 WeakPolarHBondContact O-CB 3.04Å; I439-L442 PolarHBondContact O-N 3.09Å; I439-F1609 HydrophobicContact CG1-CE2 4.49Å; I439-L1612 HydrophobicContact CB-CD1 4.46Å; I439-L1612 HydrophobicContact CD1-CD1 3.45Å; I439-L1612 VanDerWaalsContact CD1-CD1 3.45Å; I439-L1612 HydrophobicContact CD1-CD2 4.06Å; I439-L1612 HydrophobicContact CD1-CG 4.26Å; I439-L1612 HydrophobicContact CG1-CD1 3.52Å
440	E	69.3	Low	79.4	Confident	35 Å²	35	42.2 Å²	42.2	16%	0.164	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-66.6	-27.5	169.1	53.5	-95.2	-137.5	0	0	112.8	K431 D438 Y765	K431-E440 HydrophobicContact CD-CG 4.48Å; K431-E440 IonicContact NZ-OE1 2.75Å; K431-E440 PolarHBondContact NZ-OE1 3.15Å; D438-E440 VanDerWaalsContact C-N 3.28Å; D438-E440 HydrophobicContact CB-CG 4.46Å; D438-E440 PolarHBondContact O-N 2.76Å; E440-Y765 HydrophobicContact CG-CE2 4.32Å; E440-Y765 WeakPolarHBondContact OE1-CE2 3.28Å
441	C	80.7	Confident	79.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-94	2.1	-179.4	-68	0	0	0	0	113	C427 I432 D438 I439 H443 T446 D449	C427-C441 VanDerWaalsContact CA-SG 3.55Å; C427-C441 HydrophobicContact CB-CB 4.03Å; C427-C441 WeakPolarHBondContact CB-SG 3.36Å; C427-C441 WeakPolarHBondContact SG-CA 3.29Å; C427-C441 WeakPolarHBondContact SG-CB 3.01Å; C427-C441 CovalentContact SG-SG 2.04Å; C427-C441 PolarHBondContact SG-SG 2.65Å; I432-C441 HydrophobicContact CG1-CB 4.11Å; D438-C441 HydrophobicContact CB-CB 4.12Å; D438-C441 CarbonylContact O-C 3.56Å; D438-C441 WeakPolarHBondContact O-CA 3.34Å; D438-C441 WeakPolarHBondContact O-CB 3.36Å; D438-C441 PolarHBondContact O-N 2.88Å; I439-C441 VanDerWaalsContact C-N 3.27Å; C441-H443 PolarHBondContact O-N 2.66Å; C441-T446 PolarHBondContact O-OG1 2.74Å; C441-D449 HydrophobicContact CB-CB 4.23Å; C441-D449 WeakPolarHBondContact CB-OD1 3.43Å; C441-D449 PolarHBondContact O-N 2.63Å
442	L	83.6	Confident	79.4	Confident	98 Å²	98	40.6 Å²	40.6	51%	0.513	23%	0.227	S	C	.	.			trans	-70.8	67.7	174	-172.7	63.9	0	0	0	112	D438 I439 C453	D438-L442 PolarHBondContact O-N 2.68Å; I439-L442 WeakPolarHBondContact O-CB 3.04Å; I439-L442 PolarHBondContact O-N 3.09Å; L442-C453 HydrophobicContact CD1-CB 3.54Å
443	H	79.9	Confident	79.5	Confident	33 Å²	33	41.2 Å²	41.2	15%	0.153	23%	0.232	C	C	.	.			trans	-125.5	143.5	-179.5	-160.1	-87.6	0	0	0	111.5	V424 C441 I445 T446 S448 S536	V424-H443 HydrophobicContact CG1-CB 4.29Å; C441-H443 PolarHBondContact O-N 2.66Å; H443-I445 VanDerWaalsContact C-N 3.27Å; H443-I445 WeakPolarHBondContact ND1-CG2 3.39Å; H443-I445 PolarHBondContact ND1-N 2.98Å; H443-I445 PolarHBondContact O-N 2.03Å; H443-T446 HydrophobicContact CB-CG2 4.34Å; H443-T446 PolarHBondContact O-N 3.1Å; H443-T446 VanDerWaalsContact O-N 3.17Å; H443-T446 PolarHBondContact O-OG1 3.16Å; H443-S448 PolarHBondContact O-N 3.44Å; H443-S536 PolarHBondContact CD2-OG 3.41Å; H443-S536 VanDerWaalsContact CE1-C 3.49Å; H443-S536 WeakPolarHBondContact CE1-CB 3.44Å; H443-S536 PolarHBondContact CE1-O 2.77Å; H443-S536 PolarHBondContact CE1-OG 3.28Å; H443-S536 WeakPolarHBondContact NE2-CB 3.31Å; H443-S536 PolarHBondContact NE2-O 2.86Å; H443-S536 PolarHBondContact NE2-OG 2.96Å
444	P	82.5	Confident	79.2	Confident	110 Å²	110	41.1 Å²	41.1	71%	0.714	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-55.7	-38.9	177	-29.7	36.4	0	0	0	114	T446 G447	P444-T446 VanDerWaalsContact C-N 3.29Å; P444-T446 PolarHBondContact O-N 3.25Å; P444-G447 PolarHBondContact O-N 3.18Å; P444-G447 VanDerWaalsContact O-N 3.13Å
445	I	85.2	Confident	78.6	Confident	24 Å²	24	39.7 Å²	39.7	12%	0.123	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-68.1	-22	-179.4	-150.7	-179.3	0	0	0	114.5	K422 V424 H443 G447 I501 A509 Y510	K422-I445 HydrophobicContact CB-CD1 3.73Å; K422-I445 HydrophobicContact CD-CD1 3.94Å; K422-I445 HydrophobicContact CG-CD1 3.85Å; V424-I445 HydrophobicContact CG2-CG2 3.69Å; H443-I445 VanDerWaalsContact C-N 3.27Å; H443-I445 WeakPolarHBondContact ND1-CG2 3.39Å; H443-I445 PolarHBondContact ND1-N 2.98Å; H443-I445 PolarHBondContact O-N 2.03Å; I445-G447 VanDerWaalsContact C-N 3.32Å; I445-I501 WeakPolarHBondContact O-CG2 3.48Å; I445-A509 HydrophobicContact CD1-CB 4.06Å; I445-A509 HydrophobicContact CG1-CB 3.99Å; I445-Y510 WeakPolarHBondContact O-CD1 3.13Å
446	T	86	Confident	77.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-93.5	4.6	176.7	58.2	0	0	0	0	111.4	V424 I432 C441 H443 P444 D449 N450 Y510	V424-T446 HydrophobicContact CG2-CG2 4.05Å; I432-T446 HydrophobicContact CD1-CG2 3.49Å; I432-T446 VanDerWaalsContact CD1-CG2 3.49Å; I432-T446 HydrophobicContact CG1-CG2 4.25Å; C441-T446 PolarHBondContact O-OG1 2.74Å; H443-T446 HydrophobicContact CB-CG2 4.34Å; H443-T446 PolarHBondContact O-N 3.1Å; H443-T446 VanDerWaalsContact O-N 3.17Å; H443-T446 PolarHBondContact O-OG1 3.16Å; P444-T446 VanDerWaalsContact C-N 3.29Å; P444-T446 PolarHBondContact O-N 3.25Å; T446-D449 PolarHBondContact OG1-N 3.2Å; T446-N450 WeakPolarHBondContact O-CA 3.16Å; T446-N450 PolarHBondContact O-N 3.29Å; T446-Y510 HydrophobicContact CG2-CD1 4.04Å; T446-Y510 HydrophobicContact CG2-CD2 4.48Å; T446-Y510 HydrophobicContact CG2-CE1 4.33Å; T446-Y510 HydrophobicContact CG2-CG 4.12Å
447	G	80.7	Confident	77.1	Confident	14 Å²	14	32.4 Å²	32.4	14%	0.144	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	21.4	-172.9	0	0	0	0	0	114.4	P444 I445 G451	P444-G447 PolarHBondContact O-N 3.18Å; P444-G447 VanDerWaalsContact O-N 3.13Å; I445-G447 VanDerWaalsContact C-N 3.32Å; G447-G451 PolarHBondContact O-N 2.79Å
448	S	83.4	Confident	76	Confident	46 Å²	46	34.7 Å²	34.7	32%	0.322	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	62.1	-165.5	-54.1	0	0	0	0	110.6	H443 G451 C453	H443-S448 PolarHBondContact O-N 3.44Å; S448-G451 PolarHBondContact O-N 2.64Å; S448-C453 PolarHBondContact O-N 2.74Å
449	D	84.1	Confident	75.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	63.1	46.8	-177.4	-157.1	26.2	0	0	0	113.2	I432 Q436 C437 D438 C441 T446 G451 D452 C453	I432-D449 WeakPolarHBondContact CA-OD1 3.47Å; Q436-D449 VanDerWaalsContact O-OD2 3.09Å; C437-D449 WeakPolarHBondContact CA-OD2 3.39Å; D438-D449 PolarHBondContact N-OD2 3.03Å; C441-D449 HydrophobicContact CB-CB 4.23Å; C441-D449 WeakPolarHBondContact CB-OD1 3.43Å; C441-D449 PolarHBondContact O-N 2.63Å; T446-D449 PolarHBondContact OG1-N 3.2Å; D449-G451 PolarHBondContact O-N 2.89Å; D449-D452 HydrophobicContact CB-CB 4.35Å; D449-D452 VanDerWaalsContact O-CB 3.26Å; D449-D452 WeakPolarHBondContact O-CB 3.41Å; D449-D452 PolarHBondContact O-N 2.93Å; D449-C453 HydrophobicContact CB-CB 4.25Å
450	N	82.2	Confident	74.7	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.011	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	52.8	19.2	-173.3	-127.6	-19.7	0	0	0	115.3	I432 T446 Y478 P479 W483 I501 P503	I432-N450 HydrophobicContact CG2-CB 3.71Å; T446-N450 WeakPolarHBondContact O-CA 3.16Å; T446-N450 PolarHBondContact O-N 3.29Å; N450-Y478 WeakPolarHBondContact O-CD1 3.14Å; N450-P479 HydrophobicContact CB-CG 4.02Å; N450-P479 WeakPolarHBondContact O-CD 3.28Å; N450-W483 WeakPolarHBondContact ND2-CZ2 3.23Å; N450-W483 PolarHBondContact OD1-NE1 3.15Å; N450-I501 PolarHBondContact ND2-O 3.49Å; N450-I501 VanDerWaalsContact OD1-CD1 3.31Å; N450-I501 WeakPolarHBondContact OD1-CD1 3.5Å; N450-P503 WeakPolarHBondContact ND2-CD 3.01Å
451	G	75.4	Confident	75	Confident	19 Å²	19	40.3 Å²	40.3	20%	0.196	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	99.4	-6.3	-173.7	0	0	0	0	0	115.4	G447 S448 D449 C453 G454	G447-G451 PolarHBondContact O-N 2.79Å; S448-G451 PolarHBondContact O-N 2.64Å; D449-G451 PolarHBondContact O-N 2.89Å; G451-C453 VanDerWaalsContact C-N 3.34Å; G451-C453 PolarHBondContact O-N 3.15Å; G451-G454 VanDerWaalsContact O-CA 3.28Å; G451-G454 WeakPolarHBondContact O-CA 3.44Å; G451-G454 PolarHBondContact O-N 3.13Å
452	D	79.9	Confident	75.1	Confident	42 Å²	42	41.1 Å²	41.1	23%	0.225	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-33.9	-178.9	-65.8	-24.9	0	0	0	112.3	G433 N434 K435 D449 G454	G433-D452 WeakPolarHBondContact CA-OD2 3.49Å; G433-D452 PolarHBondContact N-OD2 3.49Å; N434-D452 PolarHBondContact N-OD2 3.32Å; K435-D452 VanDerWaalsContact CA-CG 3.48Å; K435-D452 WeakPolarHBondContact CA-OD1 3.46Å; K435-D452 WeakPolarHBondContact CA-OD2 3.21Å; K435-D452 PolarHBondContact N-OD2 3.12Å; D449-D452 HydrophobicContact CB-CB 4.35Å; D449-D452 VanDerWaalsContact O-CB 3.26Å; D449-D452 WeakPolarHBondContact O-CB 3.41Å; D449-D452 PolarHBondContact O-N 2.93Å; D452-G454 VanDerWaalsContact C-N 3.32Å
453	C	80.6	Confident	75.2	Confident	17 Å²	17	40.1 Å²	40.1	12%	0.115	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-2.6	167.1	-67	0	0	0	0	113.9	C437 L442 S448 D449 G451	C437-C453 WeakPolarHBondContact CA-SG 3.41Å; C437-C453 HydrophobicContact CB-CB 4Å; C437-C453 WeakPolarHBondContact CB-SG 3.14Å; C437-C453 WeakPolarHBondContact SG-CA 3.33Å; C437-C453 WeakPolarHBondContact SG-CB 3.15Å; C437-C453 CovalentContact SG-SG 2.04Å; C437-C453 PolarHBondContact SG-SG 2.93Å; L442-C453 HydrophobicContact CD1-CB 3.54Å; S448-C453 PolarHBondContact O-N 2.74Å; D449-C453 HydrophobicContact CB-CB 4.25Å; G451-C453 VanDerWaalsContact C-N 3.34Å; G451-C453 PolarHBondContact O-N 3.15Å
454	G	69.1	Low	75.4	Confident	24 Å²	24	44.2 Å²	44.2	25%	0.247	28%	0.283	C	S	.	.	S	Bend	trans	-75.9	149.4	-179.1	0	0	0	0	0	112.6	G451 D452 A456	G451-G454 VanDerWaalsContact O-CA 3.28Å; G451-G454 WeakPolarHBondContact O-CA 3.44Å; G451-G454 PolarHBondContact O-N 3.13Å; D452-G454 VanDerWaalsContact C-N 3.32Å; G454-A456 PolarHBondContact O-N 3.17Å
455	N	63.9	Low	75.7	Confident	37 Å²	37	48.2 Å²	48.2	20%	0.198	28%	0.284	C	S	.	.			trans	-67.6	122.9	166.2	-82.5	-16.4	0	0	0	108.3	A457 I458 G1522 K1567	N455-A457 PolarHBondContact O-N 3.04Å; N455-I458 WeakPolarHBondContact O-CG1 3.34Å; N455-I458 PolarHBondContact O-N 2.93Å; N455-G1522 WeakPolarHBondContact ND2-CA 3.29Å; N455-G1522 PolarHBondContact ND2-O 2.81Å; N455-K1567 WeakPolarHBondContact OD1-CE 3.28Å
456	A	60.7	Low	75.8	Confident	80 Å²	80	48 Å²	48	66%	0.661	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-13.9	177.3	0	0	0	0	0	115.3	G454 I458 L459	G454-A456 PolarHBondContact O-N 3.17Å; A456-I458 VanDerWaalsContact C-N 3.26Å; A456-I458 PolarHBondContact O-N 3.37Å; A456-L459 PolarHBondContact O-N 2.9Å
457	A	58.5	Low	75.8	Confident	24 Å²	24	50.1 Å²	50.1	20%	0.198	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-24.8	169.9	0	0	0	0	0	113.8	N455 L459 S460 Q1521	N455-A457 PolarHBondContact O-N 3.04Å; A457-L459 VanDerWaalsContact C-N 3.33Å; A457-L459 PolarHBondContact O-N 3.05Å; A457-S460 WeakPolarHBondContact O-CB 3.29Å; A457-S460 PolarHBondContact O-N 2.94Å; A457-S460 PolarHBondContact O-OG 3.18Å; A457-Q1521 HydrophobicContact CB-CB 3.65Å; A457-Q1521 HydrophobicContact CB-CG 3.89Å; A457-Q1521 PolarHBondContact O-OE1 2.81Å
458	I	59.4	Low	76.2	Confident	59 Å²	59	55.4 Å²	55.4	30%	0.303	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-64.4	-39.7	177.1	-59.1	168.7	0	0	0	110.7	N455 A456 S460 K461 Y478	N455-I458 WeakPolarHBondContact O-CG1 3.34Å; N455-I458 PolarHBondContact O-N 2.93Å; A456-I458 VanDerWaalsContact C-N 3.26Å; A456-I458 PolarHBondContact O-N 3.37Å; I458-S460 PolarHBondContact O-N 3.43Å; I458-S460 VanDerWaalsContact O-N 3.1Å; I458-K461 WeakPolarHBondContact O-CB 2.97Å; I458-K461 PolarHBondContact O-N 3.02Å; I458-K461 VanDerWaalsContact O-N 3.1Å; I458-Y478 HydrophobicContact CG2-CE2 3.75Å; I458-Y478 WeakPolarHBondContact CG2-OH 3.25Å
459	L	60.3	Low	76.5	Confident	53 Å²	53	56.7 Å²	56.7	28%	0.277	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-57.1	-27.2	175.5	-62.9	166.9	0	0	0	112.8	A456 A457 K461 Y478 D480 F481	A456-L459 PolarHBondContact O-N 2.9Å; A457-L459 VanDerWaalsContact C-N 3.33Å; A457-L459 PolarHBondContact O-N 3.05Å; L459-K461 PolarHBondContact O-N 2.92Å; L459-Y478 HydrophobicContact CD2-CD1 4.39Å; L459-Y478 HydrophobicContact CD2-CD2 4.44Å; L459-Y478 HydrophobicContact CD2-CG 3.99Å; L459-D480 HydrophobicContact CD2-CB 4.28Å; L459-F481 HydrophobicContact CB-CE2 4.36Å; L459-F481 HydrophobicContact CD2-CD2 4.49Å; L459-F481 HydrophobicContact CD2-CE2 3.91Å; L459-F481 VanDerWaalsContact O-CZ 3.3Å; L459-F481 WeakPolarHBondContact O-CZ 3.19Å
460	S	62.2	Low	76.6	Confident	77 Å²	77	58.6 Å²	58.6	54%	0.538	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-74.1	-2.8	-179.7	74	0	0	0	0	115	A457 I458 Q1521	A457-S460 WeakPolarHBondContact O-CB 3.29Å; A457-S460 PolarHBondContact O-N 2.94Å; A457-S460 PolarHBondContact O-OG 3.18Å; I458-S460 PolarHBondContact O-N 3.43Å; I458-S460 VanDerWaalsContact O-N 3.1Å; S460-Q1521 PolarHBondContact OG-NE2 3.01Å
461	K	77.2	Confident	77	Confident	88 Å²	88	66.7 Å²	66.7	38%	0.383	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-91.1	-28.8	-179.1	-61.8	-168	-178.6	-177.8	0	114.2	I458 L459 L463 E475	I458-K461 WeakPolarHBondContact O-CB 2.97Å; I458-K461 PolarHBondContact O-N 3.02Å; I458-K461 VanDerWaalsContact O-N 3.1Å; L459-K461 PolarHBondContact O-N 2.92Å; K461-L463 PolarHBondContact O-N 2.94Å; K461-L463 VanDerWaalsContact O-N 3.11Å; K461-E475 HydrophobicContact CB-CB 3.98Å; K461-E475 HydrophobicContact CB-CG 4.19Å; K461-E475 HydrophobicContact CD-CG 4.46Å; K461-E475 VanDerWaalsContact CD-OE1 3.23Å; K461-E475 WeakPolarHBondContact CD-OE1 3.39Å; K461-E475 IonicContact NZ-OE1 2.75Å
462	C	82.7	Confident	77.7	Confident	16 Å²	16	66.6 Å²	66.6	11%	0.108	36%	0.364	C	S	.	.			trans	-62.3	114.9	176.3	-176	0	0	0	0	110.6	L467 E475 C476 F481	C462-L467 VanDerWaalsContact SG-CD2 3.55Å; C462-E475 WeakPolarHBondContact CB-O 3.41Å; C462-C476 VanDerWaalsContact CA-SG 3.54Å; C462-C476 HydrophobicContact CB-CB 3.99Å; C462-C476 WeakPolarHBondContact CB-SG 3.4Å; C462-C476 VanDerWaalsContact SG-CA 3.6Å; C462-C476 WeakPolarHBondContact SG-CB 3.13Å; C462-C476 CovalentContact SG-SG 2.04Å; C462-C476 PolarHBondContact SG-SG 3.49Å; C462-F481 HydrophobicContact CB-CD1 4.27Å; C462-F481 HydrophobicContact CB-CD2 3.81Å; C462-F481 HydrophobicContact CB-CE1 3.95Å; C462-F481 HydrophobicContact CB-CE2 3.46Å; C462-F481 VanDerWaalsContact CB-CE2 3.46Å; C462-F481 HydrophobicContact CB-CG 4.23Å; C462-F481 HydrophobicContact CB-CZ 3.55Å
463	L	85.9	Confident	78.1	Confident	77 Å²	77	65.5 Å²	65.5	40%	0.403	36%	0.358	S	S	.	.			trans	-90.3	147.4	175.4	-64.4	170.6	0	0	0	110	K461 R465 M466	K461-L463 PolarHBondContact O-N 2.94Å; K461-L463 VanDerWaalsContact O-N 3.11Å; L463-R465 HydrophobicContact CB-CG 4Å; L463-R465 PolarHBondContact O-N 2.88Å; L463-M466 HydrophobicContact CB-CG 4.26Å; L463-M466 HydrophobicContact CB-SD 3.82Å; L463-M466 HydrophobicContact CD1-SD 4.16Å; L463-M466 HydrophobicContact CG-SD 4.09Å; L463-M466 WeakPolarHBondContact O-CB 3.34Å; L463-M466 PolarHBondContact O-N 3.41Å
464	P	83.2	Confident	78.4	Confident	119 Å²	119	69.9 Å²	69.9	77%	0.773	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-11.2	177.9	-27.3	35.4	0	0	0	116.3
465	R	88.2	Confident	79.1	Confident	194 Å²	194	72.3 Å²	72.3	73%	0.732	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-7.5	174.4	70.9	-178	179	118.3	4.8	114.1	L463	L463-R465 HydrophobicContact CB-CG 4Å; L463-R465 PolarHBondContact O-N 2.88Å
466	M	88.1	Confident	80.2	Confident	19 Å²	19	70.5 Å²	70.5	9%	0.094	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-43.5	-179.4	-68.8	166	65.8	0	0	109.4	L463 H468 N469 D473 E475 C476	L463-M466 HydrophobicContact CB-CG 4.26Å; L463-M466 HydrophobicContact CB-SD 3.82Å; L463-M466 HydrophobicContact CD1-SD 4.16Å; L463-M466 HydrophobicContact CG-SD 4.09Å; L463-M466 WeakPolarHBondContact O-CB 3.34Å; L463-M466 PolarHBondContact O-N 3.41Å; M466-H468 PolarHBondContact O-N 2.79Å; M466-N469 WeakPolarHBondContact CA-ND2 3.42Å; M466-N469 VanDerWaalsContact O-CB 3.32Å; M466-N469 WeakPolarHBondContact O-CB 3.38Å; M466-N469 PolarHBondContact O-N 3.26Å; M466-N469 PolarHBondContact O-ND2 3.13Å; M466-N469 VanDerWaalsContact O-ND2 3.09Å; M466-D473 HydrophobicContact CB-CB 4.28Å; M466-D473 WeakPolarHBondContact CB-OD2 3.41Å; M466-D473 HydrophobicContact CE-CB 3.75Å; M466-D473 WeakPolarHBondContact CG-OD2 3.03Å; M466-E475 HydrophobicContact CE-CB 4.1Å; M466-C476 VanDerWaalsContact CB-SG 3.55Å
467	L	86.8	Confident	81.5	Confident	45 Å²	45	66.8 Å²	66.8	24%	0.236	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-42.9	116.1	170.2	-67.2	178.3	0	0	0	113.4	C462 N469 C476 F481 D484	C462-L467 VanDerWaalsContact SG-CD2 3.55Å; L467-N469 PolarHBondContact O-N 3.33Å; L467-C476 HydrophobicContact CD2-CB 4.14Å; L467-F481 HydrophobicContact CD2-CB 3.78Å; L467-F481 HydrophobicContact CD2-CD1 3.97Å; L467-F481 HydrophobicContact CD2-CG 4.12Å; L467-D484 WeakPolarHBondContact CA-OD1 3.43Å
468	H	87.4	Confident	82.7	Confident	125 Å²	125	67.2 Å²	67.2	58%	0.579	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	39.8	175.8	-156.7	39.9	0	0	0	114.6	M466 G470 D484 H485 D487	M466-H468 PolarHBondContact O-N 2.79Å; H468-G470 VanDerWaalsContact C-N 3.32Å; H468-D484 PolarHBondContact N-OD1 2.77Å; H468-H485 HydrophobicContact CB-CB 3.95Å; H468-D487 WeakPolarHBondContact CA-OD2 3.35Å; H468-D487 IonicContact CE1-OD1 3.96Å; H468-D487 PolarHBondContact CE1-OD1 2.88Å; H468-D487 IonicContact CG-OD1 2.72Å; H468-D487 IonicContact ND1-OD1 3.91Å; H468-D487 PolarHBondContact ND1-OD1 2.8Å; H468-D487 IonicContact ND1-OD2 3.66Å
469	N	89.8	Confident	83.9	Confident	74 Å²	74	66.5 Å²	66.5	40%	0.396	34%	0.337	S	S	.	.	S	Bend	trans	-86.2	2.1	-179.4	73.2	21.7	0	0	0	114.4	M466 L467 R471 D473 D487	M466-N469 WeakPolarHBondContact CA-ND2 3.42Å; M466-N469 VanDerWaalsContact O-CB 3.32Å; M466-N469 WeakPolarHBondContact O-CB 3.38Å; M466-N469 PolarHBondContact O-N 3.26Å; M466-N469 PolarHBondContact O-ND2 3.13Å; M466-N469 VanDerWaalsContact O-ND2 3.09Å; L467-N469 PolarHBondContact O-N 3.33Å; N469-R471 WeakPolarHBondContact OD1-CA 3.16Å; N469-R471 VanDerWaalsContact OD1-CB 3.31Å; N469-R471 WeakPolarHBondContact OD1-CB 3.47Å; N469-R471 PolarHBondContact OD1-N 3.3Å; N469-R471 PolarHBondContact OD1-O 2.82Å; N469-D473 PolarHBondContact ND2-OD2 3.5Å; N469-D487 PolarHBondContact N-OD2 3.05Å
470	G	87.5	Confident	84.9	Confident	40 Å²	40	69.1 Å²	69.1	41%	0.412	35%	0.351	S	S	.	.	S	Bend	trans	89.8	6.4	-175.7	0	0	0	0	0	114.3	H468 D487	H468-G470 VanDerWaalsContact C-N 3.32Å; G470-D487 VanDerWaalsContact CA-OD2 3.27Å; G470-D487 WeakPolarHBondContact CA-OD2 3.04Å; G470-D487 PolarHBondContact N-OD2 3.49Å
471	R	89.6	Confident	86	Confident	172 Å²	172	67.4 Å²	67.4	65%	0.649	33%	0.334	S	S	*	.	S	Bend	trans	-140.7	124	179	176.6	-158.3	-173.3	-170.2	2.1	109	N469 D473 D484	N469-R471 WeakPolarHBondContact OD1-CA 3.16Å; N469-R471 VanDerWaalsContact OD1-CB 3.31Å; N469-R471 WeakPolarHBondContact OD1-CB 3.47Å; N469-R471 PolarHBondContact OD1-N 3.3Å; N469-R471 PolarHBondContact OD1-O 2.82Å; R471-D473 IonicContact NH1-OD1 3.92Å; R471-D473 PolarHBondContact O-N 2.82Å; R471-D484 VanDerWaalsContact O-OD2 3.07Å
472	C	89.8	Confident	86.5	Confident	16 Å²	16	66 Å²	66	11%	0.108	34%	0.336	C	S	.	.			trans	-55	102.9	170.8	176.3	0	0	0	0	112.5	C488 T494	C472-C488 WeakPolarHBondContact CA-SG 3.09Å; C472-C488 HydrophobicContact CB-CB 3.89Å; C472-C488 WeakPolarHBondContact CB-SG 3.39Å; C472-C488 WeakPolarHBondContact SG-CA 3.36Å; C472-C488 WeakPolarHBondContact SG-CB 3.48Å; C472-C488 CovalentContact SG-SG 2.04Å; C472-C488 PolarHBondContact SG-SG 3.38Å; C472-T494 HydrophobicContact CB-CG2 4.26Å
473	D	89.3	Confident	86.7	Confident	20 Å²	20	67 Å²	67	11%	0.107	34%	0.337	C	S	.	.			trans	-91	111.2	172.6	-83	-37.7	0	0	0	109	M466 N469 R471 E475 C476 N477 D484	M466-D473 HydrophobicContact CB-CB 4.28Å; M466-D473 WeakPolarHBondContact CB-OD2 3.41Å; M466-D473 HydrophobicContact CE-CB 3.75Å; M466-D473 WeakPolarHBondContact CG-OD2 3.03Å; N469-D473 PolarHBondContact ND2-OD2 3.5Å; R471-D473 IonicContact NH1-OD1 3.92Å; R471-D473 PolarHBondContact O-N 2.82Å; D473-E475 PolarHBondContact O-N 2.83Å; D473-C476 CarbonylContact O-C 3.39Å; D473-C476 WeakPolarHBondContact O-CA 3.07Å; D473-C476 WeakPolarHBondContact O-CB 3.3Å; D473-C476 PolarHBondContact O-N 2.7Å; D473-N477 PolarHBondContact O-N 3.08Å; D473-D484 PolarHBondContact N-OD2 3.45Å
474	Q	85.8	Confident	86.9	Confident	108 Å²	108	63.4 Å²	63.4	51%	0.505	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-21.8	-176.2	-70.8	-69.9	-8.5	0	0	114.2	C476 N477	Q474-C476 VanDerWaalsContact C-N 3.28Å; Q474-N477 PolarHBondContact O-N 3.26Å; Q474-N477 PolarHBondContact OE1-ND2 3.45Å; Q474-N477 VanDerWaalsContact OE1-ND2 3.07Å
475	E	85	Confident	87.3	Confident	75 Å²	75	62.7 Å²	62.7	35%	0.35	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-20.3	174.9	-56.9	-168.7	144.1	0	0	112.5	K461 C462 M466 D473	K461-E475 HydrophobicContact CB-CB 3.98Å; K461-E475 HydrophobicContact CB-CG 4.19Å; K461-E475 HydrophobicContact CD-CG 4.46Å; K461-E475 VanDerWaalsContact CD-OE1 3.23Å; K461-E475 WeakPolarHBondContact CD-OE1 3.39Å; K461-E475 IonicContact NZ-OE1 2.75Å; C462-E475 WeakPolarHBondContact CB-O 3.41Å; M466-E475 HydrophobicContact CE-CB 4.1Å; D473-E475 PolarHBondContact O-N 2.83Å
476	C	87.7	Confident	87.3	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	-104.4	1.7	175	-60.5	0	0	0	0	113	C462 M466 L467 D473 Q474 Y478 F481 D484	C462-C476 VanDerWaalsContact CA-SG 3.54Å; C462-C476 HydrophobicContact CB-CB 3.99Å; C462-C476 WeakPolarHBondContact CB-SG 3.4Å; C462-C476 VanDerWaalsContact SG-CA 3.6Å; C462-C476 WeakPolarHBondContact SG-CB 3.13Å; C462-C476 CovalentContact SG-SG 2.04Å; C462-C476 PolarHBondContact SG-SG 3.49Å; M466-C476 VanDerWaalsContact CB-SG 3.55Å; L467-C476 HydrophobicContact CD2-CB 4.14Å; D473-C476 CarbonylContact O-C 3.39Å; D473-C476 WeakPolarHBondContact O-CA 3.07Å; D473-C476 WeakPolarHBondContact O-CB 3.3Å; D473-C476 PolarHBondContact O-N 2.7Å; Q474-C476 VanDerWaalsContact C-N 3.28Å; C476-Y478 PolarHBondContact O-N 3.17Å; C476-F481 HydrophobicContact CB-CB 4.42Å; C476-F481 WeakPolarHBondContact O-CB 3.45Å; C476-D484 HydrophobicContact CB-CB 4.09Å; C476-D484 PolarHBondContact O-N 3.34Å
477	N	87.7	Confident	87.5	Confident	2 Å²	2	54 Å²	54	1%	0.011	28%	0.28	C	S	.	.			trans	-82.3	59.4	-178	-166	18.2	0	0	0	111.9	D473 Q474 C488 S499 I501	D473-N477 PolarHBondContact O-N 3.08Å; Q474-N477 PolarHBondContact O-N 3.26Å; Q474-N477 PolarHBondContact OE1-ND2 3.45Å; Q474-N477 VanDerWaalsContact OE1-ND2 3.07Å; N477-C488 HydrophobicContact CB-CB 4.46Å; N477-C488 WeakPolarHBondContact OD1-CB 3.36Å; N477-S499 PolarHBondContact ND2-O 2.63Å; N477-I501 WeakPolarHBondContact O-CD1 2.9Å
478	Y	83.7	Confident	87.7	Confident	33 Å²	33	51.9 Å²	51.9	13%	0.129	27%	0.269	C	S	.	.	S	Bend	trans	-138.3	158.7	-176.5	-71	-82.2	0	0	0	111.4	N450 I458 L459 C476 D480 F481 S482 W483	N450-Y478 WeakPolarHBondContact O-CD1 3.14Å; I458-Y478 HydrophobicContact CG2-CE2 3.75Å; I458-Y478 WeakPolarHBondContact CG2-OH 3.25Å; L459-Y478 HydrophobicContact CD2-CD1 4.39Å; L459-Y478 HydrophobicContact CD2-CD2 4.44Å; L459-Y478 HydrophobicContact CD2-CG 3.99Å; C476-Y478 PolarHBondContact O-N 3.17Å; Y478-D480 VanDerWaalsContact C-N 3.31Å; Y478-D480 PolarHBondContact O-N 2.94Å; Y478-F481 CarbonylContact O-C 3.56Å; Y478-F481 PolarHBondContact O-N 2.97Å; Y478-S482 PolarHBondContact O-N 2.8Å; Y478-W483 PolarHBondContact O-N 2.92Å
479	P	83.8	Confident	87.9	Confident	43 Å²	43	46.7 Å²	46.7	28%	0.279	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-54.8	-41.8	178.5	-24.6	32.1	0	0	0	113.7	N450 F481 S482 W483	N450-P479 HydrophobicContact CB-CG 4.02Å; N450-P479 WeakPolarHBondContact O-CD 3.28Å; P479-F481 PolarHBondContact O-N 2.04Å; P479-F481 VanDerWaalsContact O-N 3.12Å; P479-S482 PolarHBondContact O-N 3.05Å; P479-W483 HydrophobicContact CB-CH2 4.2Å; P479-W483 HydrophobicContact CB-CZ2 3.86Å; P479-W483 HydrophobicContact CG-CZ2 3.73Å
480	D	81.3	Confident	87.9	Confident	108 Å²	108	45.9 Å²	45.9	58%	0.578	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-61	-21.7	179.3	-75.9	-17.2	0	0	0	113.7	L459 Y478	L459-D480 HydrophobicContact CD2-CB 4.28Å; Y478-D480 VanDerWaalsContact C-N 3.31Å; Y478-D480 PolarHBondContact O-N 2.94Å
481	F	86.2	Confident	87.9	Confident	41 Å²	41	47.5 Å²	47.5	18%	0.18	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-109.5	10.1	178.5	-60.9	-53.6	0	0	0	112.5	L459 C462 L467 C476 Y478 P479 W483 D484 H485	L459-F481 HydrophobicContact CB-CE2 4.36Å; L459-F481 HydrophobicContact CD2-CD2 4.49Å; L459-F481 HydrophobicContact CD2-CE2 3.91Å; L459-F481 VanDerWaalsContact O-CZ 3.3Å; L459-F481 WeakPolarHBondContact O-CZ 3.19Å; C462-F481 HydrophobicContact CB-CD1 4.27Å; C462-F481 HydrophobicContact CB-CD2 3.81Å; C462-F481 HydrophobicContact CB-CE1 3.95Å; C462-F481 HydrophobicContact CB-CE2 3.46Å; C462-F481 VanDerWaalsContact CB-CE2 3.46Å; C462-F481 HydrophobicContact CB-CG 4.23Å; C462-F481 HydrophobicContact CB-CZ 3.55Å; L467-F481 HydrophobicContact CD2-CB 3.78Å; L467-F481 HydrophobicContact CD2-CD1 3.97Å; L467-F481 HydrophobicContact CD2-CG 4.12Å; C476-F481 HydrophobicContact CB-CB 4.42Å; C476-F481 WeakPolarHBondContact O-CB 3.45Å; Y478-F481 CarbonylContact O-C 3.56Å; Y478-F481 PolarHBondContact O-N 2.97Å; P479-F481 PolarHBondContact O-N 2.04Å; P479-F481 VanDerWaalsContact O-N 3.12Å; F481-W483 PolarHBondContact O-N 3.31Å; F481-D484 PolarHBondContact O-N 3.13Å; F481-H485 PolarHBondContact O-N 3.45Å
482	S	86.8	Confident	87.8	Confident	60 Å²	60	44.8 Å²	44.8	42%	0.42	24%	0.241	S	C	.	.	H	α-helix	trans	52.9	38.9	-175	-52.5	0	0	0	0	113	Y478 P479 H485 G486	Y478-S482 PolarHBondContact O-N 2.8Å; P479-S482 PolarHBondContact O-N 3.05Å; S482-H485 CarbonylContact O-C 3.48Å; S482-H485 WeakPolarHBondContact O-CA 3.31Å; S482-H485 PolarHBondContact O-N 3.08Å; S482-G486 PolarHBondContact O-N 3.29Å
483	W	88.2	Confident	87.7	Confident	37 Å²	37	47.8 Å²	47.8	14%	0.14	26%	0.256	C	S	.	.	H	α-helix	trans	50.1	58.3	-175.9	-54.2	-87.2	0	0	0	112.3	N450 Y478 P479 F481 G486 C488 D502	N450-W483 WeakPolarHBondContact ND2-CZ2 3.23Å; N450-W483 PolarHBondContact OD1-NE1 3.15Å; Y478-W483 PolarHBondContact O-N 2.92Å; P479-W483 HydrophobicContact CB-CH2 4.2Å; P479-W483 HydrophobicContact CB-CZ2 3.86Å; P479-W483 HydrophobicContact CG-CZ2 3.73Å; F481-W483 PolarHBondContact O-N 3.31Å; W483-G486 PolarHBondContact O-N 3.46Å; W483-C488 HydrophobicContact CB-CB 4.42Å; W483-C488 PolarHBondContact O-N 3.05Å; W483-D502 HydrophobicContact CD2-CB 3.59Å; W483-D502 HydrophobicContact CE3-CB 3.81Å; W483-D502 HydrophobicContact CG-CB 4Å; W483-D502 HydrophobicContact CH2-CB 4.33Å; W483-D502 WeakPolarHBondContact CH2-OD1 3.3Å; W483-D502 HydrophobicContact CZ2-CB 4.13Å; W483-D502 HydrophobicContact CZ3-CB 4.18Å
484	D	90	Very high	87.6	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	58.3	45.2	-174.7	-158.5	1.4	0	0	0	112.8	L467 H468 R471 D473 C476 F481 G486 D487	L467-D484 WeakPolarHBondContact CA-OD1 3.43Å; H468-D484 PolarHBondContact N-OD1 2.77Å; R471-D484 VanDerWaalsContact O-OD2 3.07Å; D473-D484 PolarHBondContact N-OD2 3.45Å; C476-D484 HydrophobicContact CB-CB 4.09Å; C476-D484 PolarHBondContact O-N 3.34Å; F481-D484 PolarHBondContact O-N 3.13Å; D484-G486 PolarHBondContact O-N 3.17Å; D484-D487 HydrophobicContact CB-CB 4.19Å; D484-D487 WeakPolarHBondContact O-CB 2.98Å; D484-D487 PolarHBondContact O-N 3.29Å
485	H	90	Very high	87.7	Confident	104 Å²	104	47.9 Å²	47.9	48%	0.481	26%	0.261	S	S	.	.	H	α-helix	trans	47.5	30.5	-169.1	-68.8	-55.1	0	0	0	114.9	H468 F481 S482	H468-H485 HydrophobicContact CB-CB 3.95Å; F481-H485 PolarHBondContact O-N 3.45Å; S482-H485 CarbonylContact O-C 3.48Å; S482-H485 WeakPolarHBondContact O-CA 3.31Å; S482-H485 PolarHBondContact O-N 3.08Å
486	G	88.2	Confident	87.9	Confident	29 Å²	29	44.4 Å²	44.4	30%	0.299	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.1	-5.4	179.4	0	0	0	0	0	115	S482 W483 D484 C488 C489 N490	S482-G486 PolarHBondContact O-N 3.29Å; W483-G486 PolarHBondContact O-N 3.46Å; D484-G486 PolarHBondContact O-N 3.17Å; G486-C488 PolarHBondContact O-N 3.09Å; G486-C489 CarbonylContact O-C 3.56Å; G486-C489 PolarHBondContact O-N 3.41Å; G486-N490 PolarHBondContact O-N 3.08Å; G486-N490 VanDerWaalsContact O-N 3.13Å
487	D	92.3	Very high	87.7	Confident	3 Å²	3	46 Å²	46	2%	0.016	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-60.2	-31.9	177.3	-75.6	8.6	0	0	0	111.5	H468 N469 G470 D484 C489 L493 T494	H468-D487 WeakPolarHBondContact CA-OD2 3.35Å; H468-D487 IonicContact CE1-OD1 3.96Å; H468-D487 PolarHBondContact CE1-OD1 2.88Å; H468-D487 IonicContact CG-OD1 2.72Å; H468-D487 IonicContact ND1-OD1 3.91Å; H468-D487 PolarHBondContact ND1-OD1 2.8Å; H468-D487 IonicContact ND1-OD2 3.66Å; N469-D487 PolarHBondContact N-OD2 3.05Å; G470-D487 VanDerWaalsContact CA-OD2 3.27Å; G470-D487 WeakPolarHBondContact CA-OD2 3.04Å; G470-D487 PolarHBondContact N-OD2 3.49Å; D484-D487 HydrophobicContact CB-CB 4.19Å; D484-D487 WeakPolarHBondContact O-CB 2.98Å; D484-D487 PolarHBondContact O-N 3.29Å; D487-C489 VanDerWaalsContact C-N 3.32Å; D487-C489 PolarHBondContact O-N 3.03Å; D487-L493 HydrophobicContact CB-CD1 4.42Å; D487-T494 WeakPolarHBondContact O-CG2 3.36Å
488	C	91.7	Very high	87.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-75	-12.8	174.4	-70.3	0	0	0	0	115.4	C472 N477 W483 G486 S499 C500	C472-C488 WeakPolarHBondContact CA-SG 3.09Å; C472-C488 HydrophobicContact CB-CB 3.89Å; C472-C488 WeakPolarHBondContact CB-SG 3.39Å; C472-C488 WeakPolarHBondContact SG-CA 3.36Å; C472-C488 WeakPolarHBondContact SG-CB 3.48Å; C472-C488 CovalentContact SG-SG 2.04Å; C472-C488 PolarHBondContact SG-SG 3.38Å; N477-C488 HydrophobicContact CB-CB 4.46Å; N477-C488 WeakPolarHBondContact OD1-CB 3.36Å; W483-C488 HydrophobicContact CB-CB 4.42Å; W483-C488 PolarHBondContact O-N 3.05Å; G486-C488 PolarHBondContact O-N 3.09Å; C488-S499 CarbonylContact O-C 3.52Å; C488-S499 PolarHBondContact O-OG 3.47Å; C488-C500 VanDerWaalsContact O-CA 3.26Å; C488-C500 WeakPolarHBondContact O-CA 3.12Å; C488-C500 WeakPolarHBondContact O-CB 3.37Å; C488-C500 PolarHBondContact O-N 3.03Å
489	C	91.6	Very high	87.8	Confident	15 Å²	15	49.4 Å²	49.4	10%	0.101	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-117.2	11.8	178.1	-77.5	0	0	0	0	113.9	G486 D487 C500	G486-C489 CarbonylContact O-C 3.56Å; G486-C489 PolarHBondContact O-N 3.41Å; D487-C489 VanDerWaalsContact C-N 3.32Å; D487-C489 PolarHBondContact O-N 3.03Å; C489-C500 VanDerWaalsContact CA-SG 3.58Å; C489-C500 HydrophobicContact CB-CB 3.98Å; C489-C500 WeakPolarHBondContact CB-SG 3.39Å; C489-C500 WeakPolarHBondContact SG-CA 3.34Å; C489-C500 WeakPolarHBondContact SG-CB 3.44Å; C489-C500 CovalentContact SG-SG 2.04Å; C489-C500 PolarHBondContact SG-SG 3.23Å
490	N	90.1	Very high	88.2	Confident	58 Å²	58	47.3 Å²	47.3	31%	0.31	27%	0.266	S	S	.	.			trans	-96.3	110.4	178.9	-174.9	-15.4	0	0	0	111.7	G486 T492 L493 T494	G486-N490 PolarHBondContact O-N 3.08Å; G486-N490 VanDerWaalsContact O-N 3.13Å; N490-T492 PolarHBondContact ND2-OG1 2.9Å; N490-T492 PolarHBondContact O-N 3.1Å; N490-T492 PolarHBondContact OD1-N 2.9Å; N490-T492 PolarHBondContact OD1-OG1 3.45Å; N490-L493 HydrophobicContact CB-CB 4.32Å; N490-L493 HydrophobicContact CB-CD1 4.09Å; N490-L493 HydrophobicContact CB-CG 4.22Å; N490-L493 WeakPolarHBondContact ND2-CD1 3.43Å; N490-L493 PolarHBondContact O-N 3.03Å; N490-T494 PolarHBondContact O-N 3.41Å; N490-T494 VanDerWaalsContact O-N 3.11Å
491	E	86.5	Confident	88.6	Confident	74 Å²	74	42.6 Å²	42.6	35%	0.346	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-8.4	-179	71.6	177.2	156.3	0	0	115.2	R417 V496 Y507	R417-E491 IonicContact CZ-OE2 3.37Å; R417-E491 IonicContact NH1-OE2 3.82Å; R417-E491 PolarHBondContact NH1-OE2 3.37Å; E491-V496 HydrophobicContact CB-CG1 4.3Å; E491-V496 HydrophobicContact CB-CG2 4.26Å; E491-Y507 HydrophobicContact CB-CD1 4.36Å; E491-Y507 HydrophobicContact CB-CE1 4.2Å; E491-Y507 HydrophobicContact CG-CE1 3.95Å; E491-Y507 VanDerWaalsContact OE1-CE1 3.32Å; E491-Y507 WeakPolarHBondContact OE1-CE1 3.47Å; E491-Y507 PolarHBondContact OE1-OH 2.87Å; E491-Y507 WeakPolarHBondContact OE2-CE1 3.17Å
492	T	88.2	Confident	88.7	Confident	115 Å²	115	41.9 Å²	41.9	71%	0.706	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-13.6	174	65.8	0	0	0	0	113.7	N490	N490-T492 PolarHBondContact ND2-OG1 2.9Å; N490-T492 PolarHBondContact O-N 3.1Å; N490-T492 PolarHBondContact OD1-N 2.9Å; N490-T492 PolarHBondContact OD1-OG1 3.45Å
493	L	87.7	Confident	88.7	Confident	79 Å²	79	39.9 Å²	39.9	41%	0.414	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-32.7	-176.7	-60.9	179	0	0	0	113.1	D487 N490	D487-L493 HydrophobicContact CB-CD1 4.42Å; N490-L493 HydrophobicContact CB-CB 4.32Å; N490-L493 HydrophobicContact CB-CD1 4.09Å; N490-L493 HydrophobicContact CB-CG 4.22Å; N490-L493 WeakPolarHBondContact ND2-CD1 3.43Å; N490-L493 PolarHBondContact O-N 3.03Å
494	T	88	Confident	88.6	Confident	37 Å²	37	44.5 Å²	44.5	23%	0.227	25%	0.251	C	S	.	.	S	Bend	trans	-143.1	161.1	-171.7	-169.5	0	0	0	0	112.8	C472 D487 N490 V496 S499	C472-T494 HydrophobicContact CB-CG2 4.26Å; D487-T494 WeakPolarHBondContact O-CG2 3.36Å; N490-T494 PolarHBondContact O-N 3.41Å; N490-T494 VanDerWaalsContact O-N 3.11Å; T494-V496 HydrophobicContact CG2-CG1 4.07Å; T494-V496 PolarHBondContact O-N 2.91Å; T494-S499 WeakPolarHBondContact CG2-OG 3.5Å; T494-S499 PolarHBondContact OG1-OG 2.79Å
495	D	87.9	Confident	88.5	Confident	93 Å²	93	44.9 Å²	44.9	50%	0.497	25%	0.254	S	S	.	.			trans	-78.6	87.5	169.6	-174.3	-0.2	0	0	0	110.9	T497 V498 S499	D495-T497 VanDerWaalsContact CG-OG1 3.26Å; D495-T497 PolarHBondContact O-N 3.46Å; D495-T497 WeakPolarHBondContact OD1-CB 3.33Å; D495-T497 WeakPolarHBondContact OD1-CG2 3.31Å; D495-T497 PolarHBondContact OD1-N 3.18Å; D495-T497 PolarHBondContact OD1-OG1 3.48Å; D495-T497 PolarHBondContact OD2-OG1 2.81Å; D495-V498 PolarHBondContact O-N 2.91Å; D495-S499 VanDerWaalsContact C-OG 3.24Å; D495-S499 PolarHBondContact O-N 3.3Å; D495-S499 PolarHBondContact O-OG 3.5Å
496	V	88.1	Confident	88.3	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-55.5	-16.8	178.7	-62.8	0	0	0	0	114.4	E491 T494 V498 C500 Y507	E491-V496 HydrophobicContact CB-CG1 4.3Å; E491-V496 HydrophobicContact CB-CG2 4.26Å; T494-V496 HydrophobicContact CG2-CG1 4.07Å; T494-V496 PolarHBondContact O-N 2.91Å; V496-V498 PolarHBondContact O-N 2.97Å; V496-C500 HydrophobicContact CB-CB 3.82Å; V496-C500 HydrophobicContact CG1-CB 4.16Å; V496-C500 WeakPolarHBondContact O-CB 3.39Å; V496-C500 PolarHBondContact O-N 3.27Å; V496-Y507 HydrophobicContact CG2-CD1 4.45Å
497	T	84.8	Confident	88.3	Confident	35 Å²	35	47.1 Å²	47.1	22%	0.215	26%	0.262	C	S	.	.	H	α-helix	trans	-71.4	-12.6	175.7	71.4	0	0	0	0	113.4	L420 D495 A509	L420-T497 HydrophobicContact CB-CG2 3.98Å; L420-T497 HydrophobicContact CD1-CG2 4.23Å; D495-T497 VanDerWaalsContact CG-OG1 3.26Å; D495-T497 PolarHBondContact O-N 3.46Å; D495-T497 WeakPolarHBondContact OD1-CB 3.33Å; D495-T497 WeakPolarHBondContact OD1-CG2 3.31Å; D495-T497 PolarHBondContact OD1-N 3.18Å; D495-T497 PolarHBondContact OD1-OG1 3.48Å; D495-T497 PolarHBondContact OD2-OG1 2.81Å; T497-A509 VanDerWaalsContact O-CB 3.26Å; T497-A509 WeakPolarHBondContact O-CB 3.48Å
498	V	84.5	Confident	88.1	Confident	100 Å²	100	48.1 Å²	48.1	61%	0.606	27%	0.266	S	S	*	.	H	α-helix	trans	-125	-33	175.6	-172.8	0	0	0	0	111.8	D495 V496	D495-V498 PolarHBondContact O-N 2.91Å; V496-V498 PolarHBondContact O-N 2.97Å
499	S	88.4	Confident	88	Confident	5 Å²	5	48.1 Å²	48.1	4%	0.035	27%	0.266	C	S	.	.	H	α-helix	trans	-92.6	-28.6	-173.3	54.1	0	0	0	0	115.7	N477 C488 T494 D495 I501	N477-S499 PolarHBondContact ND2-O 2.63Å; C488-S499 CarbonylContact O-C 3.52Å; C488-S499 PolarHBondContact O-OG 3.47Å; T494-S499 WeakPolarHBondContact CG2-OG 3.5Å; T494-S499 PolarHBondContact OG1-OG 2.79Å; D495-S499 VanDerWaalsContact C-OG 3.24Å; D495-S499 PolarHBondContact O-N 3.3Å; D495-S499 PolarHBondContact O-OG 3.5Å; S499-I501 PolarHBondContact O-N 3.47Å
500	C	91.4	Very high	87.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.262	C	S	.	.			trans	-84.9	107.4	-173.7	-176.6	0	0	0	0	111.4	C488 C489 V496 S505 R508 A509	C488-C500 VanDerWaalsContact O-CA 3.26Å; C488-C500 WeakPolarHBondContact O-CA 3.12Å; C488-C500 WeakPolarHBondContact O-CB 3.37Å; C488-C500 PolarHBondContact O-N 3.03Å; C489-C500 VanDerWaalsContact CA-SG 3.58Å; C489-C500 HydrophobicContact CB-CB 3.98Å; C489-C500 WeakPolarHBondContact CB-SG 3.39Å; C489-C500 WeakPolarHBondContact SG-CA 3.34Å; C489-C500 WeakPolarHBondContact SG-CB 3.44Å; C489-C500 CovalentContact SG-SG 2.04Å; C489-C500 PolarHBondContact SG-SG 3.23Å; V496-C500 HydrophobicContact CB-CB 3.82Å; V496-C500 HydrophobicContact CG1-CB 4.16Å; V496-C500 WeakPolarHBondContact O-CB 3.39Å; V496-C500 PolarHBondContact O-N 3.27Å; C500-S505 VanDerWaalsContact SG-CB 3.57Å; C500-S505 PolarHBondContact SG-OG 2.88Å; C500-R508 VanDerWaalsContact O-CA 3.32Å; C500-R508 WeakPolarHBondContact O-CA 3.45Å; C500-A509 PolarHBondContact O-N 2.64Å
501	I	89.7	Confident	87.9	Confident	9 Å²	9	44.9 Å²	44.9	5%	0.046	25%	0.248	C	C	.	.			trans	-112.9	6	179.7	70.2	166.5	0	0	0	114.3	I445 N450 N477 S499 P503 Y510	I445-I501 WeakPolarHBondContact O-CG2 3.48Å; N450-I501 PolarHBondContact ND2-O 3.49Å; N450-I501 VanDerWaalsContact OD1-CD1 3.31Å; N450-I501 WeakPolarHBondContact OD1-CD1 3.5Å; N477-I501 WeakPolarHBondContact O-CD1 2.9Å; S499-I501 PolarHBondContact O-N 3.47Å; I501-P503 WeakPolarHBondContact O-CD 3.23Å; I501-Y510 HydrophobicContact CB-CE1 4.29Å; I501-Y510 PolarHBondContact O-OH 3.26Å
502	D	88.9	Confident	87.8	Confident	25 Å²	25	41.7 Å²	41.7	13%	0.134	23%	0.233	C	C	.	.			trans	-66.4	118.1	173.5	173.1	12.9	0	0	0	110.6	W483 N504 S505 R508	W483-D502 HydrophobicContact CD2-CB 3.59Å; W483-D502 HydrophobicContact CE3-CB 3.81Å; W483-D502 HydrophobicContact CG-CB 4Å; W483-D502 HydrophobicContact CH2-CB 4.33Å; W483-D502 WeakPolarHBondContact CH2-OD1 3.3Å; W483-D502 HydrophobicContact CZ2-CB 4.13Å; W483-D502 HydrophobicContact CZ3-CB 4.18Å; D502-N504 PolarHBondContact O-N 3.03Å; D502-N504 WeakPolarHBondContact OD1-CB 3.47Å; D502-N504 PolarHBondContact OD1-N 2.71Å; D502-N504 PolarHBondContact OD1-ND2 2.81Å; D502-N504 VanDerWaalsContact OD1-ND2 3.16Å; D502-S505 WeakPolarHBondContact O-CB 3.45Å; D502-S505 PolarHBondContact O-N 3.04Å; D502-S505 VanDerWaalsContact O-N 3.11Å; D502-S505 PolarHBondContact OD2-N 3.13Å; D502-R508 VanDerWaalsContact O-CB 3.29Å; D502-R508 WeakPolarHBondContact O-CB 3.41Å
503	P	86.1	Confident	87.6	Confident	19 Å²	19	37.4 Å²	37.4	12%	0.123	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.3	178.6	27.3	-37.8	0	0	0	112.8	S429 I432 N450 I501 R508 Y510	S429-P503 VanDerWaalsContact O-CB 3.3Å; S429-P503 WeakPolarHBondContact O-CB 3.48Å; I432-P503 WeakPolarHBondContact O-CG 3.37Å; N450-P503 WeakPolarHBondContact ND2-CD 3.01Å; I501-P503 WeakPolarHBondContact O-CD 3.23Å; P503-R508 WeakPolarHBondContact O-CD 3.32Å; P503-R508 PolarHBondContact O-NH1 3.32Å; P503-Y510 WeakPolarHBondContact CA-OH 3.42Å
504	N	87	Confident	87.2	Confident	133 Å²	133	38 Å²	38	71%	0.711	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-16.5	179.9	-54.2	-76.3	0	0	0	112.8	D502	D502-N504 PolarHBondContact O-N 3.03Å; D502-N504 WeakPolarHBondContact OD1-CB 3.47Å; D502-N504 PolarHBondContact OD1-N 2.71Å; D502-N504 PolarHBondContact OD1-ND2 2.81Å; D502-N504 VanDerWaalsContact OD1-ND2 3.16Å
505	S	87.7	Confident	87.1	Confident	9 Å²	9	38.3 Å²	38.3	6%	0.063	21%	0.205	C	C	.	.			trans	-74.9	130.8	-178.3	177.1	0	0	0	0	111.5	C500 D502 Y507 R508	C500-S505 VanDerWaalsContact SG-CB 3.57Å; C500-S505 PolarHBondContact SG-OG 2.88Å; D502-S505 WeakPolarHBondContact O-CB 3.45Å; D502-S505 PolarHBondContact O-N 3.04Å; D502-S505 VanDerWaalsContact O-N 3.11Å; D502-S505 PolarHBondContact OD2-N 3.13Å; S505-Y507 PolarHBondContact O-N 2.78Å; S505-Y507 PolarHBondContact OG-N 3.46Å; S505-R508 WeakPolarHBondContact O-CG 3.03Å; S505-R508 PolarHBondContact O-N 3.42Å
506	P	85.2	Confident	87.1	Confident	95 Å²	95	34 Å²	34	62%	0.617	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.7	172.3	27	-34	0	0	0	111.8	K421	K421-P506 WeakPolarHBondContact CE-O 3.21Å; K421-P506 PolarHBondContact NZ-O 2.93Å
507	Y	88	Confident	87.1	Confident	84 Å²	84	34.9 Å²	34.9	33%	0.329	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-2.6	-177.8	-62.4	-73	0	0	0	114.9	E491 V496 S505	E491-Y507 HydrophobicContact CB-CD1 4.36Å; E491-Y507 HydrophobicContact CB-CE1 4.2Å; E491-Y507 HydrophobicContact CG-CE1 3.95Å; E491-Y507 VanDerWaalsContact OE1-CE1 3.32Å; E491-Y507 WeakPolarHBondContact OE1-CE1 3.47Å; E491-Y507 PolarHBondContact OE1-OH 2.87Å; E491-Y507 WeakPolarHBondContact OE2-CE1 3.17Å; V496-Y507 HydrophobicContact CG2-CD1 4.45Å; S505-Y507 PolarHBondContact O-N 2.78Å; S505-Y507 PolarHBondContact OG-N 3.46Å
508	R	89.3	Confident	87.1	Confident	24 Å²	24	38.7 Å²	38.7	9%	0.091	20%	0.196	C	C	.	.			trans	-55	144.5	-176.3	73.8	-176.9	-171.7	-113	-11.9	113.9	K421 C500 D502 P503 S505 Y510 E515	K421-R508 WeakPolarHBondContact CD-O 3.4Å; K421-R508 WeakPolarHBondContact CE-O 2.98Å; K421-R508 PolarHBondContact NZ-O 3.39Å; C500-R508 VanDerWaalsContact O-CA 3.32Å; C500-R508 WeakPolarHBondContact O-CA 3.45Å; D502-R508 VanDerWaalsContact O-CB 3.29Å; D502-R508 WeakPolarHBondContact O-CB 3.41Å; P503-R508 WeakPolarHBondContact O-CD 3.32Å; P503-R508 PolarHBondContact O-NH1 3.32Å; S505-R508 WeakPolarHBondContact O-CG 3.03Å; S505-R508 PolarHBondContact O-N 3.42Å; R508-Y510 VanDerWaalsContact C-N 3.28Å; R508-Y510 PolarHBondContact NE-O 2.98Å; R508-Y510 PolarHBondContact O-N 3.23Å; R508-E515 IonicContact CZ-OE1 3.71Å; R508-E515 IonicContact CZ-OE2 2.82Å; R508-E515 IonicContact NH1-OE1 3.24Å; R508-E515 IonicContact NH2-OE1 3Å; R508-E515 PolarHBondContact NH2-OE1 3.3Å; R508-E515 IonicContact NH2-OE2 2.79Å; R508-E515 PolarHBondContact NH2-OE2 3.23Å
509	A	89.2	Confident	87.3	Confident	1 Å²	1	37 Å²	37	1%	0.008	19%	0.186	C	C	.	.	S	Bend	trans	-68.9	-16.8	-173.2	0	0	0	0	0	115.3	K421 K422 I445 T497 C500	K421-A509 WeakPolarHBondContact CA-O 3.5Å; K422-A509 PolarHBondContact N-O 3.31Å; I445-A509 HydrophobicContact CD1-CB 4.06Å; I445-A509 HydrophobicContact CG1-CB 3.99Å; T497-A509 VanDerWaalsContact O-CB 3.26Å; T497-A509 WeakPolarHBondContact O-CB 3.48Å; C500-A509 PolarHBondContact O-N 2.64Å
510	Y	89.7	Confident	87.3	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	162.3	-169.9	60.5	-101.5	0	0	0	114.1	K422 I432 I445 T446 I501 P503 R508	K422-Y510 VanDerWaalsContact O-CA 3.3Å; K422-Y510 WeakPolarHBondContact O-CA 3.44Å; I432-Y510 HydrophobicContact CD1-CD2 3.72Å; I432-Y510 HydrophobicContact CD1-CE1 4.21Å; I432-Y510 HydrophobicContact CD1-CE2 3.18Å; I432-Y510 HydrophobicContact CD1-CG 4.46Å; I432-Y510 VanDerWaalsContact CD1-CZ 3.45Å; I432-Y510 WeakPolarHBondContact CG2-OH 3.35Å; I445-Y510 WeakPolarHBondContact O-CD1 3.13Å; T446-Y510 HydrophobicContact CG2-CD1 4.04Å; T446-Y510 HydrophobicContact CG2-CD2 4.48Å; T446-Y510 HydrophobicContact CG2-CE1 4.33Å; T446-Y510 HydrophobicContact CG2-CG 4.12Å; I501-Y510 HydrophobicContact CB-CE1 4.29Å; I501-Y510 PolarHBondContact O-OH 3.26Å; P503-Y510 WeakPolarHBondContact CA-OH 3.42Å; R508-Y510 VanDerWaalsContact C-N 3.28Å; R508-Y510 PolarHBondContact NE-O 2.98Å; R508-Y510 PolarHBondContact O-N 3.23Å
511	V	89.3	Confident	87.2	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.018	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	151.1	177.2	68.1	0	0	0	0	109.8	L418 K421 K422 V423 V424 E515 Y516	L418-V511 HydrophobicContact CD1-CG2 4.39Å; K421-V511 HydrophobicContact CB-CB 4.22Å; K421-V511 HydrophobicContact CB-CG1 3.95Å; K421-V511 HydrophobicContact CD-CB 4.23Å; K422-V511 PolarHBondContact O-N 3.26Å; V423-V511 WeakPolarHBondContact CA-O 3.31Å; V423-V511 HydrophobicContact CG2-CG1 4.03Å; V424-V511 PolarHBondContact N-O 3.35Å; V424-V511 VanDerWaalsContact N-O 3.08Å; V511-E515 HydrophobicContact CG2-CB 3.86Å; V511-E515 HydrophobicContact CG2-CG 3.87Å; V511-E515 WeakPolarHBondContact CG2-OE2 3.47Å; V511-Y516 HydrophobicContact CG1-CD2 4.19Å
512	S	85.5	Confident	87	Confident	7 Å²	7	43 Å²	43	5%	0.049	22%	0.219	C	C	.	.			trans	-80	160.4	170.1	79.8	0	0	0	0	110.7	C427 E514 E515 Y516	C427-S512 WeakPolarHBondContact O-CB 2.96Å; S512-E514 VanDerWaalsContact C-N 3.32Å; S512-E514 PolarHBondContact O-N 3.45Å; S512-E515 PolarHBondContact O-N 3.27Å; S512-E515 VanDerWaalsContact OG-CB 3.23Å; S512-E515 WeakPolarHBondContact OG-CB 3.5Å; S512-E515 PolarHBondContact OG-N 3.41Å; S512-Y516 VanDerWaalsContact O-CB 3.29Å; S512-Y516 WeakPolarHBondContact O-CB 3.02Å; S512-Y516 PolarHBondContact O-N 3.23Å
513	I	84.1	Confident	86.6	Confident	24 Å²	24	43.8 Å²	43.8	12%	0.123	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-37.5	178.2	-174.3	58.4	0	0	0	112	V423 K517 V560	V423-I513 HydrophobicContact CG1-CB 3.91Å; V423-I513 HydrophobicContact CG1-CD1 4.34Å; I513-K517 HydrophobicContact CD1-CG 4.41Å; I513-K517 WeakPolarHBondContact O-CB 3.34Å; I513-K517 WeakPolarHBondContact O-CG 3.25Å; I513-K517 PolarHBondContact O-N 2.89Å; I513-V560 HydrophobicContact CD1-CG1 4.04Å; I513-V560 HydrophobicContact CD1-CG2 3.95Å
514	E	78.6	Confident	86.5	Confident	92 Å²	92	43 Å²	43	43%	0.43	22%	0.221	S	C	.	.	H	α-helix	trans	-68.1	-44.9	175.6	-65.7	-179.9	-161.3	0	0	111.6	S512 Y516 K517 R518	S512-E514 VanDerWaalsContact C-N 3.32Å; S512-E514 PolarHBondContact O-N 3.45Å; E514-Y516 VanDerWaalsContact C-N 3.31Å; E514-Y516 PolarHBondContact O-N 3.3Å; E514-K517 PolarHBondContact O-N 2.98Å; E514-R518 WeakPolarHBondContact O-CB 3.41Å; E514-R518 PolarHBondContact O-N 3.36Å
515	E	85.1	Confident	86.1	Confident	43 Å²	43	38.8 Å²	38.8	20%	0.201	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-39.5	177	-174.5	-178.9	-158.4	0	0	110.9	R508 V511 S512 T519	R508-E515 IonicContact CZ-OE1 3.71Å; R508-E515 IonicContact CZ-OE2 2.82Å; R508-E515 IonicContact NH1-OE1 3.24Å; R508-E515 IonicContact NH2-OE1 3Å; R508-E515 PolarHBondContact NH2-OE1 3.3Å; R508-E515 IonicContact NH2-OE2 2.79Å; R508-E515 PolarHBondContact NH2-OE2 3.23Å; V511-E515 HydrophobicContact CG2-CB 3.86Å; V511-E515 HydrophobicContact CG2-CG 3.87Å; V511-E515 WeakPolarHBondContact CG2-OE2 3.47Å; S512-E515 PolarHBondContact O-N 3.27Å; S512-E515 VanDerWaalsContact OG-CB 3.23Å; S512-E515 WeakPolarHBondContact OG-CB 3.5Å; S512-E515 PolarHBondContact OG-N 3.41Å; E515-T519 WeakPolarHBondContact O-CB 3.38Å; E515-T519 PolarHBondContact O-N 2.84Å; E515-T519 PolarHBondContact O-OG1 3.17Å
516	Y	89	Confident	85.7	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-59.1	-54.2	173.6	-179.3	-88.4	0	0	0	111.2	L373 L418 V511 S512 E514 R518 T519 L520 A531 F532 V533	L373-Y516 HydrophobicContact CD1-CE2 4.41Å; L418-Y516 HydrophobicContact CD1-CD2 3.78Å; L418-Y516 HydrophobicContact CD1-CE2 4.29Å; L418-Y516 HydrophobicContact CD2-CD2 4.04Å; L418-Y516 HydrophobicContact CD2-CE2 3.99Å; L418-Y516 HydrophobicContact CG-CD2 3.82Å; L418-Y516 HydrophobicContact CG-CE2 3.8Å; V511-Y516 HydrophobicContact CG1-CD2 4.19Å; S512-Y516 VanDerWaalsContact O-CB 3.29Å; S512-Y516 WeakPolarHBondContact O-CB 3.02Å; S512-Y516 PolarHBondContact O-N 3.23Å; E514-Y516 VanDerWaalsContact C-N 3.31Å; E514-Y516 PolarHBondContact O-N 3.3Å; Y516-R518 PolarHBondContact O-N 2.78Å; Y516-T519 PolarHBondContact O-N 3.38Å; Y516-L520 HydrophobicContact CD1-CD1 4.06Å; Y516-L520 HydrophobicContact CD1-CG 4.49Å; Y516-L520 HydrophobicContact CE1-CD1 3.44Å; Y516-L520 VanDerWaalsContact CE1-CD1 3.44Å; Y516-L520 HydrophobicContact CE1-CG 4.14Å; Y516-L520 WeakPolarHBondContact O-CG 3.23Å; Y516-L520 PolarHBondContact O-N 2.87Å; Y516-A531 HydrophobicContact CE1-CB 4.17Å; Y516-F532 PolarHBondContact OH-O 3.47Å; Y516-V533 HydrophobicContact CD1-CG1 3.96Å; Y516-V533 HydrophobicContact CD2-CG1 4.49Å; Y516-V533 HydrophobicContact CE1-CG1 3.64Å; Y516-V533 HydrophobicContact CE2-CG1 4.19Å; Y516-V533 HydrophobicContact CG-CG1 4.4Å
517	K	87.4	Confident	85.9	Confident	18 Å²	18	37.1 Å²	37.1	8%	0.078	18%	0.183	C	C	.	.	H	α-helix	trans	-64.8	-39.9	-179.9	-72.4	-169	-174.3	-170	0	112.8	I513 E514 T519 L520 N521 H556 G557	I513-K517 HydrophobicContact CD1-CG 4.41Å; I513-K517 WeakPolarHBondContact O-CB 3.34Å; I513-K517 WeakPolarHBondContact O-CG 3.25Å; I513-K517 PolarHBondContact O-N 2.89Å; E514-K517 PolarHBondContact O-N 2.98Å; K517-T519 VanDerWaalsContact C-N 3.33Å; K517-T519 PolarHBondContact O-N 3.36Å; K517-L520 PolarHBondContact O-N 2.89Å; K517-N521 PolarHBondContact O-N 2.04Å; K517-H556 WeakPolarHBondContact CD-O 3.29Å; K517-H556 WeakPolarHBondContact CE-O 3.48Å; K517-H556 PolarHBondContact NZ-O 2.86Å; K517-G557 PolarHBondContact NZ-O 3.44Å
518	R	86.1	Confident	86.2	Confident	116 Å²	116	33.2 Å²	33.2	44%	0.438	17%	0.168	S	C	.	.	H	α-helix	trans	-62.4	-37.9	173.5	-168	-179.2	-72.9	133.8	2.1	112.1	E58 E514 Y516 N521	E58-R518 IonicContact OE1-NE 3.94Å; E514-R518 WeakPolarHBondContact O-CB 3.41Å; E514-R518 PolarHBondContact O-N 3.36Å; Y516-R518 PolarHBondContact O-N 2.78Å; R518-N521 PolarHBondContact O-N 2.77Å
519	T	87.2	Confident	86.4	Confident	64 Å²	64	32.6 Å²	32.6	39%	0.393	17%	0.167	S	C	.	.	H	α-helix	trans	-71.4	-31.9	177.3	-56.8	0	0	0	0	112.1	V415 L418 E515 Y516 K517	V415-T519 HydrophobicContact CG1-CG2 3.79Å; L418-T519 HydrophobicContact CD1-CG2 4.41Å; L418-T519 HydrophobicContact CD2-CG2 3.93Å; E515-T519 WeakPolarHBondContact O-CB 3.38Å; E515-T519 PolarHBondContact O-N 2.84Å; E515-T519 PolarHBondContact O-OG1 3.17Å; Y516-T519 PolarHBondContact O-N 3.38Å; K517-T519 VanDerWaalsContact C-N 3.33Å; K517-T519 PolarHBondContact O-N 3.36Å
520	L	89.2	Confident	86.7	Confident	8 Å²	8	32.5 Å²	32.5	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-68.9	-37.4	168.4	-65.8	-178.4	0	0	0	112.1	V371 L373 M413 L418 Y516 K517 V522 A531	V371-L520 HydrophobicContact CG1-CD1 4.17Å; V371-L520 HydrophobicContact CG1-CD2 4.13Å; L373-L520 HydrophobicContact CD1-CD2 4.49Å; L373-L520 HydrophobicContact CD2-CD2 3.78Å; L373-L520 HydrophobicContact CG-CD2 4.49Å; M413-L520 WeakPolarHBondContact CE-O 3.47Å; L418-L520 HydrophobicContact CD2-CD2 3.9Å; L418-L520 HydrophobicContact CD2-CG 4.36Å; Y516-L520 HydrophobicContact CD1-CD1 4.06Å; Y516-L520 HydrophobicContact CD1-CG 4.49Å; Y516-L520 HydrophobicContact CE1-CD1 3.44Å; Y516-L520 VanDerWaalsContact CE1-CD1 3.44Å; Y516-L520 HydrophobicContact CE1-CG 4.14Å; Y516-L520 WeakPolarHBondContact O-CG 3.23Å; Y516-L520 PolarHBondContact O-N 2.87Å; K517-L520 PolarHBondContact O-N 2.89Å; L520-V522 VanDerWaalsContact C-N 3.28Å; L520-V522 HydrophobicContact CB-CG2 4.17Å; L520-V522 WeakPolarHBondContact O-CG2 3.38Å; L520-V522 PolarHBondContact O-N 3.28Å; L520-A531 HydrophobicContact CD1-CB 3.78Å
521	N	87.9	Confident	86.9	Confident	112 Å²	112	32.8 Å²	32.8	60%	0.599	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	40.3	-178.9	-167.7	31.1	0	0	0	113.4	K517 R518	K517-N521 PolarHBondContact O-N 2.04Å; R518-N521 PolarHBondContact O-N 2.77Å
522	V	86	Confident	87.1	Confident	20 Å²	20	33.1 Å²	33.1	12%	0.121	17%	0.171	C	C	.	.			trans	-104.6	103.1	-177.8	179	0	0	0	0	110	K369 V371 M413 L520	K369-V522 HydrophobicContact CD-CG1 4Å; K369-V522 VanDerWaalsContact NZ-CG1 3.27Å; V371-V522 HydrophobicContact CG1-CG2 4.32Å; V371-V522 HydrophobicContact CG2-CB 4.36Å; V371-V522 HydrophobicContact CG2-CG1 3.96Å; V371-V522 HydrophobicContact CG2-CG2 4.1Å; M413-V522 HydrophobicContact SD-CG2 4.01Å; L520-V522 VanDerWaalsContact C-N 3.28Å; L520-V522 HydrophobicContact CB-CG2 4.17Å; L520-V522 WeakPolarHBondContact O-CG2 3.38Å; L520-V522 PolarHBondContact O-N 3.28Å
523	S	81.9	Confident	87.3	Confident	41 Å²	41	33 Å²	33	29%	0.287	17%	0.169	S	C	.	.			trans	-63.2	138.7	179.4	165.3	0	0	0	0	113.3	K369 E525	K369-S523 WeakPolarHBondContact CE-O 3.37Å; K369-S523 PolarHBondContact NZ-O 3.16Å; S523-E525 WeakPolarHBondContact OG-CB 3.19Å; S523-E525 PolarHBondContact OG-N 3.36Å
524	N	83.9	Confident	87.5	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.011	19%	0.185	C	C	.	.			trans	-90.6	10.6	177.6	-152	53.5	0	0	0	114.1	S527 L528 S529 A552 F553 S554 G558 W691	N524-S527 PolarHBondContact OD1-O 2.77Å; N524-L528 WeakPolarHBondContact OD1-CA 3.41Å; N524-S529 WeakPolarHBondContact OD1-CB 3.44Å; N524-S529 PolarHBondContact OD1-N 2.92Å; N524-S529 PolarHBondContact OD1-OG 3.07Å; N524-A552 PolarHBondContact ND2-O 3Å; N524-F553 CarbonylContact C-O 3.5Å; N524-F553 WeakPolarHBondContact CA-O 3.35Å; N524-F553 PolarHBondContact N-O 2.74Å; N524-S554 VanDerWaalsContact CB-O 3.31Å; N524-S554 WeakPolarHBondContact CB-O 3.29Å; N524-S554 PolarHBondContact N-O 3.33Å; N524-G558 PolarHBondContact ND2-N 2.89Å; N524-W691 WeakPolarHBondContact ND2-CZ2 3.12Å; N524-W691 PolarHBondContact O-NE1 2.75Å
525	E	77.7	Confident	87.8	Confident	45 Å²	45	32.5 Å²	32.5	21%	0.21	17%	0.166	C	C	.	.	S	Bend	trans	-58.8	-56.5	-172.4	-171.6	174.9	-151.6	0	0	114.9	Y60 S523 F553 W691 P731 Q737	Y60-E525 WeakPolarHBondContact OH-CB 3.21Å; Y60-E525 WeakPolarHBondContact OH-CG 3.49Å; Y60-E525 PolarHBondContact OH-OE1 3.35Å; S523-E525 WeakPolarHBondContact OG-CB 3.19Å; S523-E525 PolarHBondContact OG-N 3.36Å; E525-F553 PolarHBondContact N-O 3.04Å; E525-W691 PolarHBondContact O-NE1 3.38Å; E525-P731 WeakPolarHBondContact OE1-CG 3.18Å; E525-Q737 PolarHBondContact OE1-NE2 3.45Å
526	N	80.5	Confident	87.5	Confident	53 Å²	53	31.6 Å²	31.6	28%	0.283	17%	0.165	S	C	.	.	S	Bend	trans	-109.6	1.8	-165.3	-74.4	-63.1	0	0	0	113.4
527	S	89.3	Confident	86.5	Confident	17 Å²	17	35.2 Å²	35.2	12%	0.119	18%	0.184	C	C	.	.	S	Bend	trans	-167.9	141.3	178.3	53.5	0	0	0	0	110	R367 K369 N524 S529	R367-S527 VanDerWaalsContact O-CA 3.28Å; R367-S527 WeakPolarHBondContact O-CA 3.06Å; K369-S527 WeakPolarHBondContact CD-OG 3.39Å; K369-S527 WeakPolarHBondContact CE-OG 3.43Å; N524-S527 PolarHBondContact OD1-O 2.77Å; S527-S529 PolarHBondContact O-N 3.21Å
528	L	93.1	Very high	85.2	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	126.5	173.4	-179	64.8	0	0	0	111.1	R367 Y368 K369 W406 N524 V559 L579 A582 W691	R367-L528 PolarHBondContact O-N 3.08Å; Y368-L528 CarbonylContact C-O 3.56Å; Y368-L528 WeakPolarHBondContact CA-O 3.3Å; Y368-L528 WeakPolarHBondContact CB-O 3.27Å; K369-L528 PolarHBondContact N-O 2.64Å; W406-L528 HydrophobicContact CH2-CD2 3.99Å; W406-L528 HydrophobicContact CZ3-CB 4.33Å; W406-L528 HydrophobicContact CZ3-CD2 4.06Å; N524-L528 WeakPolarHBondContact OD1-CA 3.41Å; L528-V559 HydrophobicContact CD1-CG2 4.3Å; L528-V559 HydrophobicContact CD2-CG2 4.47Å; L528-L579 HydrophobicContact CD2-CD1 3.66Å; L528-L579 HydrophobicContact CD2-CD2 4.11Å; L528-L579 HydrophobicContact CD2-CG 3.57Å; L528-A582 HydrophobicContact CD1-CB 4.17Å; L528-A582 HydrophobicContact CD2-CB 4.05Å; L528-W691 HydrophobicContact CB-CD2 4.42Å; L528-W691 HydrophobicContact CB-CE3 4Å; L528-W691 HydrophobicContact CB-CH2 4Å; L528-W691 HydrophobicContact CB-CZ2 4.38Å; L528-W691 HydrophobicContact CB-CZ3 3.79Å; L528-W691 HydrophobicContact CD1-CH2 3.62Å; L528-W691 HydrophobicContact CD1-CZ2 4.29Å; L528-W691 HydrophobicContact CD1-CZ3 4.02Å; L528-W691 HydrophobicContact CD2-CZ3 4.45Å; L528-W691 HydrophobicContact CG-CH2 4.34Å; L528-W691 HydrophobicContact CG-CZ3 4.3Å
529	S	94	Very high	84.4	Confident	11 Å²	11	38.1 Å²	38.1	8%	0.077	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	131.2	-177.2	-47	0	0	0	0	109.9	K369 N524 S527 G558 V559	K369-S529 WeakPolarHBondContact CE-OG 3.31Å; N524-S529 WeakPolarHBondContact OD1-CB 3.44Å; N524-S529 PolarHBondContact OD1-N 2.92Å; N524-S529 PolarHBondContact OD1-OG 3.07Å; S527-S529 PolarHBondContact O-N 3.21Å; S529-G558 CarbonylContact O-C 3.55Å; S529-G558 WeakPolarHBondContact O-CA 3.39Å; S529-V559 PolarHBondContact O-N 3.32Å
530	V	95.4	Very high	83.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.4	176.2	-176	0	0	0	0	108.2	Y368 K369 V370 V371 V559 V561 F566 L575	Y368-V530 HydrophobicContact CD2-CG2 4.08Å; K369-V530 PolarHBondContact O-N 2.95Å; V370-V530 WeakPolarHBondContact CA-O 3.02Å; V371-V530 PolarHBondContact N-O 3.07Å; V530-V559 WeakPolarHBondContact CA-O 3.42Å; V530-V559 HydrophobicContact CG2-CB 4.4Å; V530-V561 HydrophobicContact CG1-CG2 4.13Å; V530-F566 HydrophobicContact CG1-CE2 4.39Å; V530-L575 HydrophobicContact CG1-CD1 3.81Å; V530-L575 HydrophobicContact CG2-CD1 4.21Å
531	A	94.1	Very high	83.6	Confident	7 Å²	7	40 Å²	40	6%	0.058	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	166.6	178.8	0	0	0	0	0	112.4	V371 Y516 L520 V559 V560 V561	V371-A531 HydrophobicContact CB-CB 4.16Å; Y516-A531 HydrophobicContact CE1-CB 4.17Å; L520-A531 HydrophobicContact CD1-CB 3.78Å; A531-V559 PolarHBondContact N-O 3.45Å; A531-V560 HydrophobicContact CB-CG1 4.33Å; A531-V560 VanDerWaalsContact O-CA 3.31Å; A531-V560 WeakPolarHBondContact O-CA 3.45Å; A531-V561 PolarHBondContact O-N 2.91Å
532	F	93	Very high	83.6	Confident	11 Å²	11	35.3 Å²	35.3	5%	0.048	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.2	-172.2	-57	-70	0	0	0	113.4	V370 V371 N372 T382 V383 Y516 V561 P563 F566	V370-F532 HydrophobicContact CG1-CE2 3.55Å; V370-F532 HydrophobicContact CG1-CZ 3.59Å; V371-F532 WeakPolarHBondContact O-CD2 3.47Å; N372-F532 HydrophobicContact CB-CE2 4.42Å; T382-F532 HydrophobicContact CG2-CB 3.93Å; T382-F532 HydrophobicContact CG2-CG 4.37Å; V383-F532 HydrophobicContact CB-CZ 4.42Å; V383-F532 HydrophobicContact CG1-CD1 4.06Å; V383-F532 HydrophobicContact CG1-CE1 3.91Å; V383-F532 HydrophobicContact CG1-CE2 4.36Å; V383-F532 HydrophobicContact CG1-CG 4.37Å; V383-F532 HydrophobicContact CG1-CZ 4.06Å; V383-F532 HydrophobicContact CG2-CD2 4.29Å; V383-F532 HydrophobicContact CG2-CE1 4.16Å; V383-F532 HydrophobicContact CG2-CE2 3.53Å; V383-F532 HydrophobicContact CG2-CZ 3.46Å; V383-F532 VanDerWaalsContact CG2-CZ 3.46Å; Y516-F532 PolarHBondContact OH-O 3.47Å; F532-V561 WeakPolarHBondContact CA-O 3.14Å; F532-V561 HydrophobicContact CD1-CG2 4.04Å; F532-V561 HydrophobicContact CE1-CG2 4.04Å; F532-P563 HydrophobicContact CB-CB 4.33Å; F532-P563 HydrophobicContact CD1-CB 4.32Å; F532-F566 HydrophobicContact CE1-CB 4.01Å; F532-F566 AromaticContact CE1-CD1 3.81Å; F532-F566 HydrophobicContact CE1-CD1 3.81Å; F532-F566 AromaticContact CE1-CD2 3.65Å; F532-F566 HydrophobicContact CE1-CD2 3.65Å; F532-F566 HydrophobicContact CE1-CE1 4.12Å; F532-F566 AromaticContact CE1-CE2 3.93Å; F532-F566 HydrophobicContact CE1-CE2 3.93Å; F532-F566 AromaticContact CE1-CG 3.57Å; F532-F566 HydrophobicContact CE1-CG 3.57Å; F532-F566 HydrophobicContact CE1-CZ 4.17Å; F532-F566 HydrophobicContact CZ-CD1 4.05Å; F532-F566 HydrophobicContact CZ-CD2 4.19Å; F532-F566 AromaticContact CZ-CE1 3.9Å; F532-F566 HydrophobicContact CZ-CE1 3.9Å; F532-F566 AromaticContact CZ-CE2 3.99Å; F532-F566 HydrophobicContact CZ-CE2 3.99Å; F532-F566 HydrophobicContact CZ-CG 4.21Å; F532-F566 AromaticContact CZ-CZ 3.87Å; F532-F566 HydrophobicContact CZ-CZ 3.87Å
533	V	89.8	Confident	83.7	Confident	3 Å²	3	37 Å²	37	2%	0.018	21%	0.212	C	C	.	.			trans	-131.5	144.8	-177.6	-61.4	0	0	0	0	111.3	V423 Y516 W535 V560 V561 Q562 P563	V423-V533 HydrophobicContact CG2-CB 3.81Å; V423-V533 HydrophobicContact CG2-CG1 3.79Å; Y516-V533 HydrophobicContact CD1-CG1 3.96Å; Y516-V533 HydrophobicContact CD2-CG1 4.49Å; Y516-V533 HydrophobicContact CE1-CG1 3.64Å; Y516-V533 HydrophobicContact CE2-CG1 4.19Å; Y516-V533 HydrophobicContact CG-CG1 4.4Å; V533-W535 HydrophobicContact CG2-CD2 4.19Å; V533-W535 HydrophobicContact CG2-CZ2 3.86Å; V533-V560 HydrophobicContact CG1-CB 3.98Å; V533-V560 HydrophobicContact CG1-CG1 4.05Å; V533-V560 HydrophobicContact CG2-CB 3.86Å; V533-V560 HydrophobicContact CG2-CG2 4.01Å; V533-V561 PolarHBondContact N-O 3.1Å; V533-V561 VanDerWaalsContact N-O 3.08Å; V533-Q562 WeakPolarHBondContact O-CA 3.32Å; V533-P563 WeakPolarHBondContact O-CD 3.39Å
534	E	87.8	Confident	84.1	Confident	97 Å²	97	35.5 Å²	35.5	45%	0.453	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.2	161.2	-72.4	-161.9	-178.7	0	0	109.3	K422 V423	K422-E534 CarbonylContact C-O 3.54Å; K422-E534 VanDerWaalsContact CA-O 3.31Å; K422-E534 WeakPolarHBondContact CA-O 3.38Å; K422-E534 HydrophobicContact CD-CB 4.48Å; K422-E534 WeakPolarHBondContact CE-OE2 3.42Å; K422-E534 HydrophobicContact CG-CB 4.15Å; K422-E534 IonicContact NZ-OE2 2.67Å; K422-E534 PolarHBondContact NZ-OE2 2.72Å; V423-E534 PolarHBondContact N-O 2.98Å
535	W	84.6	Confident	84.2	Confident	10 Å²	10	35.9 Å²	35.9	4%	0.038	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	141.6	176.9	-60.5	101.3	0	0	0	111.2	V423 F425 V533 N537 M540 L543 V560	V423-W535 HydrophobicContact CB-CE3 4.02Å; V423-W535 HydrophobicContact CB-CZ3 4.22Å; V423-W535 HydrophobicContact CG1-CE3 3.89Å; V423-W535 HydrophobicContact CG1-CZ3 3.63Å; F425-W535 HydrophobicContact CB-CZ3 4.33Å; F425-W535 HydrophobicContact CD2-CH2 4.46Å; F425-W535 HydrophobicContact CD2-CZ3 4.08Å; V533-W535 HydrophobicContact CG2-CD2 4.19Å; V533-W535 HydrophobicContact CG2-CZ2 3.86Å; W535-N537 VanDerWaalsContact C-N 3.33Å; W535-N537 PolarHBondContact O-N 2.98Å; W535-M540 HydrophobicContact CD2-CB 4.03Å; W535-M540 HydrophobicContact CD2-CE 3.9Å; W535-M540 HydrophobicContact CE3-CE 3.45Å; W535-M540 VanDerWaalsContact CE3-CE 3.45Å; W535-M540 HydrophobicContact CG-CB 4.01Å; W535-M540 HydrophobicContact CH2-CE 4.07Å; W535-M540 HydrophobicContact CH2-SD 4.5Å; W535-M540 HydrophobicContact CZ2-CB 4.48Å; W535-M540 HydrophobicContact CZ2-CE 4.47Å; W535-M540 HydrophobicContact CZ3-CE 3.55Å; W535-M540 PolarHBondContact NE1-O 2.92Å; W535-L543 HydrophobicContact CH2-CB 4.02Å; W535-L543 HydrophobicContact CH2-CD2 4.07Å; W535-L543 HydrophobicContact CZ2-CB 3.92Å; W535-V560 HydrophobicContact CH2-CG2 4.04Å; W535-V560 HydrophobicContact CZ2-CG2 3.78Å
536	S	79.2	Confident	84.6	Confident	23 Å²	23	35 Å²	35	16%	0.161	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-30.8	-177.2	72.4	0	0	0	0	113.4	V423 H443	V423-S536 WeakPolarHBondContact O-CB 3.26Å; V423-S536 PolarHBondContact O-N 3.09Å; V423-S536 PolarHBondContact O-OG 2.84Å; H443-S536 PolarHBondContact CD2-OG 3.41Å; H443-S536 VanDerWaalsContact CE1-C 3.49Å; H443-S536 WeakPolarHBondContact CE1-CB 3.44Å; H443-S536 PolarHBondContact CE1-O 2.77Å; H443-S536 PolarHBondContact CE1-OG 3.28Å; H443-S536 WeakPolarHBondContact NE2-CB 3.31Å; H443-S536 PolarHBondContact NE2-O 2.86Å; H443-S536 PolarHBondContact NE2-OG 2.96Å
537	N	69.2	Low	84.5	Confident	80 Å²	80	32.5 Å²	32.5	43%	0.428	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	0.1	-176.2	64.2	-10.3	0	0	0	114.8	W535 D539	W535-N537 VanDerWaalsContact C-N 3.33Å; W535-N537 PolarHBondContact O-N 2.98Å; N537-D539 PolarHBondContact O-N 3.36Å
538	G	59.9	Low	83.5	Confident	46 Å²	46	33.5 Å²	33.5	47%	0.474	19%	0.187	S	C	.	.	S	Bend	trans	74.1	-30.5	172.6	0	0	0	0	0	117.5	Q562	G538-Q562 PolarHBondContact O-NE2 2.89Å
539	D	68.1	Low	82.2	Confident	149 Å²	149	36.3 Å²	36.3	80%	0.797	20%	0.201	S	C	*	.			trans	-75.1	-23.2	-169.8	-71.4	-22.3	0	0	0	115.2	N537	N537-D539 PolarHBondContact O-N 3.36Å
540	M	75.7	Confident	80.7	Confident	49 Å²	49	36.4 Å²	36.4	24%	0.241	20%	0.2	C	C	.	.			trans	-86	129.8	177.3	-73.8	-168.3	-71.8	0	0	111.8	F425 W535 Q562	F425-M540 HydrophobicContact CB-CE 3.76Å; F425-M540 HydrophobicContact CD2-CE 4.18Å; F425-M540 HydrophobicContact CG-CE 4Å; W535-M540 HydrophobicContact CD2-CB 4.03Å; W535-M540 HydrophobicContact CD2-CE 3.9Å; W535-M540 HydrophobicContact CE3-CE 3.45Å; W535-M540 VanDerWaalsContact CE3-CE 3.45Å; W535-M540 HydrophobicContact CG-CB 4.01Å; W535-M540 HydrophobicContact CH2-CE 4.07Å; W535-M540 HydrophobicContact CH2-SD 4.5Å; W535-M540 HydrophobicContact CZ2-CB 4.48Å; W535-M540 HydrophobicContact CZ2-CE 4.47Å; W535-M540 HydrophobicContact CZ3-CE 3.55Å; W535-M540 PolarHBondContact NE1-O 2.92Å; M540-Q562 PolarHBondContact O-NE2 2.93Å
541	I	83.7	Confident	79.4	Confident	64 Å²	64	39.9 Å²	39.9	33%	0.328	22%	0.215	S	C	.	.			trans	-88.4	-45	176.6	-63.9	176	0	0	0	110.8	Q562 R565 N574	I541-Q562 PolarHBondContact O-N 3.3Å; I541-R565 HydrophobicContact CG2-CB 4.02Å; I541-R565 HydrophobicContact CG2-CG 4.26Å; I541-N574 HydrophobicContact CG2-CB 3.92Å
542	G	87.8	Confident	78.2	Confident	12 Å²	12	39.6 Å²	39.6	12%	0.124	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	176.7	179	0	0	0	0	0	111.9	V560 E578	G542-V560 CarbonylContact C-O 3.54Å; G542-V560 WeakPolarHBondContact CA-O 3.49Å; G542-E578 VanDerWaalsContact C-OE1 3.27Å; G542-E578 VanDerWaalsContact CA-OE1 3.29Å; G542-E578 WeakPolarHBondContact CA-OE1 3.44Å
543	L	89	Confident	77.1	Confident	56 Å²	56	39.9 Å²	39.9	29%	0.293	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	128.6	172.2	176.7	69.9	0	0	0	108.6	F425 W535 V559 V560	F425-L543 HydrophobicContact CD2-CD2 4.4Å; F425-L543 HydrophobicContact CE2-CD2 3.8Å; W535-L543 HydrophobicContact CH2-CB 4.02Å; W535-L543 HydrophobicContact CH2-CD2 4.07Å; W535-L543 HydrophobicContact CZ2-CB 3.92Å; L543-V559 WeakPolarHBondContact O-CA 3.03Å; L543-V560 HydrophobicContact CB-CG2 3.85Å; L543-V560 PolarHBondContact N-O 2.97Å; L543-V560 PolarHBondContact O-N 2.89Å
544	S	91.1	Very high	76.1	Confident	9 Å²	9	40.2 Å²	40.2	6%	0.063	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	148.1	177.7	179.4	0	0	0	0	111.7	E578 A582	S544-E578 VanDerWaalsContact CB-O 3.3Å; S544-E578 WeakPolarHBondContact CB-O 3.42Å; S544-E578 VanDerWaalsContact CB-OE2 3.28Å; S544-E578 WeakPolarHBondContact CB-OE2 3.35Å; S544-E578 PolarHBondContact N-OE2 2.88Å; S544-E578 VanDerWaalsContact N-OE2 3.1Å; S544-E578 PolarHBondContact OG-O 2.84Å; S544-A582 PolarHBondContact OG-N 3.29Å
545	T	85.4	Confident	75.7	Confident	11 Å²	11	36.9 Å²	36.9	7%	0.067	20%	0.203	C	C	.	.			trans	-89.8	125.5	174.5	-38.6	0	0	0	0	109.5	E549 A552 G557 G558	T545-E549 HydrophobicContact CG2-CB 4.02Å; T545-E549 VanDerWaalsContact CG2-OE2 3.31Å; T545-E549 WeakPolarHBondContact CG2-OE2 3.24Å; T545-A552 HydrophobicContact CG2-CB 4.2Å; T545-G557 VanDerWaalsContact OG1-C 3.27Å; T545-G557 WeakPolarHBondContact OG1-CA 3.33Å; T545-G558 PolarHBondContact N-O 3.25Å; T545-G558 VanDerWaalsContact N-O 3.11Å; T545-G558 PolarHBondContact OG1-N 3.24Å; T545-G558 PolarHBondContact OG1-O 2.94Å
546	F	86.3	Confident	75.4	Confident	27 Å²	27	37.2 Å²	37.2	12%	0.118	21%	0.205	C	C	.	.			trans	-73.9	156.7	178.6	-79.3	-87.7	0	0	0	113.1	W548 E549 A552 H581 L585 W586	F546-W548 HydrophobicContact CB-CD2 3.97Å; F546-W548 HydrophobicContact CB-CE3 4.45Å; F546-W548 HydrophobicContact CB-CG 4.46Å; F546-W548 HydrophobicContact CB-CH2 4.3Å; F546-W548 HydrophobicContact CB-CZ2 3.77Å; F546-W548 AromaticContact CD1-CE2 3.96Å; F546-W548 AromaticContact CD1-CH2 3.24Å; F546-W548 HydrophobicContact CD1-CH2 3.24Å; F546-W548 AromaticContact CD1-CZ2 3.2Å; F546-W548 HydrophobicContact CD1-CZ2 3.2Å; F546-W548 HydrophobicContact CD1-CZ3 4Å; F546-W548 HydrophobicContact CD2-CZ2 4.34Å; F546-W548 AromaticContact CE1-CH2 3.69Å; F546-W548 HydrophobicContact CE1-CH2 3.69Å; F546-W548 AromaticContact CE1-CZ2 3.72Å; F546-W548 HydrophobicContact CE1-CZ2 3.72Å; F546-W548 AromaticContact CG-CE2 3.88Å; F546-W548 HydrophobicContact CG-CH2 4.03Å; F546-W548 AromaticContact CG-CZ2 3.54Å; F546-W548 HydrophobicContact CG-CZ2 3.54Å; F546-W548 HydrophobicContact CZ-CZ2 4.48Å; F546-W548 PolarHBondContact O-N 3.38Å; F546-E549 HydrophobicContact CB-CG 4.22Å; F546-E549 WeakPolarHBondContact CB-OE1 3.47Å; F546-E549 WeakPolarHBondContact CD2-OE1 3.45Å; F546-E549 PolarHBondContact N-OE1 2.84Å; F546-E549 PolarHBondContact O-N 3.09Å; F546-A552 WeakPolarHBondContact O-CB 3.18Å; F546-H581 HydrophobicContact CD1-CB 4.46Å; F546-H581 WeakPolarHBondContact CD1-O 3.47Å; F546-H581 HydrophobicContact CE1-CB 4.09Å; F546-H581 AromaticContact CE1-ND1 3.76Å; F546-H581 HydrophobicContact CE2-CB 4.43Å; F546-H581 HydrophobicContact CZ-CB 4.07Å; F546-H581 AromaticContact CZ-CG 3.91Å; F546-H581 AromaticContact CZ-ND1 3.36Å; F546-H581 WeakPolarHBondContact CZ-ND1 3.45Å; F546-L585 VanDerWaalsContact CE1-O 3.27Å; F546-L585 WeakPolarHBondContact CE1-O 3.34Å; F546-W586 HydrophobicContact CE1-CE3 4.33Å; F546-W586 HydrophobicContact CE2-CZ3 4.19Å; F546-W586 HydrophobicContact CZ-CD2 4.45Å; F546-W586 AromaticContact CZ-CE3 3.82Å; F546-W586 HydrophobicContact CZ-CE3 3.82Å; F546-W586 AromaticContact CZ-CZ3 3.89Å; F546-W586 HydrophobicContact CZ-CZ3 3.89Å
547	P	77	Confident	75.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-15.8	-177	-17.8	25.9	0	0	0	116.1	Y683 K687 Y688	P547-Y683 HydrophobicContact CB-CD1 3.63Å; P547-Y683 HydrophobicContact CB-CE1 4.04Å; P547-Y683 HydrophobicContact CB-CG 4.37Å; P547-Y683 HydrophobicContact CG-CD1 3.71Å; P547-Y683 HydrophobicContact CG-CE1 4.14Å; P547-Y683 HydrophobicContact CG-CG 4.01Å; P547-K687 HydrophobicContact CB-CG 4.09Å; P547-K687 VanDerWaalsContact O-CE 3.23Å; P547-K687 WeakPolarHBondContact O-CE 3.44Å; P547-K687 PolarHBondContact O-NZ 3.4Å; P547-Y688 VanDerWaalsContact CA-OH 3.24Å; P547-Y688 WeakPolarHBondContact CA-OH 3.38Å; P547-Y688 HydrophobicContact CB-CE2 4.11Å; P547-Y688 WeakPolarHBondContact CB-OH 3.36Å; P547-Y688 HydrophobicContact CG-CE2 4.03Å; P547-Y688 WeakPolarHBondContact CG-OH 3.4Å
548	W	69.7	Low	76.5	Confident	37 Å²	37	32.6 Å²	32.6	14%	0.14	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-10.2	-176.3	51.7	81.2	0	0	0	114.2	Q342 T343 F546 W586 Y683	Q342-W548 HydrophobicContact CB-CD2 3.62Å; Q342-W548 HydrophobicContact CB-CE3 3.89Å; Q342-W548 HydrophobicContact CB-CG 3.94Å; Q342-W548 HydrophobicContact CB-CH2 4.48Å; Q342-W548 HydrophobicContact CB-CZ2 4.28Å; Q342-W548 HydrophobicContact CB-CZ3 4.31Å; Q342-W548 HydrophobicContact CG-CD2 4.01Å; Q342-W548 HydrophobicContact CG-CG 4.42Å; Q342-W548 HydrophobicContact CG-CH2 4.37Å; Q342-W548 HydrophobicContact CG-CZ2 3.86Å; T343-W548 HydrophobicContact CG2-CB 4.04Å; T343-W548 HydrophobicContact CG2-CE3 4.26Å; F546-W548 HydrophobicContact CB-CD2 3.97Å; F546-W548 HydrophobicContact CB-CE3 4.45Å; F546-W548 HydrophobicContact CB-CG 4.46Å; F546-W548 HydrophobicContact CB-CH2 4.3Å; F546-W548 HydrophobicContact CB-CZ2 3.77Å; F546-W548 AromaticContact CD1-CE2 3.96Å; F546-W548 AromaticContact CD1-CH2 3.24Å; F546-W548 HydrophobicContact CD1-CH2 3.24Å; F546-W548 AromaticContact CD1-CZ2 3.2Å; F546-W548 HydrophobicContact CD1-CZ2 3.2Å; F546-W548 HydrophobicContact CD1-CZ3 4Å; F546-W548 HydrophobicContact CD2-CZ2 4.34Å; F546-W548 AromaticContact CE1-CH2 3.69Å; F546-W548 HydrophobicContact CE1-CH2 3.69Å; F546-W548 AromaticContact CE1-CZ2 3.72Å; F546-W548 HydrophobicContact CE1-CZ2 3.72Å; F546-W548 AromaticContact CG-CE2 3.88Å; F546-W548 HydrophobicContact CG-CH2 4.03Å; F546-W548 AromaticContact CG-CZ2 3.54Å; F546-W548 HydrophobicContact CG-CZ2 3.54Å; F546-W548 HydrophobicContact CZ-CZ2 4.48Å; F546-W548 PolarHBondContact O-N 3.38Å; W548-W586 HydrophobicContact CH2-CZ2 4.34Å; W548-W586 AromaticContact CZ2-CE2 3.97Å; W548-W586 HydrophobicContact CZ2-CH2 4.13Å; W548-W586 AromaticContact CZ2-CZ2 3.64Å; W548-W586 HydrophobicContact CZ2-CZ2 3.64Å; W548-Y683 AromaticContact CE3-CE1 3.9Å; W548-Y683 HydrophobicContact CE3-CE1 3.9Å; W548-Y683 AromaticContact CE3-CZ 3.87Å; W548-Y683 HydrophobicContact CZ3-CE1 4.08Å; W548-Y683 HydrophobicContact CZ3-CE2 4.22Å; W548-Y683 AromaticContact CZ3-CZ 3.63Å; W548-Y683 WeakPolarHBondContact CZ3-OH 3.49Å
549	E	65.7	Low	78.1	Confident	61 Å²	61	30.6 Å²	30.6	29%	0.285	16%	0.158	S	C	.	.	S	Bend	trans	-70.2	146.1	179.6	-70.5	174.7	-133.1	0	0	113.1	T545 F546 H551 A552	T545-E549 HydrophobicContact CG2-CB 4.02Å; T545-E549 VanDerWaalsContact CG2-OE2 3.31Å; T545-E549 WeakPolarHBondContact CG2-OE2 3.24Å; F546-E549 HydrophobicContact CB-CG 4.22Å; F546-E549 WeakPolarHBondContact CB-OE1 3.47Å; F546-E549 WeakPolarHBondContact CD2-OE1 3.45Å; F546-E549 PolarHBondContact N-OE1 2.84Å; F546-E549 PolarHBondContact O-N 3.09Å; E549-H551 PolarHBondContact O-N 2.97Å; E549-A552 WeakPolarHBondContact O-CB 3.39Å; E549-A552 PolarHBondContact O-N 2.92Å; E549-A552 VanDerWaalsContact O-N 3.16Å
550	K	62.8	Low	79.2	Confident	13 Å²	13	23.5 Å²	23.5	6%	0.057	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-37.2	177.2	-90.5	170.7	-173.8	156.6	0	114.2	P62 Q770 L772 P774 D776 K785 D878	P62-K550 VanDerWaalsContact CG-CA 3.47Å; P62-K550 WeakPolarHBondContact CG-O 3.17Å; K550-Q770 PolarHBondContact NZ-O 2.74Å; K550-L772 WeakPolarHBondContact CE-O 3.36Å; K550-P774 WeakPolarHBondContact CE-O 3.01Å; K550-D776 WeakPolarHBondContact CD-OD1 3.42Å; K550-D776 WeakPolarHBondContact CE-OD1 3.28Å; K550-D776 HydrophobicContact CG-CB 4.5Å; K550-D776 VanDerWaalsContact CG-OD2 3.3Å; K550-D776 WeakPolarHBondContact CG-OD2 3.43Å; K550-D776 PolarHBondContact N-OD2 2.71Å; K550-D776 IonicContact NZ-OD1 2.77Å; K550-D776 PolarHBondContact NZ-OD1 2.74Å; K550-K785 PolarHBondContact NZ-O 3.41Å; K550-D878 PolarHBondContact NZ-O 3.33Å; K550-D878 VanDerWaalsContact NZ-O 3.15Å; K550-D878 IonicContact NZ-OD1 3.68Å; K550-D878 PolarHBondContact NZ-OD1 2.85Å
551	H	67.6	Low	80	Confident	72 Å²	72	21.3 Å²	21.3	33%	0.333	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	0.4	-171.3	-65.1	-57.7	0	0	0	115.5	E549 F553 S554 H556 G557	E549-H551 PolarHBondContact O-N 2.97Å; H551-F553 PolarHBondContact O-N 3.03Å; H551-S554 WeakPolarHBondContact CA-OG 3.17Å; H551-S554 WeakPolarHBondContact CB-OG 3.5Å; H551-S554 WeakPolarHBondContact O-CB 3.42Å; H551-S554 PolarHBondContact O-N 3.24Å; H551-S554 PolarHBondContact O-OG 2.86Å; H551-H556 HydrophobicContact CB-CB 3.97Å; H551-G557 VanDerWaalsContact O-CA 3.24Å; H551-G557 WeakPolarHBondContact O-CA 3.36Å; H551-G557 PolarHBondContact O-N 2.85Å
552	A	68.7	Low	80.4	Confident	1 Å²	1	19.8 Å²	19.8	1%	0.008	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-33.6	-170.5	0	0	0	0	0	115.6	N524 T545 F546 E549	N524-A552 PolarHBondContact ND2-O 3Å; T545-A552 HydrophobicContact CG2-CB 4.2Å; F546-A552 WeakPolarHBondContact O-CB 3.18Å; E549-A552 WeakPolarHBondContact O-CB 3.39Å; E549-A552 PolarHBondContact O-N 2.92Å; E549-A552 VanDerWaalsContact O-N 3.16Å
553	F	70.7	Confident	80.5	Confident	18 Å²	18	20.4 Å²	20.4	8%	0.079	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-8.3	179.1	-66.2	-88.7	0	0	0	114.3	Y60 N524 E525 H551 K687 Y688 W691	Y60-F553 HydrophobicContact CD1-CB 3.54Å; Y60-F553 HydrophobicContact CE1-CB 3.24Å; Y60-F553 HydrophobicContact CE1-CG 4.27Å; Y60-F553 WeakPolarHBondContact CE2-O 3.25Å; Y60-F553 HydrophobicContact CG-CB 4.39Å; N524-F553 CarbonylContact C-O 3.5Å; N524-F553 WeakPolarHBondContact CA-O 3.35Å; N524-F553 PolarHBondContact N-O 2.74Å; E525-F553 PolarHBondContact N-O 3.04Å; H551-F553 PolarHBondContact O-N 3.03Å; F553-K687 HydrophobicContact CZ-CB 4.08Å; F553-K687 WeakPolarHBondContact CZ-O 3.21Å; F553-Y688 AromaticContact CE1-CD1 3.66Å; F553-Y688 HydrophobicContact CE1-CD1 3.66Å; F553-Y688 AromaticContact CE1-CE1 3.91Å; F553-Y688 HydrophobicContact CE1-CE1 3.91Å; F553-Y688 HydrophobicContact CE2-CE1 4.26Å; F553-Y688 AromaticContact CZ-CD1 3.56Å; F553-Y688 HydrophobicContact CZ-CD1 3.56Å; F553-Y688 AromaticContact CZ-CE1 3.57Å; F553-Y688 HydrophobicContact CZ-CE1 3.57Å; F553-W691 HydrophobicContact CE1-CZ2 4.47Å
554	S	68.5	Low	80.5	Confident	9 Å²	9	20.1 Å²	20.1	6%	0.063	11%	0.114	C	C	.	.	S	Bend	trans	-76.5	-178.3	-178.3	77	0	0	0	0	112.8	N524 H551 H556 G557	N524-S554 VanDerWaalsContact CB-O 3.31Å; N524-S554 WeakPolarHBondContact CB-O 3.29Å; N524-S554 PolarHBondContact N-O 3.33Å; H551-S554 WeakPolarHBondContact CA-OG 3.17Å; H551-S554 WeakPolarHBondContact CB-OG 3.5Å; H551-S554 WeakPolarHBondContact O-CB 3.42Å; H551-S554 PolarHBondContact O-N 3.24Å; H551-S554 PolarHBondContact O-OG 2.86Å; S554-H556 PolarHBondContact O-N 2.84Å; S554-H556 PolarHBondContact OG-N 3.47Å; S554-G557 PolarHBondContact O-N 2.8Å
555	V	78.9	Confident	80.4	Confident	27 Å²	27	24.2 Å²	24.2	16%	0.164	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.9	168.9	-61.2	0	0	0	0	112.8	G557	V555-G557 VanDerWaalsContact C-N 3.31Å
556	H	79.1	Confident	80.7	Confident	18 Å²	18	23.8 Å²	23.8	8%	0.083	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-3.4	177.6	-51.5	-66.4	0	0	0	113.1	E58 K517 H551 S554	E58-H556 IonicContact OE1-CD2 2.65Å; E58-H556 IonicContact OE1-CE1 3.86Å; E58-H556 IonicContact OE1-NE2 3.76Å; E58-H556 PolarHBondContact OE1-NE2 2.91Å; E58-H556 IonicContact OE2-NE2 3.25Å; K517-H556 WeakPolarHBondContact CD-O 3.29Å; K517-H556 WeakPolarHBondContact CE-O 3.48Å; K517-H556 PolarHBondContact NZ-O 2.86Å; H551-H556 HydrophobicContact CB-CB 3.97Å; S554-H556 PolarHBondContact O-N 2.84Å; S554-H556 PolarHBondContact OG-N 3.47Å
557	G	80.9	Confident	80.8	Confident	5 Å²	5	22.6 Å²	22.6	5%	0.052	12%	0.12	C	C	.	.			trans	-78.5	-164.5	178.5	0	0	0	0	0	114.3	K517 T545 H551 S554 V555	K517-G557 PolarHBondContact NZ-O 3.44Å; T545-G557 VanDerWaalsContact OG1-C 3.27Å; T545-G557 WeakPolarHBondContact OG1-CA 3.33Å; H551-G557 VanDerWaalsContact O-CA 3.24Å; H551-G557 WeakPolarHBondContact O-CA 3.36Å; H551-G557 PolarHBondContact O-N 2.85Å; S554-G557 PolarHBondContact O-N 2.8Å; V555-G557 VanDerWaalsContact C-N 3.31Å
558	G	89.6	Confident	81.4	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.01	13%	0.132	C	C	.	.	S	Bend	trans	75.6	-158.8	176.9	0	0	0	0	0	115.1	N524 S529 T545	N524-G558 PolarHBondContact ND2-N 2.89Å; S529-G558 CarbonylContact O-C 3.55Å; S529-G558 WeakPolarHBondContact O-CA 3.39Å; T545-G558 PolarHBondContact N-O 3.25Å; T545-G558 VanDerWaalsContact N-O 3.11Å; T545-G558 PolarHBondContact OG1-N 3.24Å; T545-G558 PolarHBondContact OG1-O 2.94Å
559	V	93.5	Very high	82.2	Confident	3 Å²	3	28.4 Å²	28.4	2%	0.018	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	140.7	-171.5	177.9	0	0	0	0	110.4	L528 S529 V530 A531 L543 V561 L575 E578 L579 A582	L528-V559 HydrophobicContact CD1-CG2 4.3Å; L528-V559 HydrophobicContact CD2-CG2 4.47Å; S529-V559 PolarHBondContact O-N 3.32Å; V530-V559 WeakPolarHBondContact CA-O 3.42Å; V530-V559 HydrophobicContact CG2-CB 4.4Å; A531-V559 PolarHBondContact N-O 3.45Å; L543-V559 WeakPolarHBondContact O-CA 3.03Å; V559-V561 HydrophobicContact CG1-CG1 4.02Å; V559-L575 HydrophobicContact CG1-CD1 4.2Å; V559-E578 HydrophobicContact CG1-CB 3.66Å; V559-E578 HydrophobicContact CG1-CG 4.04Å; V559-E578 HydrophobicContact CG2-CB 4.42Å; V559-L579 HydrophobicContact CG2-CD1 4.03Å; V559-A582 HydrophobicContact CG2-CB 4.5Å
560	V	91.9	Very high	83	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	141.2	165.9	-64.4	0	0	0	0	110.5	I513 A531 V533 W535 G542 L543	I513-V560 HydrophobicContact CD1-CG1 4.04Å; I513-V560 HydrophobicContact CD1-CG2 3.95Å; A531-V560 HydrophobicContact CB-CG1 4.33Å; A531-V560 VanDerWaalsContact O-CA 3.31Å; A531-V560 WeakPolarHBondContact O-CA 3.45Å; V533-V560 HydrophobicContact CG1-CB 3.98Å; V533-V560 HydrophobicContact CG1-CG1 4.05Å; V533-V560 HydrophobicContact CG2-CB 3.86Å; V533-V560 HydrophobicContact CG2-CG2 4.01Å; W535-V560 HydrophobicContact CH2-CG2 4.04Å; W535-V560 HydrophobicContact CZ2-CG2 3.78Å; G542-V560 CarbonylContact C-O 3.54Å; G542-V560 WeakPolarHBondContact CA-O 3.49Å; L543-V560 HydrophobicContact CB-CG2 3.85Å; L543-V560 PolarHBondContact N-O 2.97Å; L543-V560 PolarHBondContact O-N 2.89Å
561	V	92.3	Very high	84.1	Confident	3 Å²	3	28 Å²	28	2%	0.018	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	153.3	-178.6	-74.4	0	0	0	0	111.6	V530 A531 F532 V533 V559 F566 L575 E578	V530-V561 HydrophobicContact CG1-CG2 4.13Å; A531-V561 PolarHBondContact O-N 2.91Å; F532-V561 WeakPolarHBondContact CA-O 3.14Å; F532-V561 HydrophobicContact CD1-CG2 4.04Å; F532-V561 HydrophobicContact CE1-CG2 4.04Å; V533-V561 PolarHBondContact N-O 3.1Å; V533-V561 VanDerWaalsContact N-O 3.08Å; V559-V561 HydrophobicContact CG1-CG1 4.02Å; V561-F566 HydrophobicContact CG2-CB 4.45Å; V561-F566 HydrophobicContact CG2-CD2 4.02Å; V561-L575 HydrophobicContact CG1-CD1 4.38Å; V561-E578 HydrophobicContact CG1-CG 4.01Å
562	Q	91.3	Very high	85.1	Confident	33 Å²	33	28.2 Å²	28.2	15%	0.154	16%	0.159	C	C	.	.			trans	-65	133.1	171.6	-70	-172.7	3.2	0	0	111.2	V533 G538 M540 I541 G564 R565 F566	V533-Q562 WeakPolarHBondContact O-CA 3.32Å; G538-Q562 PolarHBondContact O-NE2 2.89Å; M540-Q562 PolarHBondContact O-NE2 2.93Å; I541-Q562 PolarHBondContact O-N 3.3Å; Q562-G564 VanDerWaalsContact C-N 3.32Å; Q562-G564 PolarHBondContact O-N 2.92Å; Q562-R565 HydrophobicContact CB-CB 4.02Å; Q562-R565 HydrophobicContact CB-CG 3.84Å; Q562-R565 PolarHBondContact O-N 3.38Å; Q562-F566 PolarHBondContact O-N 3.27Å
563	P	90.9	Very high	86.1	Confident	24 Å²	24	29.6 Å²	29.6	16%	0.156	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-64.8	-33.6	-178.7	25.2	-33.8	0	0	0	113.2	T382 V383 Q387 F532 V533 R565 F566	T382-P563 HydrophobicContact CG2-CB 3.81Å; T382-P563 HydrophobicContact CG2-CG 4.18Å; V383-P563 HydrophobicContact CG1-CB 3.74Å; Q387-P563 PolarHBondContact NE2-O 2.84Å; F532-P563 HydrophobicContact CB-CB 4.33Å; F532-P563 HydrophobicContact CD1-CB 4.32Å; V533-P563 WeakPolarHBondContact O-CD 3.39Å; P563-R565 PolarHBondContact O-N 3Å; P563-F566 PolarHBondContact O-N 3.2Å
564	G	88.3	Confident	87.1	Confident	51 Å²	51	30 Å²	30	53%	0.526	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-74.7	0.1	173.8	0	0	0	0	0	115	Q562	Q562-G564 VanDerWaalsContact C-N 3.32Å; Q562-G564 PolarHBondContact O-N 2.92Å
565	R	88.5	Confident	88.2	Confident	94 Å²	94	29.6 Å²	29.6	36%	0.355	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-122.1	15	178.9	-57.9	-66.1	-163.3	167.4	11.1	112.3	I541 Q562 P563 H571 N574	I541-R565 HydrophobicContact CG2-CB 4.02Å; I541-R565 HydrophobicContact CG2-CG 4.26Å; Q562-R565 HydrophobicContact CB-CB 4.02Å; Q562-R565 HydrophobicContact CB-CG 3.84Å; Q562-R565 PolarHBondContact O-N 3.38Å; P563-R565 PolarHBondContact O-N 3Å; R565-H571 HydrophobicContact CB-CB 4.49Å; R565-H571 VanDerWaalsContact CD-CD2 3.49Å; R565-H571 WeakPolarHBondContact CD-CD2 3.43Å; R565-H571 PolarHBondContact NH1-CE1 3.46Å; R565-H571 PolarHBondContact NH1-NE2 2.6Å; R565-N574 PolarHBondContact O-ND2 2.9Å
566	F	92.6	Very high	89	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.009	16%	0.159	C	C	.	.	S	Bend	trans	-119.4	125.8	-179.5	173.7	-83.7	0	0	0	110.1	V370 V383 Q387 I388 Q391 V530 F532 V561 Q562 P563 T568 L575	V370-F566 HydrophobicContact CG1-CZ 4.46Å; V370-F566 HydrophobicContact CG2-CZ 4.29Å; V383-F566 HydrophobicContact CB-CD1 4.48Å; V383-F566 HydrophobicContact CG1-CD1 4.26Å; V383-F566 HydrophobicContact CG2-CD1 4.36Å; V383-F566 HydrophobicContact CG2-CE1 4.18Å; Q387-F566 HydrophobicContact CB-CD1 4.35Å; Q387-F566 PolarHBondContact NE2-O 3.13Å; I388-F566 HydrophobicContact CB-CE1 4.48Å; I388-F566 HydrophobicContact CG1-CE1 3.9Å; I388-F566 HydrophobicContact CG1-CZ 4.31Å; Q391-F566 HydrophobicContact CB-CD1 4.42Å; Q391-F566 HydrophobicContact CB-CE1 4Å; Q391-F566 HydrophobicContact CB-CE2 4.24Å; Q391-F566 HydrophobicContact CB-CZ 3.91Å; Q391-F566 HydrophobicContact CG-CD2 3.9Å; Q391-F566 HydrophobicContact CG-CE1 4.28Å; Q391-F566 HydrophobicContact CG-CE2 3.64Å; Q391-F566 HydrophobicContact CG-CG 4.37Å; Q391-F566 HydrophobicContact CG-CZ 3.83Å; V530-F566 HydrophobicContact CG1-CE2 4.39Å; F532-F566 HydrophobicContact CE1-CB 4.01Å; F532-F566 AromaticContact CE1-CD1 3.81Å; F532-F566 HydrophobicContact CE1-CD1 3.81Å; F532-F566 AromaticContact CE1-CD2 3.65Å; F532-F566 HydrophobicContact CE1-CD2 3.65Å; F532-F566 HydrophobicContact CE1-CE1 4.12Å; F532-F566 AromaticContact CE1-CE2 3.93Å; F532-F566 HydrophobicContact CE1-CE2 3.93Å; F532-F566 AromaticContact CE1-CG 3.57Å; F532-F566 HydrophobicContact CE1-CG 3.57Å; F532-F566 HydrophobicContact CE1-CZ 4.17Å; F532-F566 HydrophobicContact CZ-CD1 4.05Å; F532-F566 HydrophobicContact CZ-CD2 4.19Å; F532-F566 AromaticContact CZ-CE1 3.9Å; F532-F566 HydrophobicContact CZ-CE1 3.9Å; F532-F566 AromaticContact CZ-CE2 3.99Å; F532-F566 HydrophobicContact CZ-CE2 3.99Å; F532-F566 HydrophobicContact CZ-CG 4.21Å; F532-F566 AromaticContact CZ-CZ 3.87Å; F532-F566 HydrophobicContact CZ-CZ 3.87Å; V561-F566 HydrophobicContact CG2-CB 4.45Å; V561-F566 HydrophobicContact CG2-CD2 4.02Å; Q562-F566 PolarHBondContact O-N 3.27Å; P563-F566 PolarHBondContact O-N 3.2Å; F566-T568 PolarHBondContact O-N 3.4Å; F566-T568 VanDerWaalsContact O-N 3.07Å; F566-L575 HydrophobicContact CD2-CD2 4.24Å; F566-L575 HydrophobicContact CE2-CD2 3.8Å
567	G	89	Confident	89.6	Confident	2 Å²	2	28.5 Å²	28.5	2%	0.021	16%	0.159	C	C	.	.	S	Bend	trans	64	11.6	175.8	0	0	0	0	0	115.9	Q387 Q390	Q387-G567 WeakPolarHBondContact O-CA 3.26Å; Q390-G567 PolarHBondContact OE1-O 3.29Å
568	T	89.7	Confident	90.3	Very high	41 Å²	41	29 Å²	29	25%	0.252	16%	0.161	S	C	.	.	S	Bend	trans	-100	159	176.3	63	0	0	0	0	111.3	F566 H571 R572	F566-T568 PolarHBondContact O-N 3.4Å; F566-T568 VanDerWaalsContact O-N 3.07Å; T568-H571 PolarHBondContact O-N 3.2Å; T568-R572 WeakPolarHBondContact O-CG 3.45Å; T568-R572 PolarHBondContact O-N 3.21Å
569	D	85.1	Confident	90.5	Very high	118 Å²	118	29 Å²	29	63%	0.631	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	146.5	173.7	-63.1	-25.5	0	0	0	111.5	H571 R572	D569-H571 PolarHBondContact O-N 2.89Å; D569-R572 IonicContact OD1-CZ 2.77Å; D569-R572 IonicContact OD1-NE 2.7Å; D569-R572 IonicContact OD1-NH2 3.67Å; D569-R572 PolarHBondContact OD1-NH2 3.35Å
570	G	82.6	Confident	90.6	Very high	25 Å²	25	28.9 Å²	28.9	26%	0.258	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	69	-11.1	-173	0	0	0	0	0	116.7
571	H	87	Confident	90.7	Very high	42 Å²	42	29.4 Å²	29.4	19%	0.194	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.8	0.7	-168.1	-61.3	-24.7	0	0	0	115.4	R565 T568 D569 N573 N574	R565-H571 HydrophobicContact CB-CB 4.49Å; R565-H571 VanDerWaalsContact CD-CD2 3.49Å; R565-H571 WeakPolarHBondContact CD-CD2 3.43Å; R565-H571 PolarHBondContact NH1-CE1 3.46Å; R565-H571 PolarHBondContact NH1-NE2 2.6Å; T568-H571 PolarHBondContact O-N 3.2Å; D569-H571 PolarHBondContact O-N 2.89Å; H571-N573 PolarHBondContact O-N 3.1Å; H571-N573 VanDerWaalsContact O-N 3.07Å; H571-N574 WeakPolarHBondContact CB-ND2 3.31Å; H571-N574 WeakPolarHBondContact O-CB 3.45Å; H571-N574 VanDerWaalsContact O-CG 3.28Å; H571-N574 PolarHBondContact O-N 3.34Å; H571-N574 VanDerWaalsContact O-N 3.1Å; H571-N574 PolarHBondContact O-ND2 3.43Å; H571-N574 VanDerWaalsContact O-ND2 3.13Å
572	R	88.1	Confident	90.8	Very high	75 Å²	75	29.3 Å²	29.3	28%	0.283	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.5	-176.5	-48.3	-171.4	-168.8	-178.1	3.6	114.4	Q390 Q391 S394 T568 D569	Q390-R572 VanDerWaalsContact OE1-NH2 3.16Å; Q391-R572 PolarHBondContact NE2-O 3.43Å; Q391-R572 PolarHBondContact OE1-O 3.32Å; S394-R572 VanDerWaalsContact OG-CD 3.28Å; S394-R572 WeakPolarHBondContact OG-CD 3.41Å; T568-R572 WeakPolarHBondContact O-CG 3.45Å; T568-R572 PolarHBondContact O-N 3.21Å; D569-R572 IonicContact OD1-CZ 2.77Å; D569-R572 IonicContact OD1-NE 2.7Å; D569-R572 IonicContact OD1-NH2 3.67Å; D569-R572 PolarHBondContact OD1-NH2 3.35Å
573	N	90.6	Very high	90.9	Very high	30 Å²	30	27.8 Å²	27.8	16%	0.16	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-12.9	178.7	-79	-12.6	0	0	0	114.1	H571 L575 V576 H577 Y660 G666 A669	H571-N573 PolarHBondContact O-N 3.1Å; H571-N573 VanDerWaalsContact O-N 3.07Å; N573-L575 PolarHBondContact O-N 3.01Å; N573-V576 WeakPolarHBondContact O-CA 3.32Å; N573-V576 WeakPolarHBondContact O-CB 3.44Å; N573-V576 PolarHBondContact O-N 3.21Å; N573-H577 PolarHBondContact O-N 3.23Å; N573-Y660 HydrophobicContact CB-CD1 4.47Å; N573-G666 PolarHBondContact ND2-O 3.29Å; N573-A669 PolarHBondContact ND2-O 3.14Å
574	N	90.4	Very high	90.9	Very high	26 Å²	26	26.6 Å²	26.6	14%	0.139	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-46.8	179.2	-62.2	-25.7	0	0	0	111.4	I541 R565 H571 V576 H577 E578	I541-N574 HydrophobicContact CG2-CB 3.92Å; R565-N574 PolarHBondContact O-ND2 2.9Å; H571-N574 WeakPolarHBondContact CB-ND2 3.31Å; H571-N574 WeakPolarHBondContact O-CB 3.45Å; H571-N574 VanDerWaalsContact O-CG 3.28Å; H571-N574 PolarHBondContact O-N 3.34Å; H571-N574 VanDerWaalsContact O-N 3.1Å; H571-N574 PolarHBondContact O-ND2 3.43Å; H571-N574 VanDerWaalsContact O-ND2 3.13Å; N574-V576 VanDerWaalsContact C-N 3.25Å; N574-V576 PolarHBondContact O-N 3.06Å; N574-H577 WeakPolarHBondContact O-CB 3.37Å; N574-H577 PolarHBondContact O-N 3.19Å; N574-E578 WeakPolarHBondContact O-CG 3.23Å; N574-E578 PolarHBondContact O-N 3.42Å
575	L	92.8	Very high	91.2	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-66.3	-28.2	175.6	-171.3	68.5	0	0	0	112.5	Q391 V530 V559 V561 F566 N573 L579	Q391-L575 HydrophobicContact CG-CB 4.37Å; Q391-L575 HydrophobicContact CG-CD2 3.53Å; V530-L575 HydrophobicContact CG1-CD1 3.81Å; V530-L575 HydrophobicContact CG2-CD1 4.21Å; V559-L575 HydrophobicContact CG1-CD1 4.2Å; V561-L575 HydrophobicContact CG1-CD1 4.38Å; F566-L575 HydrophobicContact CD2-CD2 4.24Å; F566-L575 HydrophobicContact CE2-CD2 3.8Å; N573-L575 PolarHBondContact O-N 3.01Å; L575-L579 HydrophobicContact CD1-CD1 3.72Å; L575-L579 HydrophobicContact CG-CD1 4Å; L575-L579 WeakPolarHBondContact O-CB 3.44Å; L575-L579 WeakPolarHBondContact O-CD1 3.37Å; L575-L579 PolarHBondContact O-N 2.76Å
576	V	94	Very high	91.4	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-67.2	-39.3	176	-179.9	0	0	0	0	110.6	L395 A398 F399 N573 N574 G580 Y660 F672	L395-V576 HydrophobicContact CD1-CG2 4.31Å; A398-V576 HydrophobicContact CB-CG1 3.76Å; A398-V576 HydrophobicContact CB-CG2 3.92Å; F399-V576 HydrophobicContact CE2-CG1 3.91Å; F399-V576 HydrophobicContact CZ-CG1 4.36Å; N573-V576 WeakPolarHBondContact O-CA 3.32Å; N573-V576 WeakPolarHBondContact O-CB 3.44Å; N573-V576 PolarHBondContact O-N 3.21Å; N574-V576 VanDerWaalsContact C-N 3.25Å; N574-V576 PolarHBondContact O-N 3.06Å; V576-G580 PolarHBondContact O-N 2.94Å; V576-G580 VanDerWaalsContact O-N 3.13Å; V576-Y660 HydrophobicContact CB-CD1 4.47Å; V576-Y660 HydrophobicContact CG1-CD1 3.86Å; V576-Y660 HydrophobicContact CG1-CD2 3.93Å; V576-Y660 HydrophobicContact CG1-CE1 4.14Å; V576-Y660 HydrophobicContact CG1-CE2 4.18Å; V576-Y660 HydrophobicContact CG1-CG 3.76Å; V576-F672 HydrophobicContact CG1-CE2 4.04Å; V576-F672 HydrophobicContact CG1-CZ 3.83Å
577	H	93.7	Very high	91.5	Very high	22 Å²	22	22.9 Å²	22.9	10%	0.102	12%	0.118	C	C	.	.	H	α-helix	trans	-62.9	-53.4	172.9	-174.9	103.3	0	0	0	111.7	N573 N574 L579 G580 H581 H587 Y660 S662 Y663	N573-H577 PolarHBondContact O-N 3.23Å; N574-H577 WeakPolarHBondContact O-CB 3.37Å; N574-H577 PolarHBondContact O-N 3.19Å; H577-L579 VanDerWaalsContact C-N 3.3Å; H577-L579 PolarHBondContact O-N 3.07Å; H577-G580 WeakPolarHBondContact O-CA 3.26Å; H577-G580 PolarHBondContact O-N 3.07Å; H577-H581 AromaticContact CD2-CD2 3.93Å; H577-H581 AromaticContact CD2-NE2 3.55Å; H577-H581 AromaticContact NE2-NE2 3.35Å; H577-H581 PolarHBondContact NE2-NE2 2.86Å; H577-H581 PolarHBondContact O-N 3.09Å; H577-H587 AromaticContact CE1-CD2 3.81Å; H577-H587 AromaticContact NE2-CD2 3.57Å; H577-H587 AromaticContact NE2-NE2 3.74Å; H577-Y660 PolarHBondContact ND1-O 3.08Å; H577-S662 PolarHBondContact CE1-O 2.92Å; H577-S662 VanDerWaalsContact CE1-O 3.28Å; H577-S662 PolarHBondContact ND1-O 2.87Å; H577-Y663 AromaticContact CE1-CD1 3.95Å; H577-Y663 AromaticContact NE2-CE1 3.93Å
578	E	94.2	Very high	91.7	Very high	16 Å²	16	23 Å²	23	8%	0.075	12%	0.118	C	C	.	.	H	α-helix	trans	-59	-39	178.2	-62.2	-56.9	157.5	0	0	112.3	G542 S544 V559 V561 N574 G580 H581 A582	G542-E578 VanDerWaalsContact C-OE1 3.27Å; G542-E578 VanDerWaalsContact CA-OE1 3.29Å; G542-E578 WeakPolarHBondContact CA-OE1 3.44Å; S544-E578 VanDerWaalsContact CB-O 3.3Å; S544-E578 WeakPolarHBondContact CB-O 3.42Å; S544-E578 VanDerWaalsContact CB-OE2 3.28Å; S544-E578 WeakPolarHBondContact CB-OE2 3.35Å; S544-E578 PolarHBondContact N-OE2 2.88Å; S544-E578 VanDerWaalsContact N-OE2 3.1Å; S544-E578 PolarHBondContact OG-O 2.84Å; V559-E578 HydrophobicContact CG1-CB 3.66Å; V559-E578 HydrophobicContact CG1-CG 4.04Å; V559-E578 HydrophobicContact CG2-CB 4.42Å; V561-E578 HydrophobicContact CG1-CG 4.01Å; N574-E578 WeakPolarHBondContact O-CG 3.23Å; N574-E578 PolarHBondContact O-N 3.42Å; E578-G580 PolarHBondContact O-N 3.1Å; E578-H581 WeakPolarHBondContact O-CB 3.42Å; E578-H581 PolarHBondContact O-N 3.16Å; E578-H581 IonicContact OE2-CD2 2.6Å; E578-A582 PolarHBondContact O-N 3.33Å
579	L	95.1	Very high	91.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-70.4	-20.8	174.8	-93.8	57.5	0	0	0	113	L395 F399 W406 L528 V559 L575 H577 L583	L395-L579 HydrophobicContact CD1-CD2 3.49Å; L395-L579 VanDerWaalsContact CD1-CD2 3.49Å; L395-L579 HydrophobicContact CD2-CD2 3.73Å; L395-L579 HydrophobicContact CG-CD2 4.22Å; F399-L579 HydrophobicContact CE2-CB 4.21Å; F399-L579 HydrophobicContact CZ-CB 4.02Å; W406-L579 HydrophobicContact CD2-CD2 4.25Å; W406-L579 HydrophobicContact CE3-CD2 4.48Å; W406-L579 HydrophobicContact CH2-CD2 3.88Å; W406-L579 HydrophobicContact CH2-CG 4.16Å; W406-L579 HydrophobicContact CZ2-CB 4.36Å; W406-L579 HydrophobicContact CZ2-CD2 3.61Å; W406-L579 HydrophobicContact CZ2-CG 4.08Å; W406-L579 HydrophobicContact CZ3-CD2 4.31Å; L528-L579 HydrophobicContact CD2-CD1 3.66Å; L528-L579 HydrophobicContact CD2-CD2 4.11Å; L528-L579 HydrophobicContact CD2-CG 3.57Å; V559-L579 HydrophobicContact CG2-CD1 4.03Å; L575-L579 HydrophobicContact CD1-CD1 3.72Å; L575-L579 HydrophobicContact CG-CD1 4Å; L575-L579 WeakPolarHBondContact O-CB 3.44Å; L575-L579 WeakPolarHBondContact O-CD1 3.37Å; L575-L579 PolarHBondContact O-N 2.76Å; H577-L579 VanDerWaalsContact C-N 3.3Å; H577-L579 PolarHBondContact O-N 3.07Å; L579-L583 WeakPolarHBondContact O-CB 3.25Å; L579-L583 VanDerWaalsContact O-CG 3.24Å; L579-L583 WeakPolarHBondContact O-CG 3.48Å; L579-L583 PolarHBondContact O-N 2.79Å
580	G	94.9	Very high	91.8	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-65.7	-44.9	167.6	0	0	0	0	0	112.2	V576 H577 E578 L583 G584 L585	V576-G580 PolarHBondContact O-N 2.94Å; V576-G580 VanDerWaalsContact O-N 3.13Å; H577-G580 WeakPolarHBondContact O-CA 3.26Å; H577-G580 PolarHBondContact O-N 3.07Å; E578-G580 PolarHBondContact O-N 3.1Å; G580-L583 CarbonylContact O-C 3.57Å; G580-L583 PolarHBondContact O-N 3.36Å; G580-L583 VanDerWaalsContact O-N 3.17Å; G580-G584 PolarHBondContact O-N 2.8Å; G580-G584 VanDerWaalsContact O-N 3.16Å; G580-L585 WeakPolarHBondContact O-CB 3.47Å; G580-L585 PolarHBondContact O-N 3.33Å
581	H	94.8	Very high	91.5	Very high	12 Å²	12	15.4 Å²	15.4	6%	0.056	7%	0.069	C	C	.	.	H	α-helix	trans	-62.3	-45.5	171.4	-65.6	-46.2	0	0	0	112	F546 H577 E578 L583 G584 L585 H587 M661	F546-H581 HydrophobicContact CD1-CB 4.46Å; F546-H581 WeakPolarHBondContact CD1-O 3.47Å; F546-H581 HydrophobicContact CE1-CB 4.09Å; F546-H581 AromaticContact CE1-ND1 3.76Å; F546-H581 HydrophobicContact CE2-CB 4.43Å; F546-H581 HydrophobicContact CZ-CB 4.07Å; F546-H581 AromaticContact CZ-CG 3.91Å; F546-H581 AromaticContact CZ-ND1 3.36Å; F546-H581 WeakPolarHBondContact CZ-ND1 3.45Å; H577-H581 AromaticContact CD2-CD2 3.93Å; H577-H581 AromaticContact CD2-NE2 3.55Å; H577-H581 AromaticContact NE2-NE2 3.35Å; H577-H581 PolarHBondContact NE2-NE2 2.86Å; H577-H581 PolarHBondContact O-N 3.09Å; E578-H581 WeakPolarHBondContact O-CB 3.42Å; E578-H581 PolarHBondContact O-N 3.16Å; E578-H581 IonicContact OE2-CD2 2.6Å; H581-L583 PolarHBondContact O-N 3.28Å; H581-L583 VanDerWaalsContact O-N 3.13Å; H581-G584 PolarHBondContact O-N 3.07Å; H581-L585 PolarHBondContact ND1-O 3.07Å; H581-H587 AromaticContact CE1-CD2 3.42Å; H581-H587 PolarHBondContact CE1-CD2 2.91Å; H581-H587 VanDerWaalsContact CE1-CD2 3.42Å; H581-H587 AromaticContact CE1-NE2 3.5Å; H581-H587 PolarHBondContact CE1-NE2 3.48Å; H581-H587 AromaticContact NE2-CD2 3.56Å; H581-H587 AromaticContact NE2-NE2 3.34Å; H581-H587 PolarHBondContact NE2-NE2 3.02Å; H581-M661 WeakPolarHBondContact CE1-CE 3.45Å; H581-M661 WeakPolarHBondContact ND1-CE 3.47Å
582	A	92.6	Very high	91.2	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.008	7%	0.065	C	C	.	.	H	α-helix	trans	-58.2	-26.8	174.9	0	0	0	0	0	112.6	L528 S544 V559 E578 Y688	L528-A582 HydrophobicContact CD1-CB 4.17Å; L528-A582 HydrophobicContact CD2-CB 4.05Å; S544-A582 PolarHBondContact OG-N 3.29Å; V559-A582 HydrophobicContact CG2-CB 4.5Å; E578-A582 PolarHBondContact O-N 3.33Å; A582-Y688 WeakPolarHBondContact O-CE2 3.46Å; A582-Y688 VanDerWaalsContact O-CZ 3.23Å; A582-Y688 PolarHBondContact O-OH 3.44Å
583	L	93.7	Very high	90.5	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	11.8	174.5	-66.6	174.3	0	0	0	114.1	L366 F399 W406 L579 G580 H581 M680 Y683 V684 Y688	L366-L583 HydrophobicContact CD1-CD2 4.17Å; F399-L583 HydrophobicContact CD1-CD1 4.35Å; F399-L583 HydrophobicContact CE1-CD1 3.66Å; F399-L583 HydrophobicContact CZ-CD1 4.31Å; W406-L583 HydrophobicContact CZ2-CD1 4.01Å; L579-L583 WeakPolarHBondContact O-CB 3.25Å; L579-L583 VanDerWaalsContact O-CG 3.24Å; L579-L583 WeakPolarHBondContact O-CG 3.48Å; L579-L583 PolarHBondContact O-N 2.79Å; G580-L583 CarbonylContact O-C 3.57Å; G580-L583 PolarHBondContact O-N 3.36Å; G580-L583 VanDerWaalsContact O-N 3.17Å; H581-L583 PolarHBondContact O-N 3.28Å; H581-L583 VanDerWaalsContact O-N 3.13Å; L583-M680 HydrophobicContact CB-CB 4.21Å; L583-M680 HydrophobicContact CB-CG 3.87Å; L583-M680 HydrophobicContact CD1-CB 4.34Å; L583-M680 HydrophobicContact CD1-CG 4.14Å; L583-M680 HydrophobicContact CD1-SD 4.04Å; L583-Y683 WeakPolarHBondContact O-CB 3.38Å; L583-Y683 VanDerWaalsContact O-CD2 3.23Å; L583-Y683 WeakPolarHBondContact O-CD2 3.1Å; L583-V684 HydrophobicContact CD2-CG2 3.75Å; L583-Y688 HydrophobicContact CD2-CD2 4.21Å; L583-Y688 HydrophobicContact CD2-CE2 4.35Å
584	G	90.5	Very high	89.6	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	25.9	169.2	0	0	0	0	0	116.3	G580 H581 R679	G580-G584 PolarHBondContact O-N 2.8Å; G580-G584 VanDerWaalsContact O-N 3.16Å; H581-G584 PolarHBondContact O-N 3.07Å; G584-R679 PolarHBondContact O-NH2 2.03Å
585	L	95.7	Very high	88.6	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.005	9%	0.087	C	C	.	.	P	Polyproline II helix	trans	-101.1	134.4	176.6	-57.4	-171.4	0	0	0	113.1	F546 G580 H581 M661 F672 Q676 R679 M680	F546-L585 VanDerWaalsContact CE1-O 3.27Å; F546-L585 WeakPolarHBondContact CE1-O 3.34Å; G580-L585 WeakPolarHBondContact O-CB 3.47Å; G580-L585 PolarHBondContact O-N 3.33Å; H581-L585 PolarHBondContact ND1-O 3.07Å; L585-M661 HydrophobicContact CB-CE 4.13Å; L585-M661 HydrophobicContact CB-CG 4.05Å; L585-M661 HydrophobicContact CB-SD 4.14Å; L585-M661 HydrophobicContact CD1-CG 3.95Å; L585-M661 HydrophobicContact CD1-SD 4.27Å; L585-F672 HydrophobicContact CD1-CD1 3.96Å; L585-F672 HydrophobicContact CD1-CE1 4.15Å; L585-Q676 HydrophobicContact CD1-CB 3.7Å; L585-Q676 HydrophobicContact CD1-CG 3.93Å; L585-Q676 HydrophobicContact CD2-CB 4.08Å; L585-Q676 HydrophobicContact CD2-CG 4.21Å; L585-R679 HydrophobicContact CD2-CB 3.91Å; L585-M680 HydrophobicContact CD1-CE 3.33Å; L585-M680 HydrophobicContact CD1-CG 4.12Å; L585-M680 HydrophobicContact CD2-CG 4.46Å; L585-M680 HydrophobicContact CG-CE 4.28Å; L585-M680 HydrophobicContact CG-CG 4.27Å
586	W	93.5	Very high	87.2	Confident	42 Å²	42	20.5 Å²	20.5	16%	0.159	11%	0.111	C	C	.	.	P	Polyproline II helix	trans	-75.7	164.7	167.8	-70.6	119.2	0	0	0	111.8	Q342 F546 W548 H590 D612	Q342-W586 HydrophobicContact CG-CZ2 4.12Å; F546-W586 HydrophobicContact CE1-CE3 4.33Å; F546-W586 HydrophobicContact CE2-CZ3 4.19Å; F546-W586 HydrophobicContact CZ-CD2 4.45Å; F546-W586 AromaticContact CZ-CE3 3.82Å; F546-W586 HydrophobicContact CZ-CE3 3.82Å; F546-W586 AromaticContact CZ-CZ3 3.89Å; F546-W586 HydrophobicContact CZ-CZ3 3.89Å; W548-W586 HydrophobicContact CH2-CZ2 4.34Å; W548-W586 AromaticContact CZ2-CE2 3.97Å; W548-W586 HydrophobicContact CZ2-CH2 4.13Å; W548-W586 AromaticContact CZ2-CZ2 3.64Å; W548-W586 HydrophobicContact CZ2-CZ2 3.64Å; W586-H590 HydrophobicContact CB-CB 3.86Å; W586-H590 AromaticContact CD1-CD2 3.71Å; W586-H590 AromaticContact CD2-CD2 3.71Å; W586-H590 AromaticContact CD2-CE1 3.98Å; W586-H590 AromaticContact CD2-NE2 3.73Å; W586-H590 AromaticContact CE2-NE2 3.66Å; W586-H590 AromaticContact CE3-CE1 3.9Å; W586-H590 AromaticContact CE3-ND1 3.92Å; W586-H590 HydrophobicContact CG-CB 4.36Å; W586-H590 AromaticContact CG-CD2 3.56Å; W586-H590 AromaticContact CG-CG 3.95Å; W586-H590 AromaticContact NE1-CD2 3.99Å; W586-H590 AromaticContact NE1-NE2 3.88Å; W586-D612 HydrophobicContact CB-CB 4.15Å
587	H	93.1	Very high	85.9	Confident	26 Å²	26	22.5 Å²	22.5	12%	0.12	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-63.6	149.1	164.4	-50.4	125	0	0	0	110.3	H577 H581 H589 H590 E594 D612 M661 Y663	H577-H587 AromaticContact CE1-CD2 3.81Å; H577-H587 AromaticContact NE2-CD2 3.57Å; H577-H587 AromaticContact NE2-NE2 3.74Å; H581-H587 AromaticContact CE1-CD2 3.42Å; H581-H587 PolarHBondContact CE1-CD2 2.91Å; H581-H587 VanDerWaalsContact CE1-CD2 3.42Å; H581-H587 AromaticContact CE1-NE2 3.5Å; H581-H587 PolarHBondContact CE1-NE2 3.48Å; H581-H587 AromaticContact NE2-CD2 3.56Å; H581-H587 AromaticContact NE2-NE2 3.34Å; H581-H587 PolarHBondContact NE2-NE2 3.02Å; H587-H589 VanDerWaalsContact CB-CE1 3.44Å; H587-H589 WeakPolarHBondContact CB-CE1 3.18Å; H587-H589 WeakPolarHBondContact CB-ND1 3.29Å; H587-H589 AromaticContact CG-CE1 3.6Å; H587-H589 AromaticContact ND1-CE1 3.76Å; H587-H589 PolarHBondContact O-N 3.07Å; H587-H590 WeakPolarHBondContact O-CB 3.04Å; H587-H590 PolarHBondContact O-N 2.96Å; H587-E594 IonicContact CE1-OE1 3.44Å; H587-E594 IonicContact CG-OE1 2.78Å; H587-E594 IonicContact ND1-OE1 3.6Å; H587-E594 PolarHBondContact ND1-OE1 3.3Å; H587-D612 WeakPolarHBondContact O-CB 3.17Å; H587-M661 WeakPolarHBondContact CA-O 3.35Å; H587-Y663 AromaticContact CD2-CE1 3.59Å; H587-Y663 AromaticContact CE1-CZ 3.75Å; H587-Y663 PolarHBondContact CE1-OH 3.2Å; H587-Y663 AromaticContact NE2-CE1 3.38Å; H587-Y663 WeakPolarHBondContact NE2-CE1 3.26Å; H587-Y663 AromaticContact NE2-CZ 3.58Å; H587-Y663 PolarHBondContact NE2-OH 3.25Å; H587-Y663 VanDerWaalsContact NE2-OH 3.15Å
588	V	93.1	Very high	84.4	Confident	3 Å²	3	29 Å²	29	2%	0.018	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-4.1	175.5	-58.8	0	0	0	0	115.1	T617 T620 P656 N659 M661	V588-T617 HydrophobicContact CG1-CG2 4.13Å; V588-T620 HydrophobicContact CB-CG2 4.42Å; V588-T620 HydrophobicContact CG2-CG2 3.91Å; V588-T620 VanDerWaalsContact O-CG2 3.25Å; V588-T620 WeakPolarHBondContact O-CG2 3.48Å; V588-P656 HydrophobicContact CB-CB 4.34Å; V588-P656 HydrophobicContact CB-CG 3.55Å; V588-P656 HydrophobicContact CG1-CB 4.2Å; V588-P656 HydrophobicContact CG1-CG 3.93Å; V588-P656 HydrophobicContact CG2-CG 3.77Å; V588-N659 HydrophobicContact CG1-CB 4.07Å; V588-M661 HydrophobicContact CG1-CB 4.05Å; V588-M661 PolarHBondContact N-O 2.87Å
589	H	89.5	Confident	83.1	Confident	5 Å²	5	30.8 Å²	30.8	2%	0.023	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	6.9	174.6	64.2	-83.7	0	0	0	113.3	H587 G591 V592 S593 E594 T620 Y663	H587-H589 VanDerWaalsContact CB-CE1 3.44Å; H587-H589 WeakPolarHBondContact CB-CE1 3.18Å; H587-H589 WeakPolarHBondContact CB-ND1 3.29Å; H587-H589 AromaticContact CG-CE1 3.6Å; H587-H589 AromaticContact ND1-CE1 3.76Å; H587-H589 PolarHBondContact O-N 3.07Å; H589-G591 PolarHBondContact O-N 3.28Å; H589-V592 PolarHBondContact O-N 3.43Å; H589-V592 VanDerWaalsContact O-N 3.09Å; H589-S593 PolarHBondContact O-N 2.87Å; H589-E594 IonicContact CD2-OE1 3.5Å; H589-E594 IonicContact NE2-OE1 3.64Å; H589-E594 PolarHBondContact NE2-OE1 3.13Å; H589-T620 VanDerWaalsContact CA-O 3.24Å; H589-T620 WeakPolarHBondContact CA-O 3.47Å; H589-T620 HydrophobicContact CB-CG2 4.21Å; H589-T620 WeakPolarHBondContact CB-O 3.09Å; H589-Y663 AromaticContact CE1-CD2 3.44Å; H589-Y663 VanDerWaalsContact CE1-CD2 3.44Å; H589-Y663 WeakPolarHBondContact CE1-CD2 3.36Å; H589-Y663 AromaticContact CE1-CE2 3.22Å; H589-Y663 WeakPolarHBondContact CE1-CE2 3.42Å; H589-Y663 AromaticContact CE1-CG 3.96Å; H589-Y663 AromaticContact CE1-CZ 3.58Å; H589-Y663 AromaticContact NE2-CD2 3.88Å; H589-Y663 AromaticContact NE2-CE2 3.38Å; H589-Y663 WeakPolarHBondContact NE2-CE2 3.38Å; H589-Y663 AromaticContact NE2-CZ 3.94Å
590	H	88.4	Confident	81.8	Confident	21 Å²	21	36.4 Å²	36.4	10%	0.097	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	135.5	172.5	-171.6	59.5	0	0	0	109.6	W586 H587 V592 E594 G611 D612	W586-H590 HydrophobicContact CB-CB 3.86Å; W586-H590 AromaticContact CD1-CD2 3.71Å; W586-H590 AromaticContact CD2-CD2 3.71Å; W586-H590 AromaticContact CD2-CE1 3.98Å; W586-H590 AromaticContact CD2-NE2 3.73Å; W586-H590 AromaticContact CE2-NE2 3.66Å; W586-H590 AromaticContact CE3-CE1 3.9Å; W586-H590 AromaticContact CE3-ND1 3.92Å; W586-H590 HydrophobicContact CG-CB 4.36Å; W586-H590 AromaticContact CG-CD2 3.56Å; W586-H590 AromaticContact CG-CG 3.95Å; W586-H590 AromaticContact NE1-CD2 3.99Å; W586-H590 AromaticContact NE1-NE2 3.88Å; H587-H590 WeakPolarHBondContact O-CB 3.04Å; H587-H590 PolarHBondContact O-N 2.96Å; H590-V592 VanDerWaalsContact C-N 3.3Å; H590-V592 PolarHBondContact O-N 2.89Å; H590-E594 WeakPolarHBondContact CA-OE2 3.49Å; H590-E594 IonicContact CE1-OE2 2.81Å; H590-E594 IonicContact CG-OE2 2.67Å; H590-E594 IonicContact ND1-OE2 2.63Å; H590-E594 PolarHBondContact ND1-OE2 3.04Å; H590-G611 PolarHBondContact CD2-O 3.5Å; H590-G611 VanDerWaalsContact CD2-O 3.24Å; H590-G611 VanDerWaalsContact O-CA 3.3Å; H590-G611 WeakPolarHBondContact O-CA 3.45Å; H590-D612 HydrophobicContact CB-CB 4.26Å
591	G	76.2	Confident	81.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	6.4	-173	0	0	0	0	0	116.9	H589 M595 R602 E603	H589-G591 PolarHBondContact O-N 3.28Å; G591-M595 VanDerWaalsContact CA-SD 3.5Å; G591-R602 CarbonylContact O-C 3.57Å; G591-R602 WeakPolarHBondContact O-CA 3.12Å; G591-R602 WeakPolarHBondContact O-CG 3.43Å; G591-E603 PolarHBondContact O-N 2.74Å
592	V	80.6	Confident	80.6	Confident	17 Å²	17	38.7 Å²	38.7	10%	0.103	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.3	-56.9	171.4	-175.6	0	0	0	0	112.5	H589 H590 E603 P619 T620 P621 Y652	H589-V592 PolarHBondContact O-N 3.43Å; H589-V592 VanDerWaalsContact O-N 3.09Å; H590-V592 VanDerWaalsContact C-N 3.3Å; H590-V592 PolarHBondContact O-N 2.89Å; V592-E603 HydrophobicContact CG2-CB 4.19Å; V592-P619 HydrophobicContact CG2-CB 3.82Å; V592-T620 VanDerWaalsContact CB-O 3.29Å; V592-T620 WeakPolarHBondContact CB-O 3.32Å; V592-P621 HydrophobicContact CG1-CB 4.41Å; V592-Y652 HydrophobicContact CG1-CE1 4.23Å; V592-Y652 WeakPolarHBondContact CG1-OH 3.37Å
593	S	73.4	Confident	80.2	Confident	65 Å²	65	38.8 Å²	38.8	46%	0.455	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-10.8	178.2	-68.9	0	0	0	0	113.9	H589 P621 K622	H589-S593 PolarHBondContact O-N 2.87Å; S593-P621 VanDerWaalsContact OG-CA 3.22Å; S593-P621 WeakPolarHBondContact OG-CA 3.32Å; S593-P621 WeakPolarHBondContact OG-CB 3.39Å; S593-K622 PolarHBondContact OG-N 3.18Å
594	E	71	Confident	79.5	Confident	86 Å²	86	43.1 Å²	43.1	40%	0.402	24%	0.244	S	C	.	.	S	Bend	trans	-99.1	-9.7	-178.4	-62	177.4	169.5	0	0	112.9	H587 H589 H590	H587-E594 IonicContact CE1-OE1 3.44Å; H587-E594 IonicContact CG-OE1 2.78Å; H587-E594 IonicContact ND1-OE1 3.6Å; H587-E594 PolarHBondContact ND1-OE1 3.3Å; H589-E594 IonicContact CD2-OE1 3.5Å; H589-E594 IonicContact NE2-OE1 3.64Å; H589-E594 PolarHBondContact NE2-OE1 3.13Å; H590-E594 WeakPolarHBondContact CA-OE2 3.49Å; H590-E594 IonicContact CE1-OE2 2.81Å; H590-E594 IonicContact CG-OE2 2.67Å; H590-E594 IonicContact ND1-OE2 2.63Å; H590-E594 PolarHBondContact ND1-OE2 3.04Å
595	M	69.4	Low	79.2	Confident	41 Å²	41	50.6 Å²	50.6	20%	0.202	28%	0.277	C	S	.	.	S	Bend	trans	-121.9	153.9	-176.7	-69.7	-175.9	-168.6	0	0	112.8	G591 D599 C601	G591-M595 VanDerWaalsContact CA-SD 3.5Å; M595-D599 HydrophobicContact CB-CB 4.07Å; M595-C601 HydrophobicContact CE-CB 3.79Å; M595-C601 HydrophobicContact SD-CB 3.63Å
596	S	64.5	Low	78.8	Confident	72 Å²	72	52 Å²	52	50%	0.503	29%	0.287	S	S	.	.			trans	-77.3	160.8	178.5	81.6	0	0	0	0	112.8	D598 D599 R602	S596-D598 PolarHBondContact O-N 3.22Å; S596-D598 VanDerWaalsContact O-N 3.15Å; S596-D599 VanDerWaalsContact O-CB 3.29Å; S596-D599 WeakPolarHBondContact O-CB 3.46Å; S596-D599 PolarHBondContact O-N 2.87Å; S596-D599 VanDerWaalsContact O-N 3.17Å; S596-R602 VanDerWaalsContact O-CD 3.31Å; S596-R602 WeakPolarHBondContact O-CD 3.29Å
597	C	65.2	Low	78.6	Confident	43 Å²	43	51.2 Å²	51.2	29%	0.291	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-32.6	-178.8	-67	0	0	0	0	114.6	L643 C645	C597-L643 PolarHBondContact SG-O 3.21Å; C597-C645 VanDerWaalsContact CA-SG 3.59Å; C597-C645 HydrophobicContact CB-CB 3.77Å; C597-C645 WeakPolarHBondContact CB-SG 3.34Å; C597-C645 WeakPolarHBondContact SG-CB 3.11Å; C597-C645 PolarHBondContact SG-N 2.7Å; C597-C645 CovalentContact SG-SG 2.04Å; C597-C645 PolarHBondContact SG-SG 2.88Å
598	D	63.3	Low	78.3	Confident	157 Å²	157	50.4 Å²	50.4	84%	0.84	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	1.5	-173.7	-61.7	-35	0	0	0	112.9	S596	S596-D598 PolarHBondContact O-N 3.22Å; S596-D598 VanDerWaalsContact O-N 3.15Å
599	D	66.8	Low	77.9	Confident	54 Å²	54	54.4 Å²	54.4	29%	0.289	31%	0.305	S	S	.	.			trans	-71.7	126.3	-178.5	-165.4	-51	0	0	0	111.2	M595 S596 C601 R602	M595-D599 HydrophobicContact CB-CB 4.07Å; S596-D599 VanDerWaalsContact O-CB 3.29Å; S596-D599 WeakPolarHBondContact O-CB 3.46Å; S596-D599 PolarHBondContact O-N 2.87Å; S596-D599 VanDerWaalsContact O-N 3.17Å; D599-C601 PolarHBondContact O-N 2.66Å; D599-C601 WeakPolarHBondContact OD1-CB 3.4Å; D599-C601 PolarHBondContact OD1-N 3.38Å; D599-R602 HydrophobicContact CB-CB 4.3Å; D599-R602 WeakPolarHBondContact O-CB 3.31Å; D599-R602 PolarHBondContact O-N 3.25Å
600	P	68.5	Low	77.7	Confident	118 Å²	118	55.6 Å²	55.6	77%	0.766	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.1	180	28.9	-36.4	0	0	0	113.8
601	C	81.6	Confident	77.7	Confident	19 Å²	19	54.7 Å²	54.7	13%	0.128	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-0.9	177.9	-66.5	0	0	0	0	113.6	C340 M595 D599 E603 T610 G611	C340-C601 VanDerWaalsContact CA-SG 3.52Å; C340-C601 HydrophobicContact CB-CB 3.74Å; C340-C601 WeakPolarHBondContact CB-SG 3.3Å; C340-C601 WeakPolarHBondContact SG-CA 3.14Å; C340-C601 WeakPolarHBondContact SG-CB 3.47Å; C340-C601 CovalentContact SG-SG 2.03Å; C340-C601 PolarHBondContact SG-SG 3.33Å; M595-C601 HydrophobicContact CE-CB 3.79Å; M595-C601 HydrophobicContact SD-CB 3.63Å; D599-C601 PolarHBondContact O-N 2.66Å; D599-C601 WeakPolarHBondContact OD1-CB 3.4Å; D599-C601 PolarHBondContact OD1-N 3.38Å; C601-E603 PolarHBondContact O-N 3.11Å; C601-T610 WeakPolarHBondContact O-CB 3.4Å; C601-G611 PolarHBondContact O-N 3.29Å
602	R	81.5	Confident	78.5	Confident	41 Å²	41	54.7 Å²	54.7	16%	0.155	31%	0.309	C	S	.	.			trans	-63.3	130.5	179.4	-176.3	173.2	172.8	-115.8	-13.2	112.3	G591 S596 D599 C645	G591-R602 CarbonylContact O-C 3.57Å; G591-R602 WeakPolarHBondContact O-CA 3.12Å; G591-R602 WeakPolarHBondContact O-CG 3.43Å; S596-R602 VanDerWaalsContact O-CD 3.31Å; S596-R602 WeakPolarHBondContact O-CD 3.29Å; D599-R602 HydrophobicContact CB-CB 4.3Å; D599-R602 WeakPolarHBondContact O-CB 3.31Å; D599-R602 PolarHBondContact O-N 3.25Å; R602-C645 VanDerWaalsContact NH1-CB 3.34Å; R602-C645 PolarHBondContact NH2-SG 3.39Å
603	E	84.7	Confident	79.1	Confident	3 Å²	3	54 Å²	54	1%	0.014	30%	0.304	C	S	.	.			trans	-89.4	114.6	-177.6	-146.8	-171.5	-164.9	0	0	112.4	G591 V592 C601 K605 S606 S607 P619	G591-E603 PolarHBondContact O-N 2.74Å; V592-E603 HydrophobicContact CG2-CB 4.19Å; C601-E603 PolarHBondContact O-N 3.11Å; E603-K605 WeakPolarHBondContact CG-O 2.95Å; E603-S606 WeakPolarHBondContact OE1-CA 3.42Å; E603-S607 PolarHBondContact OE1-N 3.47Å; E603-P619 HydrophobicContact CB-CB 4.39Å; E603-P619 HydrophobicContact CB-CG 4.43Å; E603-P619 HydrophobicContact CG-CB 4.37Å; E603-P619 HydrophobicContact CG-CG 3.92Å
604	T	79.2	Confident	80	Confident	91 Å²	91	50.9 Å²	50.9	56%	0.558	28%	0.282	S	S	*	.	S	Bend	trans	-106.6	-13.3	173.1	54.5	0	0	0	0	112.9
605	K	84.7	Confident	81.1	Confident	157 Å²	157	51 Å²	51	68%	0.683	28%	0.283	S	S	*	.	S	Bend	trans	-158.2	144.5	178.6	-178.9	-164.2	166.7	-152.2	0	107.9	E603 S607	E603-K605 WeakPolarHBondContact CG-O 2.95Å; K605-S607 PolarHBondContact O-N 3.38Å
606	S	87.1	Confident	82.2	Confident	31 Å²	31	51.9 Å²	51.9	22%	0.217	29%	0.289	C	S	.	.			trans	-46.3	130.4	178.4	69.1	0	0	0	0	112.9	E603 E615 T617	E603-S606 WeakPolarHBondContact OE1-CA 3.42Å; S606-E615 WeakPolarHBondContact CB-O 3.21Å; S606-E615 PolarHBondContact OG-O 3.42Å; S606-E615 VanDerWaalsContact OG-O 3.06Å; S606-T617 WeakPolarHBondContact CB-O 3.35Å
607	S	88.1	Confident	83.6	Confident	25 Å²	25	48.6 Å²	48.6	18%	0.175	27%	0.265	C	S	.	.			trans	-153.7	140.9	-166	-176.1	0	0	0	0	113.9	E603 K605 L609 T610 L613 C614	E603-S607 PolarHBondContact OE1-N 3.47Å; K605-S607 PolarHBondContact O-N 3.38Å; S607-L609 PolarHBondContact O-N 2.79Å; S607-L609 PolarHBondContact OG-N 2.8Å; S607-T610 WeakPolarHBondContact CB-OG1 3.5Å; S607-T610 PolarHBondContact OG-N 2.72Å; S607-T610 PolarHBondContact OG-OG1 2.71Å; S607-L613 CarbonylContact O-C 3.58Å; S607-L613 WeakPolarHBondContact O-CA 3.34Å; S607-C614 CarbonylContact O-C 3.53Å; S607-C614 PolarHBondContact O-N 2.98Å; S607-C614 VanDerWaalsContact O-N 3.16Å
608	M	87.6	Confident	84.9	Confident	9 Å²	9	49.7 Å²	49.7	4%	0.044	27%	0.269	C	S	.	.	S	Bend	trans	-80.5	0	167.8	-69.9	-60.8	-45.3	0	0	113.5	P348 V351 L613 E615 Q675	P348-M608 HydrophobicContact CB-CB 4.09Å; P348-M608 HydrophobicContact CG-CB 3.92Å; V351-M608 HydrophobicContact CB-CE 3.65Å; V351-M608 HydrophobicContact CG1-CE 3.8Å; V351-M608 HydrophobicContact CG2-CE 3.72Å; M608-L613 WeakPolarHBondContact CE-O 3.48Å; M608-E615 HydrophobicContact CG-CB 3.96Å; M608-E615 HydrophobicContact CG-CG 3.7Å; M608-E615 HydrophobicContact SD-CB 4.4Å; M608-E615 HydrophobicContact SD-CG 3.97Å; M608-Q675 HydrophobicContact SD-CG 4.31Å; M608-Q675 PolarHBondContact SD-OE1 2.75Å
609	L	83.6	Confident	86.1	Confident	88 Å²	88	42.9 Å²	42.9	46%	0.461	23%	0.233	S	C	.	.	S	Bend	trans	-127.1	-10.9	-169.3	-66.5	175.4	0	0	0	114.3	P338 C340 P348 S607	P338-L609 HydrophobicContact CB-CD2 3.91Å; P338-L609 HydrophobicContact CG-CD2 4.15Å; C340-L609 VanDerWaalsContact CB-O 3.31Å; C340-L609 WeakPolarHBondContact CB-O 3.11Å; C340-L609 PolarHBondContact SG-O 3.29Å; C340-L609 VanDerWaalsContact SG-O 3.34Å; P348-L609 HydrophobicContact CG-CD2 3.66Å; P348-L609 HydrophobicContact CG-CG 4.27Å; S607-L609 PolarHBondContact O-N 2.79Å; S607-L609 PolarHBondContact OG-N 2.8Å
610	T	87	Confident	87.2	Confident	30 Å²	30	40.6 Å²	40.6	18%	0.184	22%	0.221	C	C	.	.	S	Bend	trans	-143.9	162.9	-177.6	54.3	0	0	0	0	108.4	C601 S607	C601-T610 WeakPolarHBondContact O-CB 3.4Å; S607-T610 WeakPolarHBondContact CB-OG1 3.5Å; S607-T610 PolarHBondContact OG-N 2.72Å; S607-T610 PolarHBondContact OG-OG1 2.71Å
611	G	88.3	Confident	88	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.01	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	-145.5	-178	0	0	0	0	0	113.2	H590 C601 L613	H590-G611 PolarHBondContact CD2-O 3.5Å; H590-G611 VanDerWaalsContact CD2-O 3.24Å; H590-G611 VanDerWaalsContact O-CA 3.3Å; H590-G611 WeakPolarHBondContact O-CA 3.45Å; C601-G611 PolarHBondContact O-N 3.29Å; G611-L613 PolarHBondContact O-N 3.2Å
612	D	92.2	Very high	88.1	Confident	1 Å²	1	40 Å²	40	1%	0.005	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-5.7	-179.2	79	-4.6	0	0	0	114.6	W586 H587 H590 C614 T617 R679	W586-D612 HydrophobicContact CB-CB 4.15Å; H587-D612 WeakPolarHBondContact O-CB 3.17Å; H590-D612 HydrophobicContact CB-CB 4.26Å; D612-C614 WeakPolarHBondContact OD1-CB 3.49Å; D612-C614 PolarHBondContact OD1-N 2.8Å; D612-T617 VanDerWaalsContact CG-OG1 3.22Å; D612-T617 PolarHBondContact OD1-OG1 2.91Å; D612-T617 WeakPolarHBondContact OD2-CB 3.16Å; D612-T617 PolarHBondContact OD2-OG1 3.19Å; D612-R679 PolarHBondContact O-NH1 2.96Å
613	L	93	Very high	88.2	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	20%	0.201	C	C	.	.	S	Bend	trans	72.1	30.7	179.9	-45.4	175.4	0	0	0	114.4	C340 D346 S607 M608 G611	C340-L613 HydrophobicContact CB-CD2 4.15Å; D346-L613 HydrophobicContact CB-CD1 3.78Å; S607-L613 CarbonylContact O-C 3.58Å; S607-L613 WeakPolarHBondContact O-CA 3.34Å; M608-L613 WeakPolarHBondContact CE-O 3.48Å; G611-L613 PolarHBondContact O-N 3.2Å
614	C	93.4	Very high	88.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.227	C	C	.	.			trans	-126.9	118.4	172.1	-66.7	0	0	0	0	110.7	S607 D612 D616 T617 Q675	S607-C614 CarbonylContact O-C 3.53Å; S607-C614 PolarHBondContact O-N 2.98Å; S607-C614 VanDerWaalsContact O-N 3.16Å; D612-C614 WeakPolarHBondContact OD1-CB 3.49Å; D612-C614 PolarHBondContact OD1-N 2.8Å; C614-D616 PolarHBondContact O-N 2.81Å; C614-T617 HydrophobicContact CB-CG2 4.44Å; C614-T617 VanDerWaalsContact CB-OG1 3.28Å; C614-T617 WeakPolarHBondContact CB-OG1 3.37Å; C614-T617 PolarHBondContact O-N 3.27Å; C614-T617 PolarHBondContact O-OG1 3.3Å; C614-Q675 HydrophobicContact CB-CB 4.26Å
615	E	93.2	Very high	88.5	Confident	88 Å²	88	42 Å²	42	41%	0.411	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-9.7	172.6	65.6	-177.6	173.6	0	0	113.5	K352 S606 M608 Q675	K352-E615 WeakPolarHBondContact CE-OE1 3.21Å; S606-E615 WeakPolarHBondContact CB-O 3.21Å; S606-E615 PolarHBondContact OG-O 3.42Å; S606-E615 VanDerWaalsContact OG-O 3.06Å; M608-E615 HydrophobicContact CG-CB 3.96Å; M608-E615 HydrophobicContact CG-CG 3.7Å; M608-E615 HydrophobicContact SD-CB 4.4Å; M608-E615 HydrophobicContact SD-CG 3.97Å; E615-Q675 PolarHBondContact OE1-NE2 3.25Å
616	D	93.8	Very high	88.7	Confident	61 Å²	61	37.3 Å²	37.3	33%	0.326	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.2	176.4	72.2	5.3	0	0	0	115.3	C614 T673 A674 Q675	C614-D616 PolarHBondContact O-N 2.81Å; D616-T673 VanDerWaalsContact CG-CB 3.4Å; D616-T673 VanDerWaalsContact CG-OG1 3.29Å; D616-T673 WeakPolarHBondContact OD1-CB 3.35Å; D616-T673 PolarHBondContact OD1-OG1 2.8Å; D616-T673 WeakPolarHBondContact OD2-CB 3.4Å; D616-T673 PolarHBondContact OD2-OG1 3.25Å; D616-A674 PolarHBondContact OD2-N 3.5Å; D616-A674 VanDerWaalsContact OD2-N 3.13Å; D616-Q675 VanDerWaalsContact CG-CD 3.48Å; D616-Q675 VanDerWaalsContact N-OE1 3.1Å; D616-Q675 PolarHBondContact OD1-OE1 2.92Å; D616-Q675 WeakPolarHBondContact OD2-CG 3.32Å; D616-Q675 PolarHBondContact OD2-N 2.97Å
617	T	93.1	Very high	88.8	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.012	22%	0.215	C	C	.	.	S	Bend	trans	-107.1	139.2	164.6	41.9	0	0	0	0	109.6	V588 S606 D612 C614 P656 T673	V588-T617 HydrophobicContact CG1-CG2 4.13Å; S606-T617 WeakPolarHBondContact CB-O 3.35Å; D612-T617 VanDerWaalsContact CG-OG1 3.22Å; D612-T617 PolarHBondContact OD1-OG1 2.91Å; D612-T617 WeakPolarHBondContact OD2-CB 3.16Å; D612-T617 PolarHBondContact OD2-OG1 3.19Å; C614-T617 HydrophobicContact CB-CG2 4.44Å; C614-T617 VanDerWaalsContact CB-OG1 3.28Å; C614-T617 WeakPolarHBondContact CB-OG1 3.37Å; C614-T617 PolarHBondContact O-N 3.27Å; C614-T617 PolarHBondContact O-OG1 3.3Å; T617-P656 HydrophobicContact CG2-CB 4.2Å; T617-P656 HydrophobicContact CG2-CG 4.32Å; T617-T673 HydrophobicContact CG2-CG2 3.62Å
618	N	92.5	Very high	88.8	Confident	67 Å²	67	42.7 Å²	42.7	36%	0.358	22%	0.218	S	C	.	.			trans	-88.1	143.2	174.3	-76.7	-49.6	0	0	0	110.3	T620 N654 P656	N618-T620 PolarHBondContact O-N 2.95Å; N618-N654 WeakPolarHBondContact CB-O 2.9Å; N618-N654 PolarHBondContact ND2-O 3.39Å; N618-P656 WeakPolarHBondContact O-CD 3.32Å
619	P	89.3	Confident	88.5	Confident	14 Å²	14	42.9 Å²	42.9	9%	0.091	22%	0.22	C	C	.	.			trans	-55.1	135.3	176.3	-19.4	26.6	0	0	0	110.5	V592 E603 Y652	V592-P619 HydrophobicContact CG2-CB 3.82Å; E603-P619 HydrophobicContact CB-CB 4.39Å; E603-P619 HydrophobicContact CB-CG 4.43Å; E603-P619 HydrophobicContact CG-CB 4.37Å; E603-P619 HydrophobicContact CG-CG 3.92Å; P619-Y652 HydrophobicContact CB-CE1 4.41Å; P619-Y652 WeakPolarHBondContact O-CD1 3.4Å
620	T	88.1	Confident	87.6	Confident	6 Å²	6	43.3 Å²	43.3	4%	0.037	22%	0.222	C	C	.	.			trans	-142.3	143.6	175.8	177.4	0	0	0	0	110.5	V588 H589 V592 N618 P656	V588-T620 HydrophobicContact CB-CG2 4.42Å; V588-T620 HydrophobicContact CG2-CG2 3.91Å; V588-T620 VanDerWaalsContact O-CG2 3.25Å; V588-T620 WeakPolarHBondContact O-CG2 3.48Å; H589-T620 VanDerWaalsContact CA-O 3.24Å; H589-T620 WeakPolarHBondContact CA-O 3.47Å; H589-T620 HydrophobicContact CB-CG2 4.21Å; H589-T620 WeakPolarHBondContact CB-O 3.09Å; V592-T620 VanDerWaalsContact CB-O 3.29Å; V592-T620 WeakPolarHBondContact CB-O 3.32Å; N618-T620 PolarHBondContact O-N 2.95Å; T620-P656 HydrophobicContact CG2-CG 4.14Å
621	P	85.1	Confident	86.1	Confident	14 Å²	14	49 Å²	49	9%	0.091	25%	0.246	C	C	.	.			trans	-65.2	169.3	164.2	31.4	-36.8	0	0	0	110.6	V592 S593 N623 P629 Y652	V592-P621 HydrophobicContact CG1-CB 4.41Å; S593-P621 VanDerWaalsContact OG-CA 3.22Å; S593-P621 WeakPolarHBondContact OG-CA 3.32Å; S593-P621 WeakPolarHBondContact OG-CB 3.39Å; P621-N623 PolarHBondContact O-N 2.75Å; P621-P629 HydrophobicContact CG-CB 4.14Å; P621-P629 HydrophobicContact CG-CG 3.79Å; P621-Y652 HydrophobicContact CG-CD2 4.03Å; P621-Y652 HydrophobicContact CG-CE2 4.11Å
622	K	84.4	Confident	84.3	Confident	110 Å²	110	52.1 Å²	52.1	48%	0.478	27%	0.265	S	S	.	.	S	Bend	trans	-53	112.4	168.8	-176.2	170.7	175.5	160.2	0	109.4	S593 Y663	S593-K622 PolarHBondContact OG-N 3.18Å; K622-Y663 HydrophobicContact CD-CD2 4.09Å; K622-Y663 HydrophobicContact CD-CE2 3.96Å; K622-Y663 VanDerWaalsContact CE-CE2 3.5Å; K622-Y663 HydrophobicContact CG-CD2 3.77Å; K622-Y663 HydrophobicContact CG-CE2 4.08Å
623	N	83.3	Confident	82.1	Confident	13 Å²	13	59.4 Å²	59.4	7%	0.07	30%	0.297	C	S	.	.			trans	-134.6	132	-174	-176.8	22.2	0	0	0	110.2	P621 E625 R627 P629 Y663	P621-N623 PolarHBondContact O-N 2.75Å; N623-E625 PolarHBondContact ND2-O 3.09Å; N623-E625 PolarHBondContact OD1-N 3.15Å; N623-R627 PolarHBondContact ND2-O 3.06Å; N623-P629 HydrophobicContact CB-CB 4.49Å; N623-Y663 CarbonylContact O-C 3.57Å
624	V	85.6	Confident	79.2	Confident	90 Å²	90	67.5 Å²	67.5	55%	0.545	33%	0.329	S	S	.	.			trans	-109.5	-6.3	177.9	-61	0	0	0	0	112.7	Y663 S664 D665	V624-Y663 WeakPolarHBondContact CA-O 3.24Å; V624-S664 WeakPolarHBondContact O-CA 3.31Å; V624-D665 PolarHBondContact O-N 2.83Å
625	E	85.1	Confident	76.6	Confident	73 Å²	73	71.8 Å²	71.8	34%	0.341	35%	0.352	S	S	.	.	S	Bend	trans	-87.8	142.9	-179.4	-52.9	-168.6	137.4	0	0	111.3	N623 R627	N623-E625 PolarHBondContact ND2-O 3.09Å; N623-E625 PolarHBondContact OD1-N 3.15Å; E625-R627 HydrophobicContact CB-CG 3.87Å; E625-R627 PolarHBondContact O-N 3.25Å; E625-R627 IonicContact OE1-CZ 3.63Å; E625-R627 IonicContact OE1-NE 3.89Å; E625-R627 IonicContact OE1-NH2 3.29Å; E625-R627 PolarHBondContact OE1-NH2 3.32Å; E625-R627 IonicContact OE2-CZ 3.8Å; E625-R627 VanDerWaalsContact OE2-CZ 3.27Å; E625-R627 IonicContact OE2-NE 2.65Å; E625-R627 PolarHBondContact OE2-NE 3.04Å; E625-R627 IonicContact OE2-NH2 3.37Å; E625-R627 PolarHBondContact OE2-NH2 2.76Å
626	C	89.1	Confident	73.8	Confident	60 Å²	60	78.3 Å²	78.3	41%	0.405	37%	0.372	S	S	.	.	S	Bend	trans	-75.6	45.6	173.6	-61.2	0	0	0	0	113.1	F657 C668	C626-F657 HydrophobicContact CB-CD2 4.47Å; C626-F657 VanDerWaalsContact O-CE2 3.24Å; C626-F657 WeakPolarHBondContact O-CE2 2.98Å; C626-C668 HydrophobicContact CB-CB 3.58Å; C626-C668 WeakPolarHBondContact CB-SG 3.46Å; C626-C668 WeakPolarHBondContact SG-CB 3.37Å; C626-C668 CovalentContact SG-SG 2.03Å; C626-C668 PolarHBondContact SG-SG 3.18Å
627	R	89.4	Confident	71.3	Confident	121 Å²	121	82.7 Å²	82.7	46%	0.457	40%	0.396	S	S	.	.	S	Bend	trans	-162.8	167.5	179.7	59.9	-177.2	-179.2	-166.9	-3.6	110	N623 E625 F657	N623-R627 PolarHBondContact ND2-O 3.06Å; E625-R627 HydrophobicContact CB-CG 3.87Å; E625-R627 PolarHBondContact O-N 3.25Å; E625-R627 IonicContact OE1-CZ 3.63Å; E625-R627 IonicContact OE1-NE 3.89Å; E625-R627 IonicContact OE1-NH2 3.29Å; E625-R627 PolarHBondContact OE1-NH2 3.32Å; E625-R627 IonicContact OE2-CZ 3.8Å; E625-R627 VanDerWaalsContact OE2-CZ 3.27Å; E625-R627 IonicContact OE2-NE 2.65Å; E625-R627 PolarHBondContact OE2-NE 3.04Å; E625-R627 IonicContact OE2-NH2 3.37Å; E625-R627 PolarHBondContact OE2-NH2 2.76Å; R627-F657 VanDerWaalsContact C-CD1 3.45Å
628	D	87.9	Confident	68.7	Low	47 Å²	47	90 Å²	90	25%	0.251	43%	0.427	S	S	.	.	S	Bend	trans	-57.1	139.3	171	-74.5	-24.6	0	0	0	111.6	I630 T653 N654 T655	D628-I630 PolarHBondContact O-N 3.18Å; D628-T653 WeakPolarHBondContact OD2-CA 3.47Å; D628-N654 PolarHBondContact OD1-N 3.15Å; D628-N654 PolarHBondContact OD2-N 2.8Å; D628-T655 WeakPolarHBondContact OD1-CB 3.2Å; D628-T655 PolarHBondContact OD1-N 2.87Å; D628-T655 PolarHBondContact OD1-OG1 2.62Å
629	P	81.5	Confident	65.6	Low	13 Å²	13	91.2 Å²	91.2	8%	0.084	46%	0.456	C	S	.	.			trans	-67.9	117.8	-173	26.7	-33.8	0	0	0	111.1	P621 N623 H631 T655	P621-P629 HydrophobicContact CG-CB 4.14Å; P621-P629 HydrophobicContact CG-CG 3.79Å; N623-P629 HydrophobicContact CB-CB 4.49Å; P629-H631 VanDerWaalsContact C-N 3.31Å; P629-H631 PolarHBondContact O-N 3Å; P629-T655 HydrophobicContact CG-CG2 4.38Å
630	I	64.2	Low	62.9	Low	97 Å²	97	95.6 Å²	95.6	50%	0.497	49%	0.487	S	S	.	.	S	Bend	trans	-72.5	-21.1	-167.2	-62	-167.6	0	0	0	113.4	D628	D628-I630 PolarHBondContact O-N 3.18Å
631	H	55.2	Low	60.1	Low	149 Å²	149	103.9 Å²	103.9	69%	0.69	53%	0.525	S	S	*	.	S	Bend	trans	-141.5	146.2	177.4	-68.9	-66.5	0	0	0	112.5	P629 F633	P629-H631 VanDerWaalsContact C-N 3.31Å; P629-H631 PolarHBondContact O-N 3Å; H631-F633 PolarHBondContact O-N 2.92Å
632	V	51.7	Low	57.8	Low	67 Å²	67	108.3 Å²	108.3	41%	0.406	56%	0.557	S	S	.	*			trans	-67.9	117.4	161.2	-176.4	0	0	0	0	107.2	Y634 V648	V632-Y634 PolarHBondContact O-N 2.91Å; V632-V648 HydrophobicContact CB-CG1 4.23Å; V632-V648 HydrophobicContact CG1-CG1 3.59Å; V632-V648 HydrophobicContact CG2-CG1 3.95Å
633	F	44.8	Very low	55.8	Low	155 Å²	155	109.2 Å²	109.2	68%	0.68	57%	0.566	S	S	*	*			trans	-62.2	97.8	-176.3	-74.1	-87.4	0	0	0	112.5	H631 D635	H631-F633 PolarHBondContact O-N 2.92Å; F633-D635 PolarHBondContact O-N 2.84Å
634	Y	32.3	Very low	54.2	Low	171 Å²	171	114.1 Å²	114.1	67%	0.671	59%	0.592	S	S	*	*			trans	-80.9	88.6	149.4	-88.6	-92.3	0	0	0	107.8	V632 R636	V632-Y634 PolarHBondContact O-N 2.91Å; Y634-R636 PolarHBondContact O-N 3.27Å; Y634-R636 VanDerWaalsContact O-N 3.09Å
635	D	39.4	Very low	52.8	Low	90 Å²	90	111 Å²	111	48%	0.481	57%	0.574	S	S	.	*			trans	-69.5	103.1	162.4	-173.6	-9.1	0	0	0	107.6	F633 D637	F633-D635 PolarHBondContact O-N 2.84Å; D635-D637 VanDerWaalsContact C-N 3.29Å; D635-D637 PolarHBondContact OD1-N 2.7Å; D635-D637 VanDerWaalsContact OD1-N 3.07Å
636	R	34.8	Very low	51.1	Low	224 Å²	224	116.4 Å²	116.4	85%	0.845	60%	0.599	S	S	*	*			trans	-82.2	-10.7	-175.7	-124.8	-177.5	-171.1	-178.5	4.5	113	Y634	Y634-R636 PolarHBondContact O-N 3.27Å; Y634-R636 VanDerWaalsContact O-N 3.09Å
637	D	39.8	Very low	49.3	Very low	154 Å²	154	117.3 Å²	117.3	82%	0.824	60%	0.6	S	S	*	*	S	Bend	trans	-103.7	-1.5	-168.7	-63.3	-30.7	0	0	0	112.7	D635	D635-D637 VanDerWaalsContact C-N 3.29Å; D635-D637 PolarHBondContact OD1-N 2.7Å; D635-D637 VanDerWaalsContact OD1-N 3.07Å
638	K	39.5	Very low	47.4	Very low	154 Å²	154	113.5 Å²	113.5	67%	0.67	59%	0.59	S	S	*	*	S	Bend	trans	-122	102.3	169.8	-66.4	179.3	-174.6	169.2	0	110.3	S640	K638-S640 VanDerWaalsContact C-N 3.26Å; K638-S640 PolarHBondContact O-N 3.41Å
639	G	27.8	Very low	45.7	Very low	94 Å²	94	122.7 Å²	122.7	97%	0.969	62%	0.621	S	S	*	*			trans	-69.1	64.8	-172.1	0	0	0	0	0	116.1
640	S	32	Very low	44.8	Very low	105 Å²	105	128.7 Å²	128.7	73%	0.734	65%	0.646	S	S	*	*			trans	-116.2	128.3	172.7	-172.7	0	0	0	0	110.3	K638 S642	K638-S640 VanDerWaalsContact C-N 3.26Å; K638-S640 PolarHBondContact O-N 3.41Å; S640-S642 PolarHBondContact O-N 2.98Å
641	E	29.3	Very low	44.9	Very low	180 Å²	180	129 Å²	129	84%	0.841	65%	0.654	S	S	*	*			trans	-70.4	87.5	176.1	-70.9	-179.3	124.7	0	0	111	L643	E641-L643 PolarHBondContact O-N 2.86Å; E641-L643 VanDerWaalsContact O-N 3.1Å
642	S	37.9	Very low	46	Very low	108 Å²	108	124.7 Å²	124.7	76%	0.755	63%	0.632	S	S	*	*			trans	-70.4	98	159.3	-174.7	0	0	0	0	108.7	S640 L644	S640-S642 PolarHBondContact O-N 2.98Å; S642-L644 PolarHBondContact O-N 3.18Å
643	L	41	Very low	47.5	Very low	129 Å²	129	125.6 Å²	125.6	68%	0.675	64%	0.638	S	S	*	*			trans	-58	125.1	173.6	-110	71.4	0	0	0	109.2	C597 E641 C645	C597-L643 PolarHBondContact SG-O 3.21Å; E641-L643 PolarHBondContact O-N 2.86Å; E641-L643 VanDerWaalsContact O-N 3.1Å; L643-C645 PolarHBondContact O-N 2.75Å
644	L	50	Low	49.6	Very low	115 Å²	115	124.1 Å²	124.1	60%	0.602	64%	0.637	S	S	*	*			trans	-64.6	109.2	179.6	-73.9	83.8	0	0	0	110.7	S642	S642-L644 PolarHBondContact O-N 3.18Å
645	C	56.3	Low	52.4	Low	25 Å²	25	116.3 Å²	116.3	17%	0.169	61%	0.607	C	S	.	*			trans	-64.4	136.6	163.1	-20.1	0	0	0	0	109.4	C597 R602 L643 D647 V648	C597-C645 VanDerWaalsContact CA-SG 3.59Å; C597-C645 HydrophobicContact CB-CB 3.77Å; C597-C645 WeakPolarHBondContact CB-SG 3.34Å; C597-C645 WeakPolarHBondContact SG-CB 3.11Å; C597-C645 PolarHBondContact SG-N 2.7Å; C597-C645 CovalentContact SG-SG 2.04Å; C597-C645 PolarHBondContact SG-SG 2.88Å; R602-C645 VanDerWaalsContact NH1-CB 3.34Å; R602-C645 PolarHBondContact NH2-SG 3.39Å; L643-C645 PolarHBondContact O-N 2.75Å; C645-D647 VanDerWaalsContact C-N 3.28Å; C645-D647 PolarHBondContact O-N 2.97Å; C645-D647 VanDerWaalsContact O-N 3.08Å; C645-V648 HydrophobicContact CB-CG2 4.49Å; C645-V648 WeakPolarHBondContact O-CB 3.12Å; C645-V648 WeakPolarHBondContact O-CG2 3.4Å; C645-V648 PolarHBondContact O-N 3.1Å
646	E	48.6	Very low	54.9	Low	186 Å²	186	112.6 Å²	112.6	87%	0.869	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-64	-22.8	-164.5	-64.8	-168	129.1	0	0	115.9	V648	E646-V648 VanDerWaalsContact C-N 3.27Å; E646-V648 PolarHBondContact O-N 3.33Å
647	D	51.2	Low	57.6	Low	79 Å²	79	104.4 Å²	104.4	42%	0.422	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-74.8	-8.1	-179.1	-106.5	-47.5	0	0	0	115.1	C645 R649 K650	C645-D647 VanDerWaalsContact C-N 3.28Å; C645-D647 PolarHBondContact O-N 2.97Å; C645-D647 VanDerWaalsContact O-N 3.08Å; D647-R649 PolarHBondContact O-N 3.46Å; D647-K650 PolarHBondContact O-N 2.88Å; D647-K650 IonicContact OD1-NZ 2.85Å; D647-K650 PolarHBondContact OD1-NZ 3.38Å
648	V	50.9	Low	60.1	Low	41 Å²	41	99.7 Å²	99.7	25%	0.248	53%	0.533	C	S	.	.	G	3₁₀ helix	trans	-62.4	-1.9	-175.4	171.6	0	0	0	0	114.3	V632 C645 E646	V632-V648 HydrophobicContact CB-CG1 4.23Å; V632-V648 HydrophobicContact CG1-CG1 3.59Å; V632-V648 HydrophobicContact CG2-CG1 3.95Å; C645-V648 HydrophobicContact CB-CG2 4.49Å; C645-V648 WeakPolarHBondContact O-CB 3.12Å; C645-V648 WeakPolarHBondContact O-CG2 3.4Å; C645-V648 PolarHBondContact O-N 3.1Å; E646-V648 VanDerWaalsContact C-N 3.27Å; E646-V648 PolarHBondContact O-N 3.33Å
649	R	50.7	Low	62.7	Low	240 Å²	240	92.3 Å²	92.3	91%	0.906	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-81	-7.8	176.8	-58.1	-171.1	-169.4	-163.4	3.9	114.8	D647	D647-R649 PolarHBondContact O-N 3.46Å
650	K	62.5	Low	65.9	Low	139 Å²	139	89 Å²	89	60%	0.604	46%	0.46	S	S	*	.	S	Bend	trans	-100	132.1	175.7	-63.8	172.6	-166.6	135.3	0	109.7	D647	D647-K650 PolarHBondContact O-N 2.88Å; D647-K650 IonicContact OD1-NZ 2.85Å; D647-K650 PolarHBondContact OD1-NZ 3.38Å
651	P	67.1	Low	68.8	Low	103 Å²	103	84 Å²	84	67%	0.669	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-66.4	144.1	169.6	29.4	-33.7	0	0	0	110	T653	P651-T653 HydrophobicContact CG-CG2 4.46Å
652	Y	78.8	Confident	71.8	Confident	60 Å²	60	75.9 Å²	75.9	24%	0.235	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-73.3	132.8	168.6	-65.5	-85.9	0	0	0	108.9	V592 P619 P621	V592-Y652 HydrophobicContact CG1-CE1 4.23Å; V592-Y652 WeakPolarHBondContact CG1-OH 3.37Å; P619-Y652 HydrophobicContact CB-CE1 4.41Å; P619-Y652 WeakPolarHBondContact O-CD1 3.4Å; P621-Y652 HydrophobicContact CG-CD2 4.03Å; P621-Y652 HydrophobicContact CG-CE2 4.11Å
653	T	83.8	Confident	74.1	Confident	86 Å²	86	74.4 Å²	74.4	53%	0.528	37%	0.366	S	S	.	.			trans	-139.7	142.7	-174.5	59.3	0	0	0	0	110.8	D628 P651 T655	D628-T653 WeakPolarHBondContact OD2-CA 3.47Å; P651-T653 HydrophobicContact CG-CG2 4.46Å; T653-T655 VanDerWaalsContact C-N 3.28Å
654	N	88.9	Confident	76.1	Confident	124 Å²	124	68.8 Å²	68.8	66%	0.663	34%	0.338	S	S	*	.	S	Bend	trans	56.2	42.3	-172.9	-56.5	-39.6	0	0	0	112.2	N618 D628	N618-N654 WeakPolarHBondContact CB-O 2.9Å; N618-N654 PolarHBondContact ND2-O 3.39Å; D628-N654 PolarHBondContact OD1-N 3.15Å; D628-N654 PolarHBondContact OD2-N 2.8Å
655	T	90.2	Very high	76.9	Confident	6 Å²	6	69 Å²	69	4%	0.037	34%	0.339	C	S	.	.			trans	-68.5	147.8	175.8	61.4	0	0	0	0	111	D628 P629 T653 F657	D628-T655 WeakPolarHBondContact OD1-CB 3.2Å; D628-T655 PolarHBondContact OD1-N 2.87Å; D628-T655 PolarHBondContact OD1-OG1 2.62Å; P629-T655 HydrophobicContact CG-CG2 4.38Å; T653-T655 VanDerWaalsContact C-N 3.28Å; T655-F657 WeakPolarHBondContact O-CD1 3.14Å; T655-F657 PolarHBondContact O-N 2.83Å
656	P	92.5	Very high	77.1	Confident	12 Å²	12	68.4 Å²	68.4	8%	0.078	34%	0.337	C	S	.	.			trans	-78.2	45.4	-177.1	33.1	-38.5	0	0	0	113.3	V588 T617 N618 T620 N658 N659	V588-P656 HydrophobicContact CB-CB 4.34Å; V588-P656 HydrophobicContact CB-CG 3.55Å; V588-P656 HydrophobicContact CG1-CB 4.2Å; V588-P656 HydrophobicContact CG1-CG 3.93Å; V588-P656 HydrophobicContact CG2-CG 3.77Å; T617-P656 HydrophobicContact CG2-CB 4.2Å; T617-P656 HydrophobicContact CG2-CG 4.32Å; N618-P656 WeakPolarHBondContact O-CD 3.32Å; T620-P656 HydrophobicContact CG2-CG 4.14Å; P656-N658 PolarHBondContact O-N 3.19Å; P656-N658 VanDerWaalsContact O-N 3.15Å; P656-N659 HydrophobicContact CB-CB 4.11Å; P656-N659 WeakPolarHBondContact O-CB 3.48Å; P656-N659 PolarHBondContact O-N 3.48Å; P656-N659 VanDerWaalsContact O-N 3.08Å
657	F	90.8	Very high	78.2	Confident	52 Å²	52	67.4 Å²	67.4	23%	0.228	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-10.9	-179.8	67	-100.1	0	0	0	114.3	C626 R627 T655 S662 S664	C626-F657 HydrophobicContact CB-CD2 4.47Å; C626-F657 VanDerWaalsContact O-CE2 3.24Å; C626-F657 WeakPolarHBondContact O-CE2 2.98Å; R627-F657 VanDerWaalsContact C-CD1 3.45Å; T655-F657 WeakPolarHBondContact O-CD1 3.14Å; T655-F657 PolarHBondContact O-N 2.83Å; F657-S662 PolarHBondContact O-OG 3.13Å; F657-S664 WeakPolarHBondContact O-CB 3.39Å; F657-S664 PolarHBondContact O-OG 3.46Å
658	N	92.4	Very high	79.8	Confident	55 Å²	55	65 Å²	65	29%	0.294	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	10.4	175.9	60.9	-10.4	0	0	0	112.5	P656 A669 N670 H671	P656-N658 PolarHBondContact O-N 3.19Å; P656-N658 VanDerWaalsContact O-N 3.15Å; N658-A669 WeakPolarHBondContact O-CA 3.45Å; N658-N670 PolarHBondContact O-N 3.36Å; N658-N670 PolarHBondContact O-OD1 3.04Å; N658-H671 PolarHBondContact O-ND1 2.95Å; N658-H671 PolarHBondContact OD1-CE1 2.75Å
659	N	94.2	Very high	81.7	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-85	143.4	174.2	-167.5	-79.8	0	0	0	110.4	V588 P656 M661 S662 H671 Q676	V588-N659 HydrophobicContact CG1-CB 4.07Å; P656-N659 HydrophobicContact CB-CB 4.11Å; P656-N659 WeakPolarHBondContact O-CB 3.48Å; P656-N659 PolarHBondContact O-N 3.48Å; P656-N659 VanDerWaalsContact O-N 3.08Å; N659-M661 PolarHBondContact O-N 3Å; N659-M661 WeakPolarHBondContact OD1-CB 3.32Å; N659-M661 PolarHBondContact OD1-N 3.04Å; N659-S662 WeakPolarHBondContact O-CB 3.26Å; N659-S662 PolarHBondContact O-N 3.34Å; N659-S662 VanDerWaalsContact O-N 3.09Å; N659-S662 PolarHBondContact O-OG 2.69Å; N659-H671 WeakPolarHBondContact CA-O 3.28Å; N659-Q676 PolarHBondContact ND2-NE2 2.85Å; N659-Q676 PolarHBondContact ND2-OE1 2.87Å; N659-Q676 PolarHBondContact OD1-NE2 2.89Å; N659-Q676 VanDerWaalsContact OD1-NE2 3.12Å; N659-Q676 PolarHBondContact OD1-OE1 2.94Å
660	Y	94.1	Very high	83.6	Confident	25 Å²	25	56 Å²	56	10%	0.098	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-23.8	176	-69.8	-57.5	0	0	0	113.7	A398 N573 V576 H577 S662 A669 N670 H671 F672	A398-Y660 HydrophobicContact CB-CE2 4.16Å; N573-Y660 HydrophobicContact CB-CD1 4.47Å; V576-Y660 HydrophobicContact CB-CD1 4.47Å; V576-Y660 HydrophobicContact CG1-CD1 3.86Å; V576-Y660 HydrophobicContact CG1-CD2 3.93Å; V576-Y660 HydrophobicContact CG1-CE1 4.14Å; V576-Y660 HydrophobicContact CG1-CE2 4.18Å; V576-Y660 HydrophobicContact CG1-CG 3.76Å; H577-Y660 PolarHBondContact ND1-O 3.08Å; Y660-S662 VanDerWaalsContact C-N 3.3Å; Y660-S662 PolarHBondContact O-N 3.1Å; Y660-A669 HydrophobicContact CD1-CB 3.79Å; Y660-A669 HydrophobicContact CE1-CB 4.32Å; Y660-A669 WeakPolarHBondContact CE1-O 3.43Å; Y660-N670 VanDerWaalsContact CE2-C 3.42Å; Y660-N670 WeakPolarHBondContact CE2-O 3.4Å; Y660-N670 PolarHBondContact OH-O 3.49Å; Y660-H671 VanDerWaalsContact CD2-C 3.43Å; Y660-H671 WeakPolarHBondContact CD2-O 3.42Å; Y660-H671 PolarHBondContact N-O 2.99Å; Y660-F672 VanDerWaalsContact CB-CE1 3.46Å; Y660-F672 HydrophobicContact CD2-CD1 4.24Å; Y660-F672 AromaticContact CD2-CD2 3.74Å; Y660-F672 HydrophobicContact CD2-CD2 3.74Å; Y660-F672 HydrophobicContact CD2-CE1 4.08Å; Y660-F672 AromaticContact CD2-CE2 3.53Å; Y660-F672 HydrophobicContact CD2-CE2 3.53Å; Y660-F672 HydrophobicContact CD2-CG 4.08Å; Y660-F672 AromaticContact CD2-CZ 3.72Å; Y660-F672 HydrophobicContact CD2-CZ 3.72Å; Y660-F672 HydrophobicContact CE2-CD2 4.35Å; Y660-F672 HydrophobicContact CE2-CE2 4.19Å; Y660-F672 HydrophobicContact CG-CE1 4.25Å; Y660-F672 HydrophobicContact CG-CE2 4.3Å; Y660-F672 HydrophobicContact CG-CZ 4.03Å
661	M	94	Very high	85	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	17.4	175.6	-55.4	-49.6	-56	0	0	114	H581 L585 H587 V588 N659 F672	H581-M661 WeakPolarHBondContact CE1-CE 3.45Å; H581-M661 WeakPolarHBondContact ND1-CE 3.47Å; L585-M661 HydrophobicContact CB-CE 4.13Å; L585-M661 HydrophobicContact CB-CG 4.05Å; L585-M661 HydrophobicContact CB-SD 4.14Å; L585-M661 HydrophobicContact CD1-CG 3.95Å; L585-M661 HydrophobicContact CD1-SD 4.27Å; H587-M661 WeakPolarHBondContact CA-O 3.35Å; V588-M661 HydrophobicContact CG1-CB 4.05Å; V588-M661 PolarHBondContact N-O 2.87Å; N659-M661 PolarHBondContact O-N 3Å; N659-M661 WeakPolarHBondContact OD1-CB 3.32Å; N659-M661 PolarHBondContact OD1-N 3.04Å; M661-F672 HydrophobicContact CG-CD1 4.2Å; M661-F672 HydrophobicContact CG-CE1 3.95Å; M661-F672 HydrophobicContact SD-CE1 3.78Å
662	S	91.7	Very high	86.4	Confident	9 Å²	9	47.2 Å²	47.2	6%	0.063	24%	0.243	C	C	.	.	S	Bend	trans	-96.4	170.1	170	76.3	0	0	0	0	111.5	H577 F657 N659 Y660 S664	H577-S662 PolarHBondContact CE1-O 2.92Å; H577-S662 VanDerWaalsContact CE1-O 3.28Å; H577-S662 PolarHBondContact ND1-O 2.87Å; F657-S662 PolarHBondContact O-OG 3.13Å; N659-S662 WeakPolarHBondContact O-CB 3.26Å; N659-S662 PolarHBondContact O-N 3.34Å; N659-S662 VanDerWaalsContact O-N 3.09Å; N659-S662 PolarHBondContact O-OG 2.69Å; Y660-S662 VanDerWaalsContact C-N 3.3Å; Y660-S662 PolarHBondContact O-N 3.1Å; S662-S664 PolarHBondContact OG-N 3.01Å; S662-S664 PolarHBondContact OG-OG 3.39Å; S662-S664 VanDerWaalsContact OG-OG 3.07Å
663	Y	86.5	Confident	87.2	Confident	77 Å²	77	45.1 Å²	45.1	30%	0.302	24%	0.237	S	C	.	.			trans	-97	13.7	172	-70.4	-20.8	0	0	0	113	H577 H587 H589 K622 N623 V624	H577-Y663 AromaticContact CE1-CD1 3.95Å; H577-Y663 AromaticContact NE2-CE1 3.93Å; H587-Y663 AromaticContact CD2-CE1 3.59Å; H587-Y663 AromaticContact CE1-CZ 3.75Å; H587-Y663 PolarHBondContact CE1-OH 3.2Å; H587-Y663 AromaticContact NE2-CE1 3.38Å; H587-Y663 WeakPolarHBondContact NE2-CE1 3.26Å; H587-Y663 AromaticContact NE2-CZ 3.58Å; H587-Y663 PolarHBondContact NE2-OH 3.25Å; H587-Y663 VanDerWaalsContact NE2-OH 3.15Å; H589-Y663 AromaticContact CE1-CD2 3.44Å; H589-Y663 VanDerWaalsContact CE1-CD2 3.44Å; H589-Y663 WeakPolarHBondContact CE1-CD2 3.36Å; H589-Y663 AromaticContact CE1-CE2 3.22Å; H589-Y663 WeakPolarHBondContact CE1-CE2 3.42Å; H589-Y663 AromaticContact CE1-CG 3.96Å; H589-Y663 AromaticContact CE1-CZ 3.58Å; H589-Y663 AromaticContact NE2-CD2 3.88Å; H589-Y663 AromaticContact NE2-CE2 3.38Å; H589-Y663 WeakPolarHBondContact NE2-CE2 3.38Å; H589-Y663 AromaticContact NE2-CZ 3.94Å; K622-Y663 HydrophobicContact CD-CD2 4.09Å; K622-Y663 HydrophobicContact CD-CE2 3.96Å; K622-Y663 VanDerWaalsContact CE-CE2 3.5Å; K622-Y663 HydrophobicContact CG-CD2 3.77Å; K622-Y663 HydrophobicContact CG-CE2 4.08Å; N623-Y663 CarbonylContact O-C 3.57Å; V624-Y663 WeakPolarHBondContact CA-O 3.24Å
664	S	82.4	Confident	87.7	Confident	11 Å²	11	43.1 Å²	43.1	8%	0.077	23%	0.229	C	C	.	.	S	Bend	trans	-59.4	146.3	173.9	71.6	0	0	0	0	110.9	V624 F657 S662 G666 C668	V624-S664 WeakPolarHBondContact O-CA 3.31Å; F657-S664 WeakPolarHBondContact O-CB 3.39Å; F657-S664 PolarHBondContact O-OG 3.46Å; S662-S664 PolarHBondContact OG-N 3.01Å; S662-S664 PolarHBondContact OG-OG 3.39Å; S662-S664 VanDerWaalsContact OG-OG 3.07Å; S664-G666 PolarHBondContact O-N 3.34Å; S664-C668 WeakPolarHBondContact CB-SG 3.38Å; S664-C668 PolarHBondContact OG-SG 3.17Å; S664-C668 VanDerWaalsContact OG-SG 3.38Å
665	D	66.5	Low	88	Confident	119 Å²	119	37.8 Å²	37.8	64%	0.636	20%	0.2	S	C	*	.			trans	-50.4	140.6	174.6	-112.5	-33.5	0	0	0	112.3	V624 E667 C668	V624-D665 PolarHBondContact O-N 2.83Å; D665-E667 PolarHBondContact O-N 2.89Å; D665-C668 PolarHBondContact O-N 3.5Å; D665-C668 PolarHBondContact O-SG 2.95Å
666	G	62	Low	88.3	Confident	12 Å²	12	37.6 Å²	37.6	12%	0.124	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-1.4	-159.8	0	0	0	0	0	117.2	N573 S664	N573-G666 PolarHBondContact ND2-O 3.29Å; S664-G666 PolarHBondContact O-N 3.34Å
667	E	71.6	Confident	88.4	Confident	165 Å²	165	37.1 Å²	37.1	77%	0.771	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	-21.8	178.7	-60.4	-156.2	149.7	0	0	114.6	D665	D665-E667 PolarHBondContact O-N 2.89Å
668	C	85	Confident	88.6	Confident	29 Å²	29	34.6 Å²	34.6	20%	0.196	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-17.6	-178	63.9	0	0	0	0	114.6	C626 S664 D665 N670	C626-C668 HydrophobicContact CB-CB 3.58Å; C626-C668 WeakPolarHBondContact CB-SG 3.46Å; C626-C668 WeakPolarHBondContact SG-CB 3.37Å; C626-C668 CovalentContact SG-SG 2.03Å; C626-C668 PolarHBondContact SG-SG 3.18Å; S664-C668 WeakPolarHBondContact CB-SG 3.38Å; S664-C668 PolarHBondContact OG-SG 3.17Å; S664-C668 VanDerWaalsContact OG-SG 3.38Å; D665-C668 PolarHBondContact O-N 3.5Å; D665-C668 PolarHBondContact O-SG 2.95Å; C668-N670 PolarHBondContact O-N 3.45Å
669	A	89.1	Confident	88.7	Confident	8 Å²	8	32.1 Å²	32.1	7%	0.066	17%	0.171	C	C	.	.			trans	-68.9	126.5	170.9	0	0	0	0	0	111.2	N573 N658 Y660	N573-A669 PolarHBondContact ND2-O 3.14Å; N658-A669 WeakPolarHBondContact O-CA 3.45Å; Y660-A669 HydrophobicContact CD1-CB 3.79Å; Y660-A669 HydrophobicContact CE1-CB 4.32Å; Y660-A669 WeakPolarHBondContact CE1-O 3.43Å
670	N	90.7	Very high	88.7	Confident	84 Å²	84	32.1 Å²	32.1	45%	0.449	17%	0.171	S	C	.	.			trans	-142.3	-9.6	-172.9	65.6	22.8	0	0	0	116.1	K401 N658 Y660 C668	K401-N670 PolarHBondContact NZ-O 2.94Å; N658-N670 PolarHBondContact O-N 3.36Å; N658-N670 PolarHBondContact O-OD1 3.04Å; Y660-N670 VanDerWaalsContact CE2-C 3.42Å; Y660-N670 WeakPolarHBondContact CE2-O 3.4Å; Y660-N670 PolarHBondContact OH-O 3.49Å; C668-N670 PolarHBondContact O-N 3.45Å
671	H	93.6	Very high	88.7	Confident	53 Å²	53	30.9 Å²	30.9	25%	0.245	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-150.2	160.8	-177.3	75.3	-72.8	0	0	0	114.1	Y402 N658 N659 Y660	Y402-H671 WeakPolarHBondContact OH-CA 3.32Å; Y402-H671 WeakPolarHBondContact OH-CB 3.5Å; N658-H671 PolarHBondContact O-ND1 2.95Å; N658-H671 PolarHBondContact OD1-CE1 2.75Å; N659-H671 WeakPolarHBondContact CA-O 3.28Å; Y660-H671 VanDerWaalsContact CD2-C 3.43Å; Y660-H671 WeakPolarHBondContact CD2-O 3.42Å; Y660-H671 PolarHBondContact N-O 2.99Å
672	F	95.6	Very high	88.5	Confident	5 Å²	5	31 Å²	31	2%	0.022	17%	0.167	C	C	.	.			trans	-103.1	151.8	157.3	-62.5	-71.1	0	0	0	108.7	F399 Y402 V576 L585 Y660 M661 Q676 V677 M680	F399-F672 HydrophobicContact CD1-CE2 4.26Å; F399-F672 AromaticContact CE1-CE2 3.71Å; F399-F672 HydrophobicContact CE1-CE2 3.71Å; F399-F672 HydrophobicContact CE1-CZ 4.14Å; F399-F672 HydrophobicContact CE2-CE2 4.39Å; F399-F672 AromaticContact CZ-CE2 3.79Å; F399-F672 HydrophobicContact CZ-CE2 3.79Å; F399-F672 AromaticContact CZ-CZ 3.9Å; F399-F672 HydrophobicContact CZ-CZ 3.9Å; Y402-F672 HydrophobicContact CD2-CD2 4.14Å; Y402-F672 HydrophobicContact CE2-CB 4.17Å; Y402-F672 AromaticContact CE2-CD2 3.74Å; Y402-F672 HydrophobicContact CE2-CD2 3.74Å; Y402-F672 HydrophobicContact CE2-CG 4.44Å; Y402-F672 PolarHBondContact OH-N 3.23Å; Y402-F672 PolarHBondContact OH-O 3.3Å; Y402-F672 VanDerWaalsContact OH-O 3.13Å; V576-F672 HydrophobicContact CG1-CE2 4.04Å; V576-F672 HydrophobicContact CG1-CZ 3.83Å; L585-F672 HydrophobicContact CD1-CD1 3.96Å; L585-F672 HydrophobicContact CD1-CE1 4.15Å; Y660-F672 VanDerWaalsContact CB-CE1 3.46Å; Y660-F672 HydrophobicContact CD2-CD1 4.24Å; Y660-F672 AromaticContact CD2-CD2 3.74Å; Y660-F672 HydrophobicContact CD2-CD2 3.74Å; Y660-F672 HydrophobicContact CD2-CE1 4.08Å; Y660-F672 AromaticContact CD2-CE2 3.53Å; Y660-F672 HydrophobicContact CD2-CE2 3.53Å; Y660-F672 HydrophobicContact CD2-CG 4.08Å; Y660-F672 AromaticContact CD2-CZ 3.72Å; Y660-F672 HydrophobicContact CD2-CZ 3.72Å; Y660-F672 HydrophobicContact CE2-CD2 4.35Å; Y660-F672 HydrophobicContact CE2-CE2 4.19Å; Y660-F672 HydrophobicContact CG-CE1 4.25Å; Y660-F672 HydrophobicContact CG-CE2 4.3Å; Y660-F672 HydrophobicContact CG-CZ 4.03Å; M661-F672 HydrophobicContact CG-CD1 4.2Å; M661-F672 HydrophobicContact CG-CE1 3.95Å; M661-F672 HydrophobicContact SD-CE1 3.78Å; F672-Q676 VanDerWaalsContact CA-OE1 3.28Å; F672-Q676 HydrophobicContact CB-CB 4.22Å; F672-V677 HydrophobicContact CB-CG2 3.91Å; F672-M680 HydrophobicContact CB-CE 4.43Å; F672-M680 HydrophobicContact CD1-CE 3.53Å; F672-M680 HydrophobicContact CD2-CE 3.55Å; F672-M680 HydrophobicContact CD2-SD 4.45Å; F672-M680 HydrophobicContact CE1-CE 3.46Å; F672-M680 VanDerWaalsContact CE1-CE 3.46Å; F672-M680 HydrophobicContact CE2-CE 3.53Å; F672-M680 HydrophobicContact CG-CE 3.57Å; F672-M680 HydrophobicContact CZ-CE 3.48Å; F672-M680 VanDerWaalsContact CZ-CE 3.48Å
673	T	95.1	Very high	88.3	Confident	15 Å²	15	30.5 Å²	30.5	9%	0.092	16%	0.164	C	C	.	.			trans	-75.4	171.2	174.4	74.3	0	0	0	0	111.8	D616 T617 Q675 Q676 V677	D616-T673 VanDerWaalsContact CG-CB 3.4Å; D616-T673 VanDerWaalsContact CG-OG1 3.29Å; D616-T673 WeakPolarHBondContact OD1-CB 3.35Å; D616-T673 PolarHBondContact OD1-OG1 2.8Å; D616-T673 WeakPolarHBondContact OD2-CB 3.4Å; D616-T673 PolarHBondContact OD2-OG1 3.25Å; T617-T673 HydrophobicContact CG2-CG2 3.62Å; T673-Q675 VanDerWaalsContact C-N 3.32Å; T673-Q675 PolarHBondContact O-N 3.36Å; T673-Q676 WeakPolarHBondContact OG1-CB 3.34Å; T673-Q676 WeakPolarHBondContact OG1-CG 3.39Å; T673-Q676 PolarHBondContact OG1-N 2.98Å; T673-V677 VanDerWaalsContact O-CG2 3.28Å; T673-V677 WeakPolarHBondContact O-CG2 3.14Å; T673-V677 PolarHBondContact O-N 3.24Å
674	A	94.2	Very high	88.3	Confident	44 Å²	44	26.9 Å²	26.9	36%	0.364	15%	0.149	S	C	.	.	H	α-helix	trans	-70.1	-33.4	-176.3	0	0	0	0	0	111.7	N355 D616 A678	N355-A674 WeakPolarHBondContact OD1-CB 3.34Å; D616-A674 PolarHBondContact OD2-N 3.5Å; D616-A674 VanDerWaalsContact OD2-N 3.13Å; A674-A678 WeakPolarHBondContact O-CB 3.37Å; A674-A678 PolarHBondContact O-N 2.91Å
675	Q	95.4	Very high	88.2	Confident	12 Å²	12	27.3 Å²	27.3	6%	0.056	15%	0.151	C	C	.	.	H	α-helix	trans	-77.3	-37.8	177.4	-66.7	167.4	5.3	0	0	112.4	V351 M608 C614 E615 D616 T673 V677 A678 R679	V351-Q675 HydrophobicContact CG1-CB 3.86Å; V351-Q675 HydrophobicContact CG1-CG 4.11Å; M608-Q675 HydrophobicContact SD-CG 4.31Å; M608-Q675 PolarHBondContact SD-OE1 2.75Å; C614-Q675 HydrophobicContact CB-CB 4.26Å; E615-Q675 PolarHBondContact OE1-NE2 3.25Å; D616-Q675 VanDerWaalsContact CG-CD 3.48Å; D616-Q675 VanDerWaalsContact N-OE1 3.1Å; D616-Q675 PolarHBondContact OD1-OE1 2.92Å; D616-Q675 WeakPolarHBondContact OD2-CG 3.32Å; D616-Q675 PolarHBondContact OD2-N 2.97Å; T673-Q675 VanDerWaalsContact C-N 3.32Å; T673-Q675 PolarHBondContact O-N 3.36Å; Q675-V677 PolarHBondContact O-N 3.31Å; Q675-A678 WeakPolarHBondContact O-CB 3.39Å; Q675-A678 PolarHBondContact O-N 2.75Å; Q675-R679 WeakPolarHBondContact O-CG 3.25Å; Q675-R679 PolarHBondContact O-N 3.05Å
676	Q	96.5	Very high	88.6	Confident	2 Å²	2	22.6 Å²	22.6	1%	0.009	13%	0.125	C	C	.	.	H	α-helix	trans	-55.7	-50.1	167.8	-76.2	178.3	-20.5	0	0	111.2	L585 N659 F672 T673 A678 R679 M680	L585-Q676 HydrophobicContact CD1-CB 3.7Å; L585-Q676 HydrophobicContact CD1-CG 3.93Å; L585-Q676 HydrophobicContact CD2-CB 4.08Å; L585-Q676 HydrophobicContact CD2-CG 4.21Å; N659-Q676 PolarHBondContact ND2-NE2 2.85Å; N659-Q676 PolarHBondContact ND2-OE1 2.87Å; N659-Q676 PolarHBondContact OD1-NE2 2.89Å; N659-Q676 VanDerWaalsContact OD1-NE2 3.12Å; N659-Q676 PolarHBondContact OD1-OE1 2.94Å; F672-Q676 VanDerWaalsContact CA-OE1 3.28Å; F672-Q676 HydrophobicContact CB-CB 4.22Å; T673-Q676 WeakPolarHBondContact OG1-CB 3.34Å; T673-Q676 WeakPolarHBondContact OG1-CG 3.39Å; T673-Q676 PolarHBondContact OG1-N 2.98Å; Q676-A678 VanDerWaalsContact C-N 3.33Å; Q676-A678 PolarHBondContact O-N 2.85Å; Q676-R679 PolarHBondContact O-N 2.8Å; Q676-M680 WeakPolarHBondContact O-CG 3.14Å; Q676-M680 PolarHBondContact O-N 2.72Å
677	V	96	Very high	89.1	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.012	12%	0.121	C	C	.	.	H	α-helix	trans	-60.4	-40.7	176.5	168.7	0	0	0	0	112	Y402 F672 T673 Q675 M680 H681	Y402-V677 HydrophobicContact CD1-CG1 4.32Å; Y402-V677 HydrophobicContact CD1-CG2 3.52Å; Y402-V677 HydrophobicContact CD2-CG2 4.04Å; Y402-V677 HydrophobicContact CE1-CG2 3.86Å; Y402-V677 HydrophobicContact CE2-CG2 4.37Å; Y402-V677 HydrophobicContact CG-CG1 4.34Å; Y402-V677 HydrophobicContact CG-CG2 3.59Å; F672-V677 HydrophobicContact CB-CG2 3.91Å; T673-V677 VanDerWaalsContact O-CG2 3.28Å; T673-V677 WeakPolarHBondContact O-CG2 3.14Å; T673-V677 PolarHBondContact O-N 3.24Å; Q675-V677 PolarHBondContact O-N 3.31Å; V677-M680 PolarHBondContact O-N 2.72Å; V677-H681 PolarHBondContact O-CD2 3.39Å; V677-H681 VanDerWaalsContact O-CD2 3.28Å; V677-H681 PolarHBondContact O-N 3.15Å
678	A	94.4	Very high	89.4	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.7	-42.6	175.7	0	0	0	0	0	112.5	V351 N355 A674 Q675 Q676 H681 C682	V351-A678 HydrophobicContact CG1-CB 3.81Å; V351-A678 WeakPolarHBondContact O-CB 2.92Å; N355-A678 HydrophobicContact CB-CB 4.09Å; A674-A678 WeakPolarHBondContact O-CB 3.37Å; A674-A678 PolarHBondContact O-N 2.91Å; Q675-A678 WeakPolarHBondContact O-CB 3.39Å; Q675-A678 PolarHBondContact O-N 2.75Å; Q676-A678 VanDerWaalsContact C-N 3.33Å; Q676-A678 PolarHBondContact O-N 2.85Å; A678-H681 PolarHBondContact O-N 3Å; A678-C682 WeakPolarHBondContact O-CB 3.37Å; A678-C682 PolarHBondContact O-N 3.22Å
679	R	94.3	Very high	88.7	Confident	2 Å²	2	13.8 Å²	13.8	1%	0.008	8%	0.08	C	C	.	.	H	α-helix	trans	-62.6	-46.1	173.6	-71.6	174.8	72.9	-156.2	3.5	111.6	D346 V351 G584 L585 D612 Q675 Q676 H681 C682 Y683	D346-R679 IonicContact OD1-CZ 2.66Å; D346-R679 IonicContact OD1-NE 3.4Å; D346-R679 PolarHBondContact OD1-NE 3.49Å; D346-R679 VanDerWaalsContact OD1-NE 3.1Å; D346-R679 IonicContact OD1-NH2 3.54Å; D346-R679 PolarHBondContact OD1-NH2 2.8Å; V351-R679 HydrophobicContact CG1-CG 4.12Å; V351-R679 HydrophobicContact CG2-CG 3.67Å; G584-R679 PolarHBondContact O-NH2 2.03Å; L585-R679 HydrophobicContact CD2-CB 3.91Å; D612-R679 PolarHBondContact O-NH1 2.96Å; Q675-R679 WeakPolarHBondContact O-CG 3.25Å; Q675-R679 PolarHBondContact O-N 3.05Å; Q676-R679 PolarHBondContact O-N 2.8Å; R679-H681 PolarHBondContact O-N 3.24Å; R679-C682 WeakPolarHBondContact O-CB 2.98Å; R679-C682 PolarHBondContact O-N 2.67Å; R679-C682 VanDerWaalsContact O-N 3.12Å; R679-Y683 HydrophobicContact CB-CD2 4.47Å; R679-Y683 HydrophobicContact CB-CE2 4.48Å; R679-Y683 VanDerWaalsContact O-CD2 3.25Å; R679-Y683 WeakPolarHBondContact O-CD2 3.01Å; R679-Y683 PolarHBondContact O-N 2.83Å
680	M	94.9	Very high	87.8	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-53.9	-50.2	175.1	-66.8	-179.9	175	0	0	112.2	F399 I404 L583 L585 F672 Q676 V677 C682 Y683 V684	F399-M680 HydrophobicContact CD1-SD 4.3Å; F399-M680 HydrophobicContact CE1-CE 3.74Å; F399-M680 HydrophobicContact CE1-SD 3.84Å; F399-M680 HydrophobicContact CZ-CE 4.45Å; I404-M680 HydrophobicContact CD1-CB 3.9Å; I404-M680 HydrophobicContact CD1-SD 4.28Å; L583-M680 HydrophobicContact CB-CB 4.21Å; L583-M680 HydrophobicContact CB-CG 3.87Å; L583-M680 HydrophobicContact CD1-CB 4.34Å; L583-M680 HydrophobicContact CD1-CG 4.14Å; L583-M680 HydrophobicContact CD1-SD 4.04Å; L585-M680 HydrophobicContact CD1-CE 3.33Å; L585-M680 HydrophobicContact CD1-CG 4.12Å; L585-M680 HydrophobicContact CD2-CG 4.46Å; L585-M680 HydrophobicContact CG-CE 4.28Å; L585-M680 HydrophobicContact CG-CG 4.27Å; F672-M680 HydrophobicContact CB-CE 4.43Å; F672-M680 HydrophobicContact CD1-CE 3.53Å; F672-M680 HydrophobicContact CD2-CE 3.55Å; F672-M680 HydrophobicContact CD2-SD 4.45Å; F672-M680 HydrophobicContact CE1-CE 3.46Å; F672-M680 VanDerWaalsContact CE1-CE 3.46Å; F672-M680 HydrophobicContact CE2-CE 3.53Å; F672-M680 HydrophobicContact CG-CE 3.57Å; F672-M680 HydrophobicContact CZ-CE 3.48Å; F672-M680 VanDerWaalsContact CZ-CE 3.48Å; Q676-M680 WeakPolarHBondContact O-CG 3.14Å; Q676-M680 PolarHBondContact O-N 2.72Å; V677-M680 PolarHBondContact O-N 2.72Å; M680-C682 VanDerWaalsContact C-N 3.3Å; M680-C682 PolarHBondContact O-N 3.34Å; M680-Y683 PolarHBondContact O-N 2.84Å; M680-V684 WeakPolarHBondContact O-CG2 2.93Å; M680-V684 PolarHBondContact O-N 2.72Å
681	H	92.7	Very high	87.5	Confident	0 Å²	0	10 Å²	10	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-62.8	-37.2	178.8	-83.2	-82.2	0	0	0	112.6	Y354 R361 K364 Y402 V677 A678 R679 V684 D685	Y354-H681 HydrophobicContact CD1-CB 3.68Å; Y354-H681 HydrophobicContact CE1-CB 3.88Å; R361-H681 HydrophobicContact CG-CB 4.2Å; K364-H681 PolarHBondContact NZ-ND1 3.46Å; K364-H681 PolarHBondContact NZ-O 3.13Å; Y402-H681 PolarHBondContact O-NE2 3.07Å; V677-H681 PolarHBondContact O-CD2 3.39Å; V677-H681 VanDerWaalsContact O-CD2 3.28Å; V677-H681 PolarHBondContact O-N 3.15Å; A678-H681 PolarHBondContact O-N 3Å; R679-H681 PolarHBondContact O-N 3.24Å; H681-V684 PolarHBondContact O-N 3.1Å; H681-D685 VanDerWaalsContact O-CG 3.3Å; H681-D685 PolarHBondContact O-N 3.42Å
682	C	90.5	Very high	87	Confident	1 Å²	1	9.4 Å²	9.4	1%	0.007	6%	0.06	C	C	.	.	H	α-helix	trans	-65.2	-45.8	175.3	-177.1	0	0	0	0	111.7	C345 I350 Y354 A678 R679 M680 V684 D685 L686 L724	C345-C682 WeakPolarHBondContact CA-SG 3.48Å; C345-C682 HydrophobicContact CB-CB 3.75Å; C345-C682 WeakPolarHBondContact CB-SG 3.37Å; C345-C682 WeakPolarHBondContact SG-CB 3.07Å; C345-C682 PolarHBondContact SG-O 3.5Å; C345-C682 CovalentContact SG-SG 2.04Å; C345-C682 PolarHBondContact SG-SG 3.22Å; I350-C682 HydrophobicContact CG2-CB 4.49Å; I350-C682 VanDerWaalsContact CG2-SG 3.54Å; Y354-C682 HydrophobicContact CD1-CB 4.46Å; Y354-C682 HydrophobicContact CD2-CB 4.14Å; Y354-C682 HydrophobicContact CE1-CB 4.27Å; Y354-C682 HydrophobicContact CE2-CB 3.94Å; Y354-C682 HydrophobicContact CG-CB 4.4Å; A678-C682 WeakPolarHBondContact O-CB 3.37Å; A678-C682 PolarHBondContact O-N 3.22Å; R679-C682 WeakPolarHBondContact O-CB 2.98Å; R679-C682 PolarHBondContact O-N 2.67Å; R679-C682 VanDerWaalsContact O-N 3.12Å; M680-C682 VanDerWaalsContact C-N 3.3Å; M680-C682 PolarHBondContact O-N 3.34Å; C682-V684 VanDerWaalsContact C-N 3.31Å; C682-V684 PolarHBondContact O-N 3.07Å; C682-D685 PolarHBondContact O-N 3.06Å; C682-D685 VanDerWaalsContact O-N 3.13Å; C682-L686 VanDerWaalsContact O-CB 3.25Å; C682-L686 WeakPolarHBondContact O-CB 3.45Å; C682-L686 PolarHBondContact O-N 2.03Å; C682-L724 WeakPolarHBondContact SG-CD1 3Å
683	Y	87.1	Confident	85.9	Confident	0 Å²	0	10.2 Å²	10.2	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-63.5	-35.2	176.5	-80.7	-67.5	0	0	0	112.4	T343 C345 D346 P547 W548 L583 R679 M680 D685 K687 Y688	T343-Y683 HydrophobicContact CG2-CE1 3.77Å; T343-Y683 WeakPolarHBondContact OG1-CE1 3.32Å; T343-Y683 VanDerWaalsContact OG1-CZ 3.26Å; T343-Y683 PolarHBondContact OG1-OH 2.83Å; C345-Y683 HydrophobicContact CB-CD1 4.37Å; C345-Y683 HydrophobicContact CB-CD2 4.04Å; C345-Y683 HydrophobicContact CB-CE1 4.07Å; C345-Y683 HydrophobicContact CB-CE2 3.7Å; C345-Y683 HydrophobicContact CB-CG 4.34Å; D346-Y683 VanDerWaalsContact CG-OH 3.31Å; D346-Y683 PolarHBondContact OD1-OH 2.79Å; D346-Y683 PolarHBondContact OD2-OH 3.09Å; D346-Y683 VanDerWaalsContact OD2-OH 3.06Å; P547-Y683 HydrophobicContact CB-CD1 3.63Å; P547-Y683 HydrophobicContact CB-CE1 4.04Å; P547-Y683 HydrophobicContact CB-CG 4.37Å; P547-Y683 HydrophobicContact CG-CD1 3.71Å; P547-Y683 HydrophobicContact CG-CE1 4.14Å; P547-Y683 HydrophobicContact CG-CG 4.01Å; W548-Y683 AromaticContact CE3-CE1 3.9Å; W548-Y683 HydrophobicContact CE3-CE1 3.9Å; W548-Y683 AromaticContact CE3-CZ 3.87Å; W548-Y683 HydrophobicContact CZ3-CE1 4.08Å; W548-Y683 HydrophobicContact CZ3-CE2 4.22Å; W548-Y683 AromaticContact CZ3-CZ 3.63Å; W548-Y683 WeakPolarHBondContact CZ3-OH 3.49Å; L583-Y683 WeakPolarHBondContact O-CB 3.38Å; L583-Y683 VanDerWaalsContact O-CD2 3.23Å; L583-Y683 WeakPolarHBondContact O-CD2 3.1Å; R679-Y683 HydrophobicContact CB-CD2 4.47Å; R679-Y683 HydrophobicContact CB-CE2 4.48Å; R679-Y683 VanDerWaalsContact O-CD2 3.25Å; R679-Y683 WeakPolarHBondContact O-CD2 3.01Å; R679-Y683 PolarHBondContact O-N 2.83Å; M680-Y683 PolarHBondContact O-N 2.84Å; Y683-D685 VanDerWaalsContact C-N 3.35Å; Y683-D685 PolarHBondContact O-N 3.33Å; Y683-K687 HydrophobicContact CD1-CG 4.39Å; Y683-K687 WeakPolarHBondContact O-CA 3.23Å; Y683-K687 VanDerWaalsContact O-CB 3.31Å; Y683-K687 WeakPolarHBondContact O-CB 3.18Å; Y683-K687 PolarHBondContact O-N 2.99Å; Y683-Y688 PolarHBondContact O-N 3.44Å
684	V	86.5	Confident	84.3	Confident	0 Å²	0	11.5 Å²	11.5	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62.1	-41.4	172	174.1	0	0	0	0	112.1	K364 L366 L583 M680 H681 C682 Y688 A689 L692	K364-V684 HydrophobicContact CD-CB 4.27Å; K364-V684 HydrophobicContact CD-CG1 3.78Å; K364-V684 HydrophobicContact CG-CG1 4.47Å; L366-V684 HydrophobicContact CD1-CG2 3.92Å; L366-V684 HydrophobicContact CD2-CG1 3.86Å; L366-V684 HydrophobicContact CD2-CG2 4.27Å; L583-V684 HydrophobicContact CD2-CG2 3.75Å; M680-V684 WeakPolarHBondContact O-CG2 2.93Å; M680-V684 PolarHBondContact O-N 2.72Å; H681-V684 PolarHBondContact O-N 3.1Å; C682-V684 VanDerWaalsContact C-N 3.31Å; C682-V684 PolarHBondContact O-N 3.07Å; V684-Y688 CarbonylContact O-C 3.58Å; V684-Y688 VanDerWaalsContact O-C 3.28Å; V684-Y688 WeakPolarHBondContact O-CA 3.44Å; V684-Y688 PolarHBondContact O-N 3.45Å; V684-Y688 VanDerWaalsContact O-N 3.09Å; V684-A689 PolarHBondContact O-N 3.37Å; V684-A689 VanDerWaalsContact O-N 3.17Å; V684-L692 HydrophobicContact CG1-CD2 4.23Å
685	D	80.6	Confident	82.3	Confident	20 Å²	20	16.1 Å²	16.1	11%	0.107	11%	0.11	C	C	.	.	H	α-helix	trans	-76.3	-34.4	-179.8	-62.7	-22.5	0	0	0	112.9	Y354 K364 H681 C682 Y683 G725	Y354-D685 VanDerWaalsContact CE1-OD2 3.27Å; Y354-D685 WeakPolarHBondContact CE1-OD2 3.4Å; Y354-D685 PolarHBondContact OH-OD2 2.71Å; K364-D685 WeakPolarHBondContact CE-OD1 3.3Å; K364-D685 IonicContact NZ-OD1 3.04Å; K364-D685 PolarHBondContact NZ-OD1 3.15Å; K364-D685 IonicContact NZ-OD2 2.71Å; K364-D685 PolarHBondContact NZ-OD2 3.28Å; H681-D685 VanDerWaalsContact O-CG 3.3Å; H681-D685 PolarHBondContact O-N 3.42Å; C682-D685 PolarHBondContact O-N 3.06Å; C682-D685 VanDerWaalsContact O-N 3.13Å; Y683-D685 VanDerWaalsContact C-N 3.35Å; Y683-D685 PolarHBondContact O-N 3.33Å; D685-G725 WeakPolarHBondContact O-CA 3.15Å; D685-G725 PolarHBondContact O-N 2.75Å
686	L	75.3	Confident	80	Confident	20 Å²	20	20 Å²	20	11%	0.105	14%	0.139	C	C	.	.	H	α-helix	trans	-79.8	-33.8	-178.8	179.5	67.2	0	0	0	113.3	I344 C345 C682 L724	I344-L686 HydrophobicContact CG2-CD1 4.22Å; I344-L686 HydrophobicContact CG2-CD2 3.97Å; C345-L686 VanDerWaalsContact SG-CD2 3.59Å; C682-L686 VanDerWaalsContact O-CB 3.25Å; C682-L686 WeakPolarHBondContact O-CB 3.45Å; C682-L686 PolarHBondContact O-N 2.03Å; L686-L724 HydrophobicContact CB-CB 4.38Å; L686-L724 HydrophobicContact CD1-CB 4.11Å
687	K	72	Confident	77.8	Confident	7 Å²	7	25.5 Å²	25.5	3%	0.03	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.6	-50.8	-169.8	-63.2	-70.6	-167.9	135.9	0	112.5	H63 P547 F553 Y683 A689	H63-K687 HydrophobicContact CB-CD 4.38Å; H63-K687 VanDerWaalsContact O-CE 3.28Å; H63-K687 WeakPolarHBondContact O-CE 3.25Å; H63-K687 PolarHBondContact O-NZ 3.43Å; P547-K687 HydrophobicContact CB-CG 4.09Å; P547-K687 VanDerWaalsContact O-CE 3.23Å; P547-K687 WeakPolarHBondContact O-CE 3.44Å; P547-K687 PolarHBondContact O-NZ 3.4Å; F553-K687 HydrophobicContact CZ-CB 4.08Å; F553-K687 WeakPolarHBondContact CZ-O 3.21Å; Y683-K687 HydrophobicContact CD1-CG 4.39Å; Y683-K687 WeakPolarHBondContact O-CA 3.23Å; Y683-K687 VanDerWaalsContact O-CB 3.31Å; Y683-K687 WeakPolarHBondContact O-CB 3.18Å; Y683-K687 PolarHBondContact O-N 2.99Å; K687-A689 PolarHBondContact O-N 3.39Å
688	Y	78.3	Confident	75.8	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.008	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-97.6	26.2	-164.5	-51	-54.8	0	0	0	115.7	P547 F553 A582 L583 Y683 V684 G690 W691	P547-Y688 VanDerWaalsContact CA-OH 3.24Å; P547-Y688 WeakPolarHBondContact CA-OH 3.38Å; P547-Y688 HydrophobicContact CB-CE2 4.11Å; P547-Y688 WeakPolarHBondContact CB-OH 3.36Å; P547-Y688 HydrophobicContact CG-CE2 4.03Å; P547-Y688 WeakPolarHBondContact CG-OH 3.4Å; F553-Y688 AromaticContact CE1-CD1 3.66Å; F553-Y688 HydrophobicContact CE1-CD1 3.66Å; F553-Y688 AromaticContact CE1-CE1 3.91Å; F553-Y688 HydrophobicContact CE1-CE1 3.91Å; F553-Y688 HydrophobicContact CE2-CE1 4.26Å; F553-Y688 AromaticContact CZ-CD1 3.56Å; F553-Y688 HydrophobicContact CZ-CD1 3.56Å; F553-Y688 AromaticContact CZ-CE1 3.57Å; F553-Y688 HydrophobicContact CZ-CE1 3.57Å; A582-Y688 WeakPolarHBondContact O-CE2 3.46Å; A582-Y688 VanDerWaalsContact O-CZ 3.23Å; A582-Y688 PolarHBondContact O-OH 3.44Å; L583-Y688 HydrophobicContact CD2-CD2 4.21Å; L583-Y688 HydrophobicContact CD2-CE2 4.35Å; Y683-Y688 PolarHBondContact O-N 3.44Å; V684-Y688 CarbonylContact O-C 3.58Å; V684-Y688 VanDerWaalsContact O-C 3.28Å; V684-Y688 WeakPolarHBondContact O-CA 3.44Å; V684-Y688 PolarHBondContact O-N 3.45Å; V684-Y688 VanDerWaalsContact O-N 3.09Å; Y688-G690 PolarHBondContact O-N 3.02Å; Y688-G690 VanDerWaalsContact O-N 3.09Å; Y688-W691 AromaticContact CD1-CD2 3.8Å; Y688-W691 HydrophobicContact CD1-CD2 3.8Å; Y688-W691 AromaticContact CD1-CE2 3.64Å; Y688-W691 AromaticContact CD1-CE3 3.77Å; Y688-W691 HydrophobicContact CD1-CE3 3.77Å; Y688-W691 AromaticContact CD1-CH2 3.44Å; Y688-W691 HydrophobicContact CD1-CH2 3.44Å; Y688-W691 VanDerWaalsContact CD1-CH2 3.44Å; Y688-W691 AromaticContact CD1-CZ2 3.49Å; Y688-W691 HydrophobicContact CD1-CZ2 3.49Å; Y688-W691 VanDerWaalsContact CD1-CZ2 3.49Å; Y688-W691 AromaticContact CD1-CZ3 3.59Å; Y688-W691 HydrophobicContact CD1-CZ3 3.59Å; Y688-W691 HydrophobicContact CD2-CE3 4.23Å; Y688-W691 HydrophobicContact CD2-CH2 4.42Å; Y688-W691 AromaticContact CD2-CZ3 3.93Å; Y688-W691 HydrophobicContact CD2-CZ3 3.93Å; Y688-W691 HydrophobicContact CE1-CE3 4.34Å; Y688-W691 AromaticContact CE1-CH2 3.18Å; Y688-W691 HydrophobicContact CE1-CH2 3.18Å; Y688-W691 AromaticContact CE1-CZ2 3.44Å; Y688-W691 HydrophobicContact CE1-CZ2 3.44Å; Y688-W691 VanDerWaalsContact CE1-CZ2 3.44Å; Y688-W691 AromaticContact CE1-CZ3 3.69Å; Y688-W691 HydrophobicContact CE1-CZ3 3.69Å; Y688-W691 HydrophobicContact CE2-CH2 4.19Å; Y688-W691 AromaticContact CE2-CZ3 3.99Å; Y688-W691 HydrophobicContact CE2-CZ3 3.99Å; Y688-W691 HydrophobicContact CG-CD2 4.03Å; Y688-W691 AromaticContact CG-CE3 3.69Å; Y688-W691 HydrophobicContact CG-CE3 3.69Å; Y688-W691 HydrophobicContact CG-CH2 4.05Å; Y688-W691 HydrophobicContact CG-CZ2 4.38Å; Y688-W691 AromaticContact CG-CZ3 3.7Å; Y688-W691 HydrophobicContact CG-CZ3 3.7Å; Y688-W691 AromaticContact CZ-CH2 3.55Å; Y688-W691 AromaticContact CZ-CZ3 3.84Å; Y688-W691 PolarHBondContact O-N 3.5Å
689	A	69.5	Low	74.1	Confident	13 Å²	13	34.2 Å²	34.2	11%	0.107	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-52.4	-29.9	165.9	0	0	0	0	0	112	V684 K687 W691 K730	V684-A689 PolarHBondContact O-N 3.37Å; V684-A689 VanDerWaalsContact O-N 3.17Å; K687-A689 PolarHBondContact O-N 3.39Å; A689-W691 PolarHBondContact O-N 2.85Å; A689-K730 WeakPolarHBondContact O-CE 3.15Å; A689-K730 PolarHBondContact O-NZ 3.19Å
690	G	70.3	Confident	72.7	Confident	13 Å²	13	35.3 Å²	35.3	13%	0.134	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-42.9	-52.5	164.9	0	0	0	0	0	114.1	Y688 L692 K730	Y688-G690 PolarHBondContact O-N 3.02Å; Y688-G690 VanDerWaalsContact O-N 3.09Å; G690-L692 PolarHBondContact O-N 3.1Å; G690-K730 VanDerWaalsContact C-CE 3.47Å; G690-K730 WeakPolarHBondContact O-CE 3.38Å; G690-K730 PolarHBondContact O-NZ 2.91Å
691	W	83.9	Confident	71.9	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-86.1	-7.3	-166.3	-56.7	-8.5	0	0	0	114.2	L366 R367 N524 E525 L528 F553 Y688 A689 A693	L366-W691 CarbonylContact C-O 3.55Å; L366-W691 HydrophobicContact CD2-CB 4.07Å; R367-W691 WeakPolarHBondContact CG-O 3.37Å; R367-W691 PolarHBondContact N-O 2.83Å; N524-W691 WeakPolarHBondContact ND2-CZ2 3.12Å; N524-W691 PolarHBondContact O-NE1 2.75Å; E525-W691 PolarHBondContact O-NE1 3.38Å; L528-W691 HydrophobicContact CB-CD2 4.42Å; L528-W691 HydrophobicContact CB-CE3 4Å; L528-W691 HydrophobicContact CB-CH2 4Å; L528-W691 HydrophobicContact CB-CZ2 4.38Å; L528-W691 HydrophobicContact CB-CZ3 3.79Å; L528-W691 HydrophobicContact CD1-CH2 3.62Å; L528-W691 HydrophobicContact CD1-CZ2 4.29Å; L528-W691 HydrophobicContact CD1-CZ3 4.02Å; L528-W691 HydrophobicContact CD2-CZ3 4.45Å; L528-W691 HydrophobicContact CG-CH2 4.34Å; L528-W691 HydrophobicContact CG-CZ3 4.3Å; F553-W691 HydrophobicContact CE1-CZ2 4.47Å; Y688-W691 AromaticContact CD1-CD2 3.8Å; Y688-W691 HydrophobicContact CD1-CD2 3.8Å; Y688-W691 AromaticContact CD1-CE2 3.64Å; Y688-W691 AromaticContact CD1-CE3 3.77Å; Y688-W691 HydrophobicContact CD1-CE3 3.77Å; Y688-W691 AromaticContact CD1-CH2 3.44Å; Y688-W691 HydrophobicContact CD1-CH2 3.44Å; Y688-W691 VanDerWaalsContact CD1-CH2 3.44Å; Y688-W691 AromaticContact CD1-CZ2 3.49Å; Y688-W691 HydrophobicContact CD1-CZ2 3.49Å; Y688-W691 VanDerWaalsContact CD1-CZ2 3.49Å; Y688-W691 AromaticContact CD1-CZ3 3.59Å; Y688-W691 HydrophobicContact CD1-CZ3 3.59Å; Y688-W691 HydrophobicContact CD2-CE3 4.23Å; Y688-W691 HydrophobicContact CD2-CH2 4.42Å; Y688-W691 AromaticContact CD2-CZ3 3.93Å; Y688-W691 HydrophobicContact CD2-CZ3 3.93Å; Y688-W691 HydrophobicContact CE1-CE3 4.34Å; Y688-W691 AromaticContact CE1-CH2 3.18Å; Y688-W691 HydrophobicContact CE1-CH2 3.18Å; Y688-W691 AromaticContact CE1-CZ2 3.44Å; Y688-W691 HydrophobicContact CE1-CZ2 3.44Å; Y688-W691 VanDerWaalsContact CE1-CZ2 3.44Å; Y688-W691 AromaticContact CE1-CZ3 3.69Å; Y688-W691 HydrophobicContact CE1-CZ3 3.69Å; Y688-W691 HydrophobicContact CE2-CH2 4.19Å; Y688-W691 AromaticContact CE2-CZ3 3.99Å; Y688-W691 HydrophobicContact CE2-CZ3 3.99Å; Y688-W691 HydrophobicContact CG-CD2 4.03Å; Y688-W691 AromaticContact CG-CE3 3.69Å; Y688-W691 HydrophobicContact CG-CE3 3.69Å; Y688-W691 HydrophobicContact CG-CH2 4.05Å; Y688-W691 HydrophobicContact CG-CZ2 4.38Å; Y688-W691 AromaticContact CG-CZ3 3.7Å; Y688-W691 HydrophobicContact CG-CZ3 3.7Å; Y688-W691 AromaticContact CZ-CH2 3.55Å; Y688-W691 AromaticContact CZ-CZ3 3.84Å; Y688-W691 PolarHBondContact O-N 3.5Å; A689-W691 PolarHBondContact O-N 2.85Å; W691-A693 PolarHBondContact O-N 3.14Å
692	L	83.5	Confident	71.4	Confident	40 Å²	40	35.6 Å²	35.6	21%	0.209	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-63.8	129.6	-178.4	-69.6	170.1	0	0	0	112.5	K364 V365 L366 V684 G690	K364-L692 HydrophobicContact CB-CD2 4.04Å; K364-L692 HydrophobicContact CG-CD2 4.26Å; V365-L692 CarbonylContact O-C 3.59Å; V365-L692 WeakPolarHBondContact O-CA 3.22Å; L366-L692 HydrophobicContact CD2-CD2 3.95Å; L366-L692 HydrophobicContact CD2-CG 4.47Å; V684-L692 HydrophobicContact CG1-CD2 4.23Å; G690-L692 PolarHBondContact O-N 3.1Å
693	A	72.4	Confident	71.1	Confident	21 Å²	21	35.6 Å²	35.6	17%	0.174	21%	0.209	C	C	.	.			trans	-82.2	-27.5	-163.1	0	0	0	0	0	116.2	V365 R367 Q407 W691	V365-A693 HydrophobicContact CB-CB 3.97Å; V365-A693 HydrophobicContact CG1-CB 3.72Å; V365-A693 WeakPolarHBondContact O-CB 3.38Å; V365-A693 PolarHBondContact O-N 2.86Å; R367-A693 HydrophobicContact CG-CB 4.02Å; R367-A693 PolarHBondContact NH2-O 3.23Å; Q407-A693 HydrophobicContact CB-CB 4.46Å; Q407-A693 VanDerWaalsContact OE1-CB 3.29Å; W691-A693 PolarHBondContact O-N 3.14Å
694	G	62.3	Low	71	Confident	43 Å²	43	36 Å²	36	44%	0.443	21%	0.212	S	C	.	.	S	Bend	trans	-129.4	164.9	-167.9	0	0	0	0	0	115.6	S696	G694-S696 VanDerWaalsContact C-N 3.34Å; G694-S696 PolarHBondContact O-N 2.89Å; G694-S696 VanDerWaalsContact O-N 3.15Å
695	P	52.8	Low	70.9	Confident	140 Å²	140	37.6 Å²	37.6	91%	0.909	23%	0.225	S	C	*	.	S	Bend	trans	-86.4	65.1	178.1	36.3	-35.6	0	0	0	111.6
696	S	45.6	Very low	71.2	Confident	95 Å²	95	36.9 Å²	36.9	66%	0.664	22%	0.222	S	C	*	.			trans	-152.6	142	-172.9	39	0	0	0	0	114.1	G694	G694-S696 VanDerWaalsContact C-N 3.34Å; G694-S696 PolarHBondContact O-N 2.89Å; G694-S696 VanDerWaalsContact O-N 3.15Å
697	M	50.7	Low	71.7	Confident	117 Å²	117	37.8 Å²	37.8	58%	0.576	22%	0.224	S	C	*	.	S	Bend	trans	65.6	154.7	-175.2	-68.2	-75.9	-136.2	0	0	116	H362	H362-M697 HydrophobicContact CB-CE 4.07Å
698	P	53.5	Low	72.4	Confident	21 Å²	21	37.9 Å²	37.9	14%	0.136	23%	0.225	C	C	.	.			trans	-89.2	135	-166.5	-8.7	29.4	0	0	0	112.7	D700 I946 N947 S948	P698-D700 VanDerWaalsContact C-N 3.29Å; P698-D700 PolarHBondContact O-N 3.44Å; P698-I946 HydrophobicContact CB-CG2 4.1Å; P698-I946 HydrophobicContact CG-CG2 4.33Å; P698-N947 WeakPolarHBondContact CB-O 3.47Å; P698-N947 WeakPolarHBondContact CG-O 3.12Å; P698-S948 VanDerWaalsContact CB-CA 3.44Å
699	R	59.2	Low	72.5	Confident	164 Å²	164	38.6 Å²	38.6	62%	0.619	23%	0.229	S	C	*	.	S	Bend	trans	-76.3	-16.2	-173.9	-51.5	179.9	-161.6	-179.2	6.8	113.8
700	D	66.1	Low	73.1	Confident	25 Å²	25	43.2 Å²	43.2	13%	0.134	24%	0.243	C	C	.	.			trans	-105	52.3	-168.1	-64.6	-70.8	0	0	0	112.5	P698 P723 H726 A937 S948	P698-D700 VanDerWaalsContact C-N 3.29Å; P698-D700 PolarHBondContact O-N 3.44Å; D700-P723 VanDerWaalsContact C-CB 3.45Å; D700-P723 HydrophobicContact CB-CB 4.07Å; D700-P723 HydrophobicContact CB-CG 3.85Å; D700-P723 WeakPolarHBondContact O-CG 2.99Å; D700-H726 IonicContact OD1-CE1 2.6Å; D700-H726 IonicContact OD1-CG 3.59Å; D700-H726 IonicContact OD1-ND1 3.86Å; D700-H726 PolarHBondContact OD1-ND1 2.84Å; D700-A937 HydrophobicContact CB-CB 4.18Å; D700-S948 WeakPolarHBondContact O-CB 3.34Å
701	C	77.4	Confident	73.8	Confident	6 Å²	6	45.8 Å²	45.8	4%	0.041	25%	0.251	C	S	.	.			trans	-74.3	128.2	176.6	-82.8	0	0	0	0	112.9	L360 P723 C949	L360-C701 HydrophobicContact CD2-CB 4.08Å; C701-P723 VanDerWaalsContact O-CA 3.3Å; C701-P723 WeakPolarHBondContact O-CA 3.47Å; C701-P723 WeakPolarHBondContact O-CB 3.44Å; C701-C949 WeakPolarHBondContact CA-SG 3.46Å; C701-C949 HydrophobicContact CB-CB 4.49Å; C701-C949 WeakPolarHBondContact CB-SG 3.44Å; C701-C949 WeakPolarHBondContact SG-CB 3.29Å; C701-C949 CovalentContact SG-SG 2.03Å; C701-C949 PolarHBondContact SG-SG 3.18Å
702	I	82.9	Confident	73.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.271	C	S	.	.			trans	-78.1	120.7	173.4	-70.1	170.7	0	0	0	109.1	T704 L721 P723 Y899 I935 A937 P952	I702-T704 WeakPolarHBondContact CG2-O 3.08Å; I702-T704 PolarHBondContact O-N 3.05Å; I702-L721 WeakPolarHBondContact CG2-O 3.43Å; I702-P723 HydrophobicContact CG1-CG 4.15Å; I702-Y899 HydrophobicContact CD1-CD1 4.11Å; I702-Y899 HydrophobicContact CD1-CE1 4.2Å; I702-I935 HydrophobicContact CD1-CB 3.84Å; I702-I935 HydrophobicContact CD1-CG2 3.41Å; I702-I935 VanDerWaalsContact CD1-CG2 3.41Å; I702-A937 HydrophobicContact CD1-CB 4.47Å; I702-P952 WeakPolarHBondContact O-CD 3.37Å
703	P	83.1	Confident	73.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.301	C	S	.	.			trans	-78.6	-16.1	-164.2	32.1	-39.4	0	0	0	114.7	I350 S353 Y354 L360 L721 L724	I350-P703 HydrophobicContact CD1-CB 3.83Å; I350-P703 HydrophobicContact CD1-CG 3.92Å; S353-P703 WeakPolarHBondContact CB-O 3.39Å; S353-P703 PolarHBondContact OG-O 3.4Å; Y354-P703 HydrophobicContact CE2-CB 4.06Å; L360-P703 WeakPolarHBondContact CD1-O 3.2Å; P703-L721 HydrophobicContact CG-CB 4.14Å; P703-L721 HydrophobicContact CG-CD1 3.98Å; P703-L724 HydrophobicContact CB-CD1 3.94Å; P703-L724 HydrophobicContact CB-CD2 4.38Å; P703-L724 HydrophobicContact CB-CG 3.94Å; P703-L724 HydrophobicContact CG-CD1 4.36Å; P703-L724 HydrophobicContact CG-CD2 3.91Å; P703-L724 HydrophobicContact CG-CG 3.85Å
704	T	84.1	Confident	74.4	Confident	8 Å²	8	57.4 Å²	57.4	5%	0.049	32%	0.319	C	S	.	.	S	Bend	trans	-132.2	162.3	-175.4	62.8	0	0	0	0	112	L335 I350 I702 L721	L335-T704 HydrophobicContact CD1-CG2 4.48Å; I350-T704 HydrophobicContact CD1-CG2 3.67Å; I702-T704 WeakPolarHBondContact CG2-O 3.08Å; I702-T704 PolarHBondContact O-N 3.05Å; T704-L721 HydrophobicContact CG2-CD1 3.92Å
705	A	84.9	Confident	75.8	Confident	34 Å²	34	56.1 Å²	56.1	28%	0.281	30%	0.303	S	S	.	.			trans	-64.7	153.5	167.3	0	0	0	0	0	110.8	P952	A705-P952 WeakPolarHBondContact CA-O 2.98Å; A705-P952 HydrophobicContact CB-CB 3.99Å
706	P	88.4	Confident	77.6	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.032	26%	0.261	C	S	.	.			trans	-61.8	142.1	168.3	-19.9	30.7	0	0	0	111.7	F718 V719 I935 P952 L954	P706-F718 HydrophobicContact CB-CB 4.49Å; P706-F718 HydrophobicContact CB-CD2 3.79Å; P706-F718 HydrophobicContact CB-CE2 4.41Å; P706-F718 HydrophobicContact CB-CG 4.4Å; P706-V719 CarbonylContact C-O 3.57Å; P706-V719 VanDerWaalsContact CA-O 3.29Å; P706-V719 WeakPolarHBondContact CA-O 3.3Å; P706-I935 HydrophobicContact CB-CD1 4.25Å; P706-I935 HydrophobicContact CG-CD1 3.29Å; P706-I935 HydrophobicContact CG-CG1 4.33Å; P706-P952 WeakPolarHBondContact CD-O 3.41Å; P706-L954 HydrophobicContact CB-CB 3.98Å; P706-L954 HydrophobicContact CB-CD2 3.96Å; P706-L954 HydrophobicContact CG-CB 4.03Å
707	R	84.4	Confident	79.7	Confident	39 Å²	39	45.5 Å²	45.5	15%	0.147	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.4	-179.7	-168.7	-175.2	-157.5	94.5	31.6	110.3	Y333 F718 V719 M1008 N1009	Y333-R707 PolarHBondContact OH-NH1 3.27Å; R707-F718 CarbonylContact O-C 3.23Å; R707-F718 WeakPolarHBondContact O-CA 3.27Å; R707-F718 WeakPolarHBondContact O-CB 2.96Å; R707-V719 HydrophobicContact CB-CG2 4.08Å; R707-V719 PolarHBondContact N-O 2.7Å; R707-V719 PolarHBondContact O-N 3.43Å; R707-M1008 PolarHBondContact NH1-SD 3.13Å; R707-M1008 VanDerWaalsContact NH1-SD 3.42Å; R707-M1008 VanDerWaalsContact NH2-C 3.31Å; R707-M1008 PolarHBondContact NH2-O 2.84Å; R707-N1009 VanDerWaalsContact CZ-OD1 3.23Å; R707-N1009 PolarHBondContact NH1-OD1 3.17Å; R707-N1009 PolarHBondContact NH2-OD1 3.09Å
708	V	86.4	Confident	81.5	Confident	9 Å²	9	39.9 Å²	39.9	6%	0.055	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	133.1	170	-174.9	0	0	0	0	108.8	I716 L954 F956 F962	V708-I716 HydrophobicContact CG1-CD1 4.27Å; V708-I716 HydrophobicContact CG1-CG1 3.91Å; V708-I716 HydrophobicContact CG2-CD1 3.79Å; V708-I716 HydrophobicContact CG2-CG1 4.28Å; V708-L954 HydrophobicContact CG2-CD1 3.97Å; V708-L954 HydrophobicContact CG2-CD2 3.85Å; V708-F956 HydrophobicContact CG2-CD2 3.92Å; V708-F956 HydrophobicContact CG2-CE2 4.12Å; V708-F956 HydrophobicContact CG2-CG 4.23Å; V708-F962 HydrophobicContact CB-CB 4.31Å; V708-F962 HydrophobicContact CB-CD2 3.89Å; V708-F962 HydrophobicContact CB-CE2 4.44Å; V708-F962 HydrophobicContact CB-CG 3.99Å; V708-F962 HydrophobicContact CG1-CD1 3.88Å; V708-F962 HydrophobicContact CG1-CD2 3.77Å; V708-F962 HydrophobicContact CG1-CE1 4.02Å; V708-F962 HydrophobicContact CG1-CE2 3.95Å; V708-F962 HydrophobicContact CG1-CG 3.77Å; V708-F962 HydrophobicContact CG1-CZ 4.08Å; V708-F962 WeakPolarHBondContact O-CD2 3.42Å
709	I	80.1	Confident	83	Confident	18 Å²	18	39 Å²	39	9%	0.092	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	-27.7	177.5	56.9	160.2	0	0	0	113	D331 T717 V719 V1000	D331-I709 VanDerWaalsContact OD1-CD1 3.27Å; D331-I709 WeakPolarHBondContact OD1-CD1 3.3Å; I709-T717 HydrophobicContact CD1-CG2 3.99Å; I709-T717 HydrophobicContact CG1-CG2 3.94Å; I709-T717 PolarHBondContact N-O 2.81Å; I709-V719 HydrophobicContact CD1-CG1 3.64Å; I709-V719 HydrophobicContact CG1-CG1 4.13Å; I709-V719 HydrophobicContact CG2-CG1 4.23Å; I709-V719 HydrophobicContact CG2-CG2 3.69Å; I709-V1000 HydrophobicContact CG2-CG2 4.21Å
710	R	83.3	Confident	84.2	Confident	109 Å²	109	31.1 Å²	31.1	41%	0.411	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	144.2	-179.9	-60.5	-176.1	-79.2	-171.5	-1.3	110	D331 T717	D331-R710 IonicContact OD1-CZ 3.53Å; D331-R710 IonicContact OD1-NE 2.69Å; D331-R710 IonicContact OD1-NH2 3.65Å; D331-R710 PolarHBondContact OD1-NH2 3.26Å; D331-R710 IonicContact OD2-CZ 3.42Å; D331-R710 IonicContact OD2-NH2 2.75Å; D331-R710 PolarHBondContact OD2-NH2 3.02Å; R710-T717 PolarHBondContact N-O 3.16Å; R710-T717 PolarHBondContact O-N 2.8Å
711	K	84.6	Confident	84.7	Confident	67 Å²	67	30.1 Å²	30.1	29%	0.291	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	151.8	169.9	79.7	-171.1	169.7	-161.3	0	111.3	S715 W960 F962 D965	K711-S715 WeakPolarHBondContact CA-O 3.28Å; K711-W960 PolarHBondContact NZ-O 3.28Å; K711-F962 HydrophobicContact CB-CE1 3.98Å; K711-F962 HydrophobicContact CD-CD1 3.88Å; K711-F962 HydrophobicContact CD-CE1 3.59Å; K711-F962 HydrophobicContact CG-CD1 4.49Å; K711-F962 HydrophobicContact CG-CE1 3.73Å; K711-D965 IonicContact NZ-OD2 3.17Å; K711-D965 PolarHBondContact NZ-OD2 3.01Å
712	T	84.8	Confident	84.5	Confident	71 Å²	71	30.1 Å²	30.1	44%	0.436	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	177.4	165.1	77.7	0	0	0	0	109.1	S714 S715	T712-S714 PolarHBondContact O-N 3.29Å; T712-S714 PolarHBondContact OG1-N 2.8Å; T712-S715 WeakPolarHBondContact CG2-OG 3.22Å; T712-S715 PolarHBondContact N-O 3.11Å; T712-S715 PolarHBondContact OG1-N 3.21Å; T712-S715 PolarHBondContact OG1-OG 3.12Å
713	N	81.3	Confident	84.1	Confident	156 Å²	156	30.2 Å²	30.2	83%	0.834	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-12.9	176.6	-64.5	-2.7	0	0	0	113.8
714	S	86.8	Confident	83.5	Confident	78 Å²	78	31.2 Å²	31.2	55%	0.545	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-141.8	13.9	-177.2	62.9	0	0	0	0	114	T712	T712-S714 PolarHBondContact O-N 3.29Å; T712-S714 PolarHBondContact OG1-N 2.8Å
715	S	90.8	Very high	82.2	Confident	17 Å²	17	31.4 Å²	31.4	12%	0.119	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	154.8	176.4	68.8	0	0	0	0	113.4	K711 T712 D922	K711-S715 WeakPolarHBondContact CA-O 3.28Å; T712-S715 WeakPolarHBondContact CG2-OG 3.22Å; T712-S715 PolarHBondContact N-O 3.11Å; T712-S715 PolarHBondContact OG1-N 3.21Å; T712-S715 PolarHBondContact OG1-OG 3.12Å; S715-D922 CarbonylContact C-O 3.53Å; S715-D922 WeakPolarHBondContact CA-O 3.27Å; S715-D922 WeakPolarHBondContact CB-O 3.49Å
716	I	90.8	Very high	80.5	Confident	2 Å²	2	32 Å²	32	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133.4	172.7	-174.8	-175.9	0	0	0	109.1	V708 T921 D922 V925 F956 L958	V708-I716 HydrophobicContact CG1-CD1 4.27Å; V708-I716 HydrophobicContact CG1-CG1 3.91Å; V708-I716 HydrophobicContact CG2-CD1 3.79Å; V708-I716 HydrophobicContact CG2-CG1 4.28Å; I716-T921 CarbonylContact O-C 3.36Å; I716-T921 WeakPolarHBondContact O-CA 3.41Å; I716-D922 HydrophobicContact CG2-CB 3.78Å; I716-D922 PolarHBondContact N-O 3.43Å; I716-D922 PolarHBondContact O-N 3.48Å; I716-V925 HydrophobicContact CG2-CG1 3.97Å; I716-V925 HydrophobicContact CG2-CG2 4.41Å; I716-F956 HydrophobicContact CD1-CB 4.11Å; I716-F956 HydrophobicContact CD1-CD1 3.29Å; I716-F956 HydrophobicContact CD1-CE1 3.81Å; I716-F956 HydrophobicContact CD1-CG 3.76Å; I716-F956 HydrophobicContact CG1-CD1 4.33Å; I716-F956 HydrophobicContact CG1-CE1 4.43Å; I716-L958 HydrophobicContact CB-CD2 4.43Å
717	T	89.6	Confident	78.5	Confident	9 Å²	9	34.1 Å²	34.1	6%	0.055	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.1	175.4	-52.5	0	0	0	0	109.6	I709 R710 V919 F920 T921	I709-T717 HydrophobicContact CD1-CG2 3.99Å; I709-T717 HydrophobicContact CG1-CG2 3.94Å; I709-T717 PolarHBondContact N-O 2.81Å; R710-T717 PolarHBondContact N-O 3.16Å; R710-T717 PolarHBondContact O-N 2.8Å; T717-V919 HydrophobicContact CG2-CG2 3.86Å; T717-F920 WeakPolarHBondContact CA-O 3.39Å; T717-T921 WeakPolarHBondContact CG2-OG1 3.45Å; T717-T921 PolarHBondContact OG1-OG1 2.75Å
718	F	89.3	Confident	76.2	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.3	179.6	58.5	-99.4	0	0	0	112.7	P706 R707 W720 I901 V919 F920 Y933 I935 L954	P706-F718 HydrophobicContact CB-CB 4.49Å; P706-F718 HydrophobicContact CB-CD2 3.79Å; P706-F718 HydrophobicContact CB-CE2 4.41Å; P706-F718 HydrophobicContact CB-CG 4.4Å; R707-F718 CarbonylContact O-C 3.23Å; R707-F718 WeakPolarHBondContact O-CA 3.27Å; R707-F718 WeakPolarHBondContact O-CB 2.96Å; F718-W720 AromaticContact CD2-CE3 3.93Å; F718-W720 HydrophobicContact CD2-CE3 3.93Å; F718-W720 AromaticContact CD2-CZ3 3.85Å; F718-W720 HydrophobicContact CD2-CZ3 3.85Å; F718-W720 HydrophobicContact CE2-CE3 4.1Å; F718-W720 AromaticContact CE2-CZ3 3.76Å; F718-W720 HydrophobicContact CE2-CZ3 3.76Å; F718-I901 HydrophobicContact CE2-CG2 4.47Å; F718-I901 HydrophobicContact CZ-CG2 4.04Å; F718-V919 WeakPolarHBondContact O-CA 3.44Å; F718-F920 AromaticContact CE1-CD1 3.89Å; F718-F920 HydrophobicContact CE1-CD1 3.89Å; F718-F920 HydrophobicContact CE2-CB 4Å; F718-F920 HydrophobicContact CE2-CD1 4.34Å; F718-F920 HydrophobicContact CZ-CB 4.1Å; F718-F920 AromaticContact CZ-CD1 3.58Å; F718-F920 HydrophobicContact CZ-CD1 3.58Å; F718-F920 HydrophobicContact CZ-CG 4.29Å; F718-F920 PolarHBondContact N-O 3.45Å; F718-F920 PolarHBondContact O-N 2.96Å; F718-Y933 AromaticContact CE1-CD1 3.58Å; F718-Y933 HydrophobicContact CE1-CD1 3.58Å; F718-Y933 HydrophobicContact CE1-CD2 4.29Å; F718-Y933 AromaticContact CE1-CE1 3.6Å; F718-Y933 HydrophobicContact CE1-CE1 3.6Å; F718-Y933 HydrophobicContact CE1-CE2 4.32Å; F718-Y933 AromaticContact CE1-CG 3.94Å; F718-Y933 HydrophobicContact CE1-CG 3.94Å; F718-Y933 AromaticContact CZ-CD1 3.51Å; F718-Y933 HydrophobicContact CZ-CD1 3.51Å; F718-Y933 AromaticContact CZ-CE1 3.94Å; F718-Y933 HydrophobicContact CZ-CE1 3.94Å; F718-Y933 AromaticContact CZ-CG 3.97Å; F718-Y933 HydrophobicContact CZ-CG 3.97Å; F718-I935 HydrophobicContact CE2-CD1 4.06Å; F718-L954 HydrophobicContact CB-CD2 3.99Å; F718-L954 HydrophobicContact CD1-CD2 4.18Å; F718-L954 HydrophobicContact CG-CD2 4.03Å
719	V	85.7	Confident	73.6	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	160.3	-177.5	-61	0	0	0	0	110.8	Y333 P706 R707 I709 T918 V919	Y333-V719 HydrophobicContact CG-CG2 4.16Å; P706-V719 CarbonylContact C-O 3.57Å; P706-V719 VanDerWaalsContact CA-O 3.29Å; P706-V719 WeakPolarHBondContact CA-O 3.3Å; R707-V719 HydrophobicContact CB-CG2 4.08Å; R707-V719 PolarHBondContact N-O 2.7Å; R707-V719 PolarHBondContact O-N 3.43Å; I709-V719 HydrophobicContact CD1-CG1 3.64Å; I709-V719 HydrophobicContact CG1-CG1 4.13Å; I709-V719 HydrophobicContact CG2-CG1 4.23Å; I709-V719 HydrophobicContact CG2-CG2 3.69Å; V719-T918 VanDerWaalsContact CA-O 3.3Å; V719-T918 WeakPolarHBondContact CA-O 3.39Å; V719-V919 HydrophobicContact CG1-CB 3.95Å; V719-V919 HydrophobicContact CG1-CG2 3.78Å
720	W	83.2	Confident	71.3	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.206	C	C	.	.			trans	-145.8	162.9	175.5	56.7	93	0	0	0	111.9	F718 Y899 I901 T915 L917 T918 F920 I935	F718-W720 AromaticContact CD2-CE3 3.93Å; F718-W720 HydrophobicContact CD2-CE3 3.93Å; F718-W720 AromaticContact CD2-CZ3 3.85Å; F718-W720 HydrophobicContact CD2-CZ3 3.85Å; F718-W720 HydrophobicContact CE2-CE3 4.1Å; F718-W720 AromaticContact CE2-CZ3 3.76Å; F718-W720 HydrophobicContact CE2-CZ3 3.76Å; W720-Y899 HydrophobicContact CZ2-CD1 4.32Å; W720-Y899 HydrophobicContact CZ2-CD2 4.01Å; W720-Y899 AromaticContact CZ2-CG 3.78Å; W720-Y899 HydrophobicContact CZ2-CG 3.78Å; W720-Y899 AromaticContact NE1-CD1 3.27Å; W720-Y899 VanDerWaalsContact NE1-CD1 3.27Å; W720-Y899 AromaticContact NE1-CE1 3.39Å; W720-Y899 AromaticContact NE1-CG 3.62Å; W720-Y899 AromaticContact NE1-CZ 3.84Å; W720-I901 HydrophobicContact CH2-CD1 4.3Å; W720-I901 HydrophobicContact CH2-CG1 4.36Å; W720-T915 HydrophobicContact CH2-CG2 3.86Å; W720-T915 HydrophobicContact CZ2-CG2 3.98Å; W720-L917 WeakPolarHBondContact CH2-O 3.31Å; W720-L917 WeakPolarHBondContact CZ2-O 3.36Å; W720-T918 PolarHBondContact N-O 2.99Å; W720-T918 VanDerWaalsContact N-O 3.12Å; W720-F920 HydrophobicContact CH2-CB 3.96Å; W720-F920 HydrophobicContact CZ3-CB 3.83Å; W720-I935 HydrophobicContact CD2-CG1 3.97Å; W720-I935 HydrophobicContact CD2-CG2 4.44Å; W720-I935 HydrophobicContact CE3-CG1 4.07Å; W720-I935 HydrophobicContact CG-CG1 4.44Å; W720-I935 HydrophobicContact CZ2-CG1 4.46Å; W720-I935 HydrophobicContact CZ2-CG2 4.31Å; W720-I935 HydrophobicContact CZ3-CG1 4.38Å
721	L	77	Confident	68.7	Low	3 Å²	3	34.9 Å²	34.9	2%	0.016	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-76.4	145.4	170.1	-66.8	175.1	0	0	0	110.7	P67 Y333 L335 I350 I702 P703 T704	P67-L721 HydrophobicContact CG-CD2 4.46Å; Y333-L721 HydrophobicContact CD1-CD2 3.49Å; Y333-L721 VanDerWaalsContact CD1-CD2 3.49Å; Y333-L721 HydrophobicContact CD1-CG 3.56Å; Y333-L721 HydrophobicContact CE1-CD1 4.16Å; Y333-L721 HydrophobicContact CE1-CD2 3.92Å; Y333-L721 HydrophobicContact CE1-CG 3.65Å; Y333-L721 HydrophobicContact CG-CD2 4.28Å; Y333-L721 WeakPolarHBondContact O-CD2 3.4Å; L335-L721 HydrophobicContact CD1-CD1 3.77Å; L335-L721 HydrophobicContact CG-CD1 4.2Å; I350-L721 HydrophobicContact CD1-CD1 3.98Å; I702-L721 WeakPolarHBondContact CG2-O 3.43Å; P703-L721 HydrophobicContact CG-CB 4.14Å; P703-L721 HydrophobicContact CG-CD1 3.98Å; T704-L721 HydrophobicContact CG2-CD1 3.92Å
722	P	73.9	Confident	66.2	Low	7 Å²	7	39 Å²	39	5%	0.045	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-62.8	164.1	162.8	32.7	-38	0	0	0	110.7	P67	P67-P722 HydrophobicContact CB-CG 3.81Å
723	P	74.4	Confident	63.5	Low	1 Å²	1	38.6 Å²	38.6	1%	0.006	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-60	140.5	171.9	-20.2	32	0	0	0	112.8	D700 C701 I702 G725 H726 L897 A937	D700-P723 VanDerWaalsContact C-CB 3.45Å; D700-P723 HydrophobicContact CB-CB 4.07Å; D700-P723 HydrophobicContact CB-CG 3.85Å; D700-P723 WeakPolarHBondContact O-CG 2.99Å; C701-P723 VanDerWaalsContact O-CA 3.3Å; C701-P723 WeakPolarHBondContact O-CA 3.47Å; C701-P723 WeakPolarHBondContact O-CB 3.44Å; I702-P723 HydrophobicContact CG1-CG 4.15Å; P723-G725 PolarHBondContact O-N 2.92Å; P723-H726 HydrophobicContact CB-CB 4.25Å; P723-H726 PolarHBondContact O-N 3.28Å; P723-L897 HydrophobicContact CG-CD1 4.15Å; P723-A937 HydrophobicContact CG-CB 3.57Å
724	L	69.4	Low	61.1	Low	22 Å²	22	38.4 Å²	38.4	12%	0.115	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-62.6	-43	-175.4	-64.9	-179.7	0	0	0	113.1	I344 Y354 C682 L686 P703	I344-L724 HydrophobicContact CG2-CD2 3.91Å; Y354-L724 HydrophobicContact CE2-CD1 4.13Å; C682-L724 WeakPolarHBondContact SG-CD1 3Å; L686-L724 HydrophobicContact CB-CB 4.38Å; L686-L724 HydrophobicContact CD1-CB 4.11Å; P703-L724 HydrophobicContact CB-CD1 3.94Å; P703-L724 HydrophobicContact CB-CD2 4.38Å; P703-L724 HydrophobicContact CB-CG 3.94Å; P703-L724 HydrophobicContact CG-CD1 4.36Å; P703-L724 HydrophobicContact CG-CD2 3.91Å; P703-L724 HydrophobicContact CG-CG 3.85Å
725	G	56.6	Low	58.4	Low	12 Å²	12	40.5 Å²	40.5	12%	0.124	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-85.6	3.5	-177	0	0	0	0	0	115.7	D685 P723 H727 S728	D685-G725 WeakPolarHBondContact O-CA 3.15Å; D685-G725 PolarHBondContact O-N 2.75Å; P723-G725 PolarHBondContact O-N 2.92Å; G725-H727 PolarHBondContact O-N 2.97Å; G725-H727 VanDerWaalsContact O-N 3.16Å; G725-S728 VanDerWaalsContact O-CB 3.29Å; G725-S728 WeakPolarHBondContact O-CB 3.41Å; G725-S728 PolarHBondContact O-N 3.14Å; G725-S728 VanDerWaalsContact O-N 3.08Å; G725-S728 PolarHBondContact O-OG 2.87Å
726	H	50.1	Low	55.5	Low	47 Å²	47	41 Å²	41	22%	0.218	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-65.1	-23	-172.6	-168.9	63.2	0	0	0	113.5	D700 P723 S728 L897	D700-H726 IonicContact OD1-CE1 2.6Å; D700-H726 IonicContact OD1-CG 3.59Å; D700-H726 IonicContact OD1-ND1 3.86Å; D700-H726 PolarHBondContact OD1-ND1 2.84Å; P723-H726 HydrophobicContact CB-CB 4.25Å; P723-H726 PolarHBondContact O-N 3.28Å; H726-S728 VanDerWaalsContact C-N 3.29Å; H726-S728 PolarHBondContact O-N 2.94Å; H726-L897 HydrophobicContact CB-CD1 4.39Å; H726-L897 WeakPolarHBondContact CE1-CD2 3.39Å; H726-L897 VanDerWaalsContact CE1-CG 3.49Å; H726-L897 WeakPolarHBondContact CE1-CG 3.43Å; H726-L897 WeakPolarHBondContact NE2-CG 3.38Å
727	H	45.1	Very low	52.5	Low	49 Å²	49	45.4 Å²	45.4	23%	0.227	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-90.8	17.5	177.7	-56.6	-76.2	0	0	0	113.2	H63 G725 C741	H63-H727 PolarHBondContact CE1-O 2.81Å; H63-H727 PolarHBondContact ND1-O 2.81Å; G725-H727 PolarHBondContact O-N 2.97Å; G725-H727 VanDerWaalsContact O-N 3.16Å; H727-C741 PolarHBondContact CE1-O 3.46Å; H727-C741 PolarHBondContact ND1-O 3.37Å
728	S	37.6	Very low	49.7	Very low	26 Å²	26	46.6 Å²	46.6	18%	0.182	27%	0.265	C	S	.	.			trans	-115.1	78.3	-175.8	-47.4	0	0	0	0	111.6	G725 H726	G725-S728 VanDerWaalsContact O-CB 3.29Å; G725-S728 WeakPolarHBondContact O-CB 3.41Å; G725-S728 PolarHBondContact O-N 3.14Å; G725-S728 VanDerWaalsContact O-N 3.08Å; G725-S728 PolarHBondContact O-OG 2.87Å; H726-S728 VanDerWaalsContact C-N 3.29Å; H726-S728 PolarHBondContact O-N 2.94Å
729	C	30.4	Very low	47.5	Very low	63 Å²	63	47.1 Å²	47.1	43%	0.426	27%	0.269	S	S	.	.			trans	-75.9	135.9	178.5	-68.2	0	0	0	0	112.7	C736	C729-C736 HydrophobicContact CB-CB 4.14Å
730	K	32.3	Very low	45.8	Very low	59 Å²	59	47.5 Å²	47.5	26%	0.257	27%	0.273	S	S	.	.			trans	-89.9	163.6	-178.6	-100.1	-170.3	158	171.7	0	113.2	A689 G690 D732	A689-K730 WeakPolarHBondContact O-CE 3.15Å; A689-K730 PolarHBondContact O-NZ 3.19Å; G690-K730 VanDerWaalsContact C-CE 3.47Å; G690-K730 WeakPolarHBondContact O-CE 3.38Å; G690-K730 PolarHBondContact O-NZ 2.91Å; K730-D732 PolarHBondContact O-N 2.85Å
731	P	30	Very low	44.4	Very low	42 Å²	42	48.3 Å²	48.3	27%	0.273	28%	0.279	S	S	.	.	S	Bend	trans	-77	-1.3	-166.5	-12.7	27.7	0	0	0	118	E525 G733	E525-P731 WeakPolarHBondContact OE1-CG 3.18Å; P731-G733 PolarHBondContact O-N 3.17Å; P731-G733 VanDerWaalsContact O-N 3.08Å
732	D	31	Very low	43.4	Very low	155 Å²	155	49.5 Å²	49.5	83%	0.829	29%	0.285	S	S	*	.	S	Bend	trans	-90.6	70.4	-167.4	-66.1	-40.6	0	0	0	113.5	K730	K730-D732 PolarHBondContact O-N 2.85Å
733	G	29	Very low	42.2	Very low	62 Å²	62	50.7 Å²	50.7	64%	0.639	29%	0.29	S	S	*	.	S	Bend	trans	96.3	126.1	162.1	0	0	0	0	0	116.6	P731	P731-G733 PolarHBondContact O-N 3.17Å; P731-G733 VanDerWaalsContact O-N 3.08Å
734	I	29.6	Very low	41.2	Very low	151 Å²	151	52.4 Å²	52.4	77%	0.774	30%	0.299	S	S	*	.	S	Bend	trans	75	131.4	-172.3	-52.2	176.3	0	0	0	112.9	C736	I734-C736 PolarHBondContact O-N 2.92Å
735	I	30.5	Very low	40.6	Very low	122 Å²	122	52 Å²	52	63%	0.626	30%	0.301	S	S	*	.	S	Bend	trans	-69.3	87.5	-170.8	-55.6	162.9	0	0	0	110.3	D738	I735-D738 VanDerWaalsContact CG2-OD2 3.28Å; I735-D738 WeakPolarHBondContact CG2-OD2 3.45Å
736	C	29.1	Very low	41	Very low	27 Å²	27	54.5 Å²	54.5	18%	0.182	31%	0.306	C	S	.	.			trans	-123.8	2.5	170.9	-74	0	0	0	0	112.7	C729 I734 C739	C729-C736 HydrophobicContact CB-CB 4.14Å; I734-C736 PolarHBondContact O-N 2.92Å; C736-C739 WeakPolarHBondContact O-CB 3.44Å; C736-C739 PolarHBondContact O-N 3.06Å
737	Q	28.2	Very low	42	Very low	95 Å²	95	52.3 Å²	52.3	44%	0.444	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-22.8	-179.8	-72.8	-165.2	-85.9	0	0	113.6	E525 C739	E525-Q737 PolarHBondContact OE1-NE2 3.45Å; Q737-C739 PolarHBondContact O-N 3.07Å
738	D	30.8	Very low	43.3	Very low	34 Å²	34	52.1 Å²	52.1	18%	0.182	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-7.3	176.1	-49.2	-45.9	0	0	0	112.3	I735 F747 V808	I735-D738 VanDerWaalsContact CG2-OD2 3.28Å; I735-D738 WeakPolarHBondContact CG2-OD2 3.45Å; D738-F747 WeakPolarHBondContact O-CE2 3.16Å; D738-V808 HydrophobicContact CB-CG2 3.55Å; D738-V808 WeakPolarHBondContact OD2-CG2 3.09Å
739	C	42.9	Very low	44.9	Very low	11 Å²	11	51 Å²	51	7%	0.074	29%	0.287	C	S	.	.			trans	-120.6	87.7	-141.3	-52.5	0	0	0	0	116.7	C736 Q737 C741 F747 P890	C736-C739 WeakPolarHBondContact O-CB 3.44Å; C736-C739 PolarHBondContact O-N 3.06Å; Q737-C739 PolarHBondContact O-N 3.07Å; C739-C741 PolarHBondContact O-N 3.16Å; C739-C741 VanDerWaalsContact O-N 3.12Å; C739-F747 HydrophobicContact CB-CD2 4.06Å; C739-F747 HydrophobicContact CB-CE2 4.07Å; C739-P890 HydrophobicContact CB-CG 4.27Å; C739-P890 WeakPolarHBondContact SG-CG 3.28Å
740	G	50.9	Low	47.2	Very low	10 Å²	10	48.6 Å²	48.6	10%	0.103	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	99	156.1	0	0	0	0	0	110.3	F748	G740-F748 PolarHBondContact N-O 2.77Å; G740-F748 WeakPolarHBondContact O-CD1 3.33Å; G740-F748 VanDerWaalsContact O-CE1 3.29Å; G740-F748 WeakPolarHBondContact O-CE1 3.47Å; G740-F748 VanDerWaalsContact O-CG 3.23Å; G740-F748 WeakPolarHBondContact O-CG 3.22Å; G740-F748 PolarHBondContact O-N 3.08Å
741	C	53.5	Low	49.6	Very low	17 Å²	17	45.8 Å²	45.8	12%	0.115	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	129.2	169.2	-58.4	0	0	0	0	110.1	H727 C739 R746 C891 C894	H727-C741 PolarHBondContact CE1-O 3.46Å; H727-C741 PolarHBondContact ND1-O 3.37Å; C739-C741 PolarHBondContact O-N 3.16Å; C739-C741 VanDerWaalsContact O-N 3.12Å; C741-R746 CarbonylContact C-O 3.52Å; C741-R746 WeakPolarHBondContact CA-O 3.45Å; C741-C891 VanDerWaalsContact CA-SG 3.51Å; C741-C891 HydrophobicContact CB-CB 3.97Å; C741-C891 WeakPolarHBondContact CB-SG 3.22Å; C741-C891 VanDerWaalsContact SG-CA 3.53Å; C741-C891 WeakPolarHBondContact SG-CB 3.22Å; C741-C891 CovalentContact SG-SG 2.02Å; C741-C891 PolarHBondContact SG-SG 2.85Å; C741-C894 PolarHBondContact SG-SG 2.9Å
742	D	55	Low	51.8	Low	27 Å²	27	44.2 Å²	44.2	14%	0.144	25%	0.247	C	C	.	.			trans	-74.9	170.8	166	94.7	-22.8	0	0	0	111.2	N744 G745 R746	D742-N744 PolarHBondContact O-N 3.29Å; D742-N744 VanDerWaalsContact OD1-CA 3.31Å; D742-N744 WeakPolarHBondContact OD1-CA 3.28Å; D742-N744 WeakPolarHBondContact OD1-CB 2.86Å; D742-N744 PolarHBondContact OD1-N 2.97Å; D742-N744 PolarHBondContact OD2-ND2 3.25Å; D742-G745 PolarHBondContact O-N 2.88Å; D742-G745 PolarHBondContact OD1-N 2.91Å; D742-R746 PolarHBondContact N-O 2.67Å; D742-R746 VanDerWaalsContact OD1-CB 3.28Å; D742-R746 WeakPolarHBondContact OD1-CB 3.49Å; D742-R746 PolarHBondContact OD1-N 3.29Å; D742-R746 IonicContact OD1-NE 3.72Å; D742-R746 IonicContact OD2-CZ 3.89Å; D742-R746 IonicContact OD2-NE 3.84Å; D742-R746 PolarHBondContact OD2-NE 3.5Å; D742-R746 IonicContact OD2-NH2 2.84Å; D742-R746 PolarHBondContact OD2-NH2 2.74Å
743	Q	49.1	Very low	54	Low	32 Å²	32	40.5 Å²	40.5	15%	0.15	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-21	-177.7	-62.8	-178.5	3.5	0	0	113.3	G745	Q743-G745 PolarHBondContact O-N 3.01Å
744	N	53.8	Low	56.5	Low	38 Å²	38	39.5 Å²	39.5	20%	0.203	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	5	174.3	-52.7	-65.7	0	0	0	112.6	V71 D742 R746 P886	V71-N744 PolarHBondContact N-OD1 3.33Å; D742-N744 PolarHBondContact O-N 3.29Å; D742-N744 VanDerWaalsContact OD1-CA 3.31Å; D742-N744 WeakPolarHBondContact OD1-CA 3.28Å; D742-N744 WeakPolarHBondContact OD1-CB 2.86Å; D742-N744 PolarHBondContact OD1-N 2.97Å; D742-N744 PolarHBondContact OD2-ND2 3.25Å; N744-R746 VanDerWaalsContact C-N 3.28Å; N744-R746 HydrophobicContact CB-CG 4.4Å; N744-R746 PolarHBondContact O-N 2.6Å; N744-P886 WeakPolarHBondContact O-CB 3.23Å
745	G	58.1	Low	58.9	Low	14 Å²	14	36.1 Å²	36.1	14%	0.144	19%	0.185	C	C	.	.	S	Bend	trans	68	26.8	-174.6	0	0	0	0	0	113.2	D742 Q743 G887	D742-G745 PolarHBondContact O-N 2.88Å; D742-G745 PolarHBondContact OD1-N 2.91Å; Q743-G745 PolarHBondContact O-N 3.01Å; G745-G887 PolarHBondContact O-N 2.76Å
746	R	65	Low	60.3	Low	64 Å²	64	32.8 Å²	32.8	24%	0.242	18%	0.176	C	C	.	.			trans	-85	126.1	167.3	-62.5	-177.3	-70.4	-179.1	-0.8	109.1	C741 D742 N744 I883 S884 P886	C741-R746 CarbonylContact C-O 3.52Å; C741-R746 WeakPolarHBondContact CA-O 3.45Å; D742-R746 PolarHBondContact N-O 2.67Å; D742-R746 VanDerWaalsContact OD1-CB 3.28Å; D742-R746 WeakPolarHBondContact OD1-CB 3.49Å; D742-R746 PolarHBondContact OD1-N 3.29Å; D742-R746 IonicContact OD1-NE 3.72Å; D742-R746 IonicContact OD2-CZ 3.89Å; D742-R746 IonicContact OD2-NE 3.84Å; D742-R746 PolarHBondContact OD2-NE 3.5Å; D742-R746 IonicContact OD2-NH2 2.84Å; D742-R746 PolarHBondContact OD2-NH2 2.74Å; N744-R746 VanDerWaalsContact C-N 3.28Å; N744-R746 HydrophobicContact CB-CG 4.4Å; N744-R746 PolarHBondContact O-N 2.6Å; R746-I883 HydrophobicContact CB-CG2 4.06Å; R746-S884 WeakPolarHBondContact CB-O 3.12Å; R746-S884 WeakPolarHBondContact CD-O 3.35Å; R746-S884 VanDerWaalsContact CG-O 3.3Å; R746-S884 WeakPolarHBondContact CG-O 3.45Å; R746-P886 HydrophobicContact CG-CB 4.25Å; R746-P886 HydrophobicContact CG-CG 3.7Å
747	F	69.4	Low	61.6	Low	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	124.9	174.9	168.1	-130.4	0	0	0	110.3	D738 C739 Q749 V808 V810 I883 S884 P890 C891	D738-F747 WeakPolarHBondContact O-CE2 3.16Å; C739-F747 HydrophobicContact CB-CD2 4.06Å; C739-F747 HydrophobicContact CB-CE2 4.07Å; F747-Q749 HydrophobicContact CE1-CG 4.33Å; F747-Q749 HydrophobicContact CE2-CB 3.89Å; F747-Q749 HydrophobicContact CZ-CB 3.68Å; F747-Q749 HydrophobicContact CZ-CG 3.92Å; F747-V808 HydrophobicContact CD1-CG1 4.47Å; F747-V808 HydrophobicContact CE1-CB 3.58Å; F747-V808 HydrophobicContact CE1-CG1 3.65Å; F747-V808 HydrophobicContact CE1-CG2 4.46Å; F747-V808 HydrophobicContact CZ-CB 3.66Å; F747-V808 HydrophobicContact CZ-CG1 4.11Å; F747-V808 HydrophobicContact CZ-CG2 4.1Å; F747-V810 HydrophobicContact CD1-CB 4.1Å; F747-V810 HydrophobicContact CD1-CG1 3.43Å; F747-V810 VanDerWaalsContact CD1-CG1 3.43Å; F747-V810 HydrophobicContact CD1-CG2 3.72Å; F747-V810 HydrophobicContact CE1-CB 4.42Å; F747-V810 HydrophobicContact CE1-CG1 3.69Å; F747-V810 HydrophobicContact CE1-CG2 3.9Å; F747-I883 CarbonylContact O-C 3.5Å; F747-I883 WeakPolarHBondContact O-CA 3.1Å; F747-S884 WeakPolarHBondContact CB-OG 3.47Å; F747-S884 PolarHBondContact N-OG 3.21Å; F747-S884 WeakPolarHBondContact O-CB 3.42Å; F747-S884 PolarHBondContact O-N 2.85Å; F747-P890 HydrophobicContact CD1-CG 4.31Å; F747-P890 HydrophobicContact CD2-CG 4.19Å; F747-P890 HydrophobicContact CE1-CG 4.44Å; F747-P890 HydrophobicContact CE2-CG 4.38Å; F747-P890 HydrophobicContact CG-CG 4.16Å; F747-P890 HydrophobicContact CZ-CG 4.46Å; F747-C891 WeakPolarHBondContact CA-SG 3.44Å; F747-C891 HydrophobicContact CB-CB 4.31Å; F747-C891 WeakPolarHBondContact CB-SG 3.43Å
748	F	72.3	Confident	62.5	Low	45 Å²	45	32.4 Å²	32.4	20%	0.197	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	143.8	168	67	-101.5	0	0	0	111.7	G740 Q881 V882 I883	G740-F748 PolarHBondContact N-O 2.77Å; G740-F748 WeakPolarHBondContact O-CD1 3.33Å; G740-F748 VanDerWaalsContact O-CE1 3.29Å; G740-F748 WeakPolarHBondContact O-CE1 3.47Å; G740-F748 VanDerWaalsContact O-CG 3.23Å; G740-F748 WeakPolarHBondContact O-CG 3.22Å; G740-F748 PolarHBondContact O-N 3.08Å; F748-Q881 VanDerWaalsContact CD2-NE2 3.32Å; F748-V882 VanDerWaalsContact CA-O 3.26Å; F748-V882 WeakPolarHBondContact CA-O 3.16Å; F748-I883 HydrophobicContact CB-CB 4.34Å; F748-I883 HydrophobicContact CB-CG1 3.89Å; F748-I883 HydrophobicContact CB-CG2 4.33Å
749	Q	71.4	Confident	63.3	Low	3 Å²	3	33.1 Å²	33.1	1%	0.014	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	163.6	174.1	69.6	-164.7	-50.4	0	0	108.9	F747 F806 V808 Q881 V882	F747-Q749 HydrophobicContact CE1-CG 4.33Å; F747-Q749 HydrophobicContact CE2-CB 3.89Å; F747-Q749 HydrophobicContact CZ-CB 3.68Å; F747-Q749 HydrophobicContact CZ-CG 3.92Å; Q749-F806 HydrophobicContact CG-CB 4.43Å; Q749-F806 HydrophobicContact CG-CD1 3.92Å; Q749-F806 HydrophobicContact CG-CG 4.45Å; Q749-V808 PolarHBondContact NE2-O 3.34Å; Q749-V808 VanDerWaalsContact OE1-N 3.08Å; Q749-V808 PolarHBondContact OE1-O 3.15Å; Q749-Q881 WeakPolarHBondContact O-CA 3.45Å; Q749-Q881 WeakPolarHBondContact O-CG 3.03Å; Q749-V882 HydrophobicContact CG-CG1 3.51Å; Q749-V882 PolarHBondContact N-O 2.85Å; Q749-V882 VanDerWaalsContact N-O 3.08Å; Q749-V882 PolarHBondContact O-N 2.96Å
750	Y	80.4	Confident	63.3	Low	12 Å²	12	40.1 Å²	40.1	5%	0.047	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	169.1	170.4	-66.2	-86.2	0	0	0	110.7	H61 S752 G773 P774 F806 W818 I880 Q881	H61-Y750 PolarHBondContact CE1-O 3.28Å; Y750-S752 PolarHBondContact O-N 2.91Å; Y750-G773 VanDerWaalsContact CB-C 3.43Å; Y750-G773 VanDerWaalsContact CB-O 3.28Å; Y750-G773 WeakPolarHBondContact CB-O 3.39Å; Y750-G773 WeakPolarHBondContact CD1-O 3.39Å; Y750-P774 HydrophobicContact CD1-CB 4.42Å; Y750-P774 HydrophobicContact CD2-CB 4.13Å; Y750-P774 HydrophobicContact CD2-CG 4.12Å; Y750-P774 HydrophobicContact CE1-CB 4.08Å; Y750-P774 HydrophobicContact CE2-CB 3.75Å; Y750-P774 HydrophobicContact CE2-CG 4.06Å; Y750-P774 HydrophobicContact CG-CB 4.45Å; Y750-F806 WeakPolarHBondContact O-CD1 3.49Å; Y750-W818 HydrophobicContact CE1-CH2 4.15Å; Y750-W818 HydrophobicContact CE1-CZ3 4.06Å; Y750-I880 CarbonylContact C-O 3.44Å; Y750-I880 VanDerWaalsContact CA-O 3.22Å; Y750-I880 WeakPolarHBondContact CA-O 3.01Å; Y750-Q881 HydrophobicContact CD1-CB 3.65Å; Y750-Q881 HydrophobicContact CD1-CG 3.96Å; Y750-Q881 HydrophobicContact CE1-CB 3.57Å; Y750-Q881 HydrophobicContact CE1-CG 3.74Å; Y750-Q881 HydrophobicContact CG-CG 4.45Å
751	A	82.6	Confident	63.1	Low	0 Å²	0	49 Å²	49	0%	0	27%	0.266	C	S	.	.			trans	-52.4	129.6	166.2	0	0	0	0	0	110.3	L772 G773 V804 F806 I880	A751-L772 HydrophobicContact CB-CD2 3.87Å; A751-G773 PolarHBondContact O-N 3.29Å; A751-V804 HydrophobicContact CB-CB 3.77Å; A751-V804 HydrophobicContact CB-CG1 4.17Å; A751-V804 HydrophobicContact CB-CG2 3.8Å; A751-F806 HydrophobicContact CB-CE1 4.48Å; A751-I880 HydrophobicContact CB-CB 4.24Å; A751-I880 PolarHBondContact N-O 3.42Å
752	S	74.7	Confident	62.6	Low	10 Å²	10	49.9 Å²	49.9	7%	0.07	27%	0.272	C	S	.	.			trans	-111.9	-20	-174.5	62.3	0	0	0	0	113.6	Y750 G805 D807	Y750-S752 PolarHBondContact O-N 2.91Å; S752-G805 PolarHBondContact N-O 3.28Å; S752-G805 PolarHBondContact OG-O 3.33Å; S752-D807 VanDerWaalsContact CB-OD1 3.28Å; S752-D807 WeakPolarHBondContact CB-OD1 3.42Å; S752-D807 WeakPolarHBondContact CB-OD2 3.32Å; S752-D807 PolarHBondContact OG-N 3.24Å; S752-D807 PolarHBondContact OG-OD1 3.42Å; S752-D807 PolarHBondContact OG-OD2 2.81Å
753	R	78.8	Confident	62.3	Low	76 Å²	76	51 Å²	51	29%	0.287	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	143.7	-174.5	56.3	-173.8	165.5	165.6	-6.4	112.6	L755 V804 G805 F806	R753-L755 HydrophobicContact CG-CD2 4.04Å; R753-L755 HydrophobicContact CG-CG 4.45Å; R753-V804 CarbonylContact O-C 3.47Å; R753-V804 WeakPolarHBondContact O-CA 3.22Å; R753-G805 PolarHBondContact N-O 3.43Å; R753-G805 PolarHBondContact O-N 3.01Å; R753-F806 PolarHBondContact NE-O 3.37Å; R753-F806 PolarHBondContact NH2-O 2.72Å
754	V	81.2	Confident	62.3	Low	42 Å²	42	51.1 Å²	51.1	26%	0.255	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	126.4	168	-175.6	0	0	0	0	108.6	P768 L772 I802	V754-P768 HydrophobicContact CB-CB 4.38Å; V754-P768 HydrophobicContact CG1-CB 3.82Å; V754-P768 HydrophobicContact CG2-CB 3.76Å; V754-P768 WeakPolarHBondContact CG2-O 3.26Å; V754-L772 HydrophobicContact CG2-CD1 4.15Å; V754-L772 HydrophobicContact CG2-CD2 4.08Å; V754-L772 HydrophobicContact CG2-CG 4.22Å; V754-I802 HydrophobicContact CG1-CG1 4.5Å
755	L	79.2	Confident	62.5	Low	79 Å²	79	53.7 Å²	53.7	41%	0.414	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-36.2	-174	-66.7	176.9	0	0	0	113.3	R753 A803 R865	R753-L755 HydrophobicContact CG-CD2 4.04Å; R753-L755 HydrophobicContact CG-CG 4.45Å; L755-A803 HydrophobicContact CB-CB 4.49Å; L755-A803 PolarHBondContact N-O 3Å; L755-R865 HydrophobicContact CD1-CB 3.48Å; L755-R865 VanDerWaalsContact CD1-CB 3.48Å; L755-R865 HydrophobicContact CD1-CG 4.15Å
756	A	60	Low	62.9	Low	52 Å²	52	56.4 Å²	56.4	43%	0.43	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	140.7	177.4	0	0	0	0	0	110.6	A803	A756-A803 HydrophobicContact CB-CB 4.19Å; A756-A803 PolarHBondContact O-N 2.85Å; A756-A803 VanDerWaalsContact O-N 3.13Å
757	H	56	Low	63.2	Low	52 Å²	52	54.1 Å²	54.1	24%	0.241	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	143	173.1	-177	59.4	0	0	0	108.4	G759 P768 W787 V801	H757-G759 VanDerWaalsContact C-N 3.33Å; H757-G759 PolarHBondContact O-N 2.94Å; H757-G759 VanDerWaalsContact O-N 3.15Å; H757-P768 HydrophobicContact CB-CG 4.38Å; H757-W787 AromaticContact CE1-CZ2 4Å; H757-W787 AromaticContact CE1-NE1 3.9Å; H757-V801 PolarHBondContact ND1-O 3.25Å
758	S	47.7	Very low	63.7	Low	63 Å²	63	54.7 Å²	54.7	44%	0.441	30%	0.298	S	S	.	.	S	Bend	trans	-87.2	72.5	176.8	77.6	0	0	0	0	110.8	G798 S799	S758-G798 WeakPolarHBondContact CB-O 3.46Å; S758-G798 VanDerWaalsContact OG-C 3.23Å; S758-G798 PolarHBondContact OG-O 2.83Å; S758-S799 PolarHBondContact OG-N 2.7Å
759	G	47.2	Very low	64	Low	48 Å²	48	57.2 Å²	57.2	50%	0.495	31%	0.31	S	S	.	.	S	Bend	trans	-168.3	152.1	178.4	0	0	0	0	0	111.6	H757	H757-G759 VanDerWaalsContact C-N 3.33Å; H757-G759 PolarHBondContact O-N 2.94Å; H757-G759 VanDerWaalsContact O-N 3.15Å
760	N	43.2	Very low	64.4	Low	158 Å²	158	58.4 Å²	58.4	85%	0.845	32%	0.316	S	S	*	.	S	Bend	trans	-59.7	156.9	160.5	-84.8	-24.6	0	0	0	108.9	S762	N760-S762 PolarHBondContact O-N 3.38Å
761	K	46.4	Very low	64.5	Low	198 Å²	198	57.9 Å²	57.9	86%	0.861	31%	0.314	S	S	*	.			trans	-55.5	98.5	175.3	-71.5	-179.1	173.3	-174.1	0	110.2
762	S	43.8	Very low	64.5	Low	34 Å²	34	59.2 Å²	59.2	24%	0.238	32%	0.321	C	S	.	.			trans	-88.6	110.2	176.7	-172.9	0	0	0	0	107.7	N760 S764 D790	N760-S762 PolarHBondContact O-N 3.38Å; S762-S764 PolarHBondContact O-N 3.45Å; S762-S764 VanDerWaalsContact O-N 3.09Å; S762-S764 VanDerWaalsContact OG-CB 3.28Å; S762-S764 WeakPolarHBondContact OG-CB 3.28Å; S762-D790 WeakPolarHBondContact CB-OD2 3.3Å; S762-D790 PolarHBondContact OG-OD2 3.17Å
763	S	47.7	Very low	64	Low	52 Å²	52	58.8 Å²	58.8	36%	0.364	32%	0.318	S	S	.	.			trans	-79.4	31.5	169.2	62.4	0	0	0	0	111.4	D428 S430	D428-S763 PolarHBondContact OD1-OG 3.2Å; S430-S763 PolarHBondContact OG-OG 3.4Å
764	S	50.3	Low	63.3	Low	34 Å²	34	55.7 Å²	55.7	24%	0.238	31%	0.308	C	S	.	.	S	Bend	trans	-65.9	152.2	172.5	-176.1	0	0	0	0	109.4	S762 W766 S767	S762-S764 PolarHBondContact O-N 3.45Å; S762-S764 VanDerWaalsContact O-N 3.09Å; S762-S764 VanDerWaalsContact OG-CB 3.28Å; S762-S764 WeakPolarHBondContact OG-CB 3.28Å; S764-W766 PolarHBondContact O-N 3.41Å; S764-S767 WeakPolarHBondContact O-CB 3.16Å; S764-S767 PolarHBondContact O-N 3.15Å; S764-S767 VanDerWaalsContact O-N 3.1Å
765	Y	56.6	Low	62.8	Low	91 Å²	91	54.3 Å²	54.3	36%	0.357	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-17.4	170.6	-79.8	-72	0	0	0	113.9	G426 E440 A784	G426-Y765 WeakPolarHBondContact CA-OH 3.09Å; G426-Y765 PolarHBondContact O-OH 3.26Å; E440-Y765 HydrophobicContact CG-CE2 4.32Å; E440-Y765 WeakPolarHBondContact OE1-CE2 3.28Å; Y765-A784 HydrophobicContact CD1-CB 3.91Å; Y765-A784 HydrophobicContact CG-CB 4.18Å; Y765-A784 CarbonylContact O-C 3.52Å
766	W	67.1	Low	62.3	Low	71 Å²	71	52.1 Å²	52.1	27%	0.269	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	25.8	-175	-48.7	97.9	0	0	0	112.7	S764 A782 S783 W787 L788	S764-W766 PolarHBondContact O-N 3.41Å; W766-A782 VanDerWaalsContact CH2-C 3.46Å; W766-A782 HydrophobicContact CH2-CB 3.95Å; W766-A782 HydrophobicContact CZ3-CB 4.4Å; W766-S783 VanDerWaalsContact CH2-C 3.49Å; W766-S783 WeakPolarHBondContact CZ3-O 3.23Å; W766-W787 VanDerWaalsContact O-CD1 3.24Å; W766-L788 HydrophobicContact CB-CB 3.89Å; W766-L788 HydrophobicContact CD2-CB 4.27Å; W766-L788 HydrophobicContact CD2-CD1 3.75Å; W766-L788 HydrophobicContact CD2-CG 4.27Å; W766-L788 HydrophobicContact CE3-CB 4.14Å; W766-L788 HydrophobicContact CE3-CD1 3.43Å; W766-L788 VanDerWaalsContact CE3-CD1 3.43Å; W766-L788 HydrophobicContact CE3-CG 3.75Å; W766-L788 HydrophobicContact CG-CB 4.17Å; W766-L788 HydrophobicContact CG-CD1 4.39Å; W766-L788 HydrophobicContact CH2-CD1 4.1Å; W766-L788 HydrophobicContact CZ2-CD1 4.41Å; W766-L788 HydrophobicContact CZ3-CD1 3.57Å; W766-L788 HydrophobicContact CZ3-CG 4.19Å; W766-L788 PolarHBondContact O-N 3.46Å
767	S	71.8	Confident	62.8	Low	16 Å²	16	50.1 Å²	50.1	11%	0.112	27%	0.272	C	S	.	.			trans	-59.9	155.1	-170.4	90	0	0	0	0	112.8	S764 E769 Q770	S764-S767 WeakPolarHBondContact O-CB 3.16Å; S764-S767 PolarHBondContact O-N 3.15Å; S764-S767 VanDerWaalsContact O-N 3.1Å; S767-E769 WeakPolarHBondContact CB-OE2 3.45Å; S767-E769 PolarHBondContact O-N 3.47Å; S767-E769 VanDerWaalsContact O-N 3.09Å; S767-E769 PolarHBondContact OG-N 2.94Å; S767-E769 PolarHBondContact OG-OE2 3.41Å; S767-Q770 VanDerWaalsContact O-CB 3.29Å; S767-Q770 WeakPolarHBondContact O-CB 3.13Å; S767-Q770 PolarHBondContact O-N 2.96Å
768	P	79.6	Confident	63.4	Low	12 Å²	12	51 Å²	51	8%	0.078	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-55.6	-26.5	178.1	-28.7	38.3	0	0	0	114.5	V754 H757 Q770 A771 W787 I802	V754-P768 HydrophobicContact CB-CB 4.38Å; V754-P768 HydrophobicContact CG1-CB 3.82Å; V754-P768 HydrophobicContact CG2-CB 3.76Å; V754-P768 WeakPolarHBondContact CG2-O 3.26Å; H757-P768 HydrophobicContact CB-CG 4.38Å; P768-Q770 PolarHBondContact O-N 3.02Å; P768-A771 PolarHBondContact O-N 2.82Å; P768-W787 VanDerWaalsContact CA-CD1 3.45Å; P768-I802 HydrophobicContact CB-CD1 3.86Å; P768-I802 HydrophobicContact CB-CG1 4.42Å; P768-I802 WeakPolarHBondContact O-CD1 3.29Å
769	E	77.4	Confident	64.7	Low	98 Å²	98	52 Å²	52	46%	0.458	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-65.4	-24.6	175.8	-62.7	72.3	-157.5	0	0	112.7	S767 A771 L772	S767-E769 WeakPolarHBondContact CB-OE2 3.45Å; S767-E769 PolarHBondContact O-N 3.47Å; S767-E769 VanDerWaalsContact O-N 3.09Å; S767-E769 PolarHBondContact OG-N 2.94Å; S767-E769 PolarHBondContact OG-OE2 3.41Å; E769-A771 PolarHBondContact O-N 3.2Å; E769-L772 HydrophobicContact CB-CD1 4.37Å; E769-L772 VanDerWaalsContact O-CB 3.26Å; E769-L772 WeakPolarHBondContact O-CB 3.37Å; E769-L772 WeakPolarHBondContact O-CG 3.32Å; E769-L772 PolarHBondContact O-N 2.78Å
770	Q	80.2	Confident	66.3	Low	29 Å²	29	50.7 Å²	50.7	14%	0.136	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-65.7	-19.4	176	-62.9	-59.5	-25.8	0	0	113.4	K550 S767 P768 L772 A786	K550-Q770 PolarHBondContact NZ-O 2.74Å; S767-Q770 VanDerWaalsContact O-CB 3.29Å; S767-Q770 WeakPolarHBondContact O-CB 3.13Å; S767-Q770 PolarHBondContact O-N 2.96Å; P768-Q770 PolarHBondContact O-N 3.02Å; Q770-L772 VanDerWaalsContact C-N 3.28Å; Q770-A786 VanDerWaalsContact CB-C 3.44Å
771	A	84	Confident	67.8	Low	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-83.7	1.4	173.1	0	0	0	0	0	114	P768 E769 W787 I802 V877 D878	P768-A771 PolarHBondContact O-N 2.82Å; E769-A771 PolarHBondContact O-N 3.2Å; A771-W787 HydrophobicContact CB-CB 3.83Å; A771-I802 HydrophobicContact CB-CD1 3.77Å; A771-V877 HydrophobicContact CB-CG1 4.37Å; A771-D878 CarbonylContact C-O 3.55Å; A771-D878 WeakPolarHBondContact CA-O 3.48Å
772	L	81	Confident	68.9	Low	28 Å²	28	41.5 Å²	41.5	15%	0.147	23%	0.228	C	C	.	.	S	Bend	trans	-90.8	154.9	179.9	-56.5	-178.5	0	0	0	111.6	K550 A751 V754 E769 Q770 V804	K550-L772 WeakPolarHBondContact CE-O 3.36Å; A751-L772 HydrophobicContact CB-CD2 3.87Å; V754-L772 HydrophobicContact CG2-CD1 4.15Å; V754-L772 HydrophobicContact CG2-CD2 4.08Å; V754-L772 HydrophobicContact CG2-CG 4.22Å; E769-L772 HydrophobicContact CB-CD1 4.37Å; E769-L772 VanDerWaalsContact O-CB 3.26Å; E769-L772 WeakPolarHBondContact O-CB 3.37Å; E769-L772 WeakPolarHBondContact O-CG 3.32Å; E769-L772 PolarHBondContact O-N 2.78Å; Q770-L772 VanDerWaalsContact C-N 3.28Å; L772-V804 HydrophobicContact CD2-CG1 4.14Å
773	G	65.7	Low	70	Confident	2 Å²	2	40.7 Å²	40.7	2%	0.021	22%	0.222	C	C	.	.	S	Bend	trans	72.1	-160.6	-179.9	0	0	0	0	0	113.5	Y750 A751 A879	Y750-G773 VanDerWaalsContact CB-C 3.43Å; Y750-G773 VanDerWaalsContact CB-O 3.28Å; Y750-G773 WeakPolarHBondContact CB-O 3.39Å; Y750-G773 WeakPolarHBondContact CD1-O 3.39Å; A751-G773 PolarHBondContact O-N 3.29Å; G773-A879 WeakPolarHBondContact O-CB 3.28Å
774	P	64	Low	71	Confident	11 Å²	11	40 Å²	40	7%	0.071	22%	0.22	C	C	.	.	S	Bend	trans	-79.9	156.2	-178	3.2	13.1	0	0	0	111.5	P62 K550 Y750 D776	P62-P774 HydrophobicContact CB-CG 3.92Å; P62-P774 VanDerWaalsContact CD-CD 3.46Å; P62-P774 HydrophobicContact CG-CG 3.79Å; P62-P774 WeakPolarHBondContact O-CG 3.37Å; K550-P774 WeakPolarHBondContact CE-O 3.01Å; Y750-P774 HydrophobicContact CD1-CB 4.42Å; Y750-P774 HydrophobicContact CD2-CB 4.13Å; Y750-P774 HydrophobicContact CD2-CG 4.12Å; Y750-P774 HydrophobicContact CE1-CB 4.08Å; Y750-P774 HydrophobicContact CE2-CB 3.75Å; Y750-P774 HydrophobicContact CE2-CG 4.06Å; Y750-P774 HydrophobicContact CG-CB 4.45Å; P774-D776 PolarHBondContact O-N 3Å
775	P	71	Confident	71.9	Confident	12 Å²	12	42.2 Å²	42.2	8%	0.078	23%	0.225	C	C	.	.			trans	-70.1	128.3	-178.6	-3.2	15.9	0	0	0	111.4	R65 W818 D878 A879	R65-P775 VanDerWaalsContact CZ-CG 3.49Å; R65-P775 PolarHBondContact NH2-O 3.3Å; P775-W818 HydrophobicContact CB-CB 3.96Å; P775-W818 HydrophobicContact CB-CD2 3.97Å; P775-W818 HydrophobicContact CB-CG 3.66Å; P775-W818 HydrophobicContact CG-CB 4.12Å; P775-W818 HydrophobicContact CG-CD2 3.14Å; P775-W818 HydrophobicContact CG-CE3 3.52Å; P775-W818 HydrophobicContact CG-CG 3.42Å; P775-W818 VanDerWaalsContact CG-CG 3.42Å; P775-W818 HydrophobicContact CG-CH2 4.14Å; P775-W818 HydrophobicContact CG-CZ2 3.85Å; P775-W818 HydrophobicContact CG-CZ3 4Å; P775-D878 VanDerWaalsContact CA-CG 3.46Å; P775-D878 WeakPolarHBondContact CA-OD1 3.39Å; P775-D878 WeakPolarHBondContact CA-OD2 3.32Å; P775-D878 WeakPolarHBondContact CB-OD2 3.35Å; P775-A879 HydrophobicContact CB-CB 3.85Å; P775-A879 HydrophobicContact CG-CB 3.62Å
776	D	67.1	Low	73.2	Confident	34 Å²	34	37.9 Å²	37.9	18%	0.182	21%	0.208	C	C	.	.			trans	-138	6.4	177.7	75.6	-18.8	0	0	0	114.1	K550 P774 K785 D878	K550-D776 WeakPolarHBondContact CD-OD1 3.42Å; K550-D776 WeakPolarHBondContact CE-OD1 3.28Å; K550-D776 HydrophobicContact CG-CB 4.5Å; K550-D776 VanDerWaalsContact CG-OD2 3.3Å; K550-D776 WeakPolarHBondContact CG-OD2 3.43Å; K550-D776 PolarHBondContact N-OD2 2.71Å; K550-D776 IonicContact NZ-OD1 2.77Å; K550-D776 PolarHBondContact NZ-OD1 2.74Å; P774-D776 PolarHBondContact O-N 3Å; D776-K785 WeakPolarHBondContact O-CD 3.22Å; D776-K785 PolarHBondContact O-NZ 3.23Å; D776-K785 WeakPolarHBondContact OD1-CB 3.27Å; D776-D878 PolarHBondContact N-OD1 3.43Å; D776-D878 VanDerWaalsContact N-OD1 3.09Å; D776-D878 PolarHBondContact N-OD2 3.17Å; D776-D878 VanDerWaalsContact N-OD2 3.12Å
777	A	71	Confident	74.2	Confident	10 Å²	10	34.5 Å²	34.5	8%	0.083	20%	0.195	C	C	.	.	S	Bend	trans	-79.4	145.5	170.3	0	0	0	0	0	111.7	K785 A786 D878	A777-K785 HydrophobicContact CB-CB 4.22Å; A777-A786 HydrophobicContact CB-CB 3.9Å; A777-D878 HydrophobicContact CB-CB 3.92Å; A777-D878 VanDerWaalsContact CB-CG 3.43Å; A777-D878 WeakPolarHBondContact CB-OD2 3.41Å; A777-D878 PolarHBondContact N-OD1 2.86Å; A777-D878 PolarHBondContact N-OD2 2.91Å
778	D	69.7	Low	74.9	Confident	70 Å²	70	34.8 Å²	34.8	37%	0.374	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-66.8	127.9	179.7	-59.8	-75.9	0	0	0	111.1	C780 E781 K785	D778-C780 PolarHBondContact O-N 3.07Å; D778-E781 HydrophobicContact CB-CB 4.43Å; D778-E781 PolarHBondContact O-N 3.46Å; D778-K785 IonicContact OD2-NZ 2.78Å
779	P	74.9	Confident	74.9	Confident	84 Å²	84	34.7 Å²	34.7	55%	0.545	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	131.1	-175.8	-25.1	34.4	0	0	0	112.8	E781 C849	P779-E781 VanDerWaalsContact C-N 3.31Å; P779-C849 WeakPolarHBondContact CB-O 3.37Å
780	C	80.8	Confident	74.6	Confident	21 Å²	21	35 Å²	35	14%	0.142	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	15.7	-179.5	-54.3	0	0	0	0	116.3	R159 D778 S820 C849	R159-C780 VanDerWaalsContact CB-SG 3.59Å; R159-C780 VanDerWaalsContact CD-SG 3.57Å; D778-C780 PolarHBondContact O-N 3.07Å; C780-S820 CarbonylContact C-O 3.53Å; C780-S820 VanDerWaalsContact C-O 3.23Å; C780-S820 WeakPolarHBondContact CA-O 3.37Å; C780-S820 PolarHBondContact N-O 2.87Å; C780-C849 WeakPolarHBondContact CA-SG 3.43Å; C780-C849 HydrophobicContact CB-CB 3.89Å; C780-C849 WeakPolarHBondContact CB-SG 3.12Å; C780-C849 WeakPolarHBondContact SG-CB 3.04Å; C780-C849 CovalentContact SG-SG 2.03Å; C780-C849 PolarHBondContact SG-SG 3.03Å
781	E	73.8	Confident	74.1	Confident	124 Å²	124	35.1 Å²	35.1	58%	0.579	20%	0.204	S	C	*	.	S	Bend	trans	-122	148	175.8	-57.1	-160.1	167.7	0	0	112.2	D778 P779 S783 S820	D778-E781 HydrophobicContact CB-CB 4.43Å; D778-E781 PolarHBondContact O-N 3.46Å; P779-E781 VanDerWaalsContact C-N 3.31Å; E781-S783 PolarHBondContact O-N 2.04Å; E781-S783 VanDerWaalsContact O-N 3.13Å; E781-S820 PolarHBondContact N-O 3.22Å
782	A	70.2	Confident	73.4	Confident	38 Å²	38	42.9 Å²	42.9	31%	0.314	24%	0.24	S	C	.	.			trans	-73.7	102.1	168.3	0	0	0	0	0	108.1	W766 W821	W766-A782 VanDerWaalsContact CH2-C 3.46Å; W766-A782 HydrophobicContact CH2-CB 3.95Å; W766-A782 HydrophobicContact CZ3-CB 4.4Å; A782-W821 HydrophobicContact CB-CD2 3.72Å; A782-W821 HydrophobicContact CB-CE3 3.69Å; A782-W821 HydrophobicContact CB-CG 4.1Å; A782-W821 HydrophobicContact CB-CZ3 4.17Å
783	S	67.1	Low	73	Confident	17 Å²	17	45 Å²	45	12%	0.119	25%	0.251	C	S	.	.			trans	-117.5	132.3	-176.7	-175.5	0	0	0	0	112	W766 E781 K785 A786	W766-S783 VanDerWaalsContact CH2-C 3.49Å; W766-S783 WeakPolarHBondContact CZ3-O 3.23Å; E781-S783 PolarHBondContact O-N 2.04Å; E781-S783 VanDerWaalsContact O-N 3.13Å; S783-K785 PolarHBondContact O-N 3.46Å; S783-A786 PolarHBondContact O-N 3.01Å
784	A	66.9	Low	73.6	Confident	38 Å²	38	45.3 Å²	45.3	31%	0.314	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	5.5	175.7	0	0	0	0	0	114.9	Y765	Y765-A784 HydrophobicContact CD1-CB 3.91Å; Y765-A784 HydrophobicContact CG-CB 4.18Å; Y765-A784 CarbonylContact O-C 3.52Å
785	K	70.5	Confident	74.1	Confident	80 Å²	80	51.3 Å²	51.3	35%	0.348	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	6.7	171	-55.9	175.2	-176.3	163.1	0	112.7	K550 D776 A777 D778 S783	K550-K785 PolarHBondContact NZ-O 3.41Å; D776-K785 WeakPolarHBondContact O-CD 3.22Å; D776-K785 PolarHBondContact O-NZ 3.23Å; D776-K785 WeakPolarHBondContact OD1-CB 3.27Å; A777-K785 HydrophobicContact CB-CB 4.22Å; D778-K785 IonicContact OD2-NZ 2.78Å; S783-K785 PolarHBondContact O-N 3.46Å
786	A	82.5	Confident	74	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-133.1	152.9	-179.7	0	0	0	0	0	111.1	Q770 A777 S783 S876 D878	Q770-A786 VanDerWaalsContact CB-C 3.44Å; A777-A786 HydrophobicContact CB-CB 3.9Å; S783-A786 PolarHBondContact O-N 3.01Å; A786-S876 WeakPolarHBondContact CB-OG 3.21Å; A786-D878 HydrophobicContact CB-CB 3.93Å
787	W	89.3	Confident	74	Confident	1 Å²	1	61.7 Å²	61.7	0%	0.004	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-73.1	135.2	177.3	171.1	68	0	0	0	111.2	H757 W766 P768 A771 P789 I802 T870 S876 V877	H757-W787 AromaticContact CE1-CZ2 4Å; H757-W787 AromaticContact CE1-NE1 3.9Å; W766-W787 VanDerWaalsContact O-CD1 3.24Å; P768-W787 VanDerWaalsContact CA-CD1 3.45Å; A771-W787 HydrophobicContact CB-CB 3.83Å; W787-P789 HydrophobicContact CH2-CG 3.67Å; W787-P789 HydrophobicContact CZ2-CB 4.27Å; W787-P789 HydrophobicContact CZ2-CG 3.84Å; W787-P789 HydrophobicContact CZ3-CG 4.1Å; W787-I802 HydrophobicContact CB-CD1 4.46Å; W787-I802 HydrophobicContact CD2-CB 4.12Å; W787-I802 HydrophobicContact CD2-CD1 3.98Å; W787-I802 HydrophobicContact CD2-CG2 4.14Å; W787-I802 HydrophobicContact CE3-CB 4.14Å; W787-I802 HydrophobicContact CE3-CD1 4.43Å; W787-I802 HydrophobicContact CE3-CG2 3.66Å; W787-I802 HydrophobicContact CG-CD1 4Å; W787-I802 HydrophobicContact CH2-CB 3.67Å; W787-I802 HydrophobicContact CH2-CG2 3.61Å; W787-I802 HydrophobicContact CZ2-CB 3.7Å; W787-I802 HydrophobicContact CZ2-CG2 4.13Å; W787-I802 HydrophobicContact CZ3-CB 3.93Å; W787-I802 HydrophobicContact CZ3-CG2 3.38Å; W787-T870 HydrophobicContact CH2-CG2 4.46Å; W787-T870 HydrophobicContact CZ3-CG2 3.97Å; W787-S876 CarbonylContact O-C 2.91Å; W787-S876 VanDerWaalsContact O-CA 3.24Å; W787-S876 WeakPolarHBondContact O-CA 3.28Å; W787-V877 HydrophobicContact CE3-CB 3.96Å; W787-V877 HydrophobicContact CE3-CG2 3.89Å; W787-V877 HydrophobicContact CZ3-CG2 4.09Å; W787-V877 PolarHBondContact N-O 2.88Å; W787-V877 PolarHBondContact O-N 3.48Å
788	L	85.2	Confident	73.9	Confident	21 Å²	21	62.9 Å²	62.9	11%	0.11	36%	0.357	C	S	.	.			trans	-121.1	141.3	161.4	-82.2	171.4	0	0	0	109.2	W766 D790 W821 V875	W766-L788 HydrophobicContact CB-CB 3.89Å; W766-L788 HydrophobicContact CD2-CB 4.27Å; W766-L788 HydrophobicContact CD2-CD1 3.75Å; W766-L788 HydrophobicContact CD2-CG 4.27Å; W766-L788 HydrophobicContact CE3-CB 4.14Å; W766-L788 HydrophobicContact CE3-CD1 3.43Å; W766-L788 VanDerWaalsContact CE3-CD1 3.43Å; W766-L788 HydrophobicContact CE3-CG 3.75Å; W766-L788 HydrophobicContact CG-CB 4.17Å; W766-L788 HydrophobicContact CG-CD1 4.39Å; W766-L788 HydrophobicContact CH2-CD1 4.1Å; W766-L788 HydrophobicContact CZ2-CD1 4.41Å; W766-L788 HydrophobicContact CZ3-CD1 3.57Å; W766-L788 HydrophobicContact CZ3-CG 4.19Å; W766-L788 PolarHBondContact O-N 3.46Å; L788-D790 PolarHBondContact O-N 3.15Å; L788-W821 HydrophobicContact CD1-CE3 4.2Å; L788-W821 HydrophobicContact CD1-CZ3 4.17Å; L788-W821 HydrophobicContact CD2-CE3 4.18Å; L788-W821 HydrophobicContact CD2-CZ3 4.44Å; L788-V875 VanDerWaalsContact CD2-C 3.44Å
789	P	81.6	Confident	74.1	Confident	10 Å²	10	59.8 Å²	59.8	7%	0.065	34%	0.34	C	S	.	.			trans	-52.1	117.6	171.1	-31.4	36.4	0	0	0	114.7	W787 S791 C800 T870 P873	W787-P789 HydrophobicContact CH2-CG 3.67Å; W787-P789 HydrophobicContact CZ2-CB 4.27Å; W787-P789 HydrophobicContact CZ2-CG 3.84Å; W787-P789 HydrophobicContact CZ3-CG 4.1Å; P789-S791 PolarHBondContact O-N 2.9Å; P789-C800 HydrophobicContact CB-CB 4.06Å; P789-C800 HydrophobicContact CG-CB 4.08Å; P789-T870 WeakPolarHBondContact CG-OG1 3.41Å; P789-P873 HydrophobicContact CB-CB 3.99Å; P789-P873 WeakPolarHBondContact CD-O 3.28Å
790	D	70.1	Confident	74.6	Confident	104 Å²	104	55.9 Å²	55.9	56%	0.556	32%	0.315	S	S	*	.	S	Bend	trans	-77.9	62.8	168.7	-161	-2.4	0	0	0	110.9	S762 L788	S762-D790 WeakPolarHBondContact CB-OD2 3.3Å; S762-D790 PolarHBondContact OG-OD2 3.17Å; L788-D790 PolarHBondContact O-N 3.15Å
791	S	69.4	Low	75	Confident	33 Å²	33	55.8 Å²	55.8	23%	0.231	31%	0.314	C	S	.	.			trans	-149.4	137.6	175.1	179.8	0	0	0	0	110.3	P789 N793 P873	P789-S791 PolarHBondContact O-N 2.9Å; S791-N793 VanDerWaalsContact C-N 3.26Å; S791-N793 PolarHBondContact O-N 2.9Å; S791-N793 PolarHBondContact OG-N 3.37Å; S791-N793 PolarHBondContact OG-O 3.39Å; S791-P873 WeakPolarHBondContact O-CB 3.44Å; S791-P873 WeakPolarHBondContact O-CG 3.23Å
792	Q	69.3	Low	75.8	Confident	162 Å²	162	49.9 Å²	49.9	76%	0.757	29%	0.286	S	S	*	.	S	Bend	trans	-78.5	-8.2	173.8	-63.6	-172.5	-0.8	0	0	113.5
793	N	71.9	Confident	76.7	Confident	72 Å²	72	48 Å²	48	39%	0.385	27%	0.271	S	S	.	.			trans	-150.2	133.9	-177.4	-172	-2.8	0	0	0	111.9	S791 D795 S799	S791-N793 VanDerWaalsContact C-N 3.26Å; S791-N793 PolarHBondContact O-N 2.9Å; S791-N793 PolarHBondContact OG-N 3.37Å; S791-N793 PolarHBondContact OG-O 3.39Å; N793-D795 WeakPolarHBondContact OD1-CB 3.1Å; N793-D795 PolarHBondContact OD1-N 3.04Å; N793-S799 WeakPolarHBondContact O-CB 2.92Å; N793-S799 PolarHBondContact O-OG 3.09Å
794	C	78.4	Confident	77.8	Confident	9 Å²	9	47.2 Å²	47.2	6%	0.061	27%	0.265	C	S	.	.	S	Bend	trans	-99.3	5.6	178.3	-52.1	0	0	0	0	114.5	Q796 S799 C800 T872 P873	C794-Q796 VanDerWaalsContact C-N 3.29Å; C794-S799 WeakPolarHBondContact CA-OG 3.48Å; C794-C800 WeakPolarHBondContact CA-SG 3.2Å; C794-C800 HydrophobicContact CB-CB 3.6Å; C794-C800 WeakPolarHBondContact CB-SG 3.14Å; C794-C800 WeakPolarHBondContact SG-CB 3.13Å; C794-C800 CovalentContact SG-SG 2.03Å; C794-C800 PolarHBondContact SG-SG 3.45Å; C794-T872 VanDerWaalsContact SG-CA 3.55Å; C794-P873 VanDerWaalsContact SG-CD 3.51Å
795	D	75	Confident	78.7	Confident	138 Å²	138	45.4 Å²	45.4	74%	0.738	25%	0.25	S	S	*	.	S	Bend	trans	-78.3	-12.1	174.2	-72.1	-27.9	0	0	0	112.8	N793	N793-D795 WeakPolarHBondContact OD1-CB 3.1Å; N793-D795 PolarHBondContact OD1-N 3.04Å
796	Q	70.3	Confident	79.3	Confident	125 Å²	125	41.7 Å²	41.7	58%	0.584	23%	0.234	S	C	*	.	S	Bend	trans	-84.5	136.3	-179.8	-62.2	-172.3	5.9	0	0	111.1	C794 G798 S799	C794-Q796 VanDerWaalsContact C-N 3.29Å; Q796-G798 PolarHBondContact O-N 2.79Å; Q796-S799 PolarHBondContact N-OG 3.43Å; Q796-S799 WeakPolarHBondContact O-CB 3.43Å; Q796-S799 PolarHBondContact O-N 3.44Å; Q796-S799 PolarHBondContact O-OG 3.46Å
797	P	67	Low	78.9	Confident	139 Å²	139	43.5 Å²	43.5	90%	0.903	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	123.9	178.3	-25.6	34.7	0	0	0	112.4	S799	P797-S799 VanDerWaalsContact C-N 3.3Å; P797-S799 PolarHBondContact O-N 3.24Å
798	G	68.5	Low	78.3	Confident	35 Å²	35	44.7 Å²	44.7	36%	0.361	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	-21.1	-178	0	0	0	0	0	114.9	S758 Q796 V801	S758-G798 WeakPolarHBondContact CB-O 3.46Å; S758-G798 VanDerWaalsContact OG-C 3.23Å; S758-G798 PolarHBondContact OG-O 2.83Å; Q796-G798 PolarHBondContact O-N 2.79Å; G798-V801 WeakPolarHBondContact O-CB 3.38Å; G798-V801 WeakPolarHBondContact O-CG2 3.47Å
799	S	73.2	Confident	78.2	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.028	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	147.1	175.1	69	0	0	0	0	111.4	S758 N793 C794 Q796 P797 V801	S758-S799 PolarHBondContact OG-N 2.7Å; N793-S799 WeakPolarHBondContact O-CB 2.92Å; N793-S799 PolarHBondContact O-OG 3.09Å; C794-S799 WeakPolarHBondContact CA-OG 3.48Å; Q796-S799 PolarHBondContact N-OG 3.43Å; Q796-S799 WeakPolarHBondContact O-CB 3.43Å; Q796-S799 PolarHBondContact O-N 3.44Å; Q796-S799 PolarHBondContact O-OG 3.46Å; P797-S799 VanDerWaalsContact C-N 3.3Å; P797-S799 PolarHBondContact O-N 3.24Å; S799-V801 PolarHBondContact O-N 3.5Å
800	C	86.5	Confident	78.3	Confident	2 Å²	2	46 Å²	46	1%	0.014	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	25.6	-178.4	-50.2	0	0	0	0	115.4	P789 C794 T870	P789-C800 HydrophobicContact CB-CB 4.06Å; P789-C800 HydrophobicContact CG-CB 4.08Å; C794-C800 WeakPolarHBondContact CA-SG 3.2Å; C794-C800 HydrophobicContact CB-CB 3.6Å; C794-C800 WeakPolarHBondContact CB-SG 3.14Å; C794-C800 WeakPolarHBondContact SG-CB 3.13Å; C794-C800 CovalentContact SG-SG 2.03Å; C794-C800 PolarHBondContact SG-SG 3.45Å; C800-T870 WeakPolarHBondContact CB-OG1 3.38Å; C800-T870 PolarHBondContact O-N 2.89Å; C800-T870 PolarHBondContact O-OG1 3.45Å
801	V	88.6	Confident	79.1	Confident	19 Å²	19	41.6 Å²	41.6	12%	0.115	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.2	175	-177.8	0	0	0	0	111.7	H757 G798 S799 E867 I868 E869	H757-V801 PolarHBondContact ND1-O 3.25Å; G798-V801 WeakPolarHBondContact O-CB 3.38Å; G798-V801 WeakPolarHBondContact O-CG2 3.47Å; S799-V801 PolarHBondContact O-N 3.5Å; V801-E867 HydrophobicContact CG1-CG 3.52Å; V801-I868 VanDerWaalsContact CA-O 3.3Å; V801-I868 WeakPolarHBondContact CA-O 3.49Å; V801-E869 HydrophobicContact CG2-CB 4.12Å; V801-E869 HydrophobicContact CG2-CG 3.87Å
802	I	89.5	Confident	80	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.5	162.7	-172.3	171.9	0	0	0	109.7	V754 P768 A771 W787 V804 E867 I868	V754-I802 HydrophobicContact CG1-CG1 4.5Å; P768-I802 HydrophobicContact CB-CD1 3.86Å; P768-I802 HydrophobicContact CB-CG1 4.42Å; P768-I802 WeakPolarHBondContact O-CD1 3.29Å; A771-I802 HydrophobicContact CB-CD1 3.77Å; W787-I802 HydrophobicContact CB-CD1 4.46Å; W787-I802 HydrophobicContact CD2-CB 4.12Å; W787-I802 HydrophobicContact CD2-CD1 3.98Å; W787-I802 HydrophobicContact CD2-CG2 4.14Å; W787-I802 HydrophobicContact CE3-CB 4.14Å; W787-I802 HydrophobicContact CE3-CD1 4.43Å; W787-I802 HydrophobicContact CE3-CG2 3.66Å; W787-I802 HydrophobicContact CG-CD1 4Å; W787-I802 HydrophobicContact CH2-CB 3.67Å; W787-I802 HydrophobicContact CH2-CG2 3.61Å; W787-I802 HydrophobicContact CZ2-CB 3.7Å; W787-I802 HydrophobicContact CZ2-CG2 4.13Å; W787-I802 HydrophobicContact CZ3-CB 3.93Å; W787-I802 HydrophobicContact CZ3-CG2 3.38Å; I802-V804 HydrophobicContact CD1-CG1 4.11Å; I802-V804 HydrophobicContact CG1-CG1 4.12Å; I802-E867 WeakPolarHBondContact O-CA 3.42Å; I802-I868 HydrophobicContact CG2-CB 3.95Å; I802-I868 HydrophobicContact CG2-CD1 4.44Å; I802-I868 HydrophobicContact CG2-CG1 4.46Å; I802-I868 PolarHBondContact N-O 2.72Å; I802-I868 PolarHBondContact O-N 3.08Å
803	A	90.6	Very high	80.6	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	117.7	170.6	0	0	0	0	0	110.3	L755 A756 V866 E867	L755-A803 HydrophobicContact CB-CB 4.49Å; L755-A803 PolarHBondContact N-O 3Å; A756-A803 HydrophobicContact CB-CB 4.19Å; A756-A803 PolarHBondContact O-N 2.85Å; A756-A803 VanDerWaalsContact O-N 3.13Å; A803-V866 CarbonylContact C-O 3.55Å; A803-V866 WeakPolarHBondContact CA-O 3.31Å; A803-E867 HydrophobicContact CB-CB 4.29Å; A803-E867 HydrophobicContact CB-CG 4.05Å
804	V	90.3	Very high	81.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	144.4	177.1	-59.4	0	0	0	0	111.8	A751 R753 L772 I802 R865 V866 I880	A751-V804 HydrophobicContact CB-CB 3.77Å; A751-V804 HydrophobicContact CB-CG1 4.17Å; A751-V804 HydrophobicContact CB-CG2 3.8Å; R753-V804 CarbonylContact O-C 3.47Å; R753-V804 WeakPolarHBondContact O-CA 3.22Å; L772-V804 HydrophobicContact CD2-CG1 4.14Å; I802-V804 HydrophobicContact CD1-CG1 4.11Å; I802-V804 HydrophobicContact CG1-CG1 4.12Å; V804-R865 VanDerWaalsContact O-CA 3.31Å; V804-R865 WeakPolarHBondContact O-CA 3.4Å; V804-R865 VanDerWaalsContact O-CB 3.23Å; V804-R865 WeakPolarHBondContact O-CB 3.47Å; V804-V866 HydrophobicContact CG2-CB 4.1Å; V804-V866 PolarHBondContact N-O 2.93Å; V804-V866 PolarHBondContact O-N 2.75Å; V804-I880 HydrophobicContact CB-CD1 4.41Å; V804-I880 HydrophobicContact CG1-CD1 4Å; V804-I880 HydrophobicContact CG2-CB 4.49Å; V804-I880 HydrophobicContact CG2-CD1 3.57Å
805	G	86.2	Confident	81.6	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	161.7	172.1	0	0	0	0	0	112.1	S752 R753	S752-G805 PolarHBondContact N-O 3.28Å; S752-G805 PolarHBondContact OG-O 3.33Å; R753-G805 PolarHBondContact N-O 3.43Å; R753-G805 PolarHBondContact O-N 3.01Å
806	F	82.6	Confident	82.2	Confident	1 Å²	1	24.1 Å²	24.1	0%	0.004	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	159	170.1	-57.3	-70.1	0	0	0	110	Q749 Y750 A751 R753 L815 L863 V866 I880 V882	Q749-F806 HydrophobicContact CG-CB 4.43Å; Q749-F806 HydrophobicContact CG-CD1 3.92Å; Q749-F806 HydrophobicContact CG-CG 4.45Å; Y750-F806 WeakPolarHBondContact O-CD1 3.49Å; A751-F806 HydrophobicContact CB-CE1 4.48Å; R753-F806 PolarHBondContact NE-O 3.37Å; R753-F806 PolarHBondContact NH2-O 2.72Å; F806-L815 HydrophobicContact CZ-CD1 4.43Å; F806-L863 HydrophobicContact CD2-CD2 4.39Å; F806-L863 HydrophobicContact CE2-CD2 3.64Å; F806-L863 HydrophobicContact CE2-CG 4.13Å; F806-L863 HydrophobicContact CZ-CD2 4.4Å; F806-V866 HydrophobicContact CE2-CG2 3.84Å; F806-V866 HydrophobicContact CZ-CG2 4.06Å; F806-I880 HydrophobicContact CE1-CG2 4.38Å; F806-I880 HydrophobicContact CZ-CG2 4.04Å; F806-V882 HydrophobicContact CD1-CG1 3.67Å; F806-V882 HydrophobicContact CD2-CG1 4.13Å; F806-V882 HydrophobicContact CE1-CB 4.02Å; F806-V882 HydrophobicContact CE1-CG1 3.59Å; F806-V882 HydrophobicContact CE2-CB 4.21Å; F806-V882 HydrophobicContact CE2-CG1 4.05Å; F806-V882 HydrophobicContact CG-CG1 3.95Å; F806-V882 HydrophobicContact CZ-CB 3.82Å; F806-V882 HydrophobicContact CZ-CG1 3.79Å
807	D	73.1	Confident	83.2	Confident	38 Å²	38	18.2 Å²	18.2	20%	0.203	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-41.1	177.1	-74	-21.6	0	0	0	111	N59 S752	N59-D807 PolarHBondContact ND2-OD2 3.35Å; S752-D807 VanDerWaalsContact CB-OD1 3.28Å; S752-D807 WeakPolarHBondContact CB-OD1 3.42Å; S752-D807 WeakPolarHBondContact CB-OD2 3.32Å; S752-D807 PolarHBondContact OG-N 3.24Å; S752-D807 PolarHBondContact OG-OD1 3.42Å; S752-D807 PolarHBondContact OG-OD2 2.81Å
808	V	76.3	Confident	84.3	Confident	26 Å²	26	12.7 Å²	12.7	16%	0.158	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	111.7	-177.7	-176.9	0	0	0	0	110.7	D738 F747 Q749 V810 P890	D738-V808 HydrophobicContact CB-CG2 3.55Å; D738-V808 WeakPolarHBondContact OD2-CG2 3.09Å; F747-V808 HydrophobicContact CD1-CG1 4.47Å; F747-V808 HydrophobicContact CE1-CB 3.58Å; F747-V808 HydrophobicContact CE1-CG1 3.65Å; F747-V808 HydrophobicContact CE1-CG2 4.46Å; F747-V808 HydrophobicContact CZ-CB 3.66Å; F747-V808 HydrophobicContact CZ-CG1 4.11Å; F747-V808 HydrophobicContact CZ-CG2 4.1Å; Q749-V808 PolarHBondContact NE2-O 3.34Å; Q749-V808 VanDerWaalsContact OE1-N 3.08Å; Q749-V808 PolarHBondContact OE1-O 3.15Å; V808-V810 HydrophobicContact CG1-CG1 4Å; V808-V810 PolarHBondContact O-N 2.76Å; V808-P890 HydrophobicContact CG1-CG 4.21Å
809	V	84.2	Confident	85.3	Confident	57 Å²	57	11.2 Å²	11.2	35%	0.345	6%	0.063	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	115.4	-178.8	-169.5	0	0	0	0	110.1	A835 L863 L864	V809-A835 HydrophobicContact CG1-CB 4.14Å; V809-L863 VanDerWaalsContact CG1-O 3.26Å; V809-L863 WeakPolarHBondContact CG1-O 3.4Å; V809-L864 HydrophobicContact CG2-CD1 3.85Å
810	V	82.8	Confident	85.9	Confident	2 Å²	2	11.2 Å²	11.2	1%	0.012	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	157.6	-177.7	-70.7	0	0	0	0	113.8	F747 V808 P812 S862 L863	F747-V810 HydrophobicContact CD1-CB 4.1Å; F747-V810 HydrophobicContact CD1-CG1 3.43Å; F747-V810 VanDerWaalsContact CD1-CG1 3.43Å; F747-V810 HydrophobicContact CD1-CG2 3.72Å; F747-V810 HydrophobicContact CE1-CB 4.42Å; F747-V810 HydrophobicContact CE1-CG1 3.69Å; F747-V810 HydrophobicContact CE1-CG2 3.9Å; V808-V810 HydrophobicContact CG1-CG1 4Å; V808-V810 PolarHBondContact O-N 2.76Å; V810-P812 VanDerWaalsContact O-CD 3.26Å; V810-P812 WeakPolarHBondContact O-CD 3.12Å; V810-S862 CarbonylContact O-C 3.5Å; V810-S862 WeakPolarHBondContact O-CA 3.1Å; V810-L863 PolarHBondContact O-N 2.99Å
811	V	88.4	Confident	85.9	Confident	11 Å²	11	14.1 Å²	14.1	7%	0.067	7%	0.074	C	C	.	.			trans	-70.2	110.9	172	-175.7	0	0	0	0	109.1	T859 D860 S884 R885	V811-T859 WeakPolarHBondContact CG1-O 3.39Å; V811-D860 WeakPolarHBondContact CG2-O 3.43Å; V811-S884 CarbonylContact O-C 3.57Å; V811-S884 VanDerWaalsContact O-CA 3.26Å; V811-S884 WeakPolarHBondContact O-CA 3.46Å; V811-R885 HydrophobicContact CG1-CG 4.18Å; V811-R885 PolarHBondContact O-N 3.08Å
812	P	87.2	Confident	85.7	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	148	-176.5	35	-36.9	0	0	0	110.8	V810 Y834 L857 T859 K861 L863 V882	V810-P812 VanDerWaalsContact O-CD 3.26Å; V810-P812 WeakPolarHBondContact O-CD 3.12Å; P812-Y834 HydrophobicContact CG-CE1 4.31Å; P812-L857 HydrophobicContact CB-CB 4.49Å; P812-L857 HydrophobicContact CB-CD1 3.81Å; P812-L857 HydrophobicContact CG-CB 4.32Å; P812-L857 HydrophobicContact CG-CD1 3.8Å; P812-T859 HydrophobicContact CG-CG2 3.6Å; P812-K861 VanDerWaalsContact CD-O 3.23Å; P812-K861 WeakPolarHBondContact CD-O 3.37Å; P812-L863 HydrophobicContact CG-CB 4.04Å; P812-V882 HydrophobicContact CB-CG2 3.63Å
813	A	82.5	Confident	85.5	Confident	16 Å²	16	15.2 Å²	15.2	13%	0.132	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-33.3	165.1	0	0	0	0	0	111.2	L856 L857 I883 S884 R885	A813-L856 WeakPolarHBondContact O-CD2 3.39Å; A813-L857 PolarHBondContact O-N 3.35Å; A813-I883 PolarHBondContact N-O 2.89Å; A813-S884 WeakPolarHBondContact CB-O 3.48Å; A813-R885 HydrophobicContact CB-CG 4.04Å
814	E	83.3	Confident	84.9	Confident	6 Å²	6	16.1 Å²	16.1	3%	0.028	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	142.2	178.4	-172	-177.1	170.5	0	0	110	Q187 R816 L855 I883	Q187-E814 PolarHBondContact NE2-OE1 3Å; E814-R816 VanDerWaalsContact CD-NH2 3.27Å; E814-R816 HydrophobicContact CG-CG 4.45Å; E814-R816 IonicContact OE1-CZ 3.17Å; E814-R816 IonicContact OE1-NE 2.69Å; E814-R816 PolarHBondContact OE1-NE 2.71Å; E814-R816 IonicContact OE1-NH2 3.26Å; E814-R816 PolarHBondContact OE1-NH2 3.05Å; E814-R816 IonicContact OE2-CZ 2.85Å; E814-R816 IonicContact OE2-NE 3.02Å; E814-R816 IonicContact OE2-NH2 2.78Å; E814-R816 PolarHBondContact OE2-NH2 3.45Å; E814-L855 CarbonylContact C-O 3.58Å; E814-L855 WeakPolarHBondContact CA-O 3.49Å; E814-I883 HydrophobicContact CB-CB 4.17Å; E814-I883 HydrophobicContact CB-CD1 4.32Å; E814-I883 HydrophobicContact CG-CD1 4.48Å; E814-I883 PolarHBondContact N-O 3.3Å; E814-I883 VanDerWaalsContact N-O 3.08Å; E814-I883 PolarHBondContact O-N 3.24Å
815	L	87.8	Confident	84.2	Confident	2 Å²	2	19.6 Å²	19.6	1%	0.01	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	139.9	169.4	-171.9	80.6	0	0	0	108.7	F806 L830 L832 L855 L857 L863 V866 I880 Q881 V882	F806-L815 HydrophobicContact CZ-CD1 4.43Å; L815-L830 HydrophobicContact CD2-CD2 3.98Å; L815-L832 HydrophobicContact CD2-CD2 3.85Å; L815-L855 HydrophobicContact CB-CB 4.48Å; L815-L855 PolarHBondContact N-O 2.83Å; L815-L855 PolarHBondContact O-N 3.48Å; L815-L857 HydrophobicContact CB-CD1 3.92Å; L815-L863 HydrophobicContact CD1-CD2 4.31Å; L815-V866 HydrophobicContact CD1-CG2 4.21Å; L815-I880 HydrophobicContact CD1-CG2 4.1Å; L815-Q881 CarbonylContact C-O 3.46Å; L815-Q881 WeakPolarHBondContact CA-O 3.41Å; L815-Q881 WeakPolarHBondContact CD1-O 3.2Å; L815-V882 HydrophobicContact CD1-CB 4.23Å
816	R	87.7	Confident	83.9	Confident	23 Å²	23	19.8 Å²	19.8	9%	0.087	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	144.6	173.3	-60.3	180	-179	157.3	4	111.3	E814 W818 P852 F853 I880 Q881	E814-R816 VanDerWaalsContact CD-NH2 3.27Å; E814-R816 HydrophobicContact CG-CG 4.45Å; E814-R816 IonicContact OE1-CZ 3.17Å; E814-R816 IonicContact OE1-NE 2.69Å; E814-R816 PolarHBondContact OE1-NE 2.71Å; E814-R816 IonicContact OE1-NH2 3.26Å; E814-R816 PolarHBondContact OE1-NH2 3.05Å; E814-R816 IonicContact OE2-CZ 2.85Å; E814-R816 IonicContact OE2-NE 3.02Å; E814-R816 IonicContact OE2-NH2 2.78Å; E814-R816 PolarHBondContact OE2-NH2 3.45Å; R816-W818 HydrophobicContact CB-CE3 4.3Å; R816-W818 HydrophobicContact CB-CH2 3.53Å; R816-W818 HydrophobicContact CB-CZ2 4.31Å; R816-W818 HydrophobicContact CB-CZ3 3.52Å; R816-W818 HydrophobicContact CG-CH2 4.38Å; R816-P852 HydrophobicContact CB-CB 4.24Å; R816-F853 CarbonylContact C-O 3.55Å; R816-F853 VanDerWaalsContact CA-O 3.28Å; R816-F853 WeakPolarHBondContact CA-O 3.35Å; R816-I880 CarbonylContact O-C 3.56Å; R816-I880 WeakPolarHBondContact O-CA 3.38Å; R816-Q881 HydrophobicContact CB-CB 4.23Å; R816-Q881 PolarHBondContact N-O 2.62Å; R816-Q881 PolarHBondContact O-N 3.43Å
817	L	90.4	Very high	84	Confident	2 Å²	2	20 Å²	20	1%	0.01	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	130.2	-176.5	171.8	64.6	0	0	0	109.2	I819 L827 P852 F853 I868 V877 I880	L817-I819 HydrophobicContact CD1-CG1 4.5Å; L817-I819 HydrophobicContact CD2-CD1 4.03Å; L817-I819 HydrophobicContact CD2-CG1 4.26Å; L817-I819 HydrophobicContact CG-CD1 4.29Å; L817-I819 HydrophobicContact CG-CG1 3.97Å; L817-L827 HydrophobicContact CD2-CD1 3.75Å; L817-L827 HydrophobicContact CD2-CD2 4.06Å; L817-L827 HydrophobicContact CD2-CG 4.5Å; L817-P852 CarbonylContact O-C 3.58Å; L817-P852 WeakPolarHBondContact O-CA 3.23Å; L817-F853 HydrophobicContact CB-CB 4.34Å; L817-F853 HydrophobicContact CB-CD1 4.13Å; L817-F853 HydrophobicContact CD2-CD1 4.2Å; L817-F853 PolarHBondContact N-O 2.86Å; L817-F853 PolarHBondContact O-N 2.79Å; L817-I868 HydrophobicContact CD1-CD1 3.66Å; L817-I868 HydrophobicContact CD2-CD1 4.35Å; L817-V877 HydrophobicContact CD1-CG1 3.56Å; L817-I880 HydrophobicContact CD1-CD1 4.34Å; L817-I880 HydrophobicContact CD1-CG1 3.54Å
818	W	89.7	Confident	84.5	Confident	22 Å²	22	21.4 Å²	21.4	8%	0.083	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.9	177.7	-71.2	-100.9	0	0	0	109.7	R65 Y750 P775 R816 P852 D878 A879 Q881	R65-W818 VanDerWaalsContact NH1-NE1 3.11Å; Y750-W818 HydrophobicContact CE1-CH2 4.15Å; Y750-W818 HydrophobicContact CE1-CZ3 4.06Å; P775-W818 HydrophobicContact CB-CB 3.96Å; P775-W818 HydrophobicContact CB-CD2 3.97Å; P775-W818 HydrophobicContact CB-CG 3.66Å; P775-W818 HydrophobicContact CG-CB 4.12Å; P775-W818 HydrophobicContact CG-CD2 3.14Å; P775-W818 HydrophobicContact CG-CE3 3.52Å; P775-W818 HydrophobicContact CG-CG 3.42Å; P775-W818 VanDerWaalsContact CG-CG 3.42Å; P775-W818 HydrophobicContact CG-CH2 4.14Å; P775-W818 HydrophobicContact CG-CZ2 3.85Å; P775-W818 HydrophobicContact CG-CZ3 4Å; R816-W818 HydrophobicContact CB-CE3 4.3Å; R816-W818 HydrophobicContact CB-CH2 3.53Å; R816-W818 HydrophobicContact CB-CZ2 4.31Å; R816-W818 HydrophobicContact CB-CZ3 3.52Å; R816-W818 HydrophobicContact CG-CH2 4.38Å; W818-P852 HydrophobicContact CD2-CB 3.86Å; W818-P852 VanDerWaalsContact CE2-CB 3.43Å; W818-P852 HydrophobicContact CE3-CB 4.48Å; W818-P852 HydrophobicContact CG-CB 4.29Å; W818-P852 HydrophobicContact CH2-CB 4.39Å; W818-P852 HydrophobicContact CZ2-CB 3.72Å; W818-P852 HydrophobicContact CZ2-CG 3.87Å; W818-D878 HydrophobicContact CB-CB 4.13Å; W818-D878 PolarHBondContact O-N 3.37Å; W818-A879 HydrophobicContact CE3-CB 4.18Å; W818-A879 PolarHBondContact N-O 2.91Å; W818-Q881 HydrophobicContact CH2-CB 3.97Å; W818-Q881 HydrophobicContact CZ3-CB 3.7Å
819	I	90.2	Very high	85	Confident	5 Å²	5	22.9 Å²	22.9	3%	0.026	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	98.4	179.8	-52.4	-174.6	0	0	0	107.2	L817 W821 A823 L827 A847 C849 V875 S876	L817-I819 HydrophobicContact CD1-CG1 4.5Å; L817-I819 HydrophobicContact CD2-CD1 4.03Å; L817-I819 HydrophobicContact CD2-CG1 4.26Å; L817-I819 HydrophobicContact CG-CD1 4.29Å; L817-I819 HydrophobicContact CG-CG1 3.97Å; I819-W821 VanDerWaalsContact C-N 3.31Å; I819-W821 PolarHBondContact O-N 2.98Å; I819-A823 HydrophobicContact CB-CB 4.05Å; I819-A823 HydrophobicContact CG2-CB 3.91Å; I819-L827 HydrophobicContact CD1-CD1 3.82Å; I819-L827 HydrophobicContact CD1-CD2 3.58Å; I819-L827 HydrophobicContact CD1-CG 3.52Å; I819-A847 HydrophobicContact CD1-CB 3.79Å; I819-A847 HydrophobicContact CG1-CB 4.47Å; I819-C849 VanDerWaalsContact O-CA 3.3Å; I819-C849 WeakPolarHBondContact O-CA 3.44Å; I819-C849 WeakPolarHBondContact O-CB 3.44Å; I819-V875 HydrophobicContact CG2-CG1 3.73Å; I819-S876 CarbonylContact C-O 3.52Å; I819-S876 WeakPolarHBondContact CA-O 3.26Å; I819-S876 WeakPolarHBondContact CG2-O 3.38Å
820	S	86.5	Confident	85.1	Confident	4 Å²	4	20.5 Å²	20.5	3%	0.028	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	-24.6	-173.4	46.7	0	0	0	0	112.7	C780 E781 S876	C780-S820 CarbonylContact C-O 3.53Å; C780-S820 VanDerWaalsContact C-O 3.23Å; C780-S820 WeakPolarHBondContact CA-O 3.37Å; C780-S820 PolarHBondContact N-O 2.87Å; E781-S820 PolarHBondContact N-O 3.22Å; S820-S876 PolarHBondContact N-O 2.76Å; S820-S876 WeakPolarHBondContact OG-CB 3.24Å; S820-S876 PolarHBondContact OG-OG 2.79Å; S820-S876 VanDerWaalsContact OG-OG 3.1Å
821	W	85.4	Confident	85.5	Confident	62 Å²	62	21.7 Å²	21.7	24%	0.235	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	146.6	-176.1	-170.2	52.7	0	0	0	114.2	A782 L788 I819 A823 F874 S876	A782-W821 HydrophobicContact CB-CD2 3.72Å; A782-W821 HydrophobicContact CB-CE3 3.69Å; A782-W821 HydrophobicContact CB-CG 4.1Å; A782-W821 HydrophobicContact CB-CZ3 4.17Å; L788-W821 HydrophobicContact CD1-CE3 4.2Å; L788-W821 HydrophobicContact CD1-CZ3 4.17Å; L788-W821 HydrophobicContact CD2-CE3 4.18Å; L788-W821 HydrophobicContact CD2-CZ3 4.44Å; I819-W821 VanDerWaalsContact C-N 3.31Å; I819-W821 PolarHBondContact O-N 2.98Å; W821-A823 VanDerWaalsContact C-N 3.29Å; W821-A823 PolarHBondContact O-N 3.13Å; W821-F874 HydrophobicContact CE3-CB 4.33Å; W821-F874 HydrophobicContact CH2-CB 3.9Å; W821-F874 HydrophobicContact CH2-CD1 4.05Å; W821-F874 HydrophobicContact CH2-CG 4.33Å; W821-F874 HydrophobicContact CZ3-CB 3.66Å; W821-F874 HydrophobicContact CZ3-CD1 4.09Å; W821-F874 HydrophobicContact CZ3-CG 4.35Å; W821-F874 WeakPolarHBondContact CZ3-O 3.34Å; W821-S876 PolarHBondContact O-N 3.28Å; W821-S876 VanDerWaalsContact O-N 3.07Å
822	N	85	Confident	85.7	Confident	42 Å²	42	21.1 Å²	21.1	23%	0.225	11%	0.106	C	C	.	.	S	Bend	trans	47.8	45.2	-170.9	-66.1	-70.4	0	0	0	113.5	G826 F874 V875	N822-G826 WeakPolarHBondContact O-CA 3.38Å; N822-F874 WeakPolarHBondContact CB-O 3.31Å; N822-F874 VanDerWaalsContact ND2-CB 3.34Å; N822-F874 WeakPolarHBondContact ND2-CB 3.36Å; N822-F874 PolarHBondContact ND2-O 2.87Å; N822-V875 HydrophobicContact CB-CG2 4.21Å
823	A	85.8	Confident	86	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.116	C	C	.	.			trans	-69.7	-33.3	-175	0	0	0	0	0	114	I819 W821 D825 G826 A847 C849	I819-A823 HydrophobicContact CB-CB 4.05Å; I819-A823 HydrophobicContact CG2-CB 3.91Å; W821-A823 VanDerWaalsContact C-N 3.29Å; W821-A823 PolarHBondContact O-N 3.13Å; A823-D825 PolarHBondContact O-N 3.05Å; A823-G826 PolarHBondContact O-N 2.86Å; A823-A847 CarbonylContact C-O 3.57Å; A823-A847 HydrophobicContact CB-CB 4.01Å; A823-A847 WeakPolarHBondContact O-CB 3.33Å; A823-A847 PolarHBondContact O-N 3.22Å; A823-C849 HydrophobicContact CB-CB 3.96Å
824	A	78.1	Confident	86.5	Confident	19 Å²	19	23.2 Å²	23.2	16%	0.157	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	116	-178.3	0	0	0	0	0	110.9	R157 E158 G826 A847	R157-A824 HydrophobicContact CB-CB 3.46Å; R157-A824 VanDerWaalsContact CB-CB 3.46Å; E158-A824 HydrophobicContact CB-CB 4.41Å; E158-A824 HydrophobicContact CG-CB 3.49Å; E158-A824 VanDerWaalsContact CG-CB 3.49Å; A824-G826 PolarHBondContact O-N 3.13Å; A824-G826 VanDerWaalsContact O-N 3.11Å; A824-A847 PolarHBondContact N-O 3.38Å
825	D	75.8	Confident	86.8	Confident	73 Å²	73	26 Å²	26	39%	0.39	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	21.4	-177.8	-45.9	-35	0	0	0	113.1	R157 A823 T846	R157-D825 IonicContact CZ-OD2 2.82Å; R157-D825 IonicContact NH1-OD2 3.72Å; R157-D825 PolarHBondContact NH1-OD2 3.42Å; A823-D825 PolarHBondContact O-N 3.05Å; D825-T846 PolarHBondContact OD1-OG1 2.97Å
826	G	79.8	Confident	86.9	Confident	4 Å²	4	30.5 Å²	30.5	4%	0.041	16%	0.158	C	C	.	.			trans	-81.6	-21.7	-177.2	0	0	0	0	0	115	N822 A823 A824 Q871	N822-G826 WeakPolarHBondContact O-CA 3.38Å; A823-G826 PolarHBondContact O-N 2.86Å; A824-G826 PolarHBondContact O-N 3.13Å; A824-G826 VanDerWaalsContact O-N 3.11Å; G826-Q871 WeakPolarHBondContact O-CB 3.34Å; G826-Q871 PolarHBondContact O-N 2.76Å
827	L	84.5	Confident	86.8	Confident	6 Å²	6	32.4 Å²	32.4	3%	0.031	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.3	173.2	-67.5	178.8	0	0	0	110.7	L817 I819 F853 I868	L817-L827 HydrophobicContact CD2-CD1 3.75Å; L817-L827 HydrophobicContact CD2-CD2 4.06Å; L817-L827 HydrophobicContact CD2-CG 4.5Å; I819-L827 HydrophobicContact CD1-CD1 3.82Å; I819-L827 HydrophobicContact CD1-CD2 3.58Å; I819-L827 HydrophobicContact CD1-CG 3.52Å; L827-F853 HydrophobicContact CD1-CD1 4.47Å; L827-I868 HydrophobicContact CD2-CG2 3.73Å
828	K	83.9	Confident	86.8	Confident	67 Å²	67	34 Å²	34	29%	0.291	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	-46.2	174.6	178.8	171.7	166.5	-164.7	0	111	P844 E869 Q871	K828-P844 WeakPolarHBondContact O-CG 3.47Å; K828-E869 HydrophobicContact CB-CB 4.49Å; K828-E869 HydrophobicContact CB-CG 4.28Å; K828-E869 WeakPolarHBondContact CB-O 3.35Å; K828-E869 HydrophobicContact CD-CG 3.97Å; K828-E869 WeakPolarHBondContact CE-OE1 3.49Å; K828-E869 HydrophobicContact CG-CG 4.38Å; K828-E869 PolarHBondContact N-O 3.39Å; K828-E869 IonicContact NZ-OE1 3.66Å; K828-E869 PolarHBondContact NZ-OE1 3.44Å; K828-Q871 HydrophobicContact CB-CB 4.24Å
829	Q	85.4	Confident	86.7	Confident	58 Å²	58	36.5 Å²	36.5	27%	0.271	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	159.5	168.5	53.3	175.6	-1	0	0	112	L841 E869	Q829-L841 HydrophobicContact CB-CD1 3.7Å; Q829-L841 HydrophobicContact CG-CD1 4.49Å; Q829-L841 VanDerWaalsContact OE1-CD1 3.29Å; Q829-E869 HydrophobicContact CG-CB 3.8Å; Q829-E869 VanDerWaalsContact CG-OE2 3.27Å; Q829-E869 WeakPolarHBondContact CG-OE2 3.46Å; Q829-E869 PolarHBondContact N-O 3.03Å; Q829-E869 PolarHBondContact NE2-OE2 3.44Å; Q829-E869 PolarHBondContact O-N 3.37Å
830	L	87.9	Confident	86.5	Confident	6 Å²	6	39.9 Å²	39.9	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	119.5	177.2	174.1	73.8	0	0	0	108.7	L815 L832 V842 F853 V866 I868	L815-L830 HydrophobicContact CD2-CD2 3.98Å; L830-L832 HydrophobicContact CG-CD2 4.28Å; L830-V842 HydrophobicContact CB-CB 4.1Å; L830-V842 HydrophobicContact CD2-CB 4.15Å; L830-V842 HydrophobicContact CD2-CG1 4.34Å; L830-V842 HydrophobicContact CD2-CG2 4.26Å; L830-V842 HydrophobicContact CG-CB 4.36Å; L830-V842 PolarHBondContact N-O 2.99Å; L830-V842 PolarHBondContact O-N 3.47Å; L830-F853 HydrophobicContact CD2-CE1 4.14Å; L830-V866 HydrophobicContact CD1-CG1 3.4Å; L830-V866 HydrophobicContact CG-CG1 4.48Å; L830-I868 HydrophobicContact CD1-CG1 3.78Å
831	L	90.3	Very high	86.4	Confident	27 Å²	27	44.3 Å²	44.3	14%	0.141	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	120.6	-174.6	-70.1	161.4	0	0	0	110.1	Y833 V839 L841 E867	L831-Y833 HydrophobicContact CB-CD2 4.48Å; L831-Y833 HydrophobicContact CB-CE2 3.74Å; L831-V839 HydrophobicContact CB-CG1 4.38Å; L831-V839 HydrophobicContact CD2-CG1 3.95Å; L831-L841 HydrophobicContact CD2-CB 4.19Å; L831-L841 HydrophobicContact CD2-CD1 3.85Å; L831-L841 HydrophobicContact CG-CD1 4.39Å; L831-E867 HydrophobicContact CB-CB 4.18Å; L831-E867 PolarHBondContact N-O 3.4Å; L831-E867 PolarHBondContact O-N 3.32Å
832	L	92.1	Very high	85.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118.8	179.1	-51.4	-178.2	0	0	0	109.2	L815 L830 Y834 V839 Q840 V842 L857 L863 V866	L815-L832 HydrophobicContact CD2-CD2 3.85Å; L830-L832 HydrophobicContact CG-CD2 4.28Å; L832-Y834 HydrophobicContact CB-CE2 4.34Å; L832-V839 CarbonylContact O-C 3.59Å; L832-V839 VanDerWaalsContact O-CA 3.32Å; L832-V839 WeakPolarHBondContact O-CA 3.47Å; L832-Q840 HydrophobicContact CB-CB 4.31Å; L832-Q840 PolarHBondContact N-O 2.96Å; L832-Q840 PolarHBondContact O-N 3.29Å; L832-V842 HydrophobicContact CD1-CG2 3.91Å; L832-V842 HydrophobicContact CG-CG2 4.14Å; L832-L857 HydrophobicContact CD1-CD1 4Å; L832-L857 HydrophobicContact CD1-CD2 3.63Å; L832-L863 HydrophobicContact CB-CD1 3.82Å; L832-L863 HydrophobicContact CD2-CD1 4.45Å; L832-V866 HydrophobicContact CD2-CG1 4.2Å; L832-V866 HydrophobicContact CD2-CG2 3.83Å
833	Y	93.2	Very high	84.9	Confident	53 Å²	53	43.6 Å²	43.6	21%	0.208	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.6	179.7	-69.3	-101	0	0	0	110	L831 V839 L864 R865 E867	L831-Y833 HydrophobicContact CB-CD2 4.48Å; L831-Y833 HydrophobicContact CB-CE2 3.74Å; Y833-V839 HydrophobicContact CD1-CG1 4.33Å; Y833-V839 HydrophobicContact CD1-CG2 3.53Å; Y833-V839 HydrophobicContact CD2-CG1 4.5Å; Y833-V839 HydrophobicContact CE1-CB 4.46Å; Y833-V839 HydrophobicContact CE1-CG1 4.07Å; Y833-V839 HydrophobicContact CE1-CG2 3.5Å; Y833-V839 VanDerWaalsContact CE1-CG2 3.5Å; Y833-V839 HydrophobicContact CE2-CG1 4.24Å; Y833-V839 HydrophobicContact CG-CG2 4.31Å; Y833-L864 WeakPolarHBondContact O-CB 3.37Å; Y833-L864 PolarHBondContact O-N 3Å; Y833-R865 HydrophobicContact CD2-CG 3.9Å; Y833-R865 VanDerWaalsContact CE2-NH2 3.28Å; Y833-R865 HydrophobicContact CG-CG 3.83Å; Y833-R865 PolarHBondContact N-O 3.44Å; Y833-R865 PolarHBondContact O-N 3.05Å; Y833-R865 PolarHBondContact OH-NH2 2.96Å; Y833-E867 HydrophobicContact CD2-CB 4.43Å; Y833-E867 HydrophobicContact CE2-CB 3.78Å
834	Y	93.8	Very high	83.7	Confident	6 Å²	6	47.6 Å²	47.6	2%	0.024	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	157.4	179.9	-64.8	-73	0	0	0	112.4	P812 L832 D836 G837 S838 Q840 T859 K861 S862 L863	P812-Y834 HydrophobicContact CG-CE1 4.31Å; L832-Y834 HydrophobicContact CB-CE2 4.34Å; Y834-D836 VanDerWaalsContact CB-OD1 3.26Å; Y834-D836 WeakPolarHBondContact CB-OD1 3.25Å; Y834-D836 PolarHBondContact O-N 3.39Å; Y834-G837 PolarHBondContact O-N 3.05Å; Y834-S838 PolarHBondContact N-O 2.68Å; Y834-Q840 HydrophobicContact CE2-CB 3.77Å; Y834-Q840 PolarHBondContact OH-OE1 3.47Å; Y834-T859 HydrophobicContact CE1-CG2 3.86Å; Y834-K861 HydrophobicContact CD1-CB 3.49Å; Y834-K861 VanDerWaalsContact CD1-CB 3.49Å; Y834-K861 WeakPolarHBondContact CD1-O 3.48Å; Y834-K861 HydrophobicContact CD2-CB 4.49Å; Y834-K861 HydrophobicContact CD2-CD 4.18Å; Y834-K861 HydrophobicContact CE1-CB 4.09Å; Y834-K861 HydrophobicContact CG-CB 3.74Å; Y834-K861 HydrophobicContact CG-CD 4.1Å; Y834-S862 CarbonylContact C-O 3.54Å; Y834-S862 WeakPolarHBondContact CA-O 3.28Å; Y834-L863 HydrophobicContact CD1-CB 4.44Å; Y834-L863 HydrophobicContact CD1-CD1 4.36Å; Y834-L863 HydrophobicContact CE1-CB 4.34Å; Y834-L863 HydrophobicContact CE1-CD1 4.09Å
835	A	88.5	Confident	83.1	Confident	64 Å²	64	47.5 Å²	47.5	53%	0.529	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-18.8	-179.6	0	0	0	0	0	114.2	V809 G837 S862	V809-A835 HydrophobicContact CG1-CB 4.14Å; A835-G837 PolarHBondContact O-N 2.81Å; A835-S862 PolarHBondContact N-O 2.92Å
836	D	89.9	Confident	83.2	Confident	97 Å²	97	45.2 Å²	45.2	52%	0.519	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	1.4	173.1	75.7	-24.3	0	0	0	113.5	Y834 S838 K861	Y834-D836 VanDerWaalsContact CB-OD1 3.26Å; Y834-D836 WeakPolarHBondContact CB-OD1 3.25Å; Y834-D836 PolarHBondContact O-N 3.39Å; D836-S838 VanDerWaalsContact C-N 3.3Å; D836-S838 VanDerWaalsContact CG-OG 3.29Å; D836-S838 VanDerWaalsContact OD1-CB 3.26Å; D836-S838 WeakPolarHBondContact OD1-CB 3.27Å; D836-S838 PolarHBondContact OD1-N 2.8Å; D836-S838 PolarHBondContact OD1-OG 2.99Å; D836-S838 PolarHBondContact OD2-OG 3.08Å; D836-K861 IonicContact OD1-NZ 2.71Å; D836-K861 WeakPolarHBondContact OD2-CD 3.24Å; D836-K861 WeakPolarHBondContact OD2-CE 3.07Å; D836-K861 IonicContact OD2-NZ 3.73Å; D836-K861 PolarHBondContact OD2-NZ 2.97Å
837	G	86.9	Confident	83.4	Confident	64 Å²	64	45 Å²	45	66%	0.66	27%	0.27	S	S	*	.	S	Bend	trans	82.6	-0.4	-176.4	0	0	0	0	0	114.5	Y834 A835	Y834-G837 PolarHBondContact O-N 3.05Å; A835-G837 PolarHBondContact O-N 2.81Å
838	S	89.8	Confident	83.4	Confident	35 Å²	35	45 Å²	45	25%	0.245	27%	0.27	C	S	.	.			trans	-77.5	151.3	174.1	70.3	0	0	0	0	112	Y834 D836 K861	Y834-S838 PolarHBondContact N-O 2.68Å; D836-S838 VanDerWaalsContact C-N 3.3Å; D836-S838 VanDerWaalsContact CG-OG 3.29Å; D836-S838 VanDerWaalsContact OD1-CB 3.26Å; D836-S838 WeakPolarHBondContact OD1-CB 3.27Å; D836-S838 PolarHBondContact OD1-N 2.8Å; D836-S838 PolarHBondContact OD1-OG 2.99Å; D836-S838 PolarHBondContact OD2-OG 3.08Å; S838-K861 WeakPolarHBondContact OG-CD 3.36Å; S838-K861 PolarHBondContact OG-NZ 2.8Å
839	V	88.6	Confident	83.6	Confident	74 Å²	74	42.2 Å²	42.2	45%	0.448	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.5	-179.3	-171.9	0	0	0	0	109.1	L831 L832 Y833	L831-V839 HydrophobicContact CB-CG1 4.38Å; L831-V839 HydrophobicContact CD2-CG1 3.95Å; L832-V839 CarbonylContact O-C 3.59Å; L832-V839 VanDerWaalsContact O-CA 3.32Å; L832-V839 WeakPolarHBondContact O-CA 3.47Å; Y833-V839 HydrophobicContact CD1-CG1 4.33Å; Y833-V839 HydrophobicContact CD1-CG2 3.53Å; Y833-V839 HydrophobicContact CD2-CG1 4.5Å; Y833-V839 HydrophobicContact CE1-CB 4.46Å; Y833-V839 HydrophobicContact CE1-CG1 4.07Å; Y833-V839 HydrophobicContact CE1-CG2 3.5Å; Y833-V839 VanDerWaalsContact CE1-CG2 3.5Å; Y833-V839 HydrophobicContact CE2-CG1 4.24Å; Y833-V839 HydrophobicContact CG-CG2 4.31Å
840	Q	85.5	Confident	83.4	Confident	76 Å²	76	42.5 Å²	42.5	36%	0.355	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.8	173.4	174.2	176.6	-13.4	0	0	109.8	L832 Y834	L832-Q840 HydrophobicContact CB-CB 4.31Å; L832-Q840 PolarHBondContact N-O 2.96Å; L832-Q840 PolarHBondContact O-N 3.29Å; Y834-Q840 HydrophobicContact CE2-CB 3.77Å; Y834-Q840 PolarHBondContact OH-OE1 3.47Å
841	L	84	Confident	83.1	Confident	98 Å²	98	43.3 Å²	43.3	51%	0.513	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.5	169	175.4	62.1	0	0	0	109.6	Q829 L831	Q829-L841 HydrophobicContact CB-CD1 3.7Å; Q829-L841 HydrophobicContact CG-CD1 4.49Å; Q829-L841 VanDerWaalsContact OE1-CD1 3.29Å; L831-L841 HydrophobicContact CD2-CB 4.19Å; L831-L841 HydrophobicContact CD2-CD1 3.85Å; L831-L841 HydrophobicContact CG-CD1 4.39Å
842	V	75.3	Confident	82.9	Confident	15 Å²	15	42.7 Å²	42.7	9%	0.091	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	124.1	165.7	-177.6	0	0	0	0	107.3	L830 L832 V845 L855	L830-V842 HydrophobicContact CB-CB 4.1Å; L830-V842 HydrophobicContact CD2-CB 4.15Å; L830-V842 HydrophobicContact CD2-CG1 4.34Å; L830-V842 HydrophobicContact CD2-CG2 4.26Å; L830-V842 HydrophobicContact CG-CB 4.36Å; L830-V842 PolarHBondContact N-O 2.99Å; L830-V842 PolarHBondContact O-N 3.47Å; L832-V842 HydrophobicContact CD1-CG2 3.91Å; L832-V842 HydrophobicContact CG-CG2 4.14Å; V842-V845 HydrophobicContact CG1-CG2 4.4Å; V842-L855 HydrophobicContact CB-CD2 4.49Å; V842-L855 HydrophobicContact CG1-CD2 3.96Å; V842-L855 HydrophobicContact CG2-CD2 3.74Å
843	S	62.8	Low	82.7	Confident	73 Å²	73	42.8 Å²	42.8	51%	0.51	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-57.6	156.9	-179.4	-64.3	0	0	0	0	111.8	V845	S843-V845 WeakPolarHBondContact O-CG2 3.24Å; S843-V845 PolarHBondContact O-N 2.85Å
844	P	61.4	Low	82.3	Confident	85 Å²	85	40.3 Å²	40.3	55%	0.552	26%	0.255	S	S	*	.	P	Polyproline II helix	trans	-50.6	136.5	175.6	-18.5	23.8	0	0	0	111.4	K828	K828-P844 WeakPolarHBondContact O-CG 3.47Å
845	V	66.7	Low	81.7	Confident	17 Å²	17	40.7 Å²	40.7	10%	0.103	26%	0.257	C	S	.	.			trans	-130.4	134.1	-179.1	-156.4	0	0	0	0	110	V842 S843 A847 F853	V842-V845 HydrophobicContact CG1-CG2 4.4Å; S843-V845 WeakPolarHBondContact O-CG2 3.24Å; S843-V845 PolarHBondContact O-N 2.85Å; V845-A847 PolarHBondContact O-N 3.05Å; V845-F853 HydrophobicContact CB-CD2 4.48Å; V845-F853 HydrophobicContact CB-CE2 4.05Å; V845-F853 HydrophobicContact CB-CZ 4.24Å; V845-F853 HydrophobicContact CG1-CD2 4.12Å; V845-F853 HydrophobicContact CG1-CE2 3.66Å; V845-F853 HydrophobicContact CG1-CZ 4.28Å; V845-F853 HydrophobicContact CG2-CE1 4.43Å; V845-F853 HydrophobicContact CG2-CE2 4.03Å; V845-F853 HydrophobicContact CG2-CZ 3.77Å
846	T	76.4	Confident	81.2	Confident	24 Å²	24	40.1 Å²	40.1	15%	0.147	25%	0.245	C	C	.	.			trans	-64	114.5	166.1	-52.4	0	0	0	0	108.3	G123 D825	G123-T846 CarbonylContact C-O 3.59Å; G123-T846 VanDerWaalsContact C-O 3.26Å; G123-T846 WeakPolarHBondContact CA-O 3.39Å; D825-T846 PolarHBondContact OD1-OG1 2.97Å
847	A	83.9	Confident	80.7	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.008	22%	0.222	C	C	.	.			trans	-95.4	160.9	170.1	0	0	0	0	0	110.3	I819 A823 A824 V845 F853	I819-A847 HydrophobicContact CD1-CB 3.79Å; I819-A847 HydrophobicContact CG1-CB 4.47Å; A823-A847 CarbonylContact C-O 3.57Å; A823-A847 HydrophobicContact CB-CB 4.01Å; A823-A847 WeakPolarHBondContact O-CB 3.33Å; A823-A847 PolarHBondContact O-N 3.22Å; A824-A847 PolarHBondContact N-O 3.38Å; V845-A847 PolarHBondContact O-N 3.05Å; A847-F853 HydrophobicContact CB-CB 4.34Å
848	L	85.7	Confident	80	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.021	23%	0.225	C	C	.	.			trans	-116.1	142.5	172.1	-63	170.3	0	0	0	107.6	R157 E158 A161 Y184 D850 M851	R157-L848 WeakPolarHBondContact O-CD2 2.99Å; E158-L848 CarbonylContact O-C 3.55Å; E158-L848 VanDerWaalsContact O-CA 3.27Å; E158-L848 WeakPolarHBondContact O-CA 3.37Å; A161-L848 HydrophobicContact CB-CD1 3.55Å; A161-L848 HydrophobicContact CB-CD2 4.38Å; Y184-L848 HydrophobicContact CE1-CD1 3.91Å; L848-D850 WeakPolarHBondContact CB-OD1 3.26Å; L848-M851 HydrophobicContact CB-CG 4Å; L848-M851 HydrophobicContact CD1-CE 3.88Å; L848-M851 HydrophobicContact CD1-CG 4.21Å; L848-M851 HydrophobicContact CD1-SD 3.87Å
849	C	87.5	Confident	79.4	Confident	9 Å²	9	38.1 Å²	38.1	6%	0.061	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-13.2	-177.4	54	0	0	0	0	113.5	E158 P779 C780 I819 A823	E158-C849 PolarHBondContact O-N 2.74Å; E158-C849 PolarHBondContact O-SG 2.84Å; P779-C849 WeakPolarHBondContact CB-O 3.37Å; C780-C849 WeakPolarHBondContact CA-SG 3.43Å; C780-C849 HydrophobicContact CB-CB 3.89Å; C780-C849 WeakPolarHBondContact CB-SG 3.12Å; C780-C849 WeakPolarHBondContact SG-CB 3.04Å; C780-C849 CovalentContact SG-SG 2.03Å; C780-C849 PolarHBondContact SG-SG 3.03Å; I819-C849 VanDerWaalsContact O-CA 3.3Å; I819-C849 WeakPolarHBondContact O-CA 3.44Å; I819-C849 WeakPolarHBondContact O-CB 3.44Å; A823-C849 HydrophobicContact CB-CB 3.96Å
850	D	80.4	Confident	79.2	Confident	65 Å²	65	40.7 Å²	40.7	35%	0.348	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	0.6	178.6	60.7	-9.4	0	0	0	114.1	R159 G160 L848	R159-D850 HydrophobicContact CB-CB 4.23Å; G160-D850 PolarHBondContact N-OD2 2.87Å; L848-D850 WeakPolarHBondContact CB-OD1 3.26Å
851	M	82.5	Confident	79.4	Confident	22 Å²	22	40.3 Å²	40.3	11%	0.108	23%	0.225	C	C	.	.	S	Bend	trans	-158.9	152.3	177	63.6	-175.9	80.8	0	0	112.7	Y184 A186 L848 F853	Y184-M851 HydrophobicContact CD1-CE 4.2Å; Y184-M851 HydrophobicContact CD2-SD 4.33Å; Y184-M851 HydrophobicContact CE1-CE 3.87Å; Y184-M851 HydrophobicContact CE1-SD 3.8Å; Y184-M851 HydrophobicContact CE2-CE 4.38Å; Y184-M851 HydrophobicContact CE2-SD 3.6Å; Y184-M851 VanDerWaalsContact CE2-SD 3.6Å; Y184-M851 WeakPolarHBondContact O-CE 3.12Å; Y184-M851 PolarHBondContact OH-SD 2.86Å; A186-M851 HydrophobicContact CB-SD 4.16Å; L848-M851 HydrophobicContact CB-CG 4Å; L848-M851 HydrophobicContact CD1-CE 3.88Å; L848-M851 HydrophobicContact CD1-CG 4.21Å; L848-M851 HydrophobicContact CD1-SD 3.87Å; M851-F853 PolarHBondContact O-N 3.13Å
852	P	86.3	Confident	79.7	Confident	15 Å²	15	37.6 Å²	37.6	10%	0.097	21%	0.214	C	C	.	.			trans	-61	130	177.2	17.5	-26.8	0	0	0	112.7	G122 R816 L817 W818 S854	G122-P852 VanDerWaalsContact CA-O 3.28Å; G122-P852 WeakPolarHBondContact CA-O 3.31Å; R816-P852 HydrophobicContact CB-CB 4.24Å; L817-P852 CarbonylContact O-C 3.58Å; L817-P852 WeakPolarHBondContact O-CA 3.23Å; W818-P852 HydrophobicContact CD2-CB 3.86Å; W818-P852 VanDerWaalsContact CE2-CB 3.43Å; W818-P852 HydrophobicContact CE3-CB 4.48Å; W818-P852 HydrophobicContact CG-CB 4.29Å; W818-P852 HydrophobicContact CH2-CB 4.39Å; W818-P852 HydrophobicContact CZ2-CB 3.72Å; W818-P852 HydrophobicContact CZ2-CG 3.87Å; P852-S854 PolarHBondContact O-N 3.31Å; P852-S854 PolarHBondContact O-OG 3.45Å; P852-S854 VanDerWaalsContact O-OG 3.08Å
853	F	87.4	Confident	80.4	Confident	2 Å²	2	37 Å²	37	1%	0.009	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	127.9	155.4	170	-120.2	0	0	0	108.2	G122 R816 L817 L827 L830 V845 A847 M851 L855	G122-F853 WeakPolarHBondContact O-CD2 3.48Å; R816-F853 CarbonylContact C-O 3.55Å; R816-F853 VanDerWaalsContact CA-O 3.28Å; R816-F853 WeakPolarHBondContact CA-O 3.35Å; L817-F853 HydrophobicContact CB-CB 4.34Å; L817-F853 HydrophobicContact CB-CD1 4.13Å; L817-F853 HydrophobicContact CD2-CD1 4.2Å; L817-F853 PolarHBondContact N-O 2.86Å; L817-F853 PolarHBondContact O-N 2.79Å; L827-F853 HydrophobicContact CD1-CD1 4.47Å; L830-F853 HydrophobicContact CD2-CE1 4.14Å; V845-F853 HydrophobicContact CB-CD2 4.48Å; V845-F853 HydrophobicContact CB-CE2 4.05Å; V845-F853 HydrophobicContact CB-CZ 4.24Å; V845-F853 HydrophobicContact CG1-CD2 4.12Å; V845-F853 HydrophobicContact CG1-CE2 3.66Å; V845-F853 HydrophobicContact CG1-CZ 4.28Å; V845-F853 HydrophobicContact CG2-CE1 4.43Å; V845-F853 HydrophobicContact CG2-CE2 4.03Å; V845-F853 HydrophobicContact CG2-CZ 3.77Å; A847-F853 HydrophobicContact CB-CB 4.34Å; M851-F853 PolarHBondContact O-N 3.13Å; F853-L855 HydrophobicContact CE1-CB 4.22Å; F853-L855 HydrophobicContact CZ-CB 3.92Å; F853-L855 HydrophobicContact CZ-CD1 4.48Å
854	S	85	Confident	81.6	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.007	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	140.5	-177.4	-5.5	0	0	0	0	110.2	G122 P852	G122-S854 PolarHBondContact N-OG 3.26Å; G122-S854 PolarHBondContact O-N 2.88Å; P852-S854 PolarHBondContact O-N 3.31Å; P852-S854 PolarHBondContact O-OG 3.45Å; P852-S854 VanDerWaalsContact O-OG 3.08Å
855	L	80.7	Confident	83.1	Confident	14 Å²	14	35.1 Å²	35.1	7%	0.073	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	111.5	-176.9	178.4	67.5	0	0	0	110.5	E814 L815 V842 F853 L857	E814-L855 CarbonylContact C-O 3.58Å; E814-L855 WeakPolarHBondContact CA-O 3.49Å; L815-L855 HydrophobicContact CB-CB 4.48Å; L815-L855 PolarHBondContact N-O 2.83Å; L815-L855 PolarHBondContact O-N 3.48Å; V842-L855 HydrophobicContact CB-CD2 4.49Å; V842-L855 HydrophobicContact CG1-CD2 3.96Å; V842-L855 HydrophobicContact CG2-CD2 3.74Å; F853-L855 HydrophobicContact CE1-CB 4.22Å; F853-L855 HydrophobicContact CZ-CB 3.92Å; F853-L855 HydrophobicContact CZ-CD1 4.48Å; L855-L857 HydrophobicContact CD2-CD2 3.72Å; L855-L857 HydrophobicContact CD2-CG 4.32Å; L855-L857 HydrophobicContact CG-CD2 3.99Å; L855-L857 HydrophobicContact CG-CG 4.27Å
856	L	78.9	Confident	84.3	Confident	51 Å²	51	34.3 Å²	34.3	27%	0.267	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	131.1	164.1	-90.1	160.6	0	0	0	110.7	Y81 E121 M252 A813	Y81-L856 HydrophobicContact CD2-CD1 3.75Å; Y81-L856 HydrophobicContact CE1-CB 4.26Å; Y81-L856 HydrophobicContact CE2-CB 3.95Å; Y81-L856 HydrophobicContact CE2-CD1 3.59Å; Y81-L856 HydrophobicContact CE2-CG 4.37Å; Y81-L856 HydrophobicContact CG-CD1 4.48Å; E121-L856 WeakPolarHBondContact OE1-CD1 3.48Å; E121-L856 WeakPolarHBondContact OE1-CG 3.29Å; E121-L856 PolarHBondContact OE1-N 2.77Å; M252-L856 HydrophobicContact CE-CD1 3.75Å; A813-L856 WeakPolarHBondContact O-CD2 3.39Å
857	L	78.3	Confident	85.1	Confident	8 Å²	8	35 Å²	35	4%	0.042	18%	0.183	C	C	.	.			trans	-117.2	109.5	-176.7	-71.2	173.4	0	0	0	110.9	P812 A813 L815 L832 L855 T859	P812-L857 HydrophobicContact CB-CB 4.49Å; P812-L857 HydrophobicContact CB-CD1 3.81Å; P812-L857 HydrophobicContact CG-CB 4.32Å; P812-L857 HydrophobicContact CG-CD1 3.8Å; A813-L857 PolarHBondContact O-N 3.35Å; L815-L857 HydrophobicContact CB-CD1 3.92Å; L832-L857 HydrophobicContact CD1-CD1 4Å; L832-L857 HydrophobicContact CD1-CD2 3.63Å; L855-L857 HydrophobicContact CD2-CD2 3.72Å; L855-L857 HydrophobicContact CD2-CG 4.32Å; L855-L857 HydrophobicContact CG-CD2 3.99Å; L855-L857 HydrophobicContact CG-CG 4.27Å; L857-T859 HydrophobicContact CB-CG2 4.44Å; L857-T859 PolarHBondContact O-N 2.67Å
858	D	72.7	Confident	85.4	Confident	134 Å²	134	35 Å²	35	72%	0.717	18%	0.183	S	C	*	.			trans	-92.8	81.6	171.9	-165.4	14.6	0	0	0	110.8	R885	D858-R885 IonicContact OD1-CZ 3.44Å; D858-R885 IonicContact OD1-NH2 2.66Å; D858-R885 PolarHBondContact OD1-NH2 2.73Å
859	T	78.1	Confident	85.6	Confident	12 Å²	12	36 Å²	36	7%	0.074	19%	0.187	C	C	.	.			trans	-136.5	147.3	176.3	-176.6	0	0	0	0	110.7	V811 P812 Y834 L857 K861 R885	V811-T859 WeakPolarHBondContact CG1-O 3.39Å; P812-T859 HydrophobicContact CG-CG2 3.6Å; Y834-T859 HydrophobicContact CE1-CG2 3.86Å; L857-T859 HydrophobicContact CB-CG2 4.44Å; L857-T859 PolarHBondContact O-N 2.67Å; T859-K861 WeakPolarHBondContact OG1-CB 3.37Å; T859-K861 PolarHBondContact OG1-N 2.72Å; T859-K861 VanDerWaalsContact OG1-N 3.15Å; T859-R885 PolarHBondContact O-NE 2.76Å; T859-R885 PolarHBondContact O-NH2 3.08Å
860	D	83.7	Confident	85.6	Confident	128 Å²	128	35.5 Å²	35.5	68%	0.684	18%	0.184	S	C	*	.	S	Bend	trans	-92.6	-2.9	170.1	63	-23.5	0	0	0	112.7	V811	V811-D860 WeakPolarHBondContact CG2-O 3.43Å
861	K	89.2	Confident	85.8	Confident	69 Å²	69	37.2 Å²	37.2	30%	0.3	19%	0.19	S	C	.	.	S	Bend	trans	-93.9	140.5	-173	-50.1	-177	179.1	-151.7	0	112.6	P812 Y834 D836 S838 T859	P812-K861 VanDerWaalsContact CD-O 3.23Å; P812-K861 WeakPolarHBondContact CD-O 3.37Å; Y834-K861 HydrophobicContact CD1-CB 3.49Å; Y834-K861 VanDerWaalsContact CD1-CB 3.49Å; Y834-K861 WeakPolarHBondContact CD1-O 3.48Å; Y834-K861 HydrophobicContact CD2-CB 4.49Å; Y834-K861 HydrophobicContact CD2-CD 4.18Å; Y834-K861 HydrophobicContact CE1-CB 4.09Å; Y834-K861 HydrophobicContact CG-CB 3.74Å; Y834-K861 HydrophobicContact CG-CD 4.1Å; D836-K861 IonicContact OD1-NZ 2.71Å; D836-K861 WeakPolarHBondContact OD2-CD 3.24Å; D836-K861 WeakPolarHBondContact OD2-CE 3.07Å; D836-K861 IonicContact OD2-NZ 3.73Å; D836-K861 PolarHBondContact OD2-NZ 2.97Å; S838-K861 WeakPolarHBondContact OG-CD 3.36Å; S838-K861 PolarHBondContact OG-NZ 2.8Å; T859-K861 WeakPolarHBondContact OG1-CB 3.37Å; T859-K861 PolarHBondContact OG1-N 2.72Å; T859-K861 VanDerWaalsContact OG1-N 3.15Å
862	S	90.3	Very high	85.9	Confident	40 Å²	40	38.7 Å²	38.7	28%	0.28	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-77.6	127.1	179.1	-43.6	0	0	0	0	112.2	V810 Y834 A835	V810-S862 CarbonylContact O-C 3.5Å; V810-S862 WeakPolarHBondContact O-CA 3.1Å; Y834-S862 CarbonylContact C-O 3.54Å; Y834-S862 WeakPolarHBondContact CA-O 3.28Å; A835-S862 PolarHBondContact N-O 2.92Å
863	L	89.7	Confident	85.7	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	125.1	-177.2	-175.5	68.7	0	0	0	111	F806 V809 V810 P812 L815 L832 Y834 V866 V882	F806-L863 HydrophobicContact CD2-CD2 4.39Å; F806-L863 HydrophobicContact CE2-CD2 3.64Å; F806-L863 HydrophobicContact CE2-CG 4.13Å; F806-L863 HydrophobicContact CZ-CD2 4.4Å; V809-L863 VanDerWaalsContact CG1-O 3.26Å; V809-L863 WeakPolarHBondContact CG1-O 3.4Å; V810-L863 PolarHBondContact O-N 2.99Å; P812-L863 HydrophobicContact CG-CB 4.04Å; L815-L863 HydrophobicContact CD1-CD2 4.31Å; L832-L863 HydrophobicContact CB-CD1 3.82Å; L832-L863 HydrophobicContact CD2-CD1 4.45Å; Y834-L863 HydrophobicContact CD1-CB 4.44Å; Y834-L863 HydrophobicContact CD1-CD1 4.36Å; Y834-L863 HydrophobicContact CE1-CB 4.34Å; Y834-L863 HydrophobicContact CE1-CD1 4.09Å; L863-V866 HydrophobicContact CD1-CG2 4.5Å; L863-V866 HydrophobicContact CD2-CG2 4.01Å; L863-V882 HydrophobicContact CD2-CB 4.43Å; L863-V882 HydrophobicContact CD2-CG2 3.9Å
864	L	89.8	Confident	85.6	Confident	69 Å²	69	42.4 Å²	42.4	36%	0.361	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-47.8	-177.4	-179.7	66.9	0	0	0	112.4	V809 Y833	V809-L864 HydrophobicContact CG2-CD1 3.85Å; Y833-L864 WeakPolarHBondContact O-CB 3.37Å; Y833-L864 PolarHBondContact O-N 3Å
865	R	92.3	Very high	85.7	Confident	50 Å²	50	42.3 Å²	42.3	19%	0.189	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	158.5	-178.3	66.8	174.4	-163.5	124.5	15.7	112.2	L755 V804 Y833 E867	L755-R865 HydrophobicContact CD1-CB 3.48Å; L755-R865 VanDerWaalsContact CD1-CB 3.48Å; L755-R865 HydrophobicContact CD1-CG 4.15Å; V804-R865 VanDerWaalsContact O-CA 3.31Å; V804-R865 WeakPolarHBondContact O-CA 3.4Å; V804-R865 VanDerWaalsContact O-CB 3.23Å; V804-R865 WeakPolarHBondContact O-CB 3.47Å; Y833-R865 HydrophobicContact CD2-CG 3.9Å; Y833-R865 VanDerWaalsContact CE2-NH2 3.28Å; Y833-R865 HydrophobicContact CG-CG 3.83Å; Y833-R865 PolarHBondContact N-O 3.44Å; Y833-R865 PolarHBondContact O-N 3.05Å; Y833-R865 PolarHBondContact OH-NH2 2.96Å; R865-E867 IonicContact CZ-OE2 3.52Å; R865-E867 IonicContact NH1-OE2 3.44Å; R865-E867 PolarHBondContact NH1-OE2 3.23Å; R865-E867 IonicContact NH2-OE2 3.81Å; R865-E867 PolarHBondContact NH2-OE2 2.98Å
866	V	92.4	Very high	86.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.2	175.2	176.4	0	0	0	0	108.4	A803 V804 F806 L815 L830 L832 L863 I868	A803-V866 CarbonylContact C-O 3.55Å; A803-V866 WeakPolarHBondContact CA-O 3.31Å; V804-V866 HydrophobicContact CG2-CB 4.1Å; V804-V866 PolarHBondContact N-O 2.93Å; V804-V866 PolarHBondContact O-N 2.75Å; F806-V866 HydrophobicContact CE2-CG2 3.84Å; F806-V866 HydrophobicContact CZ-CG2 4.06Å; L815-V866 HydrophobicContact CD1-CG2 4.21Å; L830-V866 HydrophobicContact CD1-CG1 3.4Å; L830-V866 HydrophobicContact CG-CG1 4.48Å; L832-V866 HydrophobicContact CD2-CG1 4.2Å; L832-V866 HydrophobicContact CD2-CG2 3.83Å; L863-V866 HydrophobicContact CD1-CG2 4.5Å; L863-V866 HydrophobicContact CD2-CG2 4.01Å; V866-I868 HydrophobicContact CG1-CG1 4.08Å
867	E	91.9	Very high	86.7	Confident	39 Å²	39	39.2 Å²	39.2	18%	0.182	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	124.7	175.7	-169.3	170.8	115.7	0	0	108.7	V801 I802 A803 L831 Y833 R865	V801-E867 HydrophobicContact CG1-CG 3.52Å; I802-E867 WeakPolarHBondContact O-CA 3.42Å; A803-E867 HydrophobicContact CB-CB 4.29Å; A803-E867 HydrophobicContact CB-CG 4.05Å; L831-E867 HydrophobicContact CB-CB 4.18Å; L831-E867 PolarHBondContact N-O 3.4Å; L831-E867 PolarHBondContact O-N 3.32Å; Y833-E867 HydrophobicContact CD2-CB 4.43Å; Y833-E867 HydrophobicContact CE2-CB 3.78Å; R865-E867 IonicContact CZ-OE2 3.52Å; R865-E867 IonicContact NH1-OE2 3.44Å; R865-E867 PolarHBondContact NH1-OE2 3.23Å; R865-E867 IonicContact NH2-OE2 3.81Å; R865-E867 PolarHBondContact NH2-OE2 2.98Å
868	I	90.7	Very high	87.2	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.6	-175.3	-54.7	179.9	0	0	0	107.7	V801 I802 L817 L827 L830 V866 T870 V877 I880	V801-I868 VanDerWaalsContact CA-O 3.3Å; V801-I868 WeakPolarHBondContact CA-O 3.49Å; I802-I868 HydrophobicContact CG2-CB 3.95Å; I802-I868 HydrophobicContact CG2-CD1 4.44Å; I802-I868 HydrophobicContact CG2-CG1 4.46Å; I802-I868 PolarHBondContact N-O 2.72Å; I802-I868 PolarHBondContact O-N 3.08Å; L817-I868 HydrophobicContact CD1-CD1 3.66Å; L817-I868 HydrophobicContact CD2-CD1 4.35Å; L827-I868 HydrophobicContact CD2-CG2 3.73Å; L830-I868 HydrophobicContact CD1-CG1 3.78Å; V866-I868 HydrophobicContact CG1-CG1 4.08Å; I868-T870 HydrophobicContact CG2-CG2 4.35Å; I868-V877 HydrophobicContact CD1-CG1 4.22Å; I868-I880 HydrophobicContact CD1-CD1 3.46Å; I868-I880 VanDerWaalsContact CD1-CD1 3.46Å; I868-I880 HydrophobicContact CD1-CG1 3.85Å
869	E	88.9	Confident	87.8	Confident	24 Å²	24	32.7 Å²	32.7	11%	0.112	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.4	169.1	-169.8	179.2	-173.8	0	0	109.4	V801 K828 Q829	V801-E869 HydrophobicContact CG2-CB 4.12Å; V801-E869 HydrophobicContact CG2-CG 3.87Å; K828-E869 HydrophobicContact CB-CB 4.49Å; K828-E869 HydrophobicContact CB-CG 4.28Å; K828-E869 WeakPolarHBondContact CB-O 3.35Å; K828-E869 HydrophobicContact CD-CG 3.97Å; K828-E869 WeakPolarHBondContact CE-OE1 3.49Å; K828-E869 HydrophobicContact CG-CG 4.38Å; K828-E869 PolarHBondContact N-O 3.39Å; K828-E869 IonicContact NZ-OE1 3.66Å; K828-E869 PolarHBondContact NZ-OE1 3.44Å; Q829-E869 HydrophobicContact CG-CB 3.8Å; Q829-E869 VanDerWaalsContact CG-OE2 3.27Å; Q829-E869 WeakPolarHBondContact CG-OE2 3.46Å; Q829-E869 PolarHBondContact N-O 3.03Å; Q829-E869 PolarHBondContact NE2-OE2 3.44Å; Q829-E869 PolarHBondContact O-N 3.37Å
870	T	89	Confident	88.4	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	150.5	-179.5	55	0	0	0	0	111.6	W787 P789 C800 I868 T872 V875	W787-T870 HydrophobicContact CH2-CG2 4.46Å; W787-T870 HydrophobicContact CZ3-CG2 3.97Å; P789-T870 WeakPolarHBondContact CG-OG1 3.41Å; C800-T870 WeakPolarHBondContact CB-OG1 3.38Å; C800-T870 PolarHBondContact O-N 2.89Å; C800-T870 PolarHBondContact O-OG1 3.45Å; I868-T870 HydrophobicContact CG2-CG2 4.35Å; T870-T872 PolarHBondContact OG1-O 3.07Å; T870-V875 HydrophobicContact CG2-CB 3.78Å; T870-V875 HydrophobicContact CG2-CG1 3.76Å
871	Q	84.5	Confident	88.6	Confident	100 Å²	100	26.4 Å²	26.4	47%	0.467	13%	0.131	S	C	.	.	S	Bend	trans	-78.9	-23.7	-174.3	-174.2	55.7	60.2	0	0	112.9	G826 K828	G826-Q871 WeakPolarHBondContact O-CB 3.34Å; G826-Q871 PolarHBondContact O-N 2.76Å; K828-Q871 HydrophobicContact CB-CB 4.24Å
872	T	84.5	Confident	88.4	Confident	54 Å²	54	23.1 Å²	23.1	33%	0.331	12%	0.117	S	C	.	.	S	Bend	trans	-148.4	159.4	177.2	80.3	0	0	0	0	108.8	C794 T870 F874 V875	C794-T872 VanDerWaalsContact SG-CA 3.55Å; T870-T872 PolarHBondContact OG1-O 3.07Å; T872-F874 PolarHBondContact O-N 3.19Å; T872-F874 VanDerWaalsContact O-N 3.08Å; T872-F874 PolarHBondContact OG1-N 3.46Å; T872-V875 WeakPolarHBondContact O-CG2 3.38Å; T872-V875 PolarHBondContact O-N 2.74Å
873	P	82.2	Confident	87.9	Confident	19 Å²	19	21.8 Å²	21.8	12%	0.123	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	3.1	-177.8	33	-35.8	0	0	0	113.7	P789 S791 C794	P789-P873 HydrophobicContact CB-CB 3.99Å; P789-P873 WeakPolarHBondContact CD-O 3.28Å; S791-P873 WeakPolarHBondContact O-CB 3.44Å; S791-P873 WeakPolarHBondContact O-CG 3.23Å; C794-P873 VanDerWaalsContact SG-CD 3.51Å
874	F	84.8	Confident	87.6	Confident	75 Å²	75	21.7 Å²	21.7	33%	0.329	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	10.5	-178.9	-54	-69.5	0	0	0	112.5	W821 N822 T872 W1578	W821-F874 HydrophobicContact CE3-CB 4.33Å; W821-F874 HydrophobicContact CH2-CB 3.9Å; W821-F874 HydrophobicContact CH2-CD1 4.05Å; W821-F874 HydrophobicContact CH2-CG 4.33Å; W821-F874 HydrophobicContact CZ3-CB 3.66Å; W821-F874 HydrophobicContact CZ3-CD1 4.09Å; W821-F874 HydrophobicContact CZ3-CG 4.35Å; W821-F874 WeakPolarHBondContact CZ3-O 3.34Å; N822-F874 WeakPolarHBondContact CB-O 3.31Å; N822-F874 VanDerWaalsContact ND2-CB 3.34Å; N822-F874 WeakPolarHBondContact ND2-CB 3.36Å; N822-F874 PolarHBondContact ND2-O 2.87Å; T872-F874 PolarHBondContact O-N 3.19Å; T872-F874 VanDerWaalsContact O-N 3.08Å; T872-F874 PolarHBondContact OG1-N 3.46Å; F874-W1578 HydrophobicContact CE1-CH2 4.37Å
875	V	87.8	Confident	86.9	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.104	C	C	.	.			trans	-93.3	109.8	-178.2	-179.4	0	0	0	0	109.6	L788 I819 N822 T870 T872	L788-V875 VanDerWaalsContact CD2-C 3.44Å; I819-V875 HydrophobicContact CG2-CG1 3.73Å; N822-V875 HydrophobicContact CB-CG2 4.21Å; T870-V875 HydrophobicContact CG2-CB 3.78Å; T870-V875 HydrophobicContact CG2-CG1 3.76Å; T872-V875 WeakPolarHBondContact O-CG2 3.38Å; T872-V875 PolarHBondContact O-N 2.74Å
876	S	89.6	Confident	85.8	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	121.6	-171.4	-169	0	0	0	0	111.5	A786 W787 I819 S820 W821	A786-S876 WeakPolarHBondContact CB-OG 3.21Å; W787-S876 CarbonylContact O-C 2.91Å; W787-S876 VanDerWaalsContact O-CA 3.24Å; W787-S876 WeakPolarHBondContact O-CA 3.28Å; I819-S876 CarbonylContact C-O 3.52Å; I819-S876 WeakPolarHBondContact CA-O 3.26Å; I819-S876 WeakPolarHBondContact CG2-O 3.38Å; S820-S876 PolarHBondContact N-O 2.76Å; S820-S876 WeakPolarHBondContact OG-CB 3.24Å; S820-S876 PolarHBondContact OG-OG 2.79Å; S820-S876 VanDerWaalsContact OG-OG 3.1Å; W821-S876 PolarHBondContact O-N 3.28Å; W821-S876 VanDerWaalsContact O-N 3.07Å
877	V	90.4	Very high	84.5	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	117	-179.9	-177.3	0	0	0	0	110.3	A771 W787 L817 I868 I880	A771-V877 HydrophobicContact CB-CG1 4.37Å; W787-V877 HydrophobicContact CE3-CB 3.96Å; W787-V877 HydrophobicContact CE3-CG2 3.89Å; W787-V877 HydrophobicContact CZ3-CG2 4.09Å; W787-V877 PolarHBondContact N-O 2.88Å; W787-V877 PolarHBondContact O-N 3.48Å; L817-V877 HydrophobicContact CD1-CG1 3.56Å; I868-V877 HydrophobicContact CD1-CG1 4.22Å; V877-I880 HydrophobicContact CG1-CD1 4.3Å
878	D	88.1	Confident	83.4	Confident	5 Å²	5	27.1 Å²	27.1	3%	0.027	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-42.5	-175.1	177.6	12.5	0	0	0	112.3	K550 A771 P775 D776 A777 A786 W818	K550-D878 PolarHBondContact NZ-O 3.33Å; K550-D878 VanDerWaalsContact NZ-O 3.15Å; K550-D878 IonicContact NZ-OD1 3.68Å; K550-D878 PolarHBondContact NZ-OD1 2.85Å; A771-D878 CarbonylContact C-O 3.55Å; A771-D878 WeakPolarHBondContact CA-O 3.48Å; P775-D878 VanDerWaalsContact CA-CG 3.46Å; P775-D878 WeakPolarHBondContact CA-OD1 3.39Å; P775-D878 WeakPolarHBondContact CA-OD2 3.32Å; P775-D878 WeakPolarHBondContact CB-OD2 3.35Å; D776-D878 PolarHBondContact N-OD1 3.43Å; D776-D878 VanDerWaalsContact N-OD1 3.09Å; D776-D878 PolarHBondContact N-OD2 3.17Å; D776-D878 VanDerWaalsContact N-OD2 3.12Å; A777-D878 HydrophobicContact CB-CB 3.92Å; A777-D878 VanDerWaalsContact CB-CG 3.43Å; A777-D878 WeakPolarHBondContact CB-OD2 3.41Å; A777-D878 PolarHBondContact N-OD1 2.86Å; A777-D878 PolarHBondContact N-OD2 2.91Å; A786-D878 HydrophobicContact CB-CB 3.93Å; W818-D878 HydrophobicContact CB-CB 4.13Å; W818-D878 PolarHBondContact O-N 3.37Å
879	A	86.6	Confident	82	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.9	158	-175.3	0	0	0	0	0	113.5	G773 P775 W818	G773-A879 WeakPolarHBondContact O-CB 3.28Å; P775-A879 HydrophobicContact CB-CB 3.85Å; P775-A879 HydrophobicContact CG-CB 3.62Å; W818-A879 HydrophobicContact CE3-CB 4.18Å; W818-A879 PolarHBondContact N-O 2.91Å
880	I	89.5	Confident	80.5	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	128.8	174.9	-62.2	128.7	0	0	0	109.3	Y750 A751 V804 F806 L815 R816 L817 I868 V877	Y750-I880 CarbonylContact C-O 3.44Å; Y750-I880 VanDerWaalsContact CA-O 3.22Å; Y750-I880 WeakPolarHBondContact CA-O 3.01Å; A751-I880 HydrophobicContact CB-CB 4.24Å; A751-I880 PolarHBondContact N-O 3.42Å; V804-I880 HydrophobicContact CB-CD1 4.41Å; V804-I880 HydrophobicContact CG1-CD1 4Å; V804-I880 HydrophobicContact CG2-CB 4.49Å; V804-I880 HydrophobicContact CG2-CD1 3.57Å; F806-I880 HydrophobicContact CE1-CG2 4.38Å; F806-I880 HydrophobicContact CZ-CG2 4.04Å; L815-I880 HydrophobicContact CD1-CG2 4.1Å; R816-I880 CarbonylContact O-C 3.56Å; R816-I880 WeakPolarHBondContact O-CA 3.38Å; L817-I880 HydrophobicContact CD1-CD1 4.34Å; L817-I880 HydrophobicContact CD1-CG1 3.54Å; I868-I880 HydrophobicContact CD1-CD1 3.46Å; I868-I880 VanDerWaalsContact CD1-CD1 3.46Å; I868-I880 HydrophobicContact CD1-CG1 3.85Å; V877-I880 HydrophobicContact CG1-CD1 4.3Å
881	Q	87.6	Confident	79.1	Confident	5 Å²	5	32.2 Å²	32.2	2%	0.023	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.6	175.9	-166.5	-177.3	30.4	0	0	110.4	F748 Q749 Y750 L815 R816 W818 I883	F748-Q881 VanDerWaalsContact CD2-NE2 3.32Å; Q749-Q881 WeakPolarHBondContact O-CA 3.45Å; Q749-Q881 WeakPolarHBondContact O-CG 3.03Å; Y750-Q881 HydrophobicContact CD1-CB 3.65Å; Y750-Q881 HydrophobicContact CD1-CG 3.96Å; Y750-Q881 HydrophobicContact CE1-CB 3.57Å; Y750-Q881 HydrophobicContact CE1-CG 3.74Å; Y750-Q881 HydrophobicContact CG-CG 4.45Å; L815-Q881 CarbonylContact C-O 3.46Å; L815-Q881 WeakPolarHBondContact CA-O 3.41Å; L815-Q881 WeakPolarHBondContact CD1-O 3.2Å; R816-Q881 HydrophobicContact CB-CB 4.23Å; R816-Q881 PolarHBondContact N-O 2.62Å; R816-Q881 PolarHBondContact O-N 3.43Å; W818-Q881 HydrophobicContact CH2-CB 3.97Å; W818-Q881 HydrophobicContact CZ3-CB 3.7Å; Q881-I883 HydrophobicContact CG-CG1 4.34Å
882	V	85.4	Confident	77.9	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	139	165.2	65.5	0	0	0	0	109.6	F748 Q749 F806 P812 L815 L863	F748-V882 VanDerWaalsContact CA-O 3.26Å; F748-V882 WeakPolarHBondContact CA-O 3.16Å; Q749-V882 HydrophobicContact CG-CG1 3.51Å; Q749-V882 PolarHBondContact N-O 2.85Å; Q749-V882 VanDerWaalsContact N-O 3.08Å; Q749-V882 PolarHBondContact O-N 2.96Å; F806-V882 HydrophobicContact CD1-CG1 3.67Å; F806-V882 HydrophobicContact CD2-CG1 4.13Å; F806-V882 HydrophobicContact CE1-CB 4.02Å; F806-V882 HydrophobicContact CE1-CG1 3.59Å; F806-V882 HydrophobicContact CE2-CB 4.21Å; F806-V882 HydrophobicContact CE2-CG1 4.05Å; F806-V882 HydrophobicContact CG-CG1 3.95Å; F806-V882 HydrophobicContact CZ-CB 3.82Å; F806-V882 HydrophobicContact CZ-CG1 3.79Å; P812-V882 HydrophobicContact CB-CG2 3.63Å; L815-V882 HydrophobicContact CD1-CB 4.23Å; L863-V882 HydrophobicContact CD2-CB 4.43Å; L863-V882 HydrophobicContact CD2-CG2 3.9Å
883	I	81.3	Confident	76.3	Confident	11 Å²	11	30.9 Å²	30.9	6%	0.056	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.4	177.2	-49.7	179.1	0	0	0	107.5	R746 F747 F748 A813 E814 Q881	R746-I883 HydrophobicContact CB-CG2 4.06Å; F747-I883 CarbonylContact O-C 3.5Å; F747-I883 WeakPolarHBondContact O-CA 3.1Å; F748-I883 HydrophobicContact CB-CB 4.34Å; F748-I883 HydrophobicContact CB-CG1 3.89Å; F748-I883 HydrophobicContact CB-CG2 4.33Å; A813-I883 PolarHBondContact N-O 2.89Å; E814-I883 HydrophobicContact CB-CB 4.17Å; E814-I883 HydrophobicContact CB-CD1 4.32Å; E814-I883 HydrophobicContact CG-CD1 4.48Å; E814-I883 PolarHBondContact N-O 3.3Å; E814-I883 VanDerWaalsContact N-O 3.08Å; E814-I883 PolarHBondContact O-N 3.24Å; Q881-I883 HydrophobicContact CG-CG1 4.34Å
884	S	81.6	Confident	74.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	169.9	-174.1	85	0	0	0	0	113.5	R746 F747 V811 A813	R746-S884 WeakPolarHBondContact CB-O 3.12Å; R746-S884 WeakPolarHBondContact CD-O 3.35Å; R746-S884 VanDerWaalsContact CG-O 3.3Å; R746-S884 WeakPolarHBondContact CG-O 3.45Å; F747-S884 WeakPolarHBondContact CB-OG 3.47Å; F747-S884 PolarHBondContact N-OG 3.21Å; F747-S884 WeakPolarHBondContact O-CB 3.42Å; F747-S884 PolarHBondContact O-N 2.85Å; V811-S884 CarbonylContact O-C 3.57Å; V811-S884 VanDerWaalsContact O-CA 3.26Å; V811-S884 WeakPolarHBondContact O-CA 3.46Å; A813-S884 WeakPolarHBondContact CB-O 3.48Å
885	R	75.8	Confident	73.2	Confident	83 Å²	83	32.4 Å²	32.4	31%	0.313	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-63.5	150.5	159	-66	-174.8	179	-137.2	-15.7	111	V811 A813 D858 T859 Q888	V811-R885 HydrophobicContact CG1-CG 4.18Å; V811-R885 PolarHBondContact O-N 3.08Å; A813-R885 HydrophobicContact CB-CG 4.04Å; D858-R885 IonicContact OD1-CZ 3.44Å; D858-R885 IonicContact OD1-NH2 2.66Å; D858-R885 PolarHBondContact OD1-NH2 2.73Å; T859-R885 PolarHBondContact O-NE 2.76Å; T859-R885 PolarHBondContact O-NH2 3.08Å; R885-Q888 HydrophobicContact CB-CG 4.28Å; R885-Q888 VanDerWaalsContact O-CG 3.25Å; R885-Q888 WeakPolarHBondContact O-CG 3.35Å
886	P	69.4	Low	71.7	Confident	84 Å²	84	37 Å²	37	55%	0.545	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	143.8	174.6	-28.5	36.1	0	0	0	112.9	N744 R746 Q888	N744-P886 WeakPolarHBondContact O-CB 3.23Å; R746-P886 HydrophobicContact CG-CB 4.25Å; R746-P886 HydrophobicContact CG-CG 3.7Å; P886-Q888 VanDerWaalsContact C-N 3.27Å; P886-Q888 PolarHBondContact O-N 3.29Å
887	G	65.5	Low	70.6	Confident	53 Å²	53	37.7 Å²	37.7	55%	0.546	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	13.4	172.2	0	0	0	0	0	115.2	G745	G745-G887 PolarHBondContact O-N 2.76Å
888	Q	67.4	Low	69.8	Low	53 Å²	53	38.3 Å²	38.3	25%	0.248	23%	0.231	C	C	.	.			trans	-69.4	139	167.8	-69.6	-86.3	-49	0	0	109.6	R885 P886 C891 A892	R885-Q888 HydrophobicContact CB-CG 4.28Å; R885-Q888 VanDerWaalsContact O-CG 3.25Å; R885-Q888 WeakPolarHBondContact O-CG 3.35Å; P886-Q888 VanDerWaalsContact C-N 3.27Å; P886-Q888 PolarHBondContact O-N 3.29Å; Q888-C891 CarbonylContact O-C 3.26Å; Q888-C891 PolarHBondContact O-N 2.89Å; Q888-A892 PolarHBondContact O-N 3.12Å
889	N	61.8	Low	69.4	Low	111 Å²	111	38.3 Å²	38.3	59%	0.594	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	130.6	164.9	-138.3	13.6	0	0	0	106.7	A892	N889-A892 HydrophobicContact CB-CB 4.28Å
890	P	58.7	Low	69.5	Low	13 Å²	13	39.5 Å²	39.5	8%	0.084	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	cis	-87.5	-21.6	25.3	28.9	-33.1	0	0	0	116.8	C739 F747 V808 A892 S893	C739-P890 HydrophobicContact CB-CG 4.27Å; C739-P890 WeakPolarHBondContact SG-CG 3.28Å; F747-P890 HydrophobicContact CD1-CG 4.31Å; F747-P890 HydrophobicContact CD2-CG 4.19Å; F747-P890 HydrophobicContact CE1-CG 4.44Å; F747-P890 HydrophobicContact CE2-CG 4.38Å; F747-P890 HydrophobicContact CG-CG 4.16Å; F747-P890 HydrophobicContact CZ-CG 4.46Å; V808-P890 HydrophobicContact CG1-CG 4.21Å; P890-A892 PolarHBondContact O-N 3.42Å; P890-A892 VanDerWaalsContact O-N 3.15Å; P890-S893 PolarHBondContact O-N 3.25Å; P890-S893 VanDerWaalsContact O-N 3.12Å; P890-S893 PolarHBondContact O-OG 3.34Å
891	C	59.2	Low	69.5	Low	8 Å²	8	39.4 Å²	39.4	5%	0.054	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-65.7	-18.1	-177.6	-66.4	0	0	0	0	114.8	C741 F747 Q888 S893 C894	C741-C891 VanDerWaalsContact CA-SG 3.51Å; C741-C891 HydrophobicContact CB-CB 3.97Å; C741-C891 WeakPolarHBondContact CB-SG 3.22Å; C741-C891 VanDerWaalsContact SG-CA 3.53Å; C741-C891 WeakPolarHBondContact SG-CB 3.22Å; C741-C891 CovalentContact SG-SG 2.02Å; C741-C891 PolarHBondContact SG-SG 2.85Å; F747-C891 WeakPolarHBondContact CA-SG 3.44Å; F747-C891 HydrophobicContact CB-CB 4.31Å; F747-C891 WeakPolarHBondContact CB-SG 3.43Å; Q888-C891 CarbonylContact O-C 3.26Å; Q888-C891 PolarHBondContact O-N 2.89Å; C891-S893 PolarHBondContact O-N 2.87Å; C891-S893 VanDerWaalsContact O-N 3.16Å; C891-C894 WeakPolarHBondContact O-CB 3.5Å; C891-C894 PolarHBondContact O-N 2.72Å
892	A	58.4	Low	69.7	Low	65 Å²	65	41.4 Å²	41.4	54%	0.537	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-57	-24.5	171.7	0	0	0	0	0	113.5	Q888 N889 P890	Q888-A892 PolarHBondContact O-N 3.12Å; N889-A892 HydrophobicContact CB-CB 4.28Å; P890-A892 PolarHBondContact O-N 3.42Å; P890-A892 VanDerWaalsContact O-N 3.15Å
893	S	51.7	Low	69.9	Low	61 Å²	61	41.7 Å²	41.7	43%	0.427	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-98.4	-3.7	176.7	66.6	0	0	0	0	114.5	P890 C891 N895	P890-S893 PolarHBondContact O-N 3.25Å; P890-S893 VanDerWaalsContact O-N 3.12Å; P890-S893 PolarHBondContact O-OG 3.34Å; C891-S893 PolarHBondContact O-N 2.87Å; C891-S893 VanDerWaalsContact O-N 3.16Å; S893-N895 PolarHBondContact O-N 3.04Å
894	C	51.1	Low	70.3	Confident	40 Å²	40	46.4 Å²	46.4	27%	0.27	27%	0.271	S	S	.	.			trans	-73.3	129.1	-176.3	-73.3	0	0	0	0	111.9	C741 C891 L896	C741-C894 PolarHBondContact SG-SG 2.9Å; C891-C894 WeakPolarHBondContact O-CB 3.5Å; C891-C894 PolarHBondContact O-N 2.72Å; C894-L896 PolarHBondContact O-N 2.95Å
895	N	51	Low	70.7	Confident	86 Å²	86	49.5 Å²	49.5	46%	0.46	29%	0.291	S	S	.	.			trans	-72.8	96.6	-178.6	-74.5	-53.9	0	0	0	111.3	S893 T939 R940	S893-N895 PolarHBondContact O-N 3.04Å; N895-T939 HydrophobicContact CB-CG2 3.58Å; N895-R940 VanDerWaalsContact CB-O 3.24Å; N895-R940 WeakPolarHBondContact CB-O 3.42Å; N895-R940 PolarHBondContact OD1-O 3.39Å
896	L	56.4	Low	71.3	Confident	97 Å²	97	53.8 Å²	53.8	51%	0.508	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-48.1	142.1	172.9	-65.4	169.8	0	0	0	112.2	C894 R940	C894-L896 PolarHBondContact O-N 2.95Å; L896-R940 WeakPolarHBondContact O-CB 3.33Å; L896-R940 WeakPolarHBondContact O-CG 3.29Å; L896-R940 PolarHBondContact O-N 2.85Å; L896-R940 VanDerWaalsContact O-N 3.09Å
897	L	64.9	Low	72.2	Confident	14 Å²	14	50.1 Å²	50.1	7%	0.073	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	127.4	169.5	-71.9	177.9	0	0	0	110.8	P723 H726 Y899 A937	P723-L897 HydrophobicContact CG-CD1 4.15Å; H726-L897 HydrophobicContact CB-CD1 4.39Å; H726-L897 WeakPolarHBondContact CE1-CD2 3.39Å; H726-L897 VanDerWaalsContact CE1-CG 3.49Å; H726-L897 WeakPolarHBondContact CE1-CG 3.43Å; H726-L897 WeakPolarHBondContact NE2-CG 3.38Å; L897-Y899 HydrophobicContact CB-CE2 4.24Å; L897-Y899 HydrophobicContact CD1-CE1 4.21Å; L897-Y899 WeakPolarHBondContact CD1-OH 3.26Å; L897-A937 HydrophobicContact CD1-CB 4.28Å; L897-A937 HydrophobicContact CD2-CB 4.11Å
898	D	73.8	Confident	73.1	Confident	12 Å²	12	51.3 Å²	51.3	6%	0.064	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	138.2	152.7	-69.8	-40.4	0	0	0	108.2	A937 R938 R940	D898-A937 CarbonylContact O-C 3.57Å; D898-R938 PolarHBondContact N-O 2.77Å; D898-R938 PolarHBondContact O-N 2.73Å; D898-R938 IonicContact OD2-CZ 2.74Å; D898-R938 IonicContact OD2-NH2 2.7Å; D898-R938 PolarHBondContact OD2-NH2 3.05Å; D898-R940 VanDerWaalsContact CG-NE 3.3Å; D898-R940 IonicContact OD1-CZ 3.36Å; D898-R940 VanDerWaalsContact OD1-CZ 3.26Å; D898-R940 IonicContact OD1-NE 3.64Å; D898-R940 PolarHBondContact OD1-NE 3Å; D898-R940 IonicContact OD1-NH2 2.72Å; D898-R940 PolarHBondContact OD1-NH2 2.97Å; D898-R940 WeakPolarHBondContact OD2-CG 3.25Å; D898-R940 IonicContact OD2-NE 3.67Å; D898-R940 PolarHBondContact OD2-NE 2.99Å; D898-R940 IonicContact OD2-NH2 2.63Å
899	Y	80.5	Confident	73.6	Confident	6 Å²	6	55.5 Å²	55.5	2%	0.024	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	135.1	170.5	-59.6	-81	0	0	0	110.9	I702 W720 L897 R914 T915 T918 I935 G936 A937	I702-Y899 HydrophobicContact CD1-CD1 4.11Å; I702-Y899 HydrophobicContact CD1-CE1 4.2Å; W720-Y899 HydrophobicContact CZ2-CD1 4.32Å; W720-Y899 HydrophobicContact CZ2-CD2 4.01Å; W720-Y899 AromaticContact CZ2-CG 3.78Å; W720-Y899 HydrophobicContact CZ2-CG 3.78Å; W720-Y899 AromaticContact NE1-CD1 3.27Å; W720-Y899 VanDerWaalsContact NE1-CD1 3.27Å; W720-Y899 AromaticContact NE1-CE1 3.39Å; W720-Y899 AromaticContact NE1-CG 3.62Å; W720-Y899 AromaticContact NE1-CZ 3.84Å; L897-Y899 HydrophobicContact CB-CE2 4.24Å; L897-Y899 HydrophobicContact CD1-CE1 4.21Å; L897-Y899 WeakPolarHBondContact CD1-OH 3.26Å; Y899-R914 VanDerWaalsContact O-CA 3.32Å; Y899-R914 WeakPolarHBondContact O-CA 3.42Å; Y899-T915 PolarHBondContact N-O 3.31Å; Y899-T915 PolarHBondContact O-N 3.12Å; Y899-T915 VanDerWaalsContact O-N 3.13Å; Y899-T918 HydrophobicContact CE2-CG2 3.96Å; Y899-I935 HydrophobicContact CD1-CG2 3.87Å; Y899-I935 HydrophobicContact CG-CG2 4.31Å; Y899-G936 CarbonylContact C-O 3.44Å; Y899-G936 WeakPolarHBondContact CA-O 3.5Å; Y899-A937 HydrophobicContact CD1-CB 4.08Å; Y899-A937 HydrophobicContact CE1-CB 3.98Å
900	Q	87.7	Confident	74.6	Confident	25 Å²	25	51.7 Å²	51.7	12%	0.117	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	117.6	169.7	-66.1	-176.2	9.8	0	0	109.4	Y912 R913 R914 I935 G936	Q900-Y912 HydrophobicContact CB-CD2 4.26Å; Q900-Y912 HydrophobicContact CG-CD2 4.11Å; Q900-Y912 HydrophobicContact CG-CE2 4.23Å; Q900-R913 CarbonylContact C-O 3.5Å; Q900-R913 WeakPolarHBondContact CA-O 3.11Å; Q900-R914 HydrophobicContact CG-CG 4.24Å; Q900-I935 CarbonylContact O-C 3.54Å; Q900-I935 WeakPolarHBondContact O-CA 3.01Å; Q900-G936 PolarHBondContact N-O 2.02Å; Q900-G936 PolarHBondContact O-N 3.46Å
901	I	90.8	Very high	75.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	116.5	177.7	-56.8	145	0	0	0	107.9	F718 W720 F907 Y912 R913 T915 F920 Y933 I935	F718-I901 HydrophobicContact CE2-CG2 4.47Å; F718-I901 HydrophobicContact CZ-CG2 4.04Å; W720-I901 HydrophobicContact CH2-CD1 4.3Å; W720-I901 HydrophobicContact CH2-CG1 4.36Å; I901-F907 HydrophobicContact CG2-CE2 4.43Å; I901-F907 HydrophobicContact CG2-CZ 3.96Å; I901-F907 WeakPolarHBondContact O-CE2 3.14Å; I901-Y912 CarbonylContact O-C 3.59Å; I901-Y912 WeakPolarHBondContact O-CA 3.48Å; I901-Y912 VanDerWaalsContact O-CB 3.29Å; I901-Y912 WeakPolarHBondContact O-CB 3.26Å; I901-R913 HydrophobicContact CB-CB 4.33Å; I901-R913 HydrophobicContact CD1-CB 4.2Å; I901-R913 PolarHBondContact N-O 2.93Å; I901-R913 PolarHBondContact O-N 3.14Å; I901-T915 HydrophobicContact CD1-CG2 3.77Å; I901-F920 HydrophobicContact CD1-CB 3.74Å; I901-F920 HydrophobicContact CD1-CD1 3.97Å; I901-F920 HydrophobicContact CD1-CD2 3.4Å; I901-F920 HydrophobicContact CD1-CE1 4.42Å; I901-F920 HydrophobicContact CD1-CE2 3.94Å; I901-F920 HydrophobicContact CD1-CG 3.42Å; I901-F920 VanDerWaalsContact CD1-CG 3.42Å; I901-F920 HydrophobicContact CD1-CZ 4.43Å; I901-Y933 HydrophobicContact CG2-CD1 4.29Å; I901-I935 HydrophobicContact CG1-CG1 4.16Å; I901-I935 HydrophobicContact CG2-CD1 4.46Å
902	V	91.1	Very high	76.7	Confident	46 Å²	46	60 Å²	60	28%	0.279	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	136.3	174.1	-176.3	0	0	0	0	108.3	Y933 R934 L950	V902-Y933 WeakPolarHBondContact O-CA 3.24Å; V902-R934 PolarHBondContact N-O 3.5Å; V902-R934 PolarHBondContact O-N 2.93Å; V902-L950 HydrophobicContact CG2-CD2 4.02Å
903	R	90.7	Very high	78.2	Confident	8 Å²	8	61.8 Å²	61.8	3%	0.03	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	138.8	-179.4	-167.7	-173.6	80.8	177.7	6.7	111.3	P905 R906 F907 D922 D924 Y931 V932 Y933	R903-P905 WeakPolarHBondContact CG-O 3.33Å; R903-P905 PolarHBondContact NE-O 2.89Å; R903-P905 CarbonylContact O-C 3.59Å; R903-R906 PolarHBondContact NH2-O 3.21Å; R903-R906 VanDerWaalsContact O-CA 3.28Å; R903-R906 WeakPolarHBondContact O-CA 3.41Å; R903-R906 PolarHBondContact O-N 3.15Å; R903-F907 HydrophobicContact CB-CD2 4.04Å; R903-F907 HydrophobicContact CB-CE1 4.19Å; R903-F907 HydrophobicContact CB-CE2 3.5Å; R903-F907 HydrophobicContact CB-CZ 3.6Å; R903-F907 HydrophobicContact CG-CZ 4.38Å; R903-D922 WeakPolarHBondContact CD-OD2 3.12Å; R903-D922 IonicContact CZ-OD2 2.8Å; R903-D922 IonicContact NE-OD2 3.98Å; R903-D922 VanDerWaalsContact NH1-CG 3.32Å; R903-D922 IonicContact NH1-OD1 3.72Å; R903-D922 PolarHBondContact NH1-OD1 2.89Å; R903-D922 VanDerWaalsContact NH1-OD1 3.15Å; R903-D922 IonicContact NH1-OD2 2.76Å; R903-D922 PolarHBondContact NH1-OD2 3.09Å; R903-D924 IonicContact CZ-OD2 2.67Å; R903-D924 PolarHBondContact NH1-O 3.45Å; R903-D924 IonicContact NH1-OD2 2.77Å; R903-D924 PolarHBondContact NH1-OD2 2.91Å; R903-D924 PolarHBondContact NH2-O 2.75Å; R903-D924 IonicContact NH2-OD2 3.77Å; R903-D924 PolarHBondContact NH2-OD2 3.26Å; R903-Y931 HydrophobicContact CG-CD1 4.13Å; R903-V932 CarbonylContact C-O 3.47Å; R903-V932 VanDerWaalsContact CA-O 3.28Å; R903-V932 WeakPolarHBondContact CA-O 3.18Å; R903-Y933 HydrophobicContact CB-CD1 4.13Å; R903-Y933 HydrophobicContact CB-CE1 4.18Å; R903-Y933 HydrophobicContact CG-CD1 3.79Å; R903-Y933 HydrophobicContact CG-CE1 3.52Å; R903-Y933 HydrophobicContact CG-CG 4.46Å
904	E	88.5	Confident	79.9	Confident	109 Å²	109	66 Å²	66	51%	0.509	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.5	166.9	-60.6	-169.3	158.3	0	0	110.1	Y931 V932	E904-Y931 CarbonylContact O-C 3.59Å; E904-Y931 VanDerWaalsContact O-CA 3.26Å; E904-Y931 WeakPolarHBondContact O-CA 3.33Å; E904-V932 HydrophobicContact CB-CB 4.36Å; E904-V932 PolarHBondContact N-O 3.08Å; E904-V932 PolarHBondContact O-N 3.25Å
905	P	89.7	Confident	81.3	Confident	66 Å²	66	65.2 Å²	65.2	43%	0.429	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-61.1	151.8	-10.6	28.5	-35.5	0	0	0	111.9	R903 V930 Y931	R903-P905 WeakPolarHBondContact CG-O 3.33Å; R903-P905 PolarHBondContact NE-O 2.89Å; R903-P905 CarbonylContact O-C 3.59Å; P905-V930 WeakPolarHBondContact CD-O 3.06Å; P905-Y931 HydrophobicContact CG-CD1 4.19Å; P905-Y931 HydrophobicContact CG-CE1 3.99Å
906	R	88.3	Confident	82.2	Confident	172 Å²	172	63.7 Å²	63.7	65%	0.649	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.9	158.5	-172.9	-66.5	176	177.3	171.9	0.9	113.3	R903	R903-R906 PolarHBondContact NH2-O 3.21Å; R903-R906 VanDerWaalsContact O-CA 3.28Å; R903-R906 WeakPolarHBondContact O-CA 3.41Å; R903-R906 PolarHBondContact O-N 3.15Å
907	F	89.4	Confident	83	Confident	8 Å²	8	61.6 Å²	61.6	4%	0.035	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	139.9	171.4	-58.7	-83.1	0	0	0	110.1	I901 R903 N909 A910 R913 F920	I901-F907 HydrophobicContact CG2-CE2 4.43Å; I901-F907 HydrophobicContact CG2-CZ 3.96Å; I901-F907 WeakPolarHBondContact O-CE2 3.14Å; R903-F907 HydrophobicContact CB-CD2 4.04Å; R903-F907 HydrophobicContact CB-CE1 4.19Å; R903-F907 HydrophobicContact CB-CE2 3.5Å; R903-F907 HydrophobicContact CB-CZ 3.6Å; R903-F907 HydrophobicContact CG-CZ 4.38Å; F907-N909 PolarHBondContact O-N 3Å; F907-A910 HydrophobicContact CB-CB 4.43Å; F907-A910 WeakPolarHBondContact CB-O 3.44Å; F907-A910 PolarHBondContact N-O 3.39Å; F907-A910 PolarHBondContact O-N 3.45Å; F907-A910 VanDerWaalsContact O-O 3.08Å; F907-R913 HydrophobicContact CD1-CG 3.95Å; F907-R913 HydrophobicContact CD2-CG 3.89Å; F907-R913 HydrophobicContact CE1-CG 3.84Å; F907-R913 HydrophobicContact CE2-CB 4.22Å; F907-R913 HydrophobicContact CE2-CG 3.78Å; F907-R913 HydrophobicContact CG-CG 3.97Å; F907-R913 HydrophobicContact CZ-CB 4.22Å; F907-R913 HydrophobicContact CZ-CG 3.75Å; F907-F920 HydrophobicContact CE1-CE1 4Å; F907-F920 HydrophobicContact CE1-CZ 4.22Å; F907-F920 HydrophobicContact CZ-CE1 4.25Å
908	S	83.3	Confident	83.5	Confident	77 Å²	77	61.2 Å²	61.2	54%	0.538	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-35	-177.3	39.3	0	0	0	0	114.2	D924	S908-D924 PolarHBondContact N-OD2 2.61Å; S908-D924 PolarHBondContact OG-OD1 2.67Å; S908-D924 PolarHBondContact OG-OD2 3.01Å
909	N	79	Confident	84	Confident	142 Å²	142	61.8 Å²	61.8	76%	0.759	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	8.9	-177.3	-63.5	-9.3	0	0	0	114.6	F907	F907-N909 PolarHBondContact O-N 3Å
910	A	82	Confident	84.4	Confident	31 Å²	31	63.1 Å²	63.1	26%	0.256	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	150.5	-177.2	0	0	0	0	0	114.6	F907 Y912	F907-A910 HydrophobicContact CB-CB 4.43Å; F907-A910 WeakPolarHBondContact CB-O 3.44Å; F907-A910 PolarHBondContact N-O 3.39Å; F907-A910 PolarHBondContact O-N 3.45Å; F907-A910 VanDerWaalsContact O-O 3.08Å; A910-Y912 VanDerWaalsContact C-N 3.31Å; A910-Y912 VanDerWaalsContact CB-O 3.3Å; A910-Y912 WeakPolarHBondContact CB-O 3.36Å
911	L	79.1	Confident	84.6	Confident	110 Å²	110	64.9 Å²	64.9	58%	0.576	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	-31.3	169.3	-66.4	176.2	0	0	0	112.5
912	Y	84	Confident	84.7	Confident	86 Å²	86	65 Å²	65	34%	0.337	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	159.3	179.8	60.4	-86.1	0	0	0	109.9	Q900 I901 A910 R914	Q900-Y912 HydrophobicContact CB-CD2 4.26Å; Q900-Y912 HydrophobicContact CG-CD2 4.11Å; Q900-Y912 HydrophobicContact CG-CE2 4.23Å; I901-Y912 CarbonylContact O-C 3.59Å; I901-Y912 WeakPolarHBondContact O-CA 3.48Å; I901-Y912 VanDerWaalsContact O-CB 3.29Å; I901-Y912 WeakPolarHBondContact O-CB 3.26Å; A910-Y912 VanDerWaalsContact C-N 3.31Å; A910-Y912 VanDerWaalsContact CB-O 3.3Å; A910-Y912 WeakPolarHBondContact CB-O 3.36Å; Y912-R914 HydrophobicContact CD2-CG 4.13Å; Y912-R914 HydrophobicContact CE2-CG 3.85Å
913	R	89.4	Confident	84.7	Confident	102 Å²	102	68.1 Å²	68.1	39%	0.385	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	153.6	169.5	-69.9	-68.7	-169.9	174.3	3.1	110.3	Q900 I901 F907 F920	Q900-R913 CarbonylContact C-O 3.5Å; Q900-R913 WeakPolarHBondContact CA-O 3.11Å; I901-R913 HydrophobicContact CB-CB 4.33Å; I901-R913 HydrophobicContact CD1-CB 4.2Å; I901-R913 PolarHBondContact N-O 2.93Å; I901-R913 PolarHBondContact O-N 3.14Å; F907-R913 HydrophobicContact CD1-CG 3.95Å; F907-R913 HydrophobicContact CD2-CG 3.89Å; F907-R913 HydrophobicContact CE1-CG 3.84Å; F907-R913 HydrophobicContact CE2-CB 4.22Å; F907-R913 HydrophobicContact CE2-CG 3.78Å; F907-R913 HydrophobicContact CG-CG 3.97Å; F907-R913 HydrophobicContact CZ-CB 4.22Å; F907-R913 HydrophobicContact CZ-CG 3.75Å; R913-F920 HydrophobicContact CB-CE2 4.06Å; R913-F920 HydrophobicContact CB-CZ 4.02Å; R913-F920 HydrophobicContact CG-CE2 4.29Å; R913-F920 HydrophobicContact CG-CZ 3.87Å
914	R	86.2	Confident	84.6	Confident	148 Å²	148	70 Å²	70	56%	0.558	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	141	175.4	-86.5	-176.5	-86.7	173.1	-10.9	110.4	Y899 Q900 Y912	Y899-R914 VanDerWaalsContact O-CA 3.32Å; Y899-R914 WeakPolarHBondContact O-CA 3.42Å; Q900-R914 HydrophobicContact CG-CG 4.24Å; Y912-R914 HydrophobicContact CD2-CG 4.13Å; Y912-R914 HydrophobicContact CE2-CG 3.85Å
915	T	81.3	Confident	84.7	Confident	25 Å²	25	65.4 Å²	65.4	15%	0.153	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	152.2	174.5	-178.4	0	0	0	0	109.3	W720 Y899 I901 L917	W720-T915 HydrophobicContact CH2-CG2 3.86Å; W720-T915 HydrophobicContact CZ2-CG2 3.98Å; Y899-T915 PolarHBondContact N-O 3.31Å; Y899-T915 PolarHBondContact O-N 3.12Å; Y899-T915 VanDerWaalsContact O-N 3.13Å; I901-T915 HydrophobicContact CD1-CG2 3.77Å; T915-L917 WeakPolarHBondContact CG2-O 3.42Å; T915-L917 PolarHBondContact OG1-N 2.87Å; T915-L917 VanDerWaalsContact OG1-N 3.09Å
916	S	70.7	Confident	84.5	Confident	54 Å²	54	68.9 Å²	68.9	38%	0.378	35%	0.345	S	S	.	.	S	Bend	trans	-89.4	-18.3	166.7	54.3	0	0	0	0	112.5
917	L	72	Confident	84.2	Confident	53 Å²	53	64.6 Å²	64.6	28%	0.277	34%	0.34	S	S	.	.	S	Bend	trans	-81.2	150.3	-177.4	-58.5	173.9	0	0	0	111.8	D70 L72 W720 T915 V919	D70-L917 HydrophobicContact CB-CD2 3.87Å; D70-L917 WeakPolarHBondContact OD2-CA 3.29Å; D70-L917 WeakPolarHBondContact OD2-CD2 3.46Å; L72-L917 HydrophobicContact CB-CD2 4.01Å; L72-L917 HydrophobicContact CD1-CD2 3.47Å; L72-L917 VanDerWaalsContact CD1-CD2 3.47Å; L72-L917 HydrophobicContact CG-CD2 4.36Å; W720-L917 WeakPolarHBondContact CH2-O 3.31Å; W720-L917 WeakPolarHBondContact CZ2-O 3.36Å; T915-L917 WeakPolarHBondContact CG2-O 3.42Å; T915-L917 PolarHBondContact OG1-N 2.87Å; T915-L917 VanDerWaalsContact OG1-N 3.09Å; L917-V919 HydrophobicContact CB-CG1 3.92Å; L917-V919 HydrophobicContact CD1-CG1 4.11Å; L917-V919 PolarHBondContact O-N 3.21Å
918	T	76.3	Confident	83.7	Confident	5 Å²	5	71 Å²	71	3%	0.031	37%	0.374	C	S	.	.	S	Bend	trans	-78.3	18.1	168.3	56.5	0	0	0	0	114.2	V719 W720 Y899	V719-T918 VanDerWaalsContact CA-O 3.3Å; V719-T918 WeakPolarHBondContact CA-O 3.39Å; W720-T918 PolarHBondContact N-O 2.99Å; W720-T918 VanDerWaalsContact N-O 3.12Å; Y899-T918 HydrophobicContact CE2-CG2 3.96Å
919	V	83.1	Confident	83.7	Confident	25 Å²	25	72.9 Å²	72.9	15%	0.152	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145.1	178.5	60.9	0	0	0	0	110.3	D331 T717 F718 V719 L917	D331-V919 HydrophobicContact CB-CG1 4.48Å; D331-V919 HydrophobicContact CB-CG2 4.44Å; T717-V919 HydrophobicContact CG2-CG2 3.86Å; F718-V919 WeakPolarHBondContact O-CA 3.44Å; V719-V919 HydrophobicContact CG1-CB 3.95Å; V719-V919 HydrophobicContact CG1-CG2 3.78Å; L917-V919 HydrophobicContact CB-CG1 3.92Å; L917-V919 HydrophobicContact CD1-CG1 4.11Å; L917-V919 PolarHBondContact O-N 3.21Å
920	F	90.2	Very high	84	Confident	33 Å²	33	69.1 Å²	69.1	15%	0.145	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	141	174	-175.8	-107.4	0	0	0	111.6	T717 F718 W720 I901 F907 R913 D922	T717-F920 WeakPolarHBondContact CA-O 3.39Å; F718-F920 AromaticContact CE1-CD1 3.89Å; F718-F920 HydrophobicContact CE1-CD1 3.89Å; F718-F920 HydrophobicContact CE2-CB 4Å; F718-F920 HydrophobicContact CE2-CD1 4.34Å; F718-F920 HydrophobicContact CZ-CB 4.1Å; F718-F920 AromaticContact CZ-CD1 3.58Å; F718-F920 HydrophobicContact CZ-CD1 3.58Å; F718-F920 HydrophobicContact CZ-CG 4.29Å; F718-F920 PolarHBondContact N-O 3.45Å; F718-F920 PolarHBondContact O-N 2.96Å; W720-F920 HydrophobicContact CH2-CB 3.96Å; W720-F920 HydrophobicContact CZ3-CB 3.83Å; I901-F920 HydrophobicContact CD1-CB 3.74Å; I901-F920 HydrophobicContact CD1-CD1 3.97Å; I901-F920 HydrophobicContact CD1-CD2 3.4Å; I901-F920 HydrophobicContact CD1-CE1 4.42Å; I901-F920 HydrophobicContact CD1-CE2 3.94Å; I901-F920 HydrophobicContact CD1-CG 3.42Å; I901-F920 VanDerWaalsContact CD1-CG 3.42Å; I901-F920 HydrophobicContact CD1-CZ 4.43Å; F907-F920 HydrophobicContact CE1-CE1 4Å; F907-F920 HydrophobicContact CE1-CZ 4.22Å; F907-F920 HydrophobicContact CZ-CE1 4.25Å; R913-F920 HydrophobicContact CB-CE2 4.06Å; R913-F920 HydrophobicContact CB-CZ 4.02Å; R913-F920 HydrophobicContact CG-CE2 4.29Å; R913-F920 HydrophobicContact CG-CZ 3.87Å; F920-D922 HydrophobicContact CD1-CB 4.23Å; F920-D922 HydrophobicContact CE1-CB 3.7Å
921	T	91.5	Very high	84.3	Confident	62 Å²	62	68.2 Å²	68.2	38%	0.38	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	118.3	169.1	-61.4	0	0	0	0	109.2	I716 T717 T923	I716-T921 CarbonylContact O-C 3.36Å; I716-T921 WeakPolarHBondContact O-CA 3.41Å; T717-T921 WeakPolarHBondContact CG2-OG1 3.45Å; T717-T921 PolarHBondContact OG1-OG1 2.75Å; T921-T923 HydrophobicContact CG2-CG2 4.2Å
922	D	92.4	Very high	84.9	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.021	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	120.8	172.6	-166	-7.1	0	0	0	109.7	S715 I716 R903 F920 D924 V925 Y933	S715-D922 CarbonylContact C-O 3.53Å; S715-D922 WeakPolarHBondContact CA-O 3.27Å; S715-D922 WeakPolarHBondContact CB-O 3.49Å; I716-D922 HydrophobicContact CG2-CB 3.78Å; I716-D922 PolarHBondContact N-O 3.43Å; I716-D922 PolarHBondContact O-N 3.48Å; R903-D922 WeakPolarHBondContact CD-OD2 3.12Å; R903-D922 IonicContact CZ-OD2 2.8Å; R903-D922 IonicContact NE-OD2 3.98Å; R903-D922 VanDerWaalsContact NH1-CG 3.32Å; R903-D922 IonicContact NH1-OD1 3.72Å; R903-D922 PolarHBondContact NH1-OD1 2.89Å; R903-D922 VanDerWaalsContact NH1-OD1 3.15Å; R903-D922 IonicContact NH1-OD2 2.76Å; R903-D922 PolarHBondContact NH1-OD2 3.09Å; F920-D922 HydrophobicContact CD1-CB 4.23Å; F920-D922 HydrophobicContact CE1-CB 3.7Å; D922-D924 PolarHBondContact OD1-N 3.3Å; D922-V925 HydrophobicContact CB-CG1 4.26Å; D922-Y933 HydrophobicContact CB-CE1 4.32Å; D922-Y933 VanDerWaalsContact OD2-CE1 3.27Å; D922-Y933 WeakPolarHBondContact OD2-CE1 2.99Å; D922-Y933 PolarHBondContact OD2-OH 3.22Å
923	T	91.3	Very high	85.3	Confident	111 Å²	111	60 Å²	60	68%	0.681	31%	0.308	S	S	*	.			trans	-106.8	2.1	176.5	63.8	0	0	0	0	112.6	T921 V925	T921-T923 HydrophobicContact CG2-CG2 4.2Å; T923-V925 VanDerWaalsContact C-N 3.34Å
924	D	89.1	Confident	85.4	Confident	48 Å²	48	57.9 Å²	57.9	26%	0.257	30%	0.3	S	S	.	.			trans	-101.2	46.9	179.2	179.6	54.8	0	0	0	110.1	R903 S908 D922	R903-D924 IonicContact CZ-OD2 2.67Å; R903-D924 PolarHBondContact NH1-O 3.45Å; R903-D924 IonicContact NH1-OD2 2.77Å; R903-D924 PolarHBondContact NH1-OD2 2.91Å; R903-D924 PolarHBondContact NH2-O 2.75Å; R903-D924 IonicContact NH2-OD2 3.77Å; R903-D924 PolarHBondContact NH2-OD2 3.26Å; S908-D924 PolarHBondContact N-OD2 2.61Å; S908-D924 PolarHBondContact OG-OD1 2.67Å; S908-D924 PolarHBondContact OG-OD2 3.01Å; D922-D924 PolarHBondContact OD1-N 3.3Å
925	V	89.3	Confident	85.5	Confident	12 Å²	12	50.8 Å²	50.8	7%	0.073	27%	0.273	C	S	.	.			trans	-119.6	142.7	-175.5	-72.3	0	0	0	0	111.7	I716 D922 T923 Y931 Y933 L958	I716-V925 HydrophobicContact CG2-CG1 3.97Å; I716-V925 HydrophobicContact CG2-CG2 4.41Å; D922-V925 HydrophobicContact CB-CG1 4.26Å; T923-V925 VanDerWaalsContact C-N 3.34Å; V925-Y931 WeakPolarHBondContact CA-OH 3.17Å; V925-Y931 HydrophobicContact CB-CE2 4.09Å; V925-Y931 HydrophobicContact CG1-CD1 4.48Å; V925-Y931 HydrophobicContact CG1-CD2 4.25Å; V925-Y931 HydrophobicContact CG1-CE1 4.21Å; V925-Y931 HydrophobicContact CG1-CE2 3.98Å; V925-Y931 HydrophobicContact CG1-CG 4.5Å; V925-Y933 WeakPolarHBondContact CG1-OH 3.4Å; V925-L958 HydrophobicContact CB-CD1 4.16Å; V925-L958 HydrophobicContact CB-CG 4.4Å; V925-L958 HydrophobicContact CG2-CD1 3.97Å; V925-L958 HydrophobicContact CG2-CD2 4.1Å; V925-L958 HydrophobicContact CG2-CG 4.34Å
926	K	87.2	Confident	85.7	Confident	138 Å²	138	49.9 Å²	49.9	60%	0.6	27%	0.269	S	S	*	.			trans	-119.5	147.5	-179.4	-64.4	-174.8	179	-175.1	0	110.7	K929 Y931	K926-K929 HydrophobicContact CB-CG 4.14Å; K926-Y931 PolarHBondContact N-OH 3.33Å
927	P	82.2	Confident	86	Confident	83 Å²	83	47.4 Å²	47.4	54%	0.539	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	150.1	168.3	-26.4	35.6	0	0	0	111.9	K929	P927-K929 PolarHBondContact O-N 2.85Å
928	D	77.7	Confident	86	Confident	143 Å²	143	47.3 Å²	47.3	77%	0.765	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	10.3	175.5	-49.6	-45	0	0	0	116.7
929	K	84.3	Confident	85.4	Confident	115 Å²	115	49.1 Å²	49.1	50%	0.5	26%	0.259	S	S	.	.			trans	-95.5	130.4	168.4	-74.9	-79.1	-179.4	176.6	0	109.9	K926 P927 Y931 S957	K926-K929 HydrophobicContact CB-CG 4.14Å; P927-K929 PolarHBondContact O-N 2.85Å; K929-Y931 HydrophobicContact CB-CD2 4.28Å; K929-Y931 HydrophobicContact CB-CE2 3.48Å; K929-Y931 VanDerWaalsContact CB-CE2 3.48Å; K929-Y931 VanDerWaalsContact O-CD2 3.28Å; K929-Y931 WeakPolarHBondContact O-CD2 3.02Å; K929-Y931 WeakPolarHBondContact O-CE2 3.35Å; K929-S957 WeakPolarHBondContact O-CA 3.4Å; K929-S957 WeakPolarHBondContact O-CB 3.38Å; K929-S957 PolarHBondContact O-OG 3.01Å
930	V	84.9	Confident	84.1	Confident	63 Å²	63	53.8 Å²	53.8	38%	0.382	27%	0.273	S	S	.	.			trans	-83.6	132.4	168.9	-176.8	0	0	0	0	108.9	P905 V955 F956 W960	P905-V930 WeakPolarHBondContact CD-O 3.06Å; V930-V955 HydrophobicContact CG1-CG1 3.74Å; V930-F956 WeakPolarHBondContact CA-O 3.38Å; V930-W960 HydrophobicContact CG1-CH2 4.14Å; V930-W960 HydrophobicContact CG2-CH2 4.22Å; V930-W960 HydrophobicContact CG2-CZ2 3.99Å
931	Y	89	Confident	82.3	Confident	12 Å²	12	55.7 Å²	55.7	5%	0.047	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	141.2	176.7	-64.8	-89.8	0	0	0	110	R903 E904 P905 V925 K926 K929 Y933 V955 F956	R903-Y931 HydrophobicContact CG-CD1 4.13Å; E904-Y931 CarbonylContact O-C 3.59Å; E904-Y931 VanDerWaalsContact O-CA 3.26Å; E904-Y931 WeakPolarHBondContact O-CA 3.33Å; P905-Y931 HydrophobicContact CG-CD1 4.19Å; P905-Y931 HydrophobicContact CG-CE1 3.99Å; V925-Y931 WeakPolarHBondContact CA-OH 3.17Å; V925-Y931 HydrophobicContact CB-CE2 4.09Å; V925-Y931 HydrophobicContact CG1-CD1 4.48Å; V925-Y931 HydrophobicContact CG1-CD2 4.25Å; V925-Y931 HydrophobicContact CG1-CE1 4.21Å; V925-Y931 HydrophobicContact CG1-CE2 3.98Å; V925-Y931 HydrophobicContact CG1-CG 4.5Å; K926-Y931 PolarHBondContact N-OH 3.33Å; K929-Y931 HydrophobicContact CB-CD2 4.28Å; K929-Y931 HydrophobicContact CB-CE2 3.48Å; K929-Y931 VanDerWaalsContact CB-CE2 3.48Å; K929-Y931 VanDerWaalsContact O-CD2 3.28Å; K929-Y931 WeakPolarHBondContact O-CD2 3.02Å; K929-Y931 WeakPolarHBondContact O-CE2 3.35Å; Y931-Y933 HydrophobicContact CG-CE2 4.42Å; Y931-V955 WeakPolarHBondContact O-CA 3.3Å; Y931-F956 PolarHBondContact N-O 2.97Å; Y931-F956 PolarHBondContact O-N 2.83Å
932	V	90.3	Very high	80.4	Confident	24 Å²	24	55.6 Å²	55.6	15%	0.145	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119.9	173.2	-174.2	0	0	0	0	108.1	R903 E904 P953 L954 V955	R903-V932 CarbonylContact C-O 3.47Å; R903-V932 VanDerWaalsContact CA-O 3.28Å; R903-V932 WeakPolarHBondContact CA-O 3.18Å; E904-V932 HydrophobicContact CB-CB 4.36Å; E904-V932 PolarHBondContact N-O 3.08Å; E904-V932 PolarHBondContact O-N 3.25Å; V932-P953 HydrophobicContact CG1-CB 3.78Å; V932-L954 CarbonylContact C-O 3.58Å; V932-L954 WeakPolarHBondContact CA-O 3.36Å; V932-V955 HydrophobicContact CG1-CG2 4.37Å; V932-V955 HydrophobicContact CG2-CG1 4.42Å; V932-V955 HydrophobicContact CG2-CG2 4.3Å
933	Y	92.5	Very high	78	Confident	1 Å²	1	65 Å²	65	0%	0.004	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.6	178.4	-61.6	-91.2	0	0	0	110.6	F718 I901 V902 R903 D922 V925 Y931 P953 L954	F718-Y933 AromaticContact CE1-CD1 3.58Å; F718-Y933 HydrophobicContact CE1-CD1 3.58Å; F718-Y933 HydrophobicContact CE1-CD2 4.29Å; F718-Y933 AromaticContact CE1-CE1 3.6Å; F718-Y933 HydrophobicContact CE1-CE1 3.6Å; F718-Y933 HydrophobicContact CE1-CE2 4.32Å; F718-Y933 AromaticContact CE1-CG 3.94Å; F718-Y933 HydrophobicContact CE1-CG 3.94Å; F718-Y933 AromaticContact CZ-CD1 3.51Å; F718-Y933 HydrophobicContact CZ-CD1 3.51Å; F718-Y933 AromaticContact CZ-CE1 3.94Å; F718-Y933 HydrophobicContact CZ-CE1 3.94Å; F718-Y933 AromaticContact CZ-CG 3.97Å; F718-Y933 HydrophobicContact CZ-CG 3.97Å; I901-Y933 HydrophobicContact CG2-CD1 4.29Å; V902-Y933 WeakPolarHBondContact O-CA 3.24Å; R903-Y933 HydrophobicContact CB-CD1 4.13Å; R903-Y933 HydrophobicContact CB-CE1 4.18Å; R903-Y933 HydrophobicContact CG-CD1 3.79Å; R903-Y933 HydrophobicContact CG-CE1 3.52Å; R903-Y933 HydrophobicContact CG-CG 4.46Å; D922-Y933 HydrophobicContact CB-CE1 4.32Å; D922-Y933 VanDerWaalsContact OD2-CE1 3.27Å; D922-Y933 WeakPolarHBondContact OD2-CE1 2.99Å; D922-Y933 PolarHBondContact OD2-OH 3.22Å; V925-Y933 WeakPolarHBondContact CG1-OH 3.4Å; Y931-Y933 HydrophobicContact CG-CE2 4.42Å; Y933-P953 WeakPolarHBondContact O-CA 3.44Å; Y933-L954 HydrophobicContact CD2-CD2 4.21Å; Y933-L954 HydrophobicContact CD2-CG 4.31Å; Y933-L954 PolarHBondContact N-O 3.49Å; Y933-L954 PolarHBondContact O-N 3.18Å
934	R	91.6	Very high	75.9	Confident	56 Å²	56	67.4 Å²	67.4	21%	0.211	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	141.4	169.9	-54.9	-170.3	71.5	164.6	2.4	109.9	E359 V902 L950 S951 P953	E359-R934 IonicContact OE1-CZ 3.84Å; E359-R934 IonicContact OE1-NH1 3.35Å; E359-R934 PolarHBondContact OE1-NH1 3.45Å; E359-R934 IonicContact OE1-NH2 3.46Å; E359-R934 PolarHBondContact OE1-NH2 3.27Å; V902-R934 PolarHBondContact N-O 3.5Å; V902-R934 PolarHBondContact O-N 2.93Å; R934-L950 HydrophobicContact CB-CB 4.06Å; R934-L950 HydrophobicContact CB-CD1 4.33Å; R934-L950 HydrophobicContact CB-CD2 4.27Å; R934-L950 HydrophobicContact CB-CG 4.46Å; R934-L950 PolarHBondContact NH2-O 2.96Å; R934-S951 PolarHBondContact NE-O 3.31Å; R934-S951 PolarHBondContact NH2-O 3.5Å; R934-P953 HydrophobicContact CG-CB 4Å
935	I	89.2	Confident	73.8	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	133	-177.5	-65.3	53	0	0	0	108.5	I702 P706 F718 W720 Y899 Q900 I901 S951	I702-I935 HydrophobicContact CD1-CB 3.84Å; I702-I935 HydrophobicContact CD1-CG2 3.41Å; I702-I935 VanDerWaalsContact CD1-CG2 3.41Å; P706-I935 HydrophobicContact CB-CD1 4.25Å; P706-I935 HydrophobicContact CG-CD1 3.29Å; P706-I935 HydrophobicContact CG-CG1 4.33Å; F718-I935 HydrophobicContact CE2-CD1 4.06Å; W720-I935 HydrophobicContact CD2-CG1 3.97Å; W720-I935 HydrophobicContact CD2-CG2 4.44Å; W720-I935 HydrophobicContact CE3-CG1 4.07Å; W720-I935 HydrophobicContact CG-CG1 4.44Å; W720-I935 HydrophobicContact CZ2-CG1 4.46Å; W720-I935 HydrophobicContact CZ2-CG2 4.31Å; W720-I935 HydrophobicContact CZ3-CG1 4.38Å; Y899-I935 HydrophobicContact CD1-CG2 3.87Å; Y899-I935 HydrophobicContact CG-CG2 4.31Å; Q900-I935 CarbonylContact O-C 3.54Å; Q900-I935 WeakPolarHBondContact O-CA 3.01Å; I901-I935 HydrophobicContact CG1-CG1 4.16Å; I901-I935 HydrophobicContact CG2-CD1 4.46Å; I935-S951 PolarHBondContact N-OG 3.25Å; I935-S951 WeakPolarHBondContact O-CB 3.17Å; I935-S951 PolarHBondContact O-N 3.07Å
936	G	84.4	Confident	72	Confident	6 Å²	6	76.1 Å²	76.1	6%	0.062	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128	162.9	0	0	0	0	0	110.2	Y899 Q900 S948	Y899-G936 CarbonylContact C-O 3.44Å; Y899-G936 WeakPolarHBondContact CA-O 3.5Å; Q900-G936 PolarHBondContact N-O 2.02Å; Q900-G936 PolarHBondContact O-N 3.46Å; G936-S948 VanDerWaalsContact C-OG 3.27Å; G936-S948 VanDerWaalsContact CA-OG 3.25Å; G936-S948 WeakPolarHBondContact CA-OG 3.32Å
937	A	77	Confident	70.4	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.008	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	153.8	162.7	0	0	0	0	0	111.6	D700 I702 P723 L897 D898 Y899 S948	D700-A937 HydrophobicContact CB-CB 4.18Å; I702-A937 HydrophobicContact CD1-CB 4.47Å; P723-A937 HydrophobicContact CG-CB 3.57Å; L897-A937 HydrophobicContact CD1-CB 4.28Å; L897-A937 HydrophobicContact CD2-CB 4.11Å; D898-A937 CarbonylContact O-C 3.57Å; Y899-A937 HydrophobicContact CD1-CB 4.08Å; Y899-A937 HydrophobicContact CE1-CB 3.98Å; A937-S948 WeakPolarHBondContact CA-OG 3.14Å; A937-S948 PolarHBondContact N-OG 3.3Å; A937-S948 WeakPolarHBondContact O-CB 3.24Å; A937-S948 PolarHBondContact O-N 2.89Å; A937-S948 PolarHBondContact O-OG 3.08Å
938	R	71.6	Confident	69.6	Low	52 Å²	52	70.4 Å²	70.4	20%	0.196	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	121.4	173.8	-173.5	-169.4	69.2	152	6.5	110.6	D898 R940	D898-R938 PolarHBondContact N-O 2.77Å; D898-R938 PolarHBondContact O-N 2.73Å; D898-R938 IonicContact OD2-CZ 2.74Å; D898-R938 IonicContact OD2-NH2 2.7Å; D898-R938 PolarHBondContact OD2-NH2 3.05Å; R938-R940 PolarHBondContact O-N 3.39Å
939	T	65.6	Low	69.6	Low	43 Å²	43	64.6 Å²	64.6	26%	0.264	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	126.9	171	-29.3	0	0	0	0	110.5	N895	N895-T939 HydrophobicContact CB-CG2 3.58Å
940	R	55.8	Low	69.6	Low	122 Å²	122	62.1 Å²	62.1	46%	0.46	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	157.2	167	-80.5	-173.5	174.7	-174.7	6.6	110.8	N895 L896 D898 R938 A942	N895-R940 VanDerWaalsContact CB-O 3.24Å; N895-R940 WeakPolarHBondContact CB-O 3.42Å; N895-R940 PolarHBondContact OD1-O 3.39Å; L896-R940 WeakPolarHBondContact O-CB 3.33Å; L896-R940 WeakPolarHBondContact O-CG 3.29Å; L896-R940 PolarHBondContact O-N 2.85Å; L896-R940 VanDerWaalsContact O-N 3.09Å; D898-R940 VanDerWaalsContact CG-NE 3.3Å; D898-R940 IonicContact OD1-CZ 3.36Å; D898-R940 VanDerWaalsContact OD1-CZ 3.26Å; D898-R940 IonicContact OD1-NE 3.64Å; D898-R940 PolarHBondContact OD1-NE 3Å; D898-R940 IonicContact OD1-NH2 2.72Å; D898-R940 PolarHBondContact OD1-NH2 2.97Å; D898-R940 WeakPolarHBondContact OD2-CG 3.25Å; D898-R940 IonicContact OD2-NE 3.67Å; D898-R940 PolarHBondContact OD2-NE 2.99Å; D898-R940 IonicContact OD2-NH2 2.63Å; R938-R940 PolarHBondContact O-N 3.39Å; R940-A942 PolarHBondContact O-N 2.03Å
941	G	52.2	Low	69.7	Low	73 Å²	73	59.1 Å²	59.1	75%	0.753	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	-13.2	172.7	0	0	0	0	0	117.5	M943	G941-M943 PolarHBondContact O-N 2.85Å
942	A	51.1	Low	69.7	Low	60 Å²	60	58.6 Å²	58.6	50%	0.496	32%	0.315	S	S	.	.			trans	-64	126.7	179.8	0	0	0	0	0	112.4	R940 K944	R940-A942 PolarHBondContact O-N 2.03Å; A942-K944 PolarHBondContact O-N 2.86Å
943	M	42.3	Very low	69.6	Low	202 Å²	202	58.1 Å²	58.1	100%	0.995	31%	0.312	S	S	*	.	S	Bend	trans	-67.9	-1.8	-172.2	-134.3	179.3	-170.6	0	0	115.2	G941	G941-M943 PolarHBondContact O-N 2.85Å
944	K	45.8	Very low	69.4	Low	161 Å²	161	58.8 Å²	58.8	70%	0.7	32%	0.316	S	S	*	.	S	Bend	trans	-132.4	137.9	171.8	-73.1	-179.8	176.4	176.7	0	108.8	A942 I946	A942-K944 PolarHBondContact O-N 2.86Å; K944-I946 HydrophobicContact CB-CD1 4.42Å; K944-I946 HydrophobicContact CB-CG1 3.99Å; K944-I946 PolarHBondContact O-N 3.34Å
945	N	46.4	Very low	69.1	Low	134 Å²	134	57.1 Å²	57.1	72%	0.717	31%	0.312	S	S	*	.			trans	-68.8	70.5	169.2	-85.3	-36.2	0	0	0	110.6	N947	N945-N947 PolarHBondContact O-N 3.37Å
946	I	50.5	Low	68.9	Low	109 Å²	109	57.2 Å²	57.2	56%	0.559	31%	0.312	S	S	*	.			trans	-81.8	90.1	168.3	-54.5	176.9	0	0	0	106.1	P698 K944	P698-I946 HydrophobicContact CB-CG2 4.1Å; P698-I946 HydrophobicContact CG-CG2 4.33Å; K944-I946 HydrophobicContact CB-CD1 4.42Å; K944-I946 HydrophobicContact CB-CG1 3.99Å; K944-I946 PolarHBondContact O-N 3.34Å
947	N	54.6	Low	68.9	Low	89 Å²	89	57.2 Å²	57.2	48%	0.476	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-60.4	137.1	168.9	-73.3	-8.8	0	0	0	108.7	P698 N945	P698-N947 WeakPolarHBondContact CB-O 3.47Å; P698-N947 WeakPolarHBondContact CG-O 3.12Å; N945-N947 PolarHBondContact O-N 3.37Å
948	S	65.4	Low	69.2	Low	13 Å²	13	58.1 Å²	58.1	9%	0.091	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-68.2	166.9	172.2	60.4	0	0	0	0	112.9	P698 D700 G936 A937 L950	P698-S948 VanDerWaalsContact CB-CA 3.44Å; D700-S948 WeakPolarHBondContact O-CB 3.34Å; G936-S948 VanDerWaalsContact C-OG 3.27Å; G936-S948 VanDerWaalsContact CA-OG 3.25Å; G936-S948 WeakPolarHBondContact CA-OG 3.32Å; A937-S948 WeakPolarHBondContact CA-OG 3.14Å; A937-S948 PolarHBondContact N-OG 3.3Å; A937-S948 WeakPolarHBondContact O-CB 3.24Å; A937-S948 PolarHBondContact O-N 2.89Å; A937-S948 PolarHBondContact O-OG 3.08Å; S948-L950 PolarHBondContact O-N 3.15Å
949	C	76.9	Confident	69.4	Low	20 Å²	20	58.3 Å²	58.3	14%	0.135	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-61.8	137.1	168.4	83.8	0	0	0	0	108.8	C701 S951	C701-C949 WeakPolarHBondContact CA-SG 3.46Å; C701-C949 HydrophobicContact CB-CB 4.49Å; C701-C949 WeakPolarHBondContact CB-SG 3.44Å; C701-C949 WeakPolarHBondContact SG-CB 3.29Å; C701-C949 CovalentContact SG-SG 2.03Å; C701-C949 PolarHBondContact SG-SG 3.18Å; C949-S951 PolarHBondContact O-N 3.38Å
950	L	83.9	Confident	70.1	Confident	63 Å²	63	58.5 Å²	58.5	33%	0.33	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-69.3	132.9	178	-73.1	177.5	0	0	0	109.5	V902 R934 S948	V902-L950 HydrophobicContact CG2-CD2 4.02Å; R934-L950 HydrophobicContact CB-CB 4.06Å; R934-L950 HydrophobicContact CB-CD1 4.33Å; R934-L950 HydrophobicContact CB-CD2 4.27Å; R934-L950 HydrophobicContact CB-CG 4.46Å; R934-L950 PolarHBondContact NH2-O 2.96Å; S948-L950 PolarHBondContact O-N 3.15Å
951	S	88	Confident	71.2	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-47.4	154.9	174.2	74.8	0	0	0	0	111.6	R934 I935 C949	R934-S951 PolarHBondContact NE-O 3.31Å; R934-S951 PolarHBondContact NH2-O 3.5Å; I935-S951 PolarHBondContact N-OG 3.25Å; I935-S951 WeakPolarHBondContact O-CB 3.17Å; I935-S951 PolarHBondContact O-N 3.07Å; C949-S951 PolarHBondContact O-N 3.38Å
952	P	88.2	Confident	72.7	Confident	1 Å²	1	51 Å²	51	1%	0.006	28%	0.282	C	S	.	.			trans	-43.9	142.7	158.9	-29.7	36.6	0	0	0	111.8	H357 L360 I702 A705 P706	H357-P952 HydrophobicContact CB-CG 4.26Å; L360-P952 HydrophobicContact CD1-CG 4.2Å; I702-P952 WeakPolarHBondContact O-CD 3.37Å; A705-P952 WeakPolarHBondContact CA-O 2.98Å; A705-P952 HydrophobicContact CB-CB 3.99Å; P706-P952 WeakPolarHBondContact CD-O 3.41Å
953	P	87.8	Confident	74.2	Confident	14 Å²	14	48.8 Å²	48.8	9%	0.091	26%	0.263	C	S	.	.			trans	-78.9	132.7	-171.9	29	-32.9	0	0	0	113	V932 Y933 R934 Y988	V932-P953 HydrophobicContact CG1-CB 3.78Å; Y933-P953 WeakPolarHBondContact O-CA 3.44Å; R934-P953 HydrophobicContact CG-CB 4Å; P953-Y988 HydrophobicContact CG-CE2 4.44Å; P953-Y988 WeakPolarHBondContact CG-OH 3.23Å
954	L	88.7	Confident	76.1	Confident	15 Å²	15	39.7 Å²	39.7	8%	0.079	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	115	161.1	164.7	62.1	0	0	0	108.5	P706 V708 F718 V932 Y933 F956	P706-L954 HydrophobicContact CB-CB 3.98Å; P706-L954 HydrophobicContact CB-CD2 3.96Å; P706-L954 HydrophobicContact CG-CB 4.03Å; V708-L954 HydrophobicContact CG2-CD1 3.97Å; V708-L954 HydrophobicContact CG2-CD2 3.85Å; F718-L954 HydrophobicContact CB-CD2 3.99Å; F718-L954 HydrophobicContact CD1-CD2 4.18Å; F718-L954 HydrophobicContact CG-CD2 4.03Å; V932-L954 CarbonylContact C-O 3.58Å; V932-L954 WeakPolarHBondContact CA-O 3.36Å; Y933-L954 HydrophobicContact CD2-CD2 4.21Å; Y933-L954 HydrophobicContact CD2-CG 4.31Å; Y933-L954 PolarHBondContact N-O 3.49Å; Y933-L954 PolarHBondContact O-N 3.18Å; L954-F956 HydrophobicContact CD1-CB 4.32Å
955	V	86	Confident	78	Confident	21 Å²	21	33.7 Å²	33.7	13%	0.127	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.5	173.9	-172.5	0	0	0	0	109.1	V930 Y931 V932 W960 I977	V930-V955 HydrophobicContact CG1-CG1 3.74Å; Y931-V955 WeakPolarHBondContact O-CA 3.3Å; V932-V955 HydrophobicContact CG1-CG2 4.37Å; V932-V955 HydrophobicContact CG2-CG1 4.42Å; V932-V955 HydrophobicContact CG2-CG2 4.3Å; V955-W960 HydrophobicContact CG1-CH2 4.19Å; V955-W960 HydrophobicContact CG1-CZ3 4.07Å; V955-I977 HydrophobicContact CB-CD1 4.47Å; V955-I977 HydrophobicContact CG1-CD1 4.16Å; V955-I977 HydrophobicContact CG2-CD1 3.91Å
956	F	84.9	Confident	79.9	Confident	3 Å²	3	27.4 Å²	27.4	1%	0.013	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	153.7	-173.7	-159	-99.8	0	0	0	114	V708 I716 V930 Y931 L954 W960 F962	V708-F956 HydrophobicContact CG2-CD2 3.92Å; V708-F956 HydrophobicContact CG2-CE2 4.12Å; V708-F956 HydrophobicContact CG2-CG 4.23Å; I716-F956 HydrophobicContact CD1-CB 4.11Å; I716-F956 HydrophobicContact CD1-CD1 3.29Å; I716-F956 HydrophobicContact CD1-CE1 3.81Å; I716-F956 HydrophobicContact CD1-CG 3.76Å; I716-F956 HydrophobicContact CG1-CD1 4.33Å; I716-F956 HydrophobicContact CG1-CE1 4.43Å; V930-F956 WeakPolarHBondContact CA-O 3.38Å; Y931-F956 PolarHBondContact N-O 2.97Å; Y931-F956 PolarHBondContact O-N 2.83Å; L954-F956 HydrophobicContact CD1-CB 4.32Å; F956-W960 HydrophobicContact CE2-CB 4.23Å; F956-W960 HydrophobicContact CZ-CB 4.44Å; F956-W960 WeakPolarHBondContact CZ-O 3.34Å; F956-F962 HydrophobicContact CE2-CB 4.01Å; F956-F962 HydrophobicContact CZ-CB 4.45Å; F956-F962 HydrophobicContact CZ-CD1 4.14Å
957	S	83.9	Confident	81.6	Confident	5 Å²	5	27.1 Å²	27.1	4%	0.035	16%	0.162	C	C	.	.			trans	-135.3	144.6	166.6	170.6	0	0	0	0	108.2	K929 G959 W960	K929-S957 WeakPolarHBondContact O-CA 3.4Å; K929-S957 WeakPolarHBondContact O-CB 3.38Å; K929-S957 PolarHBondContact O-OG 3.01Å; S957-G959 PolarHBondContact O-N 3.47Å; S957-W960 WeakPolarHBondContact O-CB 3.38Å; S957-W960 PolarHBondContact O-N 3.09Å
958	L	83.4	Confident	83.1	Confident	20 Å²	20	24 Å²	24	11%	0.105	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-27.1	-177.6	-73.6	179.5	0	0	0	113.7	I716 V925 W960	I716-L958 HydrophobicContact CB-CD2 4.43Å; V925-L958 HydrophobicContact CB-CD1 4.16Å; V925-L958 HydrophobicContact CB-CG 4.4Å; V925-L958 HydrophobicContact CG2-CD1 3.97Å; V925-L958 HydrophobicContact CG2-CD2 4.1Å; V925-L958 HydrophobicContact CG2-CG 4.34Å; L958-W960 VanDerWaalsContact C-N 3.33Å
959	G	76.1	Confident	83.6	Confident	57 Å²	57	24.8 Å²	24.8	59%	0.588	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-4.1	176.3	0	0	0	0	0	115.2	S957	S957-G959 PolarHBondContact O-N 3.47Å
960	W	81.2	Confident	83.1	Confident	47 Å²	47	31.1 Å²	31.1	18%	0.178	18%	0.175	C	C	.	.	S	Bend	trans	-86.8	146.8	178.9	-64.9	-3.8	0	0	0	111.3	K711 V930 V955 F956 S957 L958 V975	K711-W960 PolarHBondContact NZ-O 3.28Å; V930-W960 HydrophobicContact CG1-CH2 4.14Å; V930-W960 HydrophobicContact CG2-CH2 4.22Å; V930-W960 HydrophobicContact CG2-CZ2 3.99Å; V955-W960 HydrophobicContact CG1-CH2 4.19Å; V955-W960 HydrophobicContact CG1-CZ3 4.07Å; F956-W960 HydrophobicContact CE2-CB 4.23Å; F956-W960 HydrophobicContact CZ-CB 4.44Å; F956-W960 WeakPolarHBondContact CZ-O 3.34Å; S957-W960 WeakPolarHBondContact O-CB 3.38Å; S957-W960 PolarHBondContact O-N 3.09Å; L958-W960 VanDerWaalsContact C-N 3.33Å; W960-V975 HydrophobicContact CH2-CB 4.35Å; W960-V975 HydrophobicContact CH2-CG1 4.02Å; W960-V975 HydrophobicContact CH2-CG2 3.37Å; W960-V975 HydrophobicContact CZ2-CG2 3.9Å; W960-V975 HydrophobicContact CZ3-CG2 3.83Å
961	P	78.8	Confident	81.8	Confident	23 Å²	23	37.3 Å²	37.3	15%	0.149	20%	0.195	C	C	.	.			trans	-68.6	164.3	169.7	27.4	-30	0	0	0	110.7	D965 D969 R990	P961-D965 VanDerWaalsContact CA-OD2 3.28Å; P961-D965 WeakPolarHBondContact CA-OD2 3.43Å; P961-D969 HydrophobicContact CB-CB 4.22Å; P961-D969 HydrophobicContact CG-CB 3.77Å; P961-D969 WeakPolarHBondContact CG-OD2 3.48Å; P961-R990 PolarHBondContact O-NH1 3.47Å
962	F	82.6	Confident	80	Confident	13 Å²	13	43.1 Å²	43.1	6%	0.057	22%	0.217	C	C	.	.			trans	-153	146.9	164.6	72.3	-80.3	0	0	0	109.2	V708 K711 F956 G964 D965	V708-F962 HydrophobicContact CB-CB 4.31Å; V708-F962 HydrophobicContact CB-CD2 3.89Å; V708-F962 HydrophobicContact CB-CE2 4.44Å; V708-F962 HydrophobicContact CB-CG 3.99Å; V708-F962 HydrophobicContact CG1-CD1 3.88Å; V708-F962 HydrophobicContact CG1-CD2 3.77Å; V708-F962 HydrophobicContact CG1-CE1 4.02Å; V708-F962 HydrophobicContact CG1-CE2 3.95Å; V708-F962 HydrophobicContact CG1-CG 3.77Å; V708-F962 HydrophobicContact CG1-CZ 4.08Å; V708-F962 WeakPolarHBondContact O-CD2 3.42Å; K711-F962 HydrophobicContact CB-CE1 3.98Å; K711-F962 HydrophobicContact CD-CD1 3.88Å; K711-F962 HydrophobicContact CD-CE1 3.59Å; K711-F962 HydrophobicContact CG-CD1 4.49Å; K711-F962 HydrophobicContact CG-CE1 3.73Å; F956-F962 HydrophobicContact CE2-CB 4.01Å; F956-F962 HydrophobicContact CZ-CB 4.45Å; F956-F962 HydrophobicContact CZ-CD1 4.14Å; F962-G964 PolarHBondContact O-N 2.83Å; F962-G964 VanDerWaalsContact O-N 3.14Å; F962-D965 HydrophobicContact CD1-CB 3.94Å; F962-D965 HydrophobicContact CE1-CB 3.57Å; F962-D965 HydrophobicContact CZ-CB 3.9Å; F962-D965 PolarHBondContact N-OD2 3.12Å; F962-D965 VanDerWaalsContact O-CG 3.24Å; F962-D965 PolarHBondContact O-N 2.87Å
963	C	83.1	Confident	78.3	Confident	15 Å²	15	45.2 Å²	45.2	10%	0.101	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	120.9	176.4	-176.9	0	0	0	0	112.4	E993 V1000 M1008 C1010	C963-E993 PolarHBondContact N-OE1 2.93Å; C963-V1000 WeakPolarHBondContact O-CG1 3.44Å; C963-M1008 PolarHBondContact SG-O 3.38Å; C963-C1010 WeakPolarHBondContact CA-SG 3.48Å; C963-C1010 HydrophobicContact CB-CB 3.64Å; C963-C1010 WeakPolarHBondContact CB-SG 3.15Å; C963-C1010 WeakPolarHBondContact SG-CA 3.49Å; C963-C1010 WeakPolarHBondContact SG-CB 3.32Å; C963-C1010 PolarHBondContact SG-N 3.48Å; C963-C1010 CovalentContact SG-SG 2.02Å; C963-C1010 PolarHBondContact SG-SG 3.41Å
964	G	82.2	Confident	76.3	Confident	11 Å²	11	48 Å²	48	11%	0.113	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	105.6	6.4	-175.8	0	0	0	0	0	113.8	F962 D996 G998 N999	F962-G964 PolarHBondContact O-N 2.83Å; F962-G964 VanDerWaalsContact O-N 3.14Å; G964-D996 WeakPolarHBondContact CA-OD1 3.35Å; G964-D996 VanDerWaalsContact N-CG 3.33Å; G964-D996 PolarHBondContact N-OD1 3.24Å; G964-D996 PolarHBondContact N-OD2 3.5Å; G964-G998 CarbonylContact O-C 3.49Å; G964-G998 VanDerWaalsContact O-C 3.25Å; G964-G998 WeakPolarHBondContact O-CA 3.19Å; G964-N999 WeakPolarHBondContact CA-O 3.32Å
965	D	84.7	Confident	74.4	Confident	35 Å²	35	49 Å²	49	19%	0.187	25%	0.253	C	S	.	.	S	Bend	trans	-93.2	-8.1	170.3	79	25.3	0	0	0	114	K711 P961 F962 I967 D996	K711-D965 IonicContact NZ-OD2 3.17Å; K711-D965 PolarHBondContact NZ-OD2 3.01Å; P961-D965 VanDerWaalsContact CA-OD2 3.28Å; P961-D965 WeakPolarHBondContact CA-OD2 3.43Å; F962-D965 HydrophobicContact CD1-CB 3.94Å; F962-D965 HydrophobicContact CE1-CB 3.57Å; F962-D965 HydrophobicContact CZ-CB 3.9Å; F962-D965 PolarHBondContact N-OD2 3.12Å; F962-D965 VanDerWaalsContact O-CG 3.24Å; F962-D965 PolarHBondContact O-N 2.87Å; D965-I967 WeakPolarHBondContact OD1-CA 3Å; D965-I967 WeakPolarHBondContact OD1-CB 2.99Å; D965-I967 WeakPolarHBondContact OD1-CG1 3.31Å; D965-I967 PolarHBondContact OD1-N 3.21Å; D965-D996 PolarHBondContact N-OD2 3.45Å; D965-D996 VanDerWaalsContact N-OD2 3.15Å
966	G	86.7	Confident	72.3	Confident	2 Å²	2	53 Å²	53	2%	0.021	27%	0.274	C	S	.	.	S	Bend	trans	84.1	10.6	177.1	0	0	0	0	0	114.1	D996 S1021 P1022	G966-D996 VanDerWaalsContact CA-OD1 3.26Å; G966-D996 WeakPolarHBondContact CA-OD1 3.35Å; G966-D996 PolarHBondContact N-OD1 2.95Å; G966-D996 PolarHBondContact N-OD2 3.35Å; G966-D996 VanDerWaalsContact N-OD2 3.08Å; G966-S1021 CarbonylContact O-C 3.44Å; G966-S1021 PolarHBondContact O-OG 3.44Å; G966-P1022 WeakPolarHBondContact O-CA 3.37Å; G966-P1022 VanDerWaalsContact O-N 3.17Å
967	I	86.5	Confident	70.5	Confident	103 Å²	103	54.5 Å²	54.5	53%	0.528	28%	0.281	S	S	.	.			trans	-114.3	95.2	-178.8	-51.3	178.2	0	0	0	109.8	D965 D969 S1021	D965-I967 WeakPolarHBondContact OD1-CA 3Å; D965-I967 WeakPolarHBondContact OD1-CB 2.99Å; D965-I967 WeakPolarHBondContact OD1-CG1 3.31Å; D965-I967 PolarHBondContact OD1-N 3.21Å; I967-D969 PolarHBondContact O-N 3Å; I967-S1021 VanDerWaalsContact CA-OG 3.31Å; I967-S1021 WeakPolarHBondContact CA-OG 3.39Å
968	V	85.6	Confident	68.5	Low	23 Å²	23	61.1 Å²	61.1	14%	0.139	31%	0.312	C	S	.	.			trans	-62.7	99.6	-177.8	-169.4	0	0	0	0	111.2	K970 E993 D996 S1021	V968-K970 PolarHBondContact O-N 2.97Å; V968-E993 HydrophobicContact CG1-CB 4.07Å; V968-E993 VanDerWaalsContact CG1-O 3.32Å; V968-E993 WeakPolarHBondContact CG1-O 3.5Å; V968-D996 HydrophobicContact CG2-CB 4.06Å; V968-S1021 PolarHBondContact N-OG 2.81Å
969	D	76.3	Confident	66.4	Low	30 Å²	30	66.3 Å²	66.3	16%	0.16	35%	0.345	C	S	.	.			trans	-78.6	107.3	-178.7	-166.4	6.5	0	0	0	112.1	P961 I967 Y971 E993	P961-D969 HydrophobicContact CB-CB 4.22Å; P961-D969 HydrophobicContact CG-CB 3.77Å; P961-D969 WeakPolarHBondContact CG-OD2 3.48Å; I967-D969 PolarHBondContact O-N 3Å; D969-Y971 VanDerWaalsContact CG-O 3.3Å; D969-Y971 WeakPolarHBondContact OD1-CA 3.46Å; D969-Y971 PolarHBondContact OD1-N 2.03Å; D969-Y971 VanDerWaalsContact OD2-O 3.12Å; D969-E993 PolarHBondContact N-OE2 2.75Å; D969-E993 PolarHBondContact O-N 3.1Å
970	K	65.9	Low	64.9	Low	152 Å²	152	69.4 Å²	69.4	66%	0.661	35%	0.347	S	S	*	.			trans	-83.7	-14.4	175.5	-64.8	179.9	-178.5	175.2	0	112.8	V968	V968-K970 PolarHBondContact O-N 2.97Å
971	Y	57.2	Low	62.8	Low	194 Å²	194	72 Å²	72	76%	0.761	36%	0.363	S	S	*	.	S	Bend	trans	-99.3	135.8	-175.8	-65.6	-81.8	0	0	0	110.5	D969 V973	D969-Y971 VanDerWaalsContact CG-O 3.3Å; D969-Y971 WeakPolarHBondContact OD1-CA 3.46Å; D969-Y971 PolarHBondContact OD1-N 2.03Å; D969-Y971 VanDerWaalsContact OD2-O 3.12Å; Y971-V973 PolarHBondContact O-N 3.07Å
972	R	50.6	Low	60.6	Low	122 Å²	122	76 Å²	76	46%	0.46	40%	0.399	S	S	.	.			trans	-84.5	100.5	-178.5	-151.1	179.2	-159.9	-178.5	2.4	108.2	V974 F989 R990	R972-V974 VanDerWaalsContact C-N 3.31Å; R972-V974 HydrophobicContact CB-CG2 4.3Å; R972-V974 HydrophobicContact CG-CG2 4.15Å; R972-V974 PolarHBondContact O-N 3.24Å; R972-F989 HydrophobicContact CG-CD1 4.41Å; R972-F989 VanDerWaalsContact CZ-CG 3.43Å; R972-F989 VanDerWaalsContact NH1-CE1 3.33Å; R972-R990 WeakPolarHBondContact CG-O 3.37Å; R972-R990 PolarHBondContact NE-O 3.34Å
973	V	51.9	Low	58.4	Low	45 Å²	45	79.6 Å²	79.6	27%	0.273	43%	0.425	S	S	.	.			trans	-66.9	93.3	168.4	-176	0	0	0	0	108.3	Y971 V975	Y971-V973 PolarHBondContact O-N 3.07Å; V973-V975 HydrophobicContact CG1-CG2 3.99Å; V973-V975 PolarHBondContact O-N 2.71Å
974	V	46	Very low	56.2	Low	73 Å²	73	87.6 Å²	87.6	44%	0.442	46%	0.461	S	S	.	.	B	Isolated β-bridge	trans	-87.2	96.8	175.4	-177.8	0	0	0	0	108.2	R972 N976 F989	R972-V974 VanDerWaalsContact C-N 3.31Å; R972-V974 HydrophobicContact CB-CG2 4.3Å; R972-V974 HydrophobicContact CG-CG2 4.15Å; R972-V974 PolarHBondContact O-N 3.24Å; V974-N976 PolarHBondContact O-N 2.97Å; V974-F989 HydrophobicContact CG1-CE1 4.47Å; V974-F989 HydrophobicContact CG2-CD1 4.06Å; V974-F989 HydrophobicContact CG2-CE1 3.94Å
975	V	49.1	Very low	53.7	Low	36 Å²	36	92.9 Å²	92.9	22%	0.218	50%	0.495	C	S	.	.			trans	-81.3	109.6	173.4	-164.6	0	0	0	0	108	W960 V973 I977	W960-V975 HydrophobicContact CH2-CB 4.35Å; W960-V975 HydrophobicContact CH2-CG1 4.02Å; W960-V975 HydrophobicContact CH2-CG2 3.37Å; W960-V975 HydrophobicContact CZ2-CG2 3.9Å; W960-V975 HydrophobicContact CZ3-CG2 3.83Å; V973-V975 HydrophobicContact CG1-CG2 3.99Å; V973-V975 PolarHBondContact O-N 2.71Å; V975-I977 HydrophobicContact CB-CG1 4.15Å; V975-I977 HydrophobicContact CG1-CD1 4.3Å; V975-I977 HydrophobicContact CG1-CG1 3.68Å; V975-I977 PolarHBondContact O-N 3.22Å; V975-I977 VanDerWaalsContact O-N 3.17Å
976	N	41	Very low	51.6	Low	104 Å²	104	94.6 Å²	94.6	56%	0.556	51%	0.507	S	S	*	.			trans	-84.6	86.7	175.8	-165.2	21.1	0	0	0	110	V974 Q978	V974-N976 PolarHBondContact O-N 2.97Å; N976-Q978 PolarHBondContact ND2-OE1 3.18Å; N976-Q978 PolarHBondContact O-N 2.87Å; N976-Q978 WeakPolarHBondContact OD1-CG 2.87Å; N976-Q978 PolarHBondContact OD1-OE1 3.45Å
977	I	48.2	Very low	49.3	Very low	34 Å²	34	101.1 Å²	101.1	17%	0.174	53%	0.534	C	S	.	.			trans	-79.5	49.3	-177.2	-42.2	178.6	0	0	0	110.9	V955 V975 T979 L980 I981 Y988	V955-I977 HydrophobicContact CB-CD1 4.47Å; V955-I977 HydrophobicContact CG1-CD1 4.16Å; V955-I977 HydrophobicContact CG2-CD1 3.91Å; V975-I977 HydrophobicContact CB-CG1 4.15Å; V975-I977 HydrophobicContact CG1-CD1 4.3Å; V975-I977 HydrophobicContact CG1-CG1 3.68Å; V975-I977 PolarHBondContact O-N 3.22Å; V975-I977 VanDerWaalsContact O-N 3.17Å; I977-T979 VanDerWaalsContact C-N 3.34Å; I977-L980 HydrophobicContact CG2-CB 4.15Å; I977-I981 HydrophobicContact CG2-CD1 4.41Å; I977-I981 HydrophobicContact CG2-CG1 4.38Å; I977-Y988 HydrophobicContact CD1-CD2 3.94Å
978	Q	41.3	Very low	47.1	Very low	144 Å²	144	99.5 Å²	99.5	67%	0.673	52%	0.522	S	S	*	.	S	Bend	trans	-82.7	-8.4	176.4	-84.1	-179	-49.4	0	0	113.6	N976	N976-Q978 PolarHBondContact ND2-OE1 3.18Å; N976-Q978 PolarHBondContact O-N 2.87Å; N976-Q978 WeakPolarHBondContact OD1-CG 2.87Å; N976-Q978 PolarHBondContact OD1-OE1 3.45Å
979	T	40.7	Very low	45.1	Very low	130 Å²	130	102.5 Å²	102.5	80%	0.798	53%	0.534	S	S	*	.	S	Bend	trans	-113.2	2.2	-170.5	23.5	0	0	0	0	115.8	I977	I977-T979 VanDerWaalsContact C-N 3.34Å
980	L	43.8	Very low	43.9	Very low	121 Å²	121	104.9 Å²	104.9	63%	0.634	54%	0.54	S	S	*	.	S	Bend	trans	-126.7	-13.3	-173.4	-80.4	163.2	0	0	0	115.9	I977	I977-L980 HydrophobicContact CG2-CB 4.15Å
981	I	37.7	Very low	43.4	Very low	101 Å²	101	103.4 Å²	103.4	52%	0.518	54%	0.536	S	S	.	.			trans	-138.4	122.1	-179.2	-39.5	176.6	0	0	0	109.5	I977 S983	I977-I981 HydrophobicContact CG2-CD1 4.41Å; I977-I981 HydrophobicContact CG2-CG1 4.38Å; I981-S983 PolarHBondContact O-N 3Å; I981-S983 VanDerWaalsContact O-N 3.16Å
982	A	32.3	Very low	44	Very low	109 Å²	109	103 Å²	103	90%	0.901	53%	0.533	S	S	*	.			trans	-87.4	70.3	179.5	0	0	0	0	0	111.6
983	S	36	Very low	45.6	Very low	88 Å²	88	98.5 Å²	98.5	62%	0.615	52%	0.517	S	S	*	.	S	Bend	trans	-163.6	162.2	161.2	-11.4	0	0	0	0	109.4	I981	I981-S983 PolarHBondContact O-N 3Å; I981-S983 VanDerWaalsContact O-N 3.16Å
984	E	37.4	Very low	47.2	Very low	182 Å²	182	99.4 Å²	99.4	85%	0.85	53%	0.53	S	S	*	.	S	Bend	trans	-45.8	160.8	-163.5	-64.2	171.3	133.5	0	0	119.1	V986	E984-V986 PolarHBondContact O-N 2.93Å; E984-V986 VanDerWaalsContact O-N 3.09Å
985	C	29.9	Very low	49.4	Very low	123 Å²	123	96 Å²	96	83%	0.831	51%	0.509	S	S	*	.			trans	-53	101.8	-162.1	-62.4	0	0	0	0	117.3
986	V	39.3	Very low	51.4	Low	71 Å²	71	94.2 Å²	94.2	43%	0.43	50%	0.498	S	S	.	.			trans	-98.4	100.4	163.9	-169.5	0	0	0	0	111.3	E984 Y988	E984-V986 PolarHBondContact O-N 2.93Å; E984-V986 VanDerWaalsContact O-N 3.09Å; V986-Y988 HydrophobicContact CB-CD2 4.49Å; V986-Y988 HydrophobicContact CB-CE2 4.45Å; V986-Y988 HydrophobicContact CG1-CD2 3.56Å; V986-Y988 HydrophobicContact CG1-CE2 3.43Å; V986-Y988 VanDerWaalsContact CG1-CE2 3.43Å; V986-Y988 HydrophobicContact CG1-CG 4.38Å; V986-Y988 PolarHBondContact O-N 3.25Å
987	K	38.2	Very low	53.6	Low	138 Å²	138	89.5 Å²	89.5	60%	0.6	47%	0.473	S	S	*	.			trans	-88.2	84.8	174.6	-164.6	171.5	-170.5	174.9	0	109.8	F989	K987-F989 HydrophobicContact CD-CD2 4.39Å; K987-F989 HydrophobicContact CD-CE1 4.47Å; K987-F989 HydrophobicContact CD-CE2 3.69Å; K987-F989 HydrophobicContact CD-CZ 3.76Å; K987-F989 HydrophobicContact CG-CD2 4.23Å; K987-F989 HydrophobicContact CG-CE1 4.49Å; K987-F989 HydrophobicContact CG-CE2 4Å; K987-F989 HydrophobicContact CG-CZ 4.17Å; K987-F989 PolarHBondContact O-N 2.8Å
988	Y	41.4	Very low	55.3	Low	70 Å²	70	88.9 Å²	88.9	28%	0.275	48%	0.475	S	S	.	.			trans	-61.6	97.6	176.7	-92.3	-79.1	0	0	0	111	H357 P953 I977 V986	H357-Y988 PolarHBondContact NE2-OH 2.8Å; P953-Y988 HydrophobicContact CG-CE2 4.44Å; P953-Y988 WeakPolarHBondContact CG-OH 3.23Å; I977-Y988 HydrophobicContact CD1-CD2 3.94Å; V986-Y988 HydrophobicContact CB-CD2 4.49Å; V986-Y988 HydrophobicContact CB-CE2 4.45Å; V986-Y988 HydrophobicContact CG1-CD2 3.56Å; V986-Y988 HydrophobicContact CG1-CE2 3.43Å; V986-Y988 VanDerWaalsContact CG1-CE2 3.43Å; V986-Y988 HydrophobicContact CG1-CG 4.38Å; V986-Y988 PolarHBondContact O-N 3.25Å
989	F	43	Very low	57.2	Low	85 Å²	85	82.7 Å²	82.7	37%	0.373	45%	0.446	S	S	.	.	B	Isolated β-bridge	trans	-98	102.5	169.9	-80.5	-50.9	0	0	0	108.9	R972 V974 K987 Q991	R972-F989 HydrophobicContact CG-CD1 4.41Å; R972-F989 VanDerWaalsContact CZ-CG 3.43Å; R972-F989 VanDerWaalsContact NH1-CE1 3.33Å; V974-F989 HydrophobicContact CG1-CE1 4.47Å; V974-F989 HydrophobicContact CG2-CD1 4.06Å; V974-F989 HydrophobicContact CG2-CE1 3.94Å; K987-F989 HydrophobicContact CD-CD2 4.39Å; K987-F989 HydrophobicContact CD-CE1 4.47Å; K987-F989 HydrophobicContact CD-CE2 3.69Å; K987-F989 HydrophobicContact CD-CZ 3.76Å; K987-F989 HydrophobicContact CG-CD2 4.23Å; K987-F989 HydrophobicContact CG-CE1 4.49Å; K987-F989 HydrophobicContact CG-CE2 4Å; K987-F989 HydrophobicContact CG-CZ 4.17Å; K987-F989 PolarHBondContact O-N 2.8Å; F989-Q991 PolarHBondContact O-N 2.89Å
990	R	51.7	Low	59	Low	81 Å²	81	78 Å²	78	31%	0.306	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-58.3	136.2	156	-74.1	-175.7	174.6	-176.8	-5.8	108.6	P961 R972	P961-R990 PolarHBondContact O-NH1 3.47Å; R972-R990 WeakPolarHBondContact CG-O 3.37Å; R972-R990 PolarHBondContact NE-O 3.34Å
991	Q	54.6	Low	60.6	Low	120 Å²	120	72.8 Å²	72.8	56%	0.561	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-66.5	161.1	165.5	-75	166.8	-78.8	0	0	108.7	F989 E1011	F989-Q991 PolarHBondContact O-N 2.89Å; Q991-E1011 PolarHBondContact NE2-OE1 3.07Å
992	R	70.7	Confident	62.5	Low	185 Å²	185	68.8 Å²	68.8	70%	0.698	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-76.8	132.8	171.5	-67.8	174.8	176.1	156.8	-0.8	107.6	A994	R992-A994 PolarHBondContact O-N 3.37Å
993	E	83.4	Confident	64.6	Low	28 Å²	28	67.8 Å²	67.8	13%	0.131	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-69.9	128.1	175.1	-66.4	171.6	170.4	0	0	108.5	C963 V968 D969 C1010	C963-E993 PolarHBondContact N-OE1 2.93Å; V968-E993 HydrophobicContact CG1-CB 4.07Å; V968-E993 VanDerWaalsContact CG1-O 3.32Å; V968-E993 WeakPolarHBondContact CG1-O 3.5Å; D969-E993 PolarHBondContact N-OE2 2.75Å; D969-E993 PolarHBondContact O-N 3.1Å; E993-C1010 HydrophobicContact CB-CB 3.98Å; E993-C1010 HydrophobicContact CG-CB 3.71Å
994	A	86.7	Confident	66.9	Low	65 Å²	65	63.7 Å²	63.7	54%	0.537	31%	0.314	S	S	.	.	S	Bend	trans	-86.8	-31.3	177.8	0	0	0	0	0	111.1	R992 C1010	R992-A994 PolarHBondContact O-N 3.37Å; A994-C1010 PolarHBondContact N-O 2.99Å
995	C	90.8	Very high	69.2	Low	0 Å²	0	55 Å²	55	0%	0	27%	0.274	C	S	.	.			trans	-144.2	166.4	172.7	58.7	0	0	0	0	107.9	C1006 C1010 C1018	C995-C1006 HydrophobicContact CB-CB 3.96Å; C995-C1006 WeakPolarHBondContact CB-SG 3.18Å; C995-C1006 WeakPolarHBondContact SG-CA 3.32Å; C995-C1006 WeakPolarHBondContact SG-CB 3.1Å; C995-C1006 CovalentContact SG-SG 2.04Å; C995-C1006 PolarHBondContact SG-SG 3.16Å; C995-C1010 PolarHBondContact N-O 3.16Å; C995-C1010 WeakPolarHBondContact O-CB 3.28Å; C995-C1010 PolarHBondContact O-SG 3.17Å; C995-C1018 HydrophobicContact CB-CB 3.72Å
996	D	91.1	Very high	72	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.235	C	C	.	.			trans	-158.6	107.7	161.3	-178.1	-25.2	0	0	0	104	G964 D965 G966 V968 G998 S1023	G964-D996 WeakPolarHBondContact CA-OD1 3.35Å; G964-D996 VanDerWaalsContact N-CG 3.33Å; G964-D996 PolarHBondContact N-OD1 3.24Å; G964-D996 PolarHBondContact N-OD2 3.5Å; D965-D996 PolarHBondContact N-OD2 3.45Å; D965-D996 VanDerWaalsContact N-OD2 3.15Å; G966-D996 VanDerWaalsContact CA-OD1 3.26Å; G966-D996 WeakPolarHBondContact CA-OD1 3.35Å; G966-D996 PolarHBondContact N-OD1 2.95Å; G966-D996 PolarHBondContact N-OD2 3.35Å; G966-D996 VanDerWaalsContact N-OD2 3.08Å; V968-D996 HydrophobicContact CG2-CB 4.06Å; D996-G998 VanDerWaalsContact C-N 3.32Å; D996-G998 WeakPolarHBondContact OD1-CA 3.48Å; D996-G998 PolarHBondContact OD1-N 3.07Å; D996-S1023 PolarHBondContact N-OG 3.04Å; D996-S1023 VanDerWaalsContact O-CB 3.26Å; D996-S1023 WeakPolarHBondContact O-CB 3.36Å; D996-S1023 PolarHBondContact O-N 2.88Å; D996-S1023 PolarHBondContact O-OG 3.3Å
997	D	87.6	Confident	74	Confident	5 Å²	5	47 Å²	47	3%	0.027	22%	0.222	C	C	.	.			trans	-89	0.1	-177.4	103.9	-50.7	0	0	0	111.8	R269 N999 C1006	R269-D997 WeakPolarHBondContact CD-O 3.22Å; R269-D997 WeakPolarHBondContact CG-OD2 3.07Å; R269-D997 PolarHBondContact NE-O 3.13Å; R269-D997 PolarHBondContact NH1-O 2.9Å; D997-N999 PolarHBondContact OD1-N 3.41Å; D997-N999 PolarHBondContact OD1-ND2 3.11Å; D997-N999 PolarHBondContact OD2-ND2 2.97Å; D997-C1006 HydrophobicContact CB-CB 4.09Å
998	G	84.3	Confident	75.9	Confident	21 Å²	21	41 Å²	41	22%	0.216	20%	0.196	C	C	.	.	S	Bend	trans	81.4	24.8	-179.4	0	0	0	0	0	114.5	G964 D996	G964-G998 CarbonylContact O-C 3.49Å; G964-G998 VanDerWaalsContact O-C 3.25Å; G964-G998 WeakPolarHBondContact O-CA 3.19Å; D996-G998 VanDerWaalsContact C-N 3.32Å; D996-G998 WeakPolarHBondContact OD1-CA 3.48Å; D996-G998 PolarHBondContact OD1-N 3.07Å
999	N	81.4	Confident	77.6	Confident	14 Å²	14	40 Å²	40	8%	0.075	20%	0.196	C	C	.	.	S	Bend	trans	-148.4	-173.2	164.8	91.1	85.3	0	0	0	111.2	G964 D997 L1001 D1004	G964-N999 WeakPolarHBondContact CA-O 3.32Å; D997-N999 PolarHBondContact OD1-N 3.41Å; D997-N999 PolarHBondContact OD1-ND2 3.11Å; D997-N999 PolarHBondContact OD2-ND2 2.97Å; N999-L1001 WeakPolarHBondContact OD1-CA 3.4Å; N999-L1001 WeakPolarHBondContact OD1-CB 3.28Å; N999-L1001 WeakPolarHBondContact OD1-CD1 3.35Å; N999-L1001 WeakPolarHBondContact OD1-CG 3.48Å; N999-L1001 PolarHBondContact OD1-N 2.9Å; N999-D1004 PolarHBondContact ND2-OD2 3.06Å; N999-D1004 PolarHBondContact OD1-OD2 3.17Å
1000	V	78.2	Confident	79.6	Confident	32 Å²	32	36 Å²	36	19%	0.194	18%	0.179	C	C	.	.			trans	-131.3	30.6	-177.8	-64.3	0	0	0	0	113	I709 C963	I709-V1000 HydrophobicContact CG2-CG2 4.21Å; C963-V1000 WeakPolarHBondContact O-CG1 3.44Å
1001	L	77.3	Confident	81.2	Confident	10 Å²	10	36.4 Å²	36.4	5%	0.052	18%	0.184	C	C	.	.			trans	-97.5	117.3	-179.3	-59.3	174.6	0	0	0	110.5	W117 F329 F330 N999 D1004	W117-L1001 HydrophobicContact CH2-CD1 4.31Å; F329-L1001 HydrophobicContact CD1-CD2 4.41Å; F329-L1001 HydrophobicContact CE1-CD1 4.07Å; F329-L1001 HydrophobicContact CE1-CD2 3.47Å; F329-L1001 VanDerWaalsContact CE1-CD2 3.47Å; F329-L1001 HydrophobicContact CE1-CG 4.43Å; F329-L1001 HydrophobicContact CE2-CD2 4.45Å; F329-L1001 HydrophobicContact CZ-CD2 3.5Å; F330-L1001 HydrophobicContact CE1-CD1 4.43Å; N999-L1001 WeakPolarHBondContact OD1-CA 3.4Å; N999-L1001 WeakPolarHBondContact OD1-CB 3.28Å; N999-L1001 WeakPolarHBondContact OD1-CD1 3.35Å; N999-L1001 WeakPolarHBondContact OD1-CG 3.48Å; N999-L1001 PolarHBondContact OD1-N 2.9Å; L1001-D1004 VanDerWaalsContact O-OD2 3.13Å
1002	D	76.6	Confident	82.7	Confident	18 Å²	18	33.4 Å²	33.4	10%	0.096	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	158.1	169.1	-22.9	-72.4	0	0	0	111.2	R188 N206 M1008 E1013	R188-D1002 IonicContact CZ-OD2 2.74Å; R188-D1002 IonicContact NH1-OD2 2.75Å; R188-D1002 PolarHBondContact NH1-OD2 2.76Å; R188-D1002 IonicContact NH2-OD2 2.79Å; R188-D1002 PolarHBondContact NH2-OD2 2.04Å; N206-D1002 PolarHBondContact ND2-O 2.86Å; D1002-M1008 WeakPolarHBondContact OD1-CB 3.25Å; D1002-M1008 VanDerWaalsContact OD1-CG 3.3Å; D1002-M1008 WeakPolarHBondContact OD1-CG 3.23Å; D1002-M1008 PolarHBondContact OD1-N 2.92Å; D1002-E1013 WeakPolarHBondContact CA-OE1 3.36Å
1003	Y	76.9	Confident	83.3	Confident	88 Å²	88	26.1 Å²	26.1	35%	0.345	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	16.7	-179.5	-53.3	-80.2	0	0	0	115.5	Y182 E1013	Y182-Y1003 AromaticContact CD1-CD1 3.97Å; Y182-Y1003 HydrophobicContact CD1-CD1 3.97Å; Y182-Y1003 HydrophobicContact CE1-CD1 4.14Å; Y182-Y1003 HydrophobicContact CE1-CG 4.33Å; Y182-Y1003 WeakPolarHBondContact CE1-O 3.45Å; Y182-Y1003 HydrophobicContact CG-CD1 4.42Å; Y182-Y1003 VanDerWaalsContact CZ-O 3.3Å; Y182-Y1003 PolarHBondContact OH-O 2.82Å; Y1003-E1013 WeakPolarHBondContact CA-OE2 3.31Å; Y1003-E1013 VanDerWaalsContact N-CD 3.34Å; Y1003-E1013 PolarHBondContact N-OE1 3.16Å; Y1003-E1013 PolarHBondContact N-OE2 3.17Å; Y1003-E1013 VanDerWaalsContact N-OE2 3.15Å
1004	D	84.3	Confident	82.9	Confident	1 Å²	1	34 Å²	34	1%	0.005	19%	0.185	C	C	.	.	S	Bend	trans	-101.1	4.5	166.7	71.2	28.3	0	0	0	114.3	N206 A208 N999 L1001 C1006 E1013 C1025	N206-D1004 HydrophobicContact CB-CB 3.7Å; A208-D1004 HydrophobicContact CB-CB 4.32Å; A208-D1004 WeakPolarHBondContact CB-O 3.44Å; N999-D1004 PolarHBondContact ND2-OD2 3.06Å; N999-D1004 PolarHBondContact OD1-OD2 3.17Å; L1001-D1004 VanDerWaalsContact O-OD2 3.13Å; D1004-C1006 WeakPolarHBondContact OD1-CA 3.43Å; D1004-C1006 PolarHBondContact OD1-N 2.84Å; D1004-C1006 VanDerWaalsContact OD1-O 3.11Å; D1004-E1013 PolarHBondContact N-OE2 2.84Å; D1004-C1025 WeakPolarHBondContact O-CB 3.47Å
1005	G	85.5	Confident	82.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	92.6	-11.9	-175.7	0	0	0	0	0	114.6	E1013 F1016 C1018	G1005-E1013 VanDerWaalsContact CA-OE2 3.26Å; G1005-E1013 WeakPolarHBondContact CA-OE2 3.25Å; G1005-E1013 PolarHBondContact N-OE2 2.79Å; G1005-E1013 PolarHBondContact O-N 2.78Å; G1005-F1016 VanDerWaalsContact CA-CD2 3.5Å; G1005-F1016 VanDerWaalsContact N-CZ 3.35Å; G1005-C1018 PolarHBondContact O-SG 2.81Å
1006	C	89.1	Confident	81.7	Confident	3 Å²	3	33.4 Å²	33.4	2%	0.02	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-120.3	106.5	167.2	-158.8	0	0	0	0	110	C995 D997 D1004	C995-C1006 HydrophobicContact CB-CB 3.96Å; C995-C1006 WeakPolarHBondContact CB-SG 3.18Å; C995-C1006 WeakPolarHBondContact SG-CA 3.32Å; C995-C1006 WeakPolarHBondContact SG-CB 3.1Å; C995-C1006 CovalentContact SG-SG 2.04Å; C995-C1006 PolarHBondContact SG-SG 3.16Å; D997-C1006 HydrophobicContact CB-CB 4.09Å; D1004-C1006 WeakPolarHBondContact OD1-CA 3.43Å; D1004-C1006 PolarHBondContact OD1-N 2.84Å; D1004-C1006 VanDerWaalsContact OD1-O 3.11Å
1007	S	80.8	Confident	81.3	Confident	23 Å²	23	38.5 Å²	38.5	16%	0.161	20%	0.203	C	C	.	.			trans	-56.5	159.6	179.5	61.7	0	0	0	0	111.2	N1009 C1010 E1011	S1007-N1009 PolarHBondContact O-N 2.88Å; S1007-C1010 PolarHBondContact O-N 3.26Å; S1007-E1011 WeakPolarHBondContact CB-O 3.47Å; S1007-E1011 PolarHBondContact N-O 3.34Å; S1007-E1011 PolarHBondContact OG-N 2.75Å; S1007-E1011 VanDerWaalsContact OG-N 3.14Å; S1007-E1011 PolarHBondContact OG-O 2.8Å
1008	M	78.8	Confident	81.3	Confident	11 Å²	11	39.5 Å²	39.5	5%	0.054	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-25.7	173.8	60.7	164.6	48.3	0	0	114.2	Y333 L335 R707 C963 D1002	Y333-M1008 HydrophobicContact CD2-CE 4.01Å; Y333-M1008 HydrophobicContact CE2-CE 3.62Å; Y333-M1008 HydrophobicContact CE2-SD 3.57Å; Y333-M1008 VanDerWaalsContact CE2-SD 3.57Å; L335-M1008 HydrophobicContact CD2-CE 4.48Å; L335-M1008 HydrophobicContact CD2-SD 3.75Å; R707-M1008 PolarHBondContact NH1-SD 3.13Å; R707-M1008 VanDerWaalsContact NH1-SD 3.42Å; R707-M1008 VanDerWaalsContact NH2-C 3.31Å; R707-M1008 PolarHBondContact NH2-O 2.84Å; C963-M1008 PolarHBondContact SG-O 3.38Å; D1002-M1008 WeakPolarHBondContact OD1-CB 3.25Å; D1002-M1008 VanDerWaalsContact OD1-CG 3.3Å; D1002-M1008 WeakPolarHBondContact OD1-CG 3.23Å; D1002-M1008 PolarHBondContact OD1-N 2.92Å
1009	N	76.3	Confident	81.4	Confident	51 Å²	51	43.8 Å²	43.8	27%	0.273	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	6.3	179.6	-71.6	-17.8	0	0	0	114.3	D349 R707 S1007 E1011	D349-N1009 PolarHBondContact OD1-ND2 3Å; D349-N1009 PolarHBondContact OD2-ND2 2.9Å; R707-N1009 VanDerWaalsContact CZ-OD1 3.23Å; R707-N1009 PolarHBondContact NH1-OD1 3.17Å; R707-N1009 PolarHBondContact NH2-OD1 3.09Å; S1007-N1009 PolarHBondContact O-N 2.88Å; N1009-E1011 PolarHBondContact O-N 3.48Å
1010	C	86.1	Confident	81.4	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.007	24%	0.243	C	C	.	.	S	Bend	trans	63.3	25.2	-179.3	-81	0	0	0	0	114.4	C963 E993 A994 C995 S1007	C963-C1010 WeakPolarHBondContact CA-SG 3.48Å; C963-C1010 HydrophobicContact CB-CB 3.64Å; C963-C1010 WeakPolarHBondContact CB-SG 3.15Å; C963-C1010 WeakPolarHBondContact SG-CA 3.49Å; C963-C1010 WeakPolarHBondContact SG-CB 3.32Å; C963-C1010 PolarHBondContact SG-N 3.48Å; C963-C1010 CovalentContact SG-SG 2.02Å; C963-C1010 PolarHBondContact SG-SG 3.41Å; E993-C1010 HydrophobicContact CB-CB 3.98Å; E993-C1010 HydrophobicContact CG-CB 3.71Å; A994-C1010 PolarHBondContact N-O 2.99Å; C995-C1010 PolarHBondContact N-O 3.16Å; C995-C1010 WeakPolarHBondContact O-CB 3.28Å; C995-C1010 PolarHBondContact O-SG 3.17Å; S1007-C1010 PolarHBondContact O-N 3.26Å
1011	E	85.3	Confident	81.7	Confident	88 Å²	88	47.2 Å²	47.2	41%	0.411	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-92.3	135.3	164.5	-56.3	-170.9	151.3	0	0	108.9	Q991 S1007 N1009 E1013	Q991-E1011 PolarHBondContact NE2-OE1 3.07Å; S1007-E1011 WeakPolarHBondContact CB-O 3.47Å; S1007-E1011 PolarHBondContact N-O 3.34Å; S1007-E1011 PolarHBondContact OG-N 2.75Å; S1007-E1011 VanDerWaalsContact OG-N 3.14Å; S1007-E1011 PolarHBondContact OG-O 2.8Å; N1009-E1011 PolarHBondContact O-N 3.48Å; E1011-E1013 PolarHBondContact O-N 2.03Å
1012	T	85.7	Confident	82.2	Confident	57 Å²	57	49.2 Å²	49.2	35%	0.35	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-65.5	126.9	178.1	-57.2	0	0	0	0	109.3	F1016	T1012-F1016 HydrophobicContact CG2-CB 4.33Å
1013	E	82.8	Confident	82.8	Confident	33 Å²	33	48.5 Å²	48.5	15%	0.154	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-71.6	154	-178.1	-56.9	-176.9	141	0	0	112.2	D1002 Y1003 D1004 G1005 E1011 G1015 F1016	D1002-E1013 WeakPolarHBondContact CA-OE1 3.36Å; Y1003-E1013 WeakPolarHBondContact CA-OE2 3.31Å; Y1003-E1013 VanDerWaalsContact N-CD 3.34Å; Y1003-E1013 PolarHBondContact N-OE1 3.16Å; Y1003-E1013 PolarHBondContact N-OE2 3.17Å; Y1003-E1013 VanDerWaalsContact N-OE2 3.15Å; D1004-E1013 PolarHBondContact N-OE2 2.84Å; G1005-E1013 VanDerWaalsContact CA-OE2 3.26Å; G1005-E1013 WeakPolarHBondContact CA-OE2 3.25Å; G1005-E1013 PolarHBondContact N-OE2 2.79Å; G1005-E1013 PolarHBondContact O-N 2.78Å; E1011-E1013 PolarHBondContact O-N 2.03Å; E1013-G1015 PolarHBondContact O-N 3.12Å; E1013-F1016 HydrophobicContact CB-CD2 3.82Å; E1013-F1016 HydrophobicContact CB-CE2 4.17Å; E1013-F1016 WeakPolarHBondContact O-CB 3.5Å; E1013-F1016 PolarHBondContact O-N 2.99Å
1014	E	75.4	Confident	83.3	Confident	192 Å²	192	46 Å²	46	90%	0.897	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	139.2	-177.8	-166.9	176.8	173.1	0	0	112	F1016	E1014-F1016 PolarHBondContact O-N 2.86Å
1015	G	70.3	Confident	83.6	Confident	39 Å²	39	46.3 Å²	46.3	40%	0.402	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	-2.5	-177.2	0	0	0	0	0	114.9	E1013 V1028	E1013-G1015 PolarHBondContact O-N 3.12Å; G1015-V1028 WeakPolarHBondContact O-CB 2.94Å; G1015-V1028 WeakPolarHBondContact O-CG2 3.29Å; G1015-V1028 PolarHBondContact O-N 3.01Å
1016	F	81.7	Confident	83.5	Confident	15 Å²	15	46.5 Å²	46.5	7%	0.066	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	165.1	175.4	-72.6	-96.3	0	0	0	114.2	H181 Y182 A208 G1005 T1012 E1013 E1014 C1025 F1026	H181-F1016 AromaticContact CE1-CE1 3.72Å; H181-F1016 AromaticContact CE1-CE2 3.61Å; H181-F1016 AromaticContact CE1-CZ 3.12Å; H181-F1016 WeakPolarHBondContact CE1-CZ 3.36Å; H181-F1016 AromaticContact NE2-CD2 4Å; H181-F1016 AromaticContact NE2-CE2 3.1Å; H181-F1016 WeakPolarHBondContact NE2-CE2 3.5Å; H181-F1016 AromaticContact NE2-CZ 3.17Å; H181-F1016 WeakPolarHBondContact NE2-CZ 3.29Å; Y182-F1016 HydrophobicContact CE1-CZ 4.26Å; A208-F1016 HydrophobicContact CB-CE1 3.73Å; A208-F1016 HydrophobicContact CB-CZ 4.49Å; G1005-F1016 VanDerWaalsContact CA-CD2 3.5Å; G1005-F1016 VanDerWaalsContact N-CZ 3.35Å; T1012-F1016 HydrophobicContact CG2-CB 4.33Å; E1013-F1016 HydrophobicContact CB-CD2 3.82Å; E1013-F1016 HydrophobicContact CB-CE2 4.17Å; E1013-F1016 WeakPolarHBondContact O-CB 3.5Å; E1013-F1016 PolarHBondContact O-N 2.99Å; E1014-F1016 PolarHBondContact O-N 2.86Å; F1016-C1025 HydrophobicContact CD1-CB 4.4Å; F1016-F1026 CarbonylContact C-O 3.36Å; F1016-F1026 VanDerWaalsContact CA-O 3.26Å; F1016-F1026 WeakPolarHBondContact CA-O 3.42Å; F1016-F1026 VanDerWaalsContact CD1-C 3.49Å; F1016-F1026 WeakPolarHBondContact CD1-O 3.36Å
1017	K	84.1	Confident	83.2	Confident	106 Å²	106	46.3 Å²	46.3	46%	0.461	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	131.2	161.8	-74.9	177.6	-177.5	177	0	109.6	C1025 F1026 V1028 F1040	K1017-C1025 WeakPolarHBondContact O-CA 2.95Å; K1017-F1026 HydrophobicContact CB-CD1 4.39Å; K1017-F1026 HydrophobicContact CB-CE1 3.81Å; K1017-F1026 HydrophobicContact CB-CE2 4.05Å; K1017-F1026 HydrophobicContact CB-CZ 3.59Å; K1017-F1026 HydrophobicContact CD-CE2 4.38Å; K1017-F1026 HydrophobicContact CD-CZ 3.97Å; K1017-F1026 HydrophobicContact CG-CZ 4.33Å; K1017-F1026 PolarHBondContact N-O 3.3Å; K1017-F1026 WeakPolarHBondContact O-CD1 3.29Å; K1017-F1026 PolarHBondContact O-N 3.07Å; K1017-V1028 HydrophobicContact CB-CG2 4.39Å; K1017-V1028 HydrophobicContact CD-CG2 3.81Å; K1017-V1028 HydrophobicContact CG-CG2 3.69Å; K1017-F1040 HydrophobicContact CB-CZ 4.42Å
1018	C	87.7	Confident	82.8	Confident	26 Å²	26	48.4 Å²	48.4	18%	0.176	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	149.1	178	-58.7	0	0	0	0	111.4	C995 G1005 L1024 C1025	C995-C1018 HydrophobicContact CB-CB 3.72Å; G1005-C1018 PolarHBondContact O-SG 2.81Å; C1018-L1024 WeakPolarHBondContact CA-O 2.98Å; C1018-C1025 HydrophobicContact CB-CB 4.19Å; C1018-C1025 WeakPolarHBondContact CB-SG 3.4Å; C1018-C1025 WeakPolarHBondContact SG-CB 3.41Å; C1018-C1025 CovalentContact SG-SG 2.04Å; C1018-C1025 PolarHBondContact SG-SG 2.84Å
1019	K	85.2	Confident	82.2	Confident	112 Å²	112	51.5 Å²	51.5	49%	0.487	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	148.7	173.8	-176.3	-175.3	-179	-176.2	0	111.1	L1024 F1040	K1019-L1024 PolarHBondContact N-O 2.86Å; K1019-L1024 VanDerWaalsContact N-O 3.13Å; K1019-L1024 PolarHBondContact O-N 2.82Å; K1019-F1040 HydrophobicContact CB-CD1 3.83Å; K1019-F1040 HydrophobicContact CB-CE1 3.11Å; K1019-F1040 HydrophobicContact CB-CE2 4.33Å; K1019-F1040 HydrophobicContact CB-CZ 3.42Å; K1019-F1040 VanDerWaalsContact CB-CZ 3.42Å; K1019-F1040 HydrophobicContact CD-CB 4.33Å; K1019-F1040 HydrophobicContact CD-CD1 3.42Å; K1019-F1040 VanDerWaalsContact CD-CD1 3.42Å; K1019-F1040 HydrophobicContact CD-CD2 3.79Å; K1019-F1040 HydrophobicContact CD-CE1 3.53Å; K1019-F1040 HydrophobicContact CD-CE2 3.88Å; K1019-F1040 HydrophobicContact CD-CG 3.57Å; K1019-F1040 HydrophobicContact CD-CZ 3.75Å; K1019-F1040 HydrophobicContact CG-CD1 4.29Å; K1019-F1040 HydrophobicContact CG-CE1 3.98Å; K1019-F1040 HydrophobicContact CG-CZ 4.2Å
1020	G	82.1	Confident	81.3	Confident	47 Å²	47	50.2 Å²	50.2	49%	0.485	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	101.1	178.4	179.8	0	0	0	0	0	111.8	P1022 S1023	G1020-P1022 CarbonylContact C-O 3.5Å; G1020-S1023 PolarHBondContact O-OG 3.09Å
1021	S	84.4	Confident	80.1	Confident	70 Å²	70	50.8 Å²	50.8	49%	0.49	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.2	105.5	171.3	-156.4	0	0	0	0	107	G966 I967 V968	G966-S1021 CarbonylContact O-C 3.44Å; G966-S1021 PolarHBondContact O-OG 3.44Å; I967-S1021 VanDerWaalsContact CA-OG 3.31Å; I967-S1021 WeakPolarHBondContact CA-OG 3.39Å; V968-S1021 PolarHBondContact N-OG 2.81Å
1022	P	87.2	Confident	78.4	Confident	53 Å²	53	55.5 Å²	55.5	34%	0.344	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	cis	-60	147.3	-3	-23.3	35.9	0	0	0	113.3	G966 G1020	G966-P1022 WeakPolarHBondContact O-CA 3.37Å; G966-P1022 VanDerWaalsContact O-N 3.17Å; G1020-P1022 CarbonylContact C-O 3.5Å
1023	S	88.8	Confident	76.1	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.014	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	142.1	-179.4	-67.8	0	0	0	0	111.4	R269 D996 G1020	R269-S1023 WeakPolarHBondContact CD-O 3.01Å; D996-S1023 PolarHBondContact N-OG 3.04Å; D996-S1023 VanDerWaalsContact O-CB 3.26Å; D996-S1023 WeakPolarHBondContact O-CB 3.36Å; D996-S1023 PolarHBondContact O-N 2.88Å; D996-S1023 PolarHBondContact O-OG 3.3Å; G1020-S1023 PolarHBondContact O-OG 3.09Å
1024	L	88.5	Confident	74	Confident	35 Å²	35	56.6 Å²	56.6	18%	0.183	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	115.1	166.9	-60.3	171.8	0	0	0	107.2	A265 P266 C1018 K1019 I1043	A265-L1024 HydrophobicContact CB-CD2 4.3Å; P266-L1024 HydrophobicContact CB-CD2 4.41Å; P266-L1024 HydrophobicContact CG-CD1 3.94Å; P266-L1024 HydrophobicContact CG-CD2 4.13Å; C1018-L1024 WeakPolarHBondContact CA-O 2.98Å; K1019-L1024 PolarHBondContact N-O 2.86Å; K1019-L1024 VanDerWaalsContact N-O 3.13Å; K1019-L1024 PolarHBondContact O-N 2.82Å; L1024-I1043 HydrophobicContact CD1-CG2 3.66Å
1025	C	89.4	Confident	72.3	Confident	9 Å²	9	57.1 Å²	57.1	6%	0.061	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	145.7	-176.1	-60.5	0	0	0	0	111.6	A208 L209 D1004 F1016 K1017 C1018	A208-C1025 WeakPolarHBondContact CA-O 3.41Å; L209-C1025 PolarHBondContact N-O 3.4Å; D1004-C1025 WeakPolarHBondContact O-CB 3.47Å; F1016-C1025 HydrophobicContact CD1-CB 4.4Å; K1017-C1025 WeakPolarHBondContact O-CA 2.95Å; C1018-C1025 HydrophobicContact CB-CB 4.19Å; C1018-C1025 WeakPolarHBondContact CB-SG 3.4Å; C1018-C1025 WeakPolarHBondContact SG-CB 3.41Å; C1018-C1025 CovalentContact SG-SG 2.04Å; C1018-C1025 PolarHBondContact SG-SG 2.84Å
1026	F	84.9	Confident	70.7	Confident	3 Å²	3	57.4 Å²	57.4	1%	0.013	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	151.5	177.4	73	-101.1	0	0	0	112.6	L209 F1016 K1017 V1028 I1031 P1039 F1040 I1043	L209-F1026 HydrophobicContact CB-CB 3.97Å; L209-F1026 CarbonylContact O-C 3.53Å; L209-F1026 WeakPolarHBondContact O-CA 3.46Å; L209-F1026 WeakPolarHBondContact O-CB 3.05Å; F1016-F1026 CarbonylContact C-O 3.36Å; F1016-F1026 VanDerWaalsContact CA-O 3.26Å; F1016-F1026 WeakPolarHBondContact CA-O 3.42Å; F1016-F1026 VanDerWaalsContact CD1-C 3.49Å; F1016-F1026 WeakPolarHBondContact CD1-O 3.36Å; K1017-F1026 HydrophobicContact CB-CD1 4.39Å; K1017-F1026 HydrophobicContact CB-CE1 3.81Å; K1017-F1026 HydrophobicContact CB-CE2 4.05Å; K1017-F1026 HydrophobicContact CB-CZ 3.59Å; K1017-F1026 HydrophobicContact CD-CE2 4.38Å; K1017-F1026 HydrophobicContact CD-CZ 3.97Å; K1017-F1026 HydrophobicContact CG-CZ 4.33Å; K1017-F1026 PolarHBondContact N-O 3.3Å; K1017-F1026 WeakPolarHBondContact O-CD1 3.29Å; K1017-F1026 PolarHBondContact O-N 3.07Å; F1026-V1028 HydrophobicContact CE2-CG2 4.38Å; F1026-I1031 HydrophobicContact CB-CD1 3.79Å; F1026-I1031 HydrophobicContact CD2-CD1 3.72Å; F1026-I1031 HydrophobicContact CG-CD1 3.97Å; F1026-P1039 HydrophobicContact CE1-CB 4.16Å; F1026-P1039 HydrophobicContact CE2-CB 3.75Å; F1026-P1039 HydrophobicContact CE2-CG 4.5Å; F1026-P1039 HydrophobicContact CZ-CB 3.41Å; F1026-P1039 VanDerWaalsContact CZ-CB 3.41Å; F1026-P1039 HydrophobicContact CZ-CG 4.23Å; F1026-F1040 HydrophobicContact CD1-CD1 4.39Å; F1026-F1040 AromaticContact CD1-CE1 3.96Å; F1026-F1040 HydrophobicContact CD1-CE1 3.96Å; F1026-F1040 HydrophobicContact CD1-CZ 4.41Å; F1026-F1040 AromaticContact CE1-CD1 3.83Å; F1026-F1040 HydrophobicContact CE1-CD1 3.83Å; F1026-F1040 HydrophobicContact CE1-CD2 4.36Å; F1026-F1040 AromaticContact CE1-CE1 3.41Å; F1026-F1040 HydrophobicContact CE1-CE1 3.41Å; F1026-F1040 VanDerWaalsContact CE1-CE1 3.41Å; F1026-F1040 HydrophobicContact CE1-CE2 4.01Å; F1026-F1040 HydrophobicContact CE1-CG 4.29Å; F1026-F1040 AromaticContact CE1-CZ 3.52Å; F1026-F1040 HydrophobicContact CE1-CZ 3.52Å; F1026-F1040 HydrophobicContact CZ-CE2 4.44Å; F1026-F1040 HydrophobicContact CZ-CZ 4.28Å; F1026-I1043 HydrophobicContact CD1-CD1 3.78Å; F1026-I1043 HydrophobicContact CE1-CD1 4.45Å
1027	S	81.9	Confident	68.7	Low	0 Å²	0	64.1 Å²	64.1	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	127.3	178.1	-177.3	0	0	0	0	111.9	H181 L209 S1029 I1031	H181-S1027 WeakPolarHBondContact CB-OG 3.29Å; H181-S1027 VanDerWaalsContact CG-OG 3.3Å; L209-S1027 PolarHBondContact O-N 2.86Å; S1027-S1029 PolarHBondContact OG-OG 2.94Å; S1027-I1031 PolarHBondContact O-N 3Å
1028	V	71.5	Confident	66.8	Low	66 Å²	66	62.2 Å²	62.2	40%	0.4	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-34.2	-179.2	-179.3	0	0	0	0	111.8	G1015 K1017 F1026	G1015-V1028 WeakPolarHBondContact O-CB 2.94Å; G1015-V1028 WeakPolarHBondContact O-CG2 3.29Å; G1015-V1028 PolarHBondContact O-N 3.01Å; K1017-V1028 HydrophobicContact CB-CG2 4.39Å; K1017-V1028 HydrophobicContact CD-CG2 3.81Å; K1017-V1028 HydrophobicContact CG-CG2 3.69Å; F1026-V1028 HydrophobicContact CE2-CG2 4.38Å
1029	S	66.1	Low	64.8	Low	76 Å²	76	63.2 Å²	63.2	53%	0.531	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-31.3	-177.4	58.6	0	0	0	0	113.2	S1027	S1027-S1029 PolarHBondContact OG-OG 2.94Å
1030	G	58.1	Low	63.1	Low	25 Å²	25	59.9 Å²	59.9	26%	0.258	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-17.2	179.7	0	0	0	0	0	115.3	V210	V210-G1030 WeakPolarHBondContact O-CA 3.47Å
1031	I	60.3	Low	61.3	Low	13 Å²	13	60.1 Å²	60.1	7%	0.067	36%	0.355	C	S	.	.			trans	-105	74	173.7	-51.4	-176.9	0	0	0	109.7	L209 F1026 S1027 A1033 L1042	L209-I1031 HydrophobicContact CD2-CD1 3.61Å; L209-I1031 HydrophobicContact CG-CD1 3.82Å; F1026-I1031 HydrophobicContact CB-CD1 3.79Å; F1026-I1031 HydrophobicContact CD2-CD1 3.72Å; F1026-I1031 HydrophobicContact CG-CD1 3.97Å; S1027-I1031 PolarHBondContact O-N 3Å; I1031-A1033 VanDerWaalsContact C-N 3.3Å; I1031-A1033 PolarHBondContact O-N 3.47Å; I1031-L1042 HydrophobicContact CG2-CD1 3.49Å; I1031-L1042 VanDerWaalsContact CG2-CD1 3.49Å
1032	K	49.8	Very low	59.5	Low	186 Å²	186	58.6 Å²	58.6	81%	0.809	34%	0.34	S	S	*	.			trans	-70.6	86.3	172.1	-70.9	-168.8	177.6	-177.5	0	110.7	T1034	K1032-T1034 PolarHBondContact O-N 2.95Å; K1032-T1034 VanDerWaalsContact O-N 3.12Å
1033	A	38.3	Very low	57.6	Low	73 Å²	73	57.5 Å²	57.5	60%	0.603	33%	0.331	S	S	*	.			trans	2.6	85.4	171.7	0	0	0	0	0	116.9	I1031 H1035	I1031-A1033 VanDerWaalsContact C-N 3.3Å; I1031-A1033 PolarHBondContact O-N 3.47Å; A1033-H1035 PolarHBondContact O-N 3.08Å
1034	T	38.7	Very low	55	Low	40 Å²	40	62.8 Å²	62.8	25%	0.245	36%	0.36	C	S	.	.			trans	-73.3	91.8	166.2	43	0	0	0	0	110	D214 K1032 S1036	D214-T1034 VanDerWaalsContact OD1-CG2 3.32Å; D214-T1034 WeakPolarHBondContact OD1-CG2 3.24Å; K1032-T1034 PolarHBondContact O-N 2.95Å; K1032-T1034 VanDerWaalsContact O-N 3.12Å; T1034-S1036 PolarHBondContact O-N 3.16Å
1035	H	39.8	Very low	52.1	Low	203 Å²	203	67.8 Å²	67.8	94%	0.94	38%	0.377	S	S	*	.	S	Bend	trans	53.2	11.7	167	-81	-73.4	0	0	0	119	A1033	A1033-H1035 PolarHBondContact O-N 3.08Å
1036	S	36.3	Very low	49.2	Very low	45 Å²	45	72.1 Å²	72.1	32%	0.315	41%	0.408	S	S	.	.			trans	-120.8	136.5	175.6	-177.8	0	0	0	0	111.9	T1034 D1038 S1041	T1034-S1036 PolarHBondContact O-N 3.16Å; S1036-D1038 PolarHBondContact O-N 2.8Å; S1036-D1038 PolarHBondContact OG-N 3.39Å; S1036-D1038 PolarHBondContact OG-O 2.82Å; S1036-S1041 WeakPolarHBondContact CB-OG 3.28Å; S1036-S1041 PolarHBondContact OG-OG 3.19Å
1037	T	39	Very low	46.6	Very low	157 Å²	157	78.2 Å²	78.2	96%	0.963	45%	0.445	S	S	*	.	S	Bend	trans	-77.4	-0.4	177.8	49.4	0	0	0	0	114.1
1038	D	44.5	Very low	44.2	Very low	65 Å²	65	81.8 Å²	81.8	35%	0.348	47%	0.474	S	S	.	.			trans	-132	112.1	172.7	-175.8	0.9	0	0	0	110.8	S1036 F1040 S1041	S1036-D1038 PolarHBondContact O-N 2.8Å; S1036-D1038 PolarHBondContact OG-N 3.39Å; S1036-D1038 PolarHBondContact OG-O 2.82Å; D1038-F1040 PolarHBondContact O-N 2.9Å; D1038-F1040 VanDerWaalsContact O-N 3.13Å; D1038-F1040 WeakPolarHBondContact OD1-CB 3.3Å; D1038-F1040 WeakPolarHBondContact OD1-CD2 3.42Å; D1038-F1040 PolarHBondContact OD1-N 2.71Å; D1038-S1041 VanDerWaalsContact O-CB 3.31Å; D1038-S1041 WeakPolarHBondContact O-CB 3.4Å; D1038-S1041 PolarHBondContact O-N 2.82Å; D1038-S1041 PolarHBondContact O-OG 2.83Å
1039	P	46.3	Very low	42.8	Very low	48 Å²	48	87.7 Å²	87.7	31%	0.312	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-54.6	-26.9	173.2	-27.5	36.4	0	0	0	114.4	F1026 S1041 L1042	F1026-P1039 HydrophobicContact CE1-CB 4.16Å; F1026-P1039 HydrophobicContact CE2-CB 3.75Å; F1026-P1039 HydrophobicContact CE2-CG 4.5Å; F1026-P1039 HydrophobicContact CZ-CB 3.41Å; F1026-P1039 VanDerWaalsContact CZ-CB 3.41Å; F1026-P1039 HydrophobicContact CZ-CG 4.23Å; P1039-S1041 VanDerWaalsContact C-N 3.26Å; P1039-S1041 PolarHBondContact O-N 2.86Å; P1039-L1042 PolarHBondContact O-N 3.31Å
1040	F	49.6	Very low	41.7	Very low	41 Å²	41	86.9 Å²	86.9	18%	0.18	49%	0.485	C	S	.	.	G	3₁₀ helix	trans	-70.8	-19.3	176.2	-68.1	-74.4	0	0	0	113.5	K1017 K1019 F1026 D1038 L1042 I1043	K1017-F1040 HydrophobicContact CB-CZ 4.42Å; K1019-F1040 HydrophobicContact CB-CD1 3.83Å; K1019-F1040 HydrophobicContact CB-CE1 3.11Å; K1019-F1040 HydrophobicContact CB-CE2 4.33Å; K1019-F1040 HydrophobicContact CB-CZ 3.42Å; K1019-F1040 VanDerWaalsContact CB-CZ 3.42Å; K1019-F1040 HydrophobicContact CD-CB 4.33Å; K1019-F1040 HydrophobicContact CD-CD1 3.42Å; K1019-F1040 VanDerWaalsContact CD-CD1 3.42Å; K1019-F1040 HydrophobicContact CD-CD2 3.79Å; K1019-F1040 HydrophobicContact CD-CE1 3.53Å; K1019-F1040 HydrophobicContact CD-CE2 3.88Å; K1019-F1040 HydrophobicContact CD-CG 3.57Å; K1019-F1040 HydrophobicContact CD-CZ 3.75Å; K1019-F1040 HydrophobicContact CG-CD1 4.29Å; K1019-F1040 HydrophobicContact CG-CE1 3.98Å; K1019-F1040 HydrophobicContact CG-CZ 4.2Å; F1026-F1040 HydrophobicContact CD1-CD1 4.39Å; F1026-F1040 AromaticContact CD1-CE1 3.96Å; F1026-F1040 HydrophobicContact CD1-CE1 3.96Å; F1026-F1040 HydrophobicContact CD1-CZ 4.41Å; F1026-F1040 AromaticContact CE1-CD1 3.83Å; F1026-F1040 HydrophobicContact CE1-CD1 3.83Å; F1026-F1040 HydrophobicContact CE1-CD2 4.36Å; F1026-F1040 AromaticContact CE1-CE1 3.41Å; F1026-F1040 HydrophobicContact CE1-CE1 3.41Å; F1026-F1040 VanDerWaalsContact CE1-CE1 3.41Å; F1026-F1040 HydrophobicContact CE1-CE2 4.01Å; F1026-F1040 HydrophobicContact CE1-CG 4.29Å; F1026-F1040 AromaticContact CE1-CZ 3.52Å; F1026-F1040 HydrophobicContact CE1-CZ 3.52Å; F1026-F1040 HydrophobicContact CZ-CE2 4.44Å; F1026-F1040 HydrophobicContact CZ-CZ 4.28Å; D1038-F1040 PolarHBondContact O-N 2.9Å; D1038-F1040 VanDerWaalsContact O-N 3.13Å; D1038-F1040 WeakPolarHBondContact OD1-CB 3.3Å; D1038-F1040 WeakPolarHBondContact OD1-CD2 3.42Å; D1038-F1040 PolarHBondContact OD1-N 2.71Å; F1040-L1042 PolarHBondContact O-N 2.02Å; F1040-I1043 HydrophobicContact CD1-CD1 4.1Å; F1040-I1043 WeakPolarHBondContact O-CB 3.41Å; F1040-I1043 PolarHBondContact O-N 2.97Å
1041	S	44.5	Very low	41.2	Very low	53 Å²	53	88 Å²	88	37%	0.371	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-64.5	-20.5	174.2	67.1	0	0	0	0	113.5	S1036 D1038 P1039 I1043	S1036-S1041 WeakPolarHBondContact CB-OG 3.28Å; S1036-S1041 PolarHBondContact OG-OG 3.19Å; D1038-S1041 VanDerWaalsContact O-CB 3.31Å; D1038-S1041 WeakPolarHBondContact O-CB 3.4Å; D1038-S1041 PolarHBondContact O-N 2.82Å; D1038-S1041 PolarHBondContact O-OG 2.83Å; P1039-S1041 VanDerWaalsContact C-N 3.26Å; P1039-S1041 PolarHBondContact O-N 2.86Å; S1041-I1043 PolarHBondContact O-N 2.91Å
1042	L	46.5	Very low	40.8	Very low	37 Å²	37	92.8 Å²	92.8	19%	0.194	52%	0.524	C	S	.	.	G	3₁₀ helix	trans	-75.9	-11	173.4	-74	162.4	0	0	0	113.1	K202 I1031 P1039 F1040	K202-L1042 PolarHBondContact NZ-O 3.46Å; I1031-L1042 HydrophobicContact CG2-CD1 3.49Å; I1031-L1042 VanDerWaalsContact CG2-CD1 3.49Å; P1039-L1042 PolarHBondContact O-N 3.31Å; F1040-L1042 PolarHBondContact O-N 2.02Å
1043	I	46.4	Very low	41.4	Very low	30 Å²	30	89.5 Å²	89.5	15%	0.154	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-18.6	-175.6	-60.1	176.6	0	0	0	111.3	L209 A265 L1024 F1026 F1040 S1041	L209-I1043 HydrophobicContact CD2-CG1 4.32Å; A265-I1043 HydrophobicContact CB-CG2 4.4Å; L1024-I1043 HydrophobicContact CD1-CG2 3.66Å; F1026-I1043 HydrophobicContact CD1-CD1 3.78Å; F1026-I1043 HydrophobicContact CE1-CD1 4.45Å; F1040-I1043 HydrophobicContact CD1-CD1 4.1Å; F1040-I1043 WeakPolarHBondContact O-CB 3.41Å; F1040-I1043 PolarHBondContact O-N 2.97Å; S1041-I1043 PolarHBondContact O-N 2.91Å
1044	D	33.7	Very low	42.9	Very low	114 Å²	114	88.7 Å²	88.7	61%	0.61	49%	0.494	S	S	*	.			trans	-102.9	124.5	-174	-155.5	-10.1	0	0	0	113.7
1045	Y	29	Very low	44.4	Very low	139 Å²	139	89.7 Å²	89.7	55%	0.545	50%	0.498	S	S	.	.	S	Bend	trans	-92.7	89.7	175.9	-98.5	-96	0	0	0	109.2	N197	N197-Y1045 PolarHBondContact ND2-OH 3.05Å
1046	S	27.6	Very low	45.9	Very low	101 Å²	101	81.6 Å²	81.6	71%	0.706	46%	0.462	S	S	*	.			trans	175.9	26.2	155.2	50.8	0	0	0	0	118.7
1047	V	29.8	Very low	47.7	Very low	130 Å²	130	80.3 Å²	80.3	79%	0.788	45%	0.451	S	S	*	.			trans	-119.4	125.1	-175.3	-172.6	0	0	0	0	115.9
1048	A	33.3	Very low	49.6	Very low	75 Å²	75	75.7 Å²	75.7	62%	0.62	42%	0.416	S	S	*	.			trans	63.4	91.6	157.9	0	0	0	0	0	120.8
1049	Y	40.4	Very low	51	Low	191 Å²	191	74 Å²	74	75%	0.749	41%	0.411	S	S	*	.	S	Bend	trans	-114.6	1	152.2	-99.8	-69.9	0	0	0	114
1050	S	44	Very low	52.2	Low	59 Å²	59	76.9 Å²	76.9	41%	0.413	43%	0.427	S	S	.	.	S	Bend	trans	-95.8	130.4	164.1	37.7	0	0	0	0	108.9
1051	A	48	Very low	53.5	Low	49 Å²	49	78.8 Å²	78.8	41%	0.405	45%	0.446	S	S	.	.			trans	-63.5	148	164.3	0	0	0	0	0	108.6	E1053 F1054	A1051-E1053 PolarHBondContact O-N 3.05Å; A1051-F1054 HydrophobicContact CB-CD2 4.23Å; A1051-F1054 PolarHBondContact O-N 3.45Å; A1051-F1054 VanDerWaalsContact O-N 3.09Å
1052	P	52	Low	54.9	Low	113 Å²	113	78.2 Å²	78.2	73%	0.734	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-20.8	-171.1	-29	35.9	0	0	0	116	R1183	P1052-R1183 WeakPolarHBondContact O-CD 3.2Å
1053	E	60.9	Low	56.2	Low	116 Å²	116	87.5 Å²	87.5	54%	0.542	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-0.4	-175.8	-58.9	-178	-145.3	0	0	115.3	A1051 R1183	A1051-E1053 PolarHBondContact O-N 3.05Å; E1053-R1183 VanDerWaalsContact C-CB 3.48Å; E1053-R1183 WeakPolarHBondContact O-CB 3.31Å; E1053-R1183 PolarHBondContact O-N 3.16Å
1054	F	70.6	Confident	57.5	Low	56 Å²	56	89.1 Å²	89.1	25%	0.246	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	145	-174.5	-63.2	-88.7	0	0	0	113.6	A1051 R1180 S1181 K1182	A1051-F1054 HydrophobicContact CB-CD2 4.23Å; A1051-F1054 PolarHBondContact O-N 3.45Å; A1051-F1054 VanDerWaalsContact O-N 3.09Å; F1054-R1180 HydrophobicContact CB-CG 4.05Å; F1054-R1180 HydrophobicContact CD1-CG 3.76Å; F1054-R1180 HydrophobicContact CG-CG 4.18Å; F1054-S1181 WeakPolarHBondContact CA-O 3.41Å; F1054-K1182 HydrophobicContact CD1-CB 4.29Å; F1054-K1182 HydrophobicContact CE1-CB 4.25Å; F1054-K1182 HydrophobicContact CE1-CG 4.42Å
1055	N	70.2	Confident	59.1	Low	61 Å²	61	90.7 Å²	90.7	33%	0.326	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.5	167.8	-74.4	-11.2	0	0	0	108.6	S1181 R1183	N1055-S1181 PolarHBondContact N-O 3.26Å; N1055-S1181 PolarHBondContact O-N 3.46Å; N1055-S1181 PolarHBondContact O-OG 3.21Å; N1055-R1183 WeakPolarHBondContact OD1-CG 3.19Å; N1055-R1183 PolarHBondContact OD1-NE 3.11Å; N1055-R1183 VanDerWaalsContact OD1-NE 3.09Å
1056	D	71.6	Confident	60.7	Low	33 Å²	33	88.1 Å²	88.1	18%	0.176	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.4	-179.9	-76.6	-24.6	0	0	0	110.3	R1178 R1180	D1056-R1178 HydrophobicContact CB-CG 4.03Å; D1056-R1178 IonicContact OD1-NE 2.75Å; D1056-R1178 IonicContact OD2-CZ 3.25Å; D1056-R1178 IonicContact OD2-NE 3.12Å; D1056-R1178 IonicContact OD2-NH1 3.96Å; D1056-R1178 PolarHBondContact OD2-NH1 3.28Å; D1056-R1180 VanDerWaalsContact OD1-CB 3.26Å; D1056-R1180 WeakPolarHBondContact OD1-CB 3.49Å; D1056-R1180 VanDerWaalsContact OD1-CG 3.24Å; D1056-R1180 WeakPolarHBondContact OD1-CG 3.33Å; D1056-R1180 IonicContact OD1-CZ 2.67Å; D1056-R1180 IonicContact OD1-NE 3.09Å; D1056-R1180 PolarHBondContact OD1-NE 3.28Å; D1056-R1180 IonicContact OD1-NH2 3.95Å; D1056-R1180 PolarHBondContact OD1-NH2 2.86Å; D1056-R1180 IonicContact OD2-CZ 3.55Å; D1056-R1180 IonicContact OD2-NE 3.63Å; D1056-R1180 IonicContact OD2-NH2 3.66Å; D1056-R1180 PolarHBondContact OD2-NH2 3.18Å
1057	Q	74.5	Confident	61.9	Low	19 Å²	19	91.1 Å²	91.1	9%	0.089	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	155.8	174.3	-48.3	-168	122.5	0	0	110.1	F1088 Q1090 R1178 L1179	Q1057-F1088 HydrophobicContact CG-CB 4.46Å; Q1057-F1088 PolarHBondContact OE1-O 3.42Å; Q1057-Q1090 PolarHBondContact NE2-O 3.32Å; Q1057-Q1090 PolarHBondContact OE1-O 2.56Å; Q1057-R1178 CarbonylContact O-C 3.51Å; Q1057-R1178 VanDerWaalsContact O-CA 3.23Å; Q1057-R1178 WeakPolarHBondContact O-CA 3.39Å; Q1057-R1178 VanDerWaalsContact O-CG 3.26Å; Q1057-R1178 WeakPolarHBondContact O-CG 3.2Å; Q1057-L1179 HydrophobicContact CB-CB 4.49Å; Q1057-L1179 PolarHBondContact N-O 3.37Å; Q1057-L1179 PolarHBondContact O-N 3.27Å
1058	W	77.4	Confident	63	Low	59 Å²	59	91.3 Å²	91.3	22%	0.223	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	154.1	178.6	-64	83.4	0	0	0	110.8	V1060 K1081 Y1100 A1176 R1178	W1058-V1060 PolarHBondContact O-N 3.14Å; W1058-K1081 HydrophobicContact CD2-CB 3.48Å; W1058-K1081 VanDerWaalsContact CD2-CB 3.48Å; W1058-K1081 VanDerWaalsContact CE2-CB 3.45Å; W1058-K1081 HydrophobicContact CE3-CB 3.91Å; W1058-K1081 HydrophobicContact CG-CB 3.8Å; W1058-K1081 HydrophobicContact CH2-CB 4.24Å; W1058-K1081 HydrophobicContact CZ2-CB 3.85Å; W1058-K1081 HydrophobicContact CZ3-CB 4.27Å; W1058-Y1100 HydrophobicContact CH2-CD2 4.27Å; W1058-Y1100 HydrophobicContact CH2-CE1 4.31Å; W1058-Y1100 AromaticContact CH2-CE2 3.52Å; W1058-Y1100 HydrophobicContact CH2-CE2 3.52Å; W1058-Y1100 AromaticContact CH2-CZ 3.55Å; W1058-Y1100 AromaticContact CZ3-CD2 3.83Å; W1058-Y1100 HydrophobicContact CZ3-CD2 3.83Å; W1058-Y1100 AromaticContact CZ3-CE2 3.47Å; W1058-Y1100 HydrophobicContact CZ3-CE2 3.47Å; W1058-Y1100 VanDerWaalsContact CZ3-CE2 3.47Å; W1058-Y1100 AromaticContact CZ3-CZ 3.99Å; W1058-A1176 HydrophobicContact CE3-CB 3.92Å; W1058-A1176 HydrophobicContact CZ3-CB 3.65Å; W1058-R1178 HydrophobicContact CD2-CB 3.96Å; W1058-R1178 HydrophobicContact CD2-CG 4.07Å; W1058-R1178 HydrophobicContact CE3-CB 3.79Å; W1058-R1178 HydrophobicContact CE3-CG 4.39Å; W1058-R1178 HydrophobicContact CH2-CB 4.18Å; W1058-R1178 HydrophobicContact CH2-CG 4.46Å; W1058-R1178 HydrophobicContact CZ2-CB 4.31Å; W1058-R1178 HydrophobicContact CZ2-CG 4.13Å; W1058-R1178 HydrophobicContact CZ3-CB 3.9Å
1059	A	75	Confident	64	Low	30 Å²	30	92.8 Å²	92.8	25%	0.248	50%	0.501	C	S	.	.			trans	-60.9	121.1	177.9	0	0	0	0	0	111	V1079 G1080 V1177	A1059-V1079 CarbonylContact O-C 3.51Å; A1059-V1079 WeakPolarHBondContact O-CA 3.32Å; A1059-V1079 WeakPolarHBondContact O-CG1 3.07Å; A1059-G1080 PolarHBondContact O-N 3.41Å; A1059-V1177 HydrophobicContact CB-CB 4.24Å; A1059-V1177 PolarHBondContact N-O 2.99Å
1060	V	71.9	Confident	64.8	Low	108 Å²	108	86.9 Å²	86.9	66%	0.655	49%	0.487	S	S	*	.	S	Bend	trans	-93.1	-14.8	180	-65.7	0	0	0	0	113.7	W1058 V1079	W1058-V1060 PolarHBondContact O-N 3.14Å; V1060-V1079 WeakPolarHBondContact O-CG1 3.43Å
1061	S	75.4	Confident	65.5	Low	81 Å²	81	88.8 Å²	88.8	57%	0.566	51%	0.506	S	S	*	.			trans	-150.8	153.6	170.5	61	0	0	0	0	110.1
1062	A	75.2	Confident	65.9	Low	42 Å²	42	96.3 Å²	96.3	35%	0.347	52%	0.524	S	S	.	.			trans	-142.3	148.3	178.7	0	0	0	0	0	109.9	A1075 V1079	A1062-A1075 HydrophobicContact CB-CB 4.3Å; A1062-A1075 WeakPolarHBondContact CB-O 3.03Å; A1062-V1079 HydrophobicContact CB-CG2 3.72Å
1063	R	74.3	Confident	66.3	Low	231 Å²	231	94.8 Å²	94.8	87%	0.872	52%	0.515	S	S	*	.			trans	-140.9	135	-179.9	-66.5	-177.7	-113.4	-148.8	-4.4	109
1064	S	72.1	Confident	66.6	Low	64 Å²	64	93.2 Å²	93.2	45%	0.448	51%	0.511	S	S	.	.			trans	-92.9	175.1	173.8	43.9	0	0	0	0	111.4	D1066	S1064-D1066 PolarHBondContact OG-O 3.25Å
1065	N	67.9	Low	66.6	Low	148 Å²	148	91.9 Å²	91.9	79%	0.791	51%	0.51	S	S	*	.	S	Bend	trans	-79	-21.8	177.6	54.9	-61.7	0	0	0	114.1
1066	D	61.9	Low	66.8	Low	85 Å²	85	92 Å²	92	46%	0.455	52%	0.516	S	S	.	.			trans	-128.3	130.4	175.5	-73.6	-68.9	0	0	0	110.3	S1064 V1068 I1069	S1064-D1066 PolarHBondContact OG-O 3.25Å; D1066-V1068 VanDerWaalsContact C-N 3.29Å; D1066-V1068 PolarHBondContact O-N 3Å; D1066-I1069 HydrophobicContact CB-CD1 3.89Å; D1066-I1069 HydrophobicContact CB-CG1 4.02Å
1067	D	53.7	Low	66.7	Low	163 Å²	163	96 Å²	96	87%	0.872	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	2.3	-179.4	-76.6	-40.5	0	0	0	113.6
1068	V	53	Low	66.4	Low	135 Å²	135	95.9 Å²	95.9	82%	0.818	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	-4	-165.8	-170.6	0	0	0	0	113.6	D1066 S1070	D1066-V1068 VanDerWaalsContact C-N 3.29Å; D1066-V1068 PolarHBondContact O-N 3Å; V1068-S1070 PolarHBondContact O-N 3.1Å
1069	I	54	Low	66	Low	106 Å²	106	95.7 Å²	95.7	54%	0.544	54%	0.544	S	S	.	.	S	Bend	trans	-88	102.7	-172.2	-52	177.8	0	0	0	111.3	D1066 C1073	D1066-I1069 HydrophobicContact CB-CD1 3.89Å; D1066-I1069 HydrophobicContact CB-CG1 4.02Å; I1069-C1073 HydrophobicContact CG2-CB 3.94Å
1070	S	57.1	Low	65.1	Low	67 Å²	67	95.6 Å²	95.6	47%	0.469	55%	0.546	S	S	.	.			trans	39.1	130.4	157	-172.3	0	0	0	0	118.6	V1068 R1072 C1073	V1068-S1070 PolarHBondContact O-N 3.1Å; S1070-R1072 PolarHBondContact O-N 3.27Å; S1070-R1072 PolarHBondContact OG-N 3.31Å; S1070-C1073 PolarHBondContact O-N 3.22Å
1071	A	58.5	Low	64.4	Low	98 Å²	98	94.1 Å²	94.1	81%	0.81	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-52.2	-20	171.1	0	0	0	0	0	114.9
1072	R	56.9	Low	63.5	Low	207 Å²	207	94.7 Å²	94.7	78%	0.781	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-77.9	-14.3	175.1	-57.2	-178.2	-176.7	177.3	1.5	114.5	S1070	S1070-R1072 PolarHBondContact O-N 3.27Å; S1070-R1072 PolarHBondContact OG-N 3.31Å
1073	C	59.9	Low	61.8	Low	81 Å²	81	102.8 Å²	102.8	55%	0.547	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-117.8	23.9	-174.7	-60.8	0	0	0	0	113	I1069 S1070 A1075	I1069-C1073 HydrophobicContact CG2-CB 3.94Å; S1070-C1073 PolarHBondContact O-N 3.22Å; C1073-A1075 PolarHBondContact O-N 2.86Å
1074	N	68.3	Low	59.9	Low	84 Å²	84	97.4 Å²	97.4	45%	0.449	55%	0.547	S	S	.	.			trans	-65.7	121.8	-174.2	-171.5	-28.2	0	0	0	112.3	S1076 L1077	N1074-S1076 PolarHBondContact ND2-OG 2.82Å; N1074-S1076 PolarHBondContact O-N 2.63Å; N1074-S1076 VanDerWaalsContact O-N 3.1Å; N1074-S1076 WeakPolarHBondContact OD1-CB 3.46Å; N1074-S1076 PolarHBondContact OD1-N 2.74Å; N1074-S1076 PolarHBondContact OD1-OG 3.26Å; N1074-L1077 WeakPolarHBondContact O-CB 3.25Å; N1074-L1077 WeakPolarHBondContact O-CG 3.48Å; N1074-L1077 PolarHBondContact O-N 2.77Å
1075	A	70.5	Confident	58	Low	27 Å²	27	98.9 Å²	98.9	22%	0.223	56%	0.555	C	S	.	*	G	3₁₀ helix	trans	-57.3	-25.8	179.6	0	0	0	0	0	114	A1062 C1073 L1077 A1078	A1062-A1075 HydrophobicContact CB-CB 4.3Å; A1062-A1075 WeakPolarHBondContact CB-O 3.03Å; C1073-A1075 PolarHBondContact O-N 2.86Å; A1075-L1077 PolarHBondContact O-N 2.77Å; A1075-L1077 VanDerWaalsContact O-N 3.12Å; A1075-A1078 PolarHBondContact O-N 2.77Å; A1075-A1078 VanDerWaalsContact O-N 3.17Å
1076	S	73.7	Confident	56.1	Low	65 Å²	65	98.8 Å²	98.8	46%	0.455	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-61.4	-16.2	175.4	62.8	0	0	0	0	113.9	N1074 A1078 V1079	N1074-S1076 PolarHBondContact ND2-OG 2.82Å; N1074-S1076 PolarHBondContact O-N 2.63Å; N1074-S1076 VanDerWaalsContact O-N 3.1Å; N1074-S1076 WeakPolarHBondContact OD1-CB 3.46Å; N1074-S1076 PolarHBondContact OD1-N 2.74Å; N1074-S1076 PolarHBondContact OD1-OG 3.26Å; S1076-A1078 PolarHBondContact O-N 2.6Å; S1076-V1079 VanDerWaalsContact O-CB 3.31Å; S1076-V1079 WeakPolarHBondContact O-CB 3.29Å; S1076-V1079 PolarHBondContact O-N 3.19Å; S1076-V1079 VanDerWaalsContact O-N 3.13Å
1077	L	70.8	Confident	54.6	Low	117 Å²	117	102 Å²	102	61%	0.613	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-65.1	-19.5	174.3	-67.3	169.8	0	0	0	113.9	N1074 A1075	N1074-L1077 WeakPolarHBondContact O-CB 3.25Å; N1074-L1077 WeakPolarHBondContact O-CG 3.48Å; N1074-L1077 PolarHBondContact O-N 2.77Å; A1075-L1077 PolarHBondContact O-N 2.77Å; A1075-L1077 VanDerWaalsContact O-N 3.12Å
1078	A	67.5	Low	54	Low	16 Å²	16	100.8 Å²	100.8	13%	0.132	55%	0.553	C	S	.	*	G	3₁₀ helix	trans	-92.6	5	175.7	0	0	0	0	0	113.7	A1075 S1076 I1174	A1075-A1078 PolarHBondContact O-N 2.77Å; A1075-A1078 VanDerWaalsContact O-N 3.17Å; S1076-A1078 PolarHBondContact O-N 2.6Å; A1078-I1174 HydrophobicContact CB-CG2 4.08Å
1079	V	67.7	Low	54	Low	55 Å²	55	102.4 Å²	102.4	33%	0.333	55%	0.552	S	S	.	*	S	Bend	trans	-90.6	139.8	-179.1	174.6	0	0	0	0	111	A1059 V1060 A1062 S1076	A1059-V1079 CarbonylContact O-C 3.51Å; A1059-V1079 WeakPolarHBondContact O-CA 3.32Å; A1059-V1079 WeakPolarHBondContact O-CG1 3.07Å; V1060-V1079 WeakPolarHBondContact O-CG1 3.43Å; A1062-V1079 HydrophobicContact CB-CG2 3.72Å; S1076-V1079 VanDerWaalsContact O-CB 3.31Å; S1076-V1079 WeakPolarHBondContact O-CB 3.29Å; S1076-V1079 PolarHBondContact O-N 3.19Å; S1076-V1079 VanDerWaalsContact O-N 3.13Å
1080	G	57.8	Low	54.7	Low	28 Å²	28	104 Å²	104	29%	0.289	56%	0.557	S	S	.	*	S	Bend	trans	81.6	-179.5	-178.4	0	0	0	0	0	113.6	A1059	A1059-G1080 PolarHBondContact O-N 3.41Å
1081	K	56.6	Low	55.3	Low	76 Å²	76	102.6 Å²	102.6	33%	0.33	55%	0.549	S	S	.	.			trans	-89.9	156.2	167.1	58.9	169.3	155.2	153.6	0	110.9	W1058 R1083 V1084 P1085	W1058-K1081 HydrophobicContact CD2-CB 3.48Å; W1058-K1081 VanDerWaalsContact CD2-CB 3.48Å; W1058-K1081 VanDerWaalsContact CE2-CB 3.45Å; W1058-K1081 HydrophobicContact CE3-CB 3.91Å; W1058-K1081 HydrophobicContact CG-CB 3.8Å; W1058-K1081 HydrophobicContact CH2-CB 4.24Å; W1058-K1081 HydrophobicContact CZ2-CB 3.85Å; W1058-K1081 HydrophobicContact CZ3-CB 4.27Å; K1081-R1083 VanDerWaalsContact C-N 3.32Å; K1081-R1083 PolarHBondContact O-N 2.94Å; K1081-V1084 WeakPolarHBondContact CD-O 3.43Å; K1081-V1084 WeakPolarHBondContact CE-O 3.39Å; K1081-V1084 PolarHBondContact NZ-O 2.83Å; K1081-P1085 VanDerWaalsContact CE-CA 3.47Å; K1081-P1085 PolarHBondContact NZ-O 3.23Å
1082	P	55.8	Low	56.2	Low	93 Å²	93	99 Å²	99	60%	0.604	52%	0.517	S	S	*	.	S	Bend	trans	-57.3	91.7	169.3	-25	35.6	0	0	0	112.1
1083	R	40	Very low	57.6	Low	212 Å²	212	89.7 Å²	89.7	80%	0.8	48%	0.483	S	S	*	.	S	Bend	trans	43.1	118.5	174.1	-62.7	-174.5	176	-173	-2.5	118	K1081	K1081-R1083 VanDerWaalsContact C-N 3.32Å; K1081-R1083 PolarHBondContact O-N 2.94Å
1084	V	34.1	Very low	58.7	Low	118 Å²	118	85.9 Å²	85.9	72%	0.715	46%	0.457	S	S	*	.	S	Bend	trans	95	126.9	165.6	-171	0	0	0	0	115.8	K1081	K1081-V1084 WeakPolarHBondContact CD-O 3.43Å; K1081-V1084 WeakPolarHBondContact CE-O 3.39Å; K1081-V1084 PolarHBondContact NZ-O 2.83Å
1085	P	33.2	Very low	59.4	Low	95 Å²	95	83.4 Å²	83.4	62%	0.617	45%	0.445	S	S	*	.			trans	-84.1	171.2	-144.6	37.1	-39.6	0	0	0	116.3	K1081	K1081-P1085 VanDerWaalsContact CE-CA 3.47Å; K1081-P1085 PolarHBondContact NZ-O 3.23Å
1086	L	27.4	Very low	60.2	Low	146 Å²	146	82.3 Å²	82.3	76%	0.764	44%	0.436	S	S	*	.				-144.6	178.5	55.9	-78.5	146	0	0	0	113.2
1087	E	31.3	Very low	60.9	Low	152 Å²	152	79.2 Å²	79.2	71%	0.71	42%	0.415	S	S	*	.			trans	-106.6	171.8	-152.4	-57.1	163.4	147.4	0	0	116.8
1088	F	39.8	Very low	61.7	Low	139 Å²	139	74.1 Å²	74.1	61%	0.61	39%	0.387	S	S	*	.				-154.7	142.5	124.2	-91.8	-73.9	0	0	0	109.4	Q1057	Q1057-F1088 HydrophobicContact CG-CB 4.46Å; Q1057-F1088 PolarHBondContact OE1-O 3.42Å
1089	E	54.1	Low	62.6	Low	169 Å²	169	73.4 Å²	73.4	79%	0.79	38%	0.381	S	S	*	.			trans	-90.8	-3.1	-174	-65	-176.1	116.8	0	0	115.1
1090	Q	68.1	Low	63.5	Low	139 Å²	139	72.9 Å²	72.9	65%	0.65	37%	0.373	S	S	*	.	S	Bend	trans	-94.3	153.9	-156.7	-65.1	-178.6	-2.7	0	0	114	Q1057	Q1057-Q1090 PolarHBondContact NE2-O 3.32Å; Q1057-Q1090 PolarHBondContact OE1-O 2.56Å
1091	A	70.6	Confident	64.7	Low	37 Å²	37	72.2 Å²	72.2	31%	0.306	36%	0.363	S	S	.	.			trans	-68.2	132.7	169.7	0	0	0	0	0	109.7	I1123 Y1159 S1160 K1161	A1091-I1123 HydrophobicContact CB-CD1 4.08Å; A1091-I1123 HydrophobicContact CB-CG1 4.03Å; A1091-Y1159 WeakPolarHBondContact O-CD1 3.37Å; A1091-S1160 WeakPolarHBondContact CA-O 3.06Å; A1091-K1161 HydrophobicContact CB-CB 4.4Å
1092	V	77.3	Confident	65.7	Low	22 Å²	22	72 Å²	72	13%	0.133	38%	0.376	C	S	.	.	B	Isolated β-bridge	trans	-131	159.9	-175.2	-64.5	0	0	0	0	112	A1094 S1160 L1179	V1092-A1094 PolarHBondContact O-N 2.96Å; V1092-S1160 PolarHBondContact N-O 2.83Å; V1092-S1160 PolarHBondContact O-N 3.36Å; V1092-L1179 HydrophobicContact CG2-CD2 3.82Å; V1092-L1179 HydrophobicContact CG2-CG 4.28Å
1093	V	84.4	Confident	66.9	Low	13 Å²	13	69.3 Å²	69.3	8%	0.079	36%	0.359	C	S	.	.			trans	-71.9	94.7	163.5	-176.3	0	0	0	0	107.7	H1151 F1157 Y1159 S1181 F1185 P1187	V1093-H1151 WeakPolarHBondContact CG1-NE2 3.42Å; V1093-F1157 HydrophobicContact CG1-CB 4.27Å; V1093-F1157 HydrophobicContact CG1-CD1 3.7Å; V1093-F1157 HydrophobicContact CG1-CE1 4.47Å; V1093-F1157 HydrophobicContact CG1-CG 4.28Å; V1093-F1157 HydrophobicContact CG2-CB 3.9Å; V1093-F1157 HydrophobicContact CG2-CG 4.46Å; V1093-Y1159 HydrophobicContact CG2-CD1 4.33Å; V1093-Y1159 HydrophobicContact CG2-CE1 4.23Å; V1093-S1181 WeakPolarHBondContact O-CB 3.28Å; V1093-F1185 HydrophobicContact CG1-CE1 4.19Å; V1093-P1187 HydrophobicContact CG2-CG 4.16Å
1094	A	83.3	Confident	68.8	Low	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.33	C	S	.	.			trans	-68.8	130	-175.7	0	0	0	0	0	111.3	V1092 L1120 V1149 H1151 L1179 R1180	V1092-A1094 PolarHBondContact O-N 2.96Å; A1094-L1120 HydrophobicContact CB-CD1 4.41Å; A1094-L1120 HydrophobicContact CB-CD2 4.44Å; A1094-V1149 HydrophobicContact CB-CG2 4.36Å; A1094-V1149 VanDerWaalsContact O-CB 3.25Å; A1094-V1149 WeakPolarHBondContact O-CB 3.25Å; A1094-V1149 VanDerWaalsContact O-CG1 3.23Å; A1094-V1149 WeakPolarHBondContact O-CG1 3.31Å; A1094-H1151 PolarHBondContact O-NE2 3.4Å; A1094-L1179 HydrophobicContact CB-CD1 3.49Å; A1094-L1179 VanDerWaalsContact CB-CD1 3.49Å; A1094-L1179 HydrophobicContact CB-CD2 4.43Å; A1094-L1179 HydrophobicContact CB-CG 4.02Å; A1094-R1180 CarbonylContact C-O 3.56Å; A1094-R1180 WeakPolarHBondContact CA-O 3.2Å
1095	T	84.7	Confident	70.8	Confident	33 Å²	33	55.7 Å²	55.7	20%	0.202	30%	0.301	C	S	.	.	S	Bend	trans	-101.8	-27.8	176	57.4	0	0	0	0	112.6	V1149 R1180 K1182	T1095-V1149 PolarHBondContact O-N 3.36Å; T1095-R1180 PolarHBondContact N-O 3.05Å; T1095-R1180 PolarHBondContact OG1-O 3.02Å; T1095-K1182 HydrophobicContact CG2-CB 4.21Å
1096	S	87.3	Confident	72.4	Confident	4 Å²	4	58.1 Å²	58.1	3%	0.028	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	156.6	165.4	55.1	0	0	0	0	112.9	F1098 E1146 Y1147 R1180	S1096-F1098 WeakPolarHBondContact OG-CE2 3.37Å; S1096-E1146 WeakPolarHBondContact CB-OE1 3.5Å; S1096-E1146 PolarHBondContact OG-OE1 3.05Å; S1096-Y1147 CarbonylContact C-O 3.6Å; S1096-Y1147 VanDerWaalsContact CA-O 3.26Å; S1096-Y1147 WeakPolarHBondContact CA-O 3.44Å; S1096-Y1147 WeakPolarHBondContact CB-O 3.44Å; S1096-R1180 PolarHBondContact O-N 2.75Å
1097	V	87.9	Confident	73.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.4	172.3	-176.6	0	0	0	0	108.6	V1118 L1120 I1130 E1146 Y1147 V1149 V1163 V1177 R1178 L1179	V1097-V1118 HydrophobicContact CB-CG1 4.47Å; V1097-V1118 HydrophobicContact CG1-CG1 4.22Å; V1097-V1118 HydrophobicContact CG2-CG1 4.47Å; V1097-L1120 HydrophobicContact CG2-CD2 3.71Å; V1097-I1130 HydrophobicContact CG2-CD1 4.01Å; V1097-E1146 CarbonylContact O-C 3.42Å; V1097-E1146 WeakPolarHBondContact O-CA 3.39Å; V1097-Y1147 PolarHBondContact N-O 2.99Å; V1097-Y1147 PolarHBondContact O-N 3.31Å; V1097-V1149 HydrophobicContact CG2-CG2 4.31Å; V1097-V1163 HydrophobicContact CG1-CG1 3.8Å; V1097-V1163 HydrophobicContact CG1-CG2 4.1Å; V1097-V1163 HydrophobicContact CG2-CG2 4.21Å; V1097-V1177 HydrophobicContact CG1-CG1 3.88Å; V1097-R1178 CarbonylContact C-O 3.5Å; V1097-R1178 WeakPolarHBondContact CA-O 3.22Å; V1097-L1179 HydrophobicContact CG2-CD1 3.75Å
1098	F	86.7	Confident	74.9	Confident	10 Å²	10	49.9 Å²	49.9	4%	0.044	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.7	174.9	-61.6	-98.3	0	0	0	109.8	S1096 Y1100 P1144 I1145 E1146 V1177 R1178 R1180	S1096-F1098 WeakPolarHBondContact OG-CE2 3.37Å; F1098-Y1100 HydrophobicContact CB-CE2 3.89Å; F1098-P1144 HydrophobicContact CB-CB 4.16Å; F1098-P1144 HydrophobicContact CD1-CB 4.27Å; F1098-P1144 HydrophobicContact CD1-CG 4.19Å; F1098-I1145 WeakPolarHBondContact CA-O 3.47Å; F1098-E1146 HydrophobicContact CD1-CB 3.74Å; F1098-E1146 HydrophobicContact CD1-CG 3.98Å; F1098-E1146 HydrophobicContact CE1-CB 3.62Å; F1098-E1146 HydrophobicContact CE1-CG 3.55Å; F1098-E1146 WeakPolarHBondContact CE1-OE2 3.48Å; F1098-E1146 HydrophobicContact CE2-CG 4.37Å; F1098-E1146 HydrophobicContact CZ-CB 4.36Å; F1098-E1146 HydrophobicContact CZ-CG 3.76Å; F1098-E1146 WeakPolarHBondContact CZ-OE1 3.43Å; F1098-V1177 WeakPolarHBondContact O-CA 3.45Å; F1098-R1178 HydrophobicContact CB-CB 4.2Å; F1098-R1178 VanDerWaalsContact CD1-NH2 3.3Å; F1098-R1178 VanDerWaalsContact CD2-NE 3.3Å; F1098-R1178 VanDerWaalsContact CD2-NH2 3.28Å; F1098-R1178 VanDerWaalsContact CG-NH2 3.33Å; F1098-R1178 PolarHBondContact N-O 2.96Å; F1098-R1178 PolarHBondContact O-N 3.42Å; F1098-R1180 HydrophobicContact CE2-CB 3.94Å
1099	V	86.8	Confident	75.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	112.6	173.9	-176.4	0	0	0	0	108.5	L1101 V1118 P1144 I1145 Y1147 V1165 I1174	V1099-L1101 HydrophobicContact CG1-CD2 4.08Å; V1099-V1118 HydrophobicContact CG2-CG2 4.07Å; V1099-P1144 WeakPolarHBondContact O-CA 3.36Å; V1099-I1145 PolarHBondContact N-O 3.38Å; V1099-I1145 PolarHBondContact O-N 3.06Å; V1099-Y1147 HydrophobicContact CG2-CD2 4.31Å; V1099-Y1147 HydrophobicContact CG2-CE2 4.02Å; V1099-V1165 HydrophobicContact CG2-CG2 4.36Å; V1099-I1174 HydrophobicContact CG1-CD1 4.05Å; V1099-I1174 HydrophobicContact CG1-CG1 4.02Å; V1099-I1174 HydrophobicContact CG1-CG2 3.94Å
1100	Y	85.6	Confident	75.5	Confident	44 Å²	44	52.8 Å²	52.8	17%	0.173	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128.6	176.4	-65.9	-104	0	0	0	108.7	W1058 F1098 P1144 I1174 A1175 A1176 R1178	W1058-Y1100 HydrophobicContact CH2-CD2 4.27Å; W1058-Y1100 HydrophobicContact CH2-CE1 4.31Å; W1058-Y1100 AromaticContact CH2-CE2 3.52Å; W1058-Y1100 HydrophobicContact CH2-CE2 3.52Å; W1058-Y1100 AromaticContact CH2-CZ 3.55Å; W1058-Y1100 AromaticContact CZ3-CD2 3.83Å; W1058-Y1100 HydrophobicContact CZ3-CD2 3.83Å; W1058-Y1100 AromaticContact CZ3-CE2 3.47Å; W1058-Y1100 HydrophobicContact CZ3-CE2 3.47Å; W1058-Y1100 VanDerWaalsContact CZ3-CE2 3.47Å; W1058-Y1100 AromaticContact CZ3-CZ 3.99Å; F1098-Y1100 HydrophobicContact CB-CE2 3.89Å; Y1100-P1144 HydrophobicContact CD1-CB 3.7Å; Y1100-P1144 HydrophobicContact CD1-CG 4.2Å; Y1100-P1144 HydrophobicContact CD2-CB 4.01Å; Y1100-P1144 HydrophobicContact CE1-CB 3.64Å; Y1100-P1144 HydrophobicContact CE1-CG 3.71Å; Y1100-P1144 HydrophobicContact CE2-CB 3.94Å; Y1100-P1144 HydrophobicContact CG-CB 3.88Å; Y1100-I1174 CarbonylContact O-C 3.42Å; Y1100-I1174 WeakPolarHBondContact O-CA 3.2Å; Y1100-I1174 WeakPolarHBondContact O-CG2 3.38Å; Y1100-A1175 PolarHBondContact O-N 2.81Å; Y1100-A1176 HydrophobicContact CD2-CB 4.15Å; Y1100-A1176 HydrophobicContact CG-CB 4.36Å; Y1100-A1176 PolarHBondContact N-O 3.26Å; Y1100-R1178 HydrophobicContact CE2-CB 3.98Å
1101	L	83.6	Confident	74.8	Confident	14 Å²	14	50.1 Å²	50.1	7%	0.073	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	136.7	177.5	-56.9	-174.5	0	0	0	112	V1099 D1104 L1116 A1138 S1143 I1145 I1172 S1173 I1174	V1099-L1101 HydrophobicContact CG1-CD2 4.08Å; L1101-D1104 HydrophobicContact CD1-CB 4.42Å; L1101-L1116 HydrophobicContact CD1-CD1 4.08Å; L1101-L1116 HydrophobicContact CD2-CD1 3.74Å; L1101-L1116 HydrophobicContact CG-CD1 4.47Å; L1101-A1138 HydrophobicContact CD1-CB 4.06Å; L1101-S1143 PolarHBondContact N-OG 3.45Å; L1101-S1143 PolarHBondContact O-OG 3.12Å; L1101-I1145 HydrophobicContact CD1-CD1 3.65Å; L1101-I1145 HydrophobicContact CD1-CG1 4.47Å; L1101-I1145 HydrophobicContact CG-CD1 4.21Å; L1101-I1172 HydrophobicContact CD2-CG2 4.1Å; L1101-S1173 CarbonylContact C-O 3.54Å; L1101-S1173 WeakPolarHBondContact CA-O 3.08Å; L1101-I1174 HydrophobicContact CD2-CG1 4.2Å
1102	A	78.2	Confident	74.1	Confident	72 Å²	72	56 Å²	56	60%	0.595	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	-21.2	164.2	0	0	0	0	0	112.5	S1173 A1175	A1102-S1173 PolarHBondContact N-O 3.31Å; A1102-A1175 HydrophobicContact CB-CB 4.07Å
1103	S	80.5	Confident	73.3	Confident	37 Å²	37	62.2 Å²	62.2	26%	0.259	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	139.3	173.2	174.9	0	0	0	0	108.8	G1105 R1171 I1172 S1173	S1103-G1105 PolarHBondContact OG-N 3.26Å; S1103-G1105 VanDerWaalsContact OG-N 3.15Å; S1103-R1171 WeakPolarHBondContact CB-O 3.48Å; S1103-R1171 PolarHBondContact OG-O 3.07Å; S1103-I1172 WeakPolarHBondContact O-CA 3.03Å; S1103-S1173 PolarHBondContact N-O 3.29Å; S1103-S1173 PolarHBondContact O-N 3.4Å
1104	D	80.5	Confident	72.8	Confident	33 Å²	33	62.9 Å²	62.9	18%	0.176	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-1	170.8	53.8	16.5	0	0	0	113.5	L1101 Y1106 A1138 S1139 C1140 I1172	L1101-D1104 HydrophobicContact CD1-CB 4.42Å; D1104-Y1106 VanDerWaalsContact C-N 3.28Å; D1104-Y1106 PolarHBondContact O-N 3.47Å; D1104-Y1106 WeakPolarHBondContact OD1-CB 3.28Å; D1104-Y1106 PolarHBondContact OD1-N 3.16Å; D1104-A1138 HydrophobicContact CB-CB 4.41Å; D1104-S1139 VanDerWaalsContact CB-CA 3.46Å; D1104-C1140 PolarHBondContact N-SG 3.48Å; D1104-C1140 VanDerWaalsContact N-SG 3.43Å; D1104-C1140 PolarHBondContact OD2-N 3.31Å; D1104-I1172 WeakPolarHBondContact O-CG1 3.37Å
1105	G	74.9	Confident	72.7	Confident	10 Å²	10	64.6 Å²	64.6	10%	0.103	34%	0.339	C	S	.	.			trans	74.8	12.3	178.8	0	0	0	0	0	114.8	S1103 V1107 R1171	S1103-G1105 PolarHBondContact OG-N 3.26Å; S1103-G1105 VanDerWaalsContact OG-N 3.15Å; G1105-V1107 PolarHBondContact O-N 2.95Å; G1105-R1171 VanDerWaalsContact CA-O 3.32Å; G1105-R1171 WeakPolarHBondContact CA-O 3.22Å; G1105-R1171 PolarHBondContact N-O 3.06Å
1106	Y	67.6	Low	72.7	Confident	147 Å²	147	63.1 Å²	63.1	58%	0.576	33%	0.33	S	S	*	.			trans	-65.2	121.9	180	-172.2	-84	0	0	0	112.4	D1104 Q1114	D1104-Y1106 VanDerWaalsContact C-N 3.28Å; D1104-Y1106 PolarHBondContact O-N 3.47Å; D1104-Y1106 WeakPolarHBondContact OD1-CB 3.28Å; D1104-Y1106 PolarHBondContact OD1-N 3.16Å; Y1106-Q1114 VanDerWaalsContact CD2-NE2 3.33Å
1107	V	59.5	Low	72.6	Confident	76 Å²	76	66.1 Å²	66.1	46%	0.461	34%	0.341	S	S	.	.			trans	-133.7	126.3	170	-177.7	0	0	0	0	107.4	G1105	G1105-V1107 PolarHBondContact O-N 2.95Å
1108	G	52.4	Low	72.5	Confident	49 Å²	49	66.1 Å²	66.1	51%	0.505	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	148.3	-166.5	0	0	0	0	0	115
1109	M	51.6	Low	72.5	Confident	176 Å²	176	66.6 Å²	66.6	87%	0.867	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	-18.1	-177.7	-62.1	-163.3	71.4	0	0	119.2
1110	Y	53.5	Low	72.5	Confident	193 Å²	193	66.7 Å²	66.7	76%	0.757	34%	0.343	S	S	*	.			trans	-131.5	105.3	175.7	-64.3	-82.7	0	0	0	112.1
1111	S	53.3	Low	72.4	Confident	82 Å²	82	65.6 Å²	65.6	57%	0.573	34%	0.34	S	S	*	.			trans	-98	0.3	-170	53.5	0	0	0	0	116.1	Y1113	S1111-Y1113 PolarHBondContact O-N 3.33Å
1112	E	56.9	Low	72.2	Confident	160 Å²	160	65 Å²	65	75%	0.748	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-19.2	-160.5	-61.9	-173.7	155.2	0	0	115.9
1113	Y	61	Low	72.4	Confident	154 Å²	154	66.4 Å²	66.4	60%	0.604	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	9.4	-169.9	-61.1	-77.9	0	0	0	115.3	S1111 S1115 G1168 S1169	S1111-Y1113 PolarHBondContact O-N 3.33Å; Y1113-S1115 PolarHBondContact O-N 3.28Å; Y1113-G1168 CarbonylContact O-C 3.55Å; Y1113-G1168 VanDerWaalsContact O-C 3.26Å; Y1113-S1169 VanDerWaalsContact O-CB 3.29Å; Y1113-S1169 WeakPolarHBondContact O-CB 2.94Å
1114	Q	72.6	Confident	72.3	Confident	26 Å²	26	68.8 Å²	68.8	12%	0.121	34%	0.344	C	S	.	.			trans	-86.5	63.9	-171.5	-65.4	166.2	18.8	0	0	112.1	Y1106 V1137 A1138	Y1106-Q1114 VanDerWaalsContact CD2-NE2 3.33Å; Q1114-V1137 HydrophobicContact CB-CG1 4.29Å; Q1114-V1137 CarbonylContact O-C 3.56Å; Q1114-V1137 WeakPolarHBondContact O-CA 3.41Å; Q1114-A1138 PolarHBondContact O-N 2.6Å
1115	S	81.5	Confident	72.2	Confident	37 Å²	37	69.2 Å²	69.2	26%	0.259	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	150.4	-173.9	79.2	0	0	0	0	115.1	Y1113 K1136 G1168	Y1113-S1115 PolarHBondContact O-N 3.28Å; S1115-K1136 CarbonylContact C-O 3.26Å; S1115-K1136 WeakPolarHBondContact CA-O 3.44Å; S1115-G1168 WeakPolarHBondContact O-CA 3.38Å; S1115-G1168 PolarHBondContact O-N 3.13Å
1116	L	84.5	Confident	72.4	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.005	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142.9	179	-75.5	157.9	0	0	0	111	L1101 T1135 K1136 A1138 I1145 Y1147 V1165 H1166 V1167 I1172	L1101-L1116 HydrophobicContact CD1-CD1 4.08Å; L1101-L1116 HydrophobicContact CD2-CD1 3.74Å; L1101-L1116 HydrophobicContact CG-CD1 4.47Å; L1116-T1135 CarbonylContact O-C 3.53Å; L1116-T1135 VanDerWaalsContact O-CA 3.29Å; L1116-T1135 WeakPolarHBondContact O-CA 3.41Å; L1116-K1136 PolarHBondContact N-O 2.91Å; L1116-K1136 PolarHBondContact O-N 3.36Å; L1116-A1138 HydrophobicContact CD1-CB 3.69Å; L1116-A1138 HydrophobicContact CG-CB 4.17Å; L1116-I1145 HydrophobicContact CD1-CD1 3.76Å; L1116-Y1147 VanDerWaalsContact CB-OH 3.3Å; L1116-Y1147 WeakPolarHBondContact CB-OH 3.43Å; L1116-Y1147 PolarHBondContact O-OH 3.06Å; L1116-Y1147 VanDerWaalsContact O-OH 3.12Å; L1116-V1165 HydrophobicContact CD2-CG1 3.87Å; L1116-H1166 WeakPolarHBondContact CA-O 3.4Å; L1116-V1167 HydrophobicContact CD2-CB 4.29Å; L1116-V1167 HydrophobicContact CD2-CG1 4.14Å; L1116-V1167 HydrophobicContact CD2-CG2 3.92Å; L1116-I1172 HydrophobicContact CD1-CG2 4.26Å; L1116-I1172 HydrophobicContact CD2-CG2 4.17Å; L1116-I1172 HydrophobicContact CG-CG2 4.42Å
1117	R	85.8	Confident	72.9	Confident	67 Å²	67	70.1 Å²	70.1	25%	0.253	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147.2	174.8	170.3	175.8	176.1	-98.2	1.6	110.1	E1119 E1129 T1135 H1166	R1117-E1119 IonicContact CZ-OE1 3Å; R1117-E1119 IonicContact NH1-OE1 3.27Å; R1117-E1119 PolarHBondContact NH1-OE1 3.42Å; R1117-E1119 IonicContact NH2-OE1 2.74Å; R1117-E1119 PolarHBondContact NH2-OE1 3.17Å; R1117-E1129 IonicContact CZ-OE1 3.17Å; R1117-E1129 IonicContact NE-OE1 3.6Å; R1117-E1129 PolarHBondContact NE-OE1 3.39Å; R1117-E1129 IonicContact NH2-OE1 2.89Å; R1117-E1129 PolarHBondContact NH2-OE1 2.94Å; R1117-E1129 IonicContact NH2-OE2 3.36Å; R1117-E1129 PolarHBondContact NH2-OE2 3.24Å; R1117-E1129 VanDerWaalsContact NH2-OE2 3.12Å; R1117-T1135 HydrophobicContact CB-CG2 4.2Å; R1117-H1166 HydrophobicContact CB-CB 4.24Å; R1117-H1166 PolarHBondContact N-O 2.75Å; R1117-H1166 PolarHBondContact O-N 3.05Å
1118	V	86.1	Confident	73.8	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	132.9	-173.5	178	0	0	0	0	112.1	V1097 V1099 I1130 S1133 Y1147 V1163 R1164 V1165	V1097-V1118 HydrophobicContact CB-CG1 4.47Å; V1097-V1118 HydrophobicContact CG1-CG1 4.22Å; V1097-V1118 HydrophobicContact CG2-CG1 4.47Å; V1099-V1118 HydrophobicContact CG2-CG2 4.07Å; V1118-I1130 HydrophobicContact CB-CD1 4.32Å; V1118-I1130 HydrophobicContact CG1-CD1 3.83Å; V1118-S1133 PolarHBondContact N-OG 3.07Å; V1118-S1133 PolarHBondContact O-OG 3.11Å; V1118-Y1147 HydrophobicContact CB-CD1 3.99Å; V1118-Y1147 HydrophobicContact CB-CD2 4.28Å; V1118-Y1147 HydrophobicContact CB-CE1 4.08Å; V1118-Y1147 HydrophobicContact CB-CE2 4.36Å; V1118-Y1147 HydrophobicContact CB-CG 4.1Å; V1118-Y1147 HydrophobicContact CG2-CD1 4.11Å; V1118-Y1147 HydrophobicContact CG2-CD2 3.73Å; V1118-Y1147 HydrophobicContact CG2-CE1 3.86Å; V1118-Y1147 HydrophobicContact CG2-CE2 3.46Å; V1118-Y1147 VanDerWaalsContact CG2-CE2 3.46Å; V1118-Y1147 HydrophobicContact CG2-CG 4.06Å; V1118-V1163 HydrophobicContact CG1-CG1 3.49Å; V1118-V1163 VanDerWaalsContact CG1-CG1 3.49Å; V1118-R1164 WeakPolarHBondContact CA-O 3.49Å; V1118-V1165 HydrophobicContact CG2-CG1 4.24Å; V1118-V1165 HydrophobicContact CG2-CG2 4.27Å
1119	E	86.3	Confident	74.8	Confident	21 Å²	21	72.8 Å²	72.8	10%	0.098	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	143.8	173.4	-54.2	178	165.3	0	0	110.1	R1117 R1164 H1166	R1117-E1119 IonicContact CZ-OE1 3Å; R1117-E1119 IonicContact NH1-OE1 3.27Å; R1117-E1119 PolarHBondContact NH1-OE1 3.42Å; R1117-E1119 IonicContact NH2-OE1 2.74Å; R1117-E1119 PolarHBondContact NH2-OE1 3.17Å; E1119-R1164 HydrophobicContact CB-CB 4.31Å; E1119-R1164 PolarHBondContact N-O 2.63Å; E1119-R1164 PolarHBondContact O-N 2.83Å; E1119-R1164 IonicContact OE2-CZ 2.75Å; E1119-R1164 IonicContact OE2-NH1 3.62Å; E1119-R1164 PolarHBondContact OE2-NH1 3.48Å; E1119-H1166 IonicContact OE1-NE2 3.21Å; E1119-H1166 IonicContact OE2-NE2 2.63Å
1120	L	86.5	Confident	75.8	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	134.1	170.2	-67.6	172	0	0	0	109.8	A1094 V1097 A1127 Y1128 I1130 V1149 F1158 V1163 L1179	A1094-L1120 HydrophobicContact CB-CD1 4.41Å; A1094-L1120 HydrophobicContact CB-CD2 4.44Å; V1097-L1120 HydrophobicContact CG2-CD2 3.71Å; L1120-A1127 CarbonylContact O-C 3.02Å; L1120-A1127 WeakPolarHBondContact O-CA 3.49Å; L1120-Y1128 PolarHBondContact N-O 3.49Å; L1120-Y1128 PolarHBondContact O-N 2.92Å; L1120-I1130 HydrophobicContact CD1-CD1 4.37Å; L1120-I1130 HydrophobicContact CD1-CG1 3.94Å; L1120-I1130 HydrophobicContact CD2-CD1 4.44Å; L1120-I1130 HydrophobicContact CG-CD1 4.01Å; L1120-I1130 HydrophobicContact CG-CG1 3.82Å; L1120-V1149 HydrophobicContact CD1-CB 4.36Å; L1120-V1149 HydrophobicContact CD1-CG1 3.58Å; L1120-V1149 HydrophobicContact CD1-CG2 3.76Å; L1120-F1158 HydrophobicContact CB-CE2 4.32Å; L1120-F1158 HydrophobicContact CD1-CE2 3.87Å; L1120-F1158 HydrophobicContact CD1-CZ 4.33Å; L1120-V1163 HydrophobicContact CD2-CG2 4.22Å; L1120-L1179 HydrophobicContact CD2-CD1 4.12Å
1121	I	84.1	Confident	76.4	Confident	21 Å²	21	64 Å²	64	11%	0.108	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	118.2	171.4	-48.8	-57.8	0	0	0	108	A1127 K1161 A1162 R1164	I1121-A1127 HydrophobicContact CD1-CB 3.74Å; I1121-K1161 HydrophobicContact CG2-CG 4.46Å; I1121-K1161 WeakPolarHBondContact O-CG 3.34Å; I1121-K1161 PolarHBondContact O-N 2.99Å; I1121-A1162 HydrophobicContact CB-CB 4.14Å; I1121-A1162 HydrophobicContact CG1-CB 4.34Å; I1121-A1162 PolarHBondContact N-O 3.13Å; I1121-A1162 PolarHBondContact O-N 3.48Å; I1121-R1164 HydrophobicContact CD1-CB 4.43Å
1122	A	80	Confident	76.6	Confident	3 Å²	3	63.1 Å²	63.1	3%	0.025	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	172	178.2	0	0	0	0	0	112.5	D1124 G1125 K1126 Y1128 F1158 Y1159 K1161	A1122-D1124 WeakPolarHBondContact CB-OD1 3.48Å; A1122-D1124 PolarHBondContact O-N 2.83Å; A1122-G1125 PolarHBondContact O-N 2.97Å; A1122-K1126 PolarHBondContact N-O 2.99Å; A1122-Y1128 HydrophobicContact CB-CD2 3.75Å; A1122-Y1128 HydrophobicContact CB-CE2 3.46Å; A1122-Y1128 VanDerWaalsContact CB-CE2 3.46Å; A1122-F1158 HydrophobicContact CB-CB 4.17Å; A1122-F1158 HydrophobicContact CB-CD2 4.22Å; A1122-Y1159 CarbonylContact C-O 3.59Å; A1122-Y1159 VanDerWaalsContact CA-O 3.26Å; A1122-Y1159 WeakPolarHBondContact CA-O 3.31Å; A1122-K1161 WeakPolarHBondContact O-CE 3.43Å
1123	I	80.8	Confident	76.7	Confident	101 Å²	101	55.9 Å²	55.9	52%	0.518	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-42	178.8	-47.2	-178.5	0	0	0	111.4	A1091 G1125 Y1159 K1161	A1091-I1123 HydrophobicContact CB-CD1 4.08Å; A1091-I1123 HydrophobicContact CB-CG1 4.03Å; I1123-G1125 PolarHBondContact O-N 2.86Å; I1123-G1125 VanDerWaalsContact O-N 3.08Å; I1123-Y1159 HydrophobicContact CD1-CG 4.2Å; I1123-Y1159 WeakPolarHBondContact CG1-O 3.38Å; I1123-Y1159 PolarHBondContact N-O 2.88Å; I1123-Y1159 VanDerWaalsContact N-O 3.08Å; I1123-K1161 PolarHBondContact O-NZ 2.04Å
1124	D	79.6	Confident	76.8	Confident	87 Å²	87	56.5 Å²	56.5	47%	0.465	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-3.6	178.3	76.5	-13.9	0	0	0	114.7	A1122 K1126	A1122-D1124 WeakPolarHBondContact CB-OD1 3.48Å; A1122-D1124 PolarHBondContact O-N 2.83Å; D1124-K1126 VanDerWaalsContact C-N 3.29Å; D1124-K1126 PolarHBondContact O-N 2.68Å; D1124-K1126 WeakPolarHBondContact OD1-CB 3.46Å; D1124-K1126 PolarHBondContact OD1-N 2.83Å; D1124-K1126 VanDerWaalsContact OD2-CD 3.28Å; D1124-K1126 WeakPolarHBondContact OD2-CD 3.33Å; D1124-K1126 WeakPolarHBondContact OD2-CE 3.49Å; D1124-K1126 WeakPolarHBondContact OD2-CG 3.2Å; D1124-K1126 IonicContact OD2-NZ 3.65Å; D1124-K1126 PolarHBondContact OD2-NZ 3.2Å
1125	G	77.1	Confident	76.9	Confident	42 Å²	42	59.2 Å²	59.2	43%	0.433	32%	0.315	S	S	.	.	S	Bend	trans	83.4	-4.7	179.5	0	0	0	0	0	114.6	A1122 I1123	A1122-G1125 PolarHBondContact O-N 2.97Å; I1123-G1125 PolarHBondContact O-N 2.86Å; I1123-G1125 VanDerWaalsContact O-N 3.08Å
1126	K	80.6	Confident	76.8	Confident	127 Å²	127	61 Å²	61	55%	0.552	32%	0.318	S	S	*	.			trans	-69.6	138.4	174.3	-64.5	-176.6	-165.5	121.3	0	110.3	A1122 D1124 Y1128	A1122-K1126 PolarHBondContact N-O 2.99Å; D1124-K1126 VanDerWaalsContact C-N 3.29Å; D1124-K1126 PolarHBondContact O-N 2.68Å; D1124-K1126 WeakPolarHBondContact OD1-CB 3.46Å; D1124-K1126 PolarHBondContact OD1-N 2.83Å; D1124-K1126 VanDerWaalsContact OD2-CD 3.28Å; D1124-K1126 WeakPolarHBondContact OD2-CD 3.33Å; D1124-K1126 WeakPolarHBondContact OD2-CE 3.49Å; D1124-K1126 WeakPolarHBondContact OD2-CG 3.2Å; D1124-K1126 IonicContact OD2-NZ 3.65Å; D1124-K1126 PolarHBondContact OD2-NZ 3.2Å; K1126-Y1128 HydrophobicContact CB-CD2 4.33Å; K1126-Y1128 HydrophobicContact CB-CE2 3.65Å; K1126-Y1128 WeakPolarHBondContact O-CD2 3.09Å
1127	A	77.6	Confident	76.7	Confident	49 Å²	49	64.9 Å²	64.9	41%	0.405	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	120.3	170.1	0	0	0	0	0	109.1	L1120 I1121	L1120-A1127 CarbonylContact O-C 3.02Å; L1120-A1127 WeakPolarHBondContact O-CA 3.49Å; I1121-A1127 HydrophobicContact CD1-CB 3.74Å
1128	Y	77.6	Confident	76.3	Confident	77 Å²	77	61.7 Å²	61.7	30%	0.302	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	108	172	-66.2	-91.7	0	0	0	107.7	L1120 A1122 K1126 I1130 F1158	L1120-Y1128 PolarHBondContact N-O 3.49Å; L1120-Y1128 PolarHBondContact O-N 2.92Å; A1122-Y1128 HydrophobicContact CB-CD2 3.75Å; A1122-Y1128 HydrophobicContact CB-CE2 3.46Å; A1122-Y1128 VanDerWaalsContact CB-CE2 3.46Å; K1126-Y1128 HydrophobicContact CB-CD2 4.33Å; K1126-Y1128 HydrophobicContact CB-CE2 3.65Å; K1126-Y1128 WeakPolarHBondContact O-CD2 3.09Å; Y1128-I1130 PolarHBondContact O-N 2.86Å; Y1128-F1158 HydrophobicContact CD1-CD1 4.33Å; Y1128-F1158 HydrophobicContact CD1-CE1 4.27Å; Y1128-F1158 HydrophobicContact CD1-CZ 4.41Å; Y1128-F1158 AromaticContact CD2-CD2 3.93Å; Y1128-F1158 HydrophobicContact CD2-CD2 3.93Å; Y1128-F1158 HydrophobicContact CD2-CE2 4.2Å; Y1128-F1158 HydrophobicContact CD2-CG 4.27Å; Y1128-F1158 HydrophobicContact CE1-CD1 4.47Å; Y1128-F1158 HydrophobicContact CE2-CB 4.43Å; Y1128-F1158 HydrophobicContact CE2-CD2 4.39Å; Y1128-F1158 HydrophobicContact CE2-CG 4.36Å; Y1128-F1158 HydrophobicContact CG-CD2 4.09Å; Y1128-F1158 HydrophobicContact CG-CE1 4.41Å; Y1128-F1158 AromaticContact CG-CE2 3.97Å; Y1128-F1158 HydrophobicContact CG-CE2 3.97Å; Y1128-F1158 HydrophobicContact CG-CG 4.37Å; Y1128-F1158 HydrophobicContact CG-CZ 4.14Å
1129	E	72.9	Confident	75.8	Confident	103 Å²	103	63.1 Å²	63.1	48%	0.481	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	127.7	170.2	-178.8	163.2	-149.3	0	0	109.3	R1117 R1131	R1117-E1129 IonicContact CZ-OE1 3.17Å; R1117-E1129 IonicContact NE-OE1 3.6Å; R1117-E1129 PolarHBondContact NE-OE1 3.39Å; R1117-E1129 IonicContact NH2-OE1 2.89Å; R1117-E1129 PolarHBondContact NH2-OE1 2.94Å; R1117-E1129 IonicContact NH2-OE2 3.36Å; R1117-E1129 PolarHBondContact NH2-OE2 3.24Å; R1117-E1129 VanDerWaalsContact NH2-OE2 3.12Å; E1129-R1131 PolarHBondContact O-N 3.48Å; E1129-R1131 VanDerWaalsContact O-N 3.14Å
1130	I	73.9	Confident	75.4	Confident	7 Å²	7	64.8 Å²	64.8	4%	0.036	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-66.4	116.8	-179.8	-61.5	170.3	0	0	0	107.5	V1097 V1118 L1120 Y1128 G1132 S1133 T1148 V1149	V1097-I1130 HydrophobicContact CG2-CD1 4.01Å; V1118-I1130 HydrophobicContact CB-CD1 4.32Å; V1118-I1130 HydrophobicContact CG1-CD1 3.83Å; L1120-I1130 HydrophobicContact CD1-CD1 4.37Å; L1120-I1130 HydrophobicContact CD1-CG1 3.94Å; L1120-I1130 HydrophobicContact CD2-CD1 4.44Å; L1120-I1130 HydrophobicContact CG-CD1 4.01Å; L1120-I1130 HydrophobicContact CG-CG1 3.82Å; Y1128-I1130 PolarHBondContact O-N 2.86Å; I1130-G1132 PolarHBondContact O-N 3.22Å; I1130-G1132 VanDerWaalsContact O-N 3.12Å; I1130-S1133 WeakPolarHBondContact O-CB 3.37Å; I1130-S1133 PolarHBondContact O-N 2.64Å; I1130-T1148 WeakPolarHBondContact CG2-O 3.06Å; I1130-V1149 HydrophobicContact CD1-CG2 4.01Å; I1130-V1149 HydrophobicContact CG1-CG2 4.25Å; I1130-V1149 HydrophobicContact CG2-CG2 4.39Å
1131	R	65.8	Low	74.7	Confident	179 Å²	179	69.4 Å²	69.4	68%	0.675	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	120.7	174.5	-84.4	-175.4	169.2	-179.4	-3.7	109.5	E1129 W1150	E1129-R1131 PolarHBondContact O-N 3.48Å; E1129-R1131 VanDerWaalsContact O-N 3.14Å; R1131-W1150 VanDerWaalsContact O-CD1 3.27Å
1132	G	58.1	Low	74.3	Confident	63 Å²	63	74.8 Å²	74.8	65%	0.649	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.8	3.4	-172	0	0	0	0	0	115.2	I1130 Q1134	I1130-G1132 PolarHBondContact O-N 3.22Å; I1130-G1132 VanDerWaalsContact O-N 3.12Å; G1132-Q1134 PolarHBondContact O-N 2.7Å
1133	S	57.4	Low	74.1	Confident	8 Å²	8	76.7 Å²	76.7	6%	0.056	43%	0.427	C	S	.	.			trans	-73.4	50.4	166.7	-177.5	0	0	0	0	112.2	V1118 I1130 T1135	V1118-S1133 PolarHBondContact N-OG 3.07Å; V1118-S1133 PolarHBondContact O-OG 3.11Å; I1130-S1133 WeakPolarHBondContact O-CB 3.37Å; I1130-S1133 PolarHBondContact O-N 2.64Å; S1133-T1135 PolarHBondContact O-N 2.92Å
1134	Q	64.2	Low	74.2	Confident	167 Å²	167	74.2 Å²	74.2	78%	0.78	42%	0.418	S	S	*	.			trans	-55.8	140.2	157.7	-72.4	-173.7	-8.1	0	0	108.4	G1132 K1136	G1132-Q1134 PolarHBondContact O-N 2.7Å; Q1134-K1136 WeakPolarHBondContact O-CG 3.29Å; Q1134-K1136 PolarHBondContact O-N 3.24Å
1135	T	73.6	Confident	74.4	Confident	83 Å²	83	70.5 Å²	70.5	51%	0.509	40%	0.398	S	S	.	.			trans	-54.7	106.8	-176.1	-23.9	0	0	0	0	109.6	L1116 R1117 S1133	L1116-T1135 CarbonylContact O-C 3.53Å; L1116-T1135 VanDerWaalsContact O-CA 3.29Å; L1116-T1135 WeakPolarHBondContact O-CA 3.41Å; R1117-T1135 HydrophobicContact CB-CG2 4.2Å; S1133-T1135 PolarHBondContact O-N 2.92Å
1136	K	81	Confident	74.9	Confident	73 Å²	73	72 Å²	72	32%	0.317	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	133.5	-174.9	-65.3	-162.1	172.9	-161.3	0	109.2	S1115 L1116 Q1134 A1138 I1145 E1146 Y1147	S1115-K1136 CarbonylContact C-O 3.26Å; S1115-K1136 WeakPolarHBondContact CA-O 3.44Å; L1116-K1136 PolarHBondContact N-O 2.91Å; L1116-K1136 PolarHBondContact O-N 3.36Å; Q1134-K1136 WeakPolarHBondContact O-CG 3.29Å; Q1134-K1136 PolarHBondContact O-N 3.24Å; K1136-A1138 PolarHBondContact O-N 2.84Å; K1136-A1138 VanDerWaalsContact O-N 3.16Å; K1136-I1145 HydrophobicContact CB-CG2 4.14Å; K1136-I1145 HydrophobicContact CD-CG2 3.57Å; K1136-I1145 HydrophobicContact CG-CG2 4.44Å; K1136-E1146 PolarHBondContact NZ-O 2.9Å; K1136-Y1147 HydrophobicContact CB-CE1 4.43Å; K1136-Y1147 HydrophobicContact CD-CD1 4.21Å; K1136-Y1147 HydrophobicContact CD-CE1 3.81Å; K1136-Y1147 HydrophobicContact CD-CE2 4.35Å; K1136-Y1147 HydrophobicContact CG-CE1 3.8Å
1137	V	80.7	Confident	75.2	Confident	83 Å²	83	66 Å²	66	50%	0.503	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	118.9	174.5	179.7	0	0	0	0	108.9	Q1114 S1139	Q1114-V1137 HydrophobicContact CB-CG1 4.29Å; Q1114-V1137 CarbonylContact O-C 3.56Å; Q1114-V1137 WeakPolarHBondContact O-CA 3.41Å; V1137-S1139 PolarHBondContact O-N 2.98Å
1138	A	78.4	Confident	75.5	Confident	0 Å²	0	67 Å²	67	0%	0	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-63	125.2	173.8	0	0	0	0	0	108.5	L1101 D1104 Q1114 L1116 K1136 I1172	L1101-A1138 HydrophobicContact CD1-CB 4.06Å; D1104-A1138 HydrophobicContact CB-CB 4.41Å; Q1114-A1138 PolarHBondContact O-N 2.6Å; L1116-A1138 HydrophobicContact CD1-CB 3.69Å; L1116-A1138 HydrophobicContact CG-CB 4.17Å; K1136-A1138 PolarHBondContact O-N 2.84Å; K1136-A1138 VanDerWaalsContact O-N 3.16Å; A1138-I1172 HydrophobicContact CB-CD1 3.65Å; A1138-I1172 HydrophobicContact CB-CG1 3.9Å; A1138-I1172 HydrophobicContact CB-CG2 4.36Å
1139	S	76.4	Confident	75.7	Confident	30 Å²	30	63.9 Å²	63.9	21%	0.21	36%	0.357	C	S	.	.			trans	-154.6	128	178.5	179.5	0	0	0	0	108.9	D1104 V1137 A1141 K1142 S1143	D1104-S1139 VanDerWaalsContact CB-CA 3.46Å; V1137-S1139 PolarHBondContact O-N 2.98Å; S1139-A1141 PolarHBondContact O-N 3.2Å; S1139-A1141 PolarHBondContact OG-N 2.87Å; S1139-K1142 CarbonylContact O-C 3.57Å; S1139-K1142 WeakPolarHBondContact O-CA 3.45Å; S1139-K1142 PolarHBondContact O-N 3.15Å; S1139-S1143 PolarHBondContact O-N 3.18Å
1140	C	76.4	Confident	75.9	Confident	56 Å²	56	65.9 Å²	65.9	38%	0.378	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-62.8	-30.3	176.8	-78.4	0	0	0	0	111.1	D1104 K1142 S1143	D1104-C1140 PolarHBondContact N-SG 3.48Å; D1104-C1140 VanDerWaalsContact N-SG 3.43Å; D1104-C1140 PolarHBondContact OD2-N 3.31Å; C1140-K1142 PolarHBondContact O-N 3.28Å; C1140-S1143 VanDerWaalsContact O-CB 3.27Å; C1140-S1143 WeakPolarHBondContact O-CB 3.21Å; C1140-S1143 PolarHBondContact O-N 3.4Å; C1140-S1143 VanDerWaalsContact O-N 3.15Å
1141	A	73	Confident	75.9	Confident	99 Å²	99	67.4 Å²	67.4	82%	0.818	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-67.6	-14.9	172.2	0	0	0	0	0	114	S1139	S1139-A1141 PolarHBondContact O-N 3.2Å; S1139-A1141 PolarHBondContact OG-N 2.87Å
1142	K	75.5	Confident	75.9	Confident	134 Å²	134	61.5 Å²	61.5	58%	0.583	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-107.3	11.3	173.4	-62.6	-176.5	-179.7	176.1	0	112.9	S1139 C1140 P1144 I1145	S1139-K1142 CarbonylContact O-C 3.57Å; S1139-K1142 WeakPolarHBondContact O-CA 3.45Å; S1139-K1142 PolarHBondContact O-N 3.15Å; C1140-K1142 PolarHBondContact O-N 3.28Å; K1142-P1144 CarbonylContact O-C 3.59Å; K1142-P1144 VanDerWaalsContact O-O 3.14Å; K1142-I1145 HydrophobicContact CB-CG1 4.34Å; K1142-I1145 VanDerWaalsContact O-CG1 3.3Å; K1142-I1145 WeakPolarHBondContact O-CG1 3.46Å; K1142-I1145 PolarHBondContact O-N 3.02Å
1143	S	76.2	Confident	75.9	Confident	42 Å²	42	64.7 Å²	64.7	29%	0.294	35%	0.351	S	S	.	.			trans	-81.5	130.1	178	-171.2	0	0	0	0	110.6	L1101 S1139 C1140	L1101-S1143 PolarHBondContact N-OG 3.45Å; L1101-S1143 PolarHBondContact O-OG 3.12Å; S1139-S1143 PolarHBondContact O-N 3.18Å; C1140-S1143 VanDerWaalsContact O-CB 3.27Å; C1140-S1143 WeakPolarHBondContact O-CB 3.21Å; C1140-S1143 PolarHBondContact O-N 3.4Å; C1140-S1143 VanDerWaalsContact O-N 3.15Å
1144	P	81.9	Confident	76	Confident	50 Å²	50	69.1 Å²	69.1	33%	0.325	38%	0.381	S	S	.	.	S	Bend	cis	-76.2	137.3	-3.1	30	-33.7	0	0	0	113.4	F1098 V1099 Y1100 K1142 E1146	F1098-P1144 HydrophobicContact CB-CB 4.16Å; F1098-P1144 HydrophobicContact CD1-CB 4.27Å; F1098-P1144 HydrophobicContact CD1-CG 4.19Å; V1099-P1144 WeakPolarHBondContact O-CA 3.36Å; Y1100-P1144 HydrophobicContact CD1-CB 3.7Å; Y1100-P1144 HydrophobicContact CD1-CG 4.2Å; Y1100-P1144 HydrophobicContact CD2-CB 4.01Å; Y1100-P1144 HydrophobicContact CE1-CB 3.64Å; Y1100-P1144 HydrophobicContact CE1-CG 3.71Å; Y1100-P1144 HydrophobicContact CE2-CB 3.94Å; Y1100-P1144 HydrophobicContact CG-CB 3.88Å; K1142-P1144 CarbonylContact O-C 3.59Å; K1142-P1144 VanDerWaalsContact O-O 3.14Å; P1144-E1146 PolarHBondContact O-N 3.45Å
1145	I	84.3	Confident	76	Confident	8 Å²	8	66.9 Å²	66.9	4%	0.041	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	109.2	176	-60.1	176.9	0	0	0	108.6	F1098 V1099 L1101 L1116 K1136 K1142 Y1147	F1098-I1145 WeakPolarHBondContact CA-O 3.47Å; V1099-I1145 PolarHBondContact N-O 3.38Å; V1099-I1145 PolarHBondContact O-N 3.06Å; L1101-I1145 HydrophobicContact CD1-CD1 3.65Å; L1101-I1145 HydrophobicContact CD1-CG1 4.47Å; L1101-I1145 HydrophobicContact CG-CD1 4.21Å; L1116-I1145 HydrophobicContact CD1-CD1 3.76Å; K1136-I1145 HydrophobicContact CB-CG2 4.14Å; K1136-I1145 HydrophobicContact CD-CG2 3.57Å; K1136-I1145 HydrophobicContact CG-CG2 4.44Å; K1142-I1145 HydrophobicContact CB-CG1 4.34Å; K1142-I1145 VanDerWaalsContact O-CG1 3.3Å; K1142-I1145 WeakPolarHBondContact O-CG1 3.46Å; K1142-I1145 PolarHBondContact O-N 3.02Å; I1145-Y1147 HydrophobicContact CB-CE2 4.35Å; I1145-Y1147 HydrophobicContact CG2-CD2 4.21Å; I1145-Y1147 HydrophobicContact CG2-CE2 3.57Å
1146	E	86.8	Confident	75.6	Confident	73 Å²	73	68.8 Å²	68.8	34%	0.341	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	130.4	176.4	-174.5	169	-163.9	0	0	112.2	S1096 V1097 F1098 K1136 P1144	S1096-E1146 WeakPolarHBondContact CB-OE1 3.5Å; S1096-E1146 PolarHBondContact OG-OE1 3.05Å; V1097-E1146 CarbonylContact O-C 3.42Å; V1097-E1146 WeakPolarHBondContact O-CA 3.39Å; F1098-E1146 HydrophobicContact CD1-CB 3.74Å; F1098-E1146 HydrophobicContact CD1-CG 3.98Å; F1098-E1146 HydrophobicContact CE1-CB 3.62Å; F1098-E1146 HydrophobicContact CE1-CG 3.55Å; F1098-E1146 WeakPolarHBondContact CE1-OE2 3.48Å; F1098-E1146 HydrophobicContact CE2-CG 4.37Å; F1098-E1146 HydrophobicContact CZ-CB 4.36Å; F1098-E1146 HydrophobicContact CZ-CG 3.76Å; F1098-E1146 WeakPolarHBondContact CZ-OE1 3.43Å; K1136-E1146 PolarHBondContact NZ-O 2.9Å; P1144-E1146 PolarHBondContact O-N 3.45Å
1147	Y	87.5	Confident	75.1	Confident	3 Å²	3	66.9 Å²	66.9	1%	0.012	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	101.3	168.3	-65.7	-102	0	0	0	108.3	S1096 V1097 V1099 L1116 V1118 K1136 I1145	S1096-Y1147 CarbonylContact C-O 3.6Å; S1096-Y1147 VanDerWaalsContact CA-O 3.26Å; S1096-Y1147 WeakPolarHBondContact CA-O 3.44Å; S1096-Y1147 WeakPolarHBondContact CB-O 3.44Å; V1097-Y1147 PolarHBondContact N-O 2.99Å; V1097-Y1147 PolarHBondContact O-N 3.31Å; V1099-Y1147 HydrophobicContact CG2-CD2 4.31Å; V1099-Y1147 HydrophobicContact CG2-CE2 4.02Å; L1116-Y1147 VanDerWaalsContact CB-OH 3.3Å; L1116-Y1147 WeakPolarHBondContact CB-OH 3.43Å; L1116-Y1147 PolarHBondContact O-OH 3.06Å; L1116-Y1147 VanDerWaalsContact O-OH 3.12Å; V1118-Y1147 HydrophobicContact CB-CD1 3.99Å; V1118-Y1147 HydrophobicContact CB-CD2 4.28Å; V1118-Y1147 HydrophobicContact CB-CE1 4.08Å; V1118-Y1147 HydrophobicContact CB-CE2 4.36Å; V1118-Y1147 HydrophobicContact CB-CG 4.1Å; V1118-Y1147 HydrophobicContact CG2-CD1 4.11Å; V1118-Y1147 HydrophobicContact CG2-CD2 3.73Å; V1118-Y1147 HydrophobicContact CG2-CE1 3.86Å; V1118-Y1147 HydrophobicContact CG2-CE2 3.46Å; V1118-Y1147 VanDerWaalsContact CG2-CE2 3.46Å; V1118-Y1147 HydrophobicContact CG2-CG 4.06Å; K1136-Y1147 HydrophobicContact CB-CE1 4.43Å; K1136-Y1147 HydrophobicContact CD-CD1 4.21Å; K1136-Y1147 HydrophobicContact CD-CE1 3.81Å; K1136-Y1147 HydrophobicContact CD-CE2 4.35Å; K1136-Y1147 HydrophobicContact CG-CE1 3.8Å; I1145-Y1147 HydrophobicContact CB-CE2 4.35Å; I1145-Y1147 HydrophobicContact CG2-CD2 4.21Å; I1145-Y1147 HydrophobicContact CG2-CE2 3.57Å
1148	T	84.8	Confident	74.9	Confident	68 Å²	68	65 Å²	65	42%	0.417	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	129.5	177.3	-45.2	0	0	0	0	110.7	I1130	I1130-T1148 WeakPolarHBondContact CG2-O 3.06Å
1149	V	81	Confident	75	Confident	12 Å²	12	69.4 Å²	69.4	7%	0.073	38%	0.377	C	S	.	.			trans	-96.9	116.5	-178.3	-178.8	0	0	0	0	109.5	A1094 T1095 V1097 L1120 I1130	A1094-V1149 HydrophobicContact CB-CG2 4.36Å; A1094-V1149 VanDerWaalsContact O-CB 3.25Å; A1094-V1149 WeakPolarHBondContact O-CB 3.25Å; A1094-V1149 VanDerWaalsContact O-CG1 3.23Å; A1094-V1149 WeakPolarHBondContact O-CG1 3.31Å; T1095-V1149 PolarHBondContact O-N 3.36Å; V1097-V1149 HydrophobicContact CG2-CG2 4.31Å; L1120-V1149 HydrophobicContact CD1-CB 4.36Å; L1120-V1149 HydrophobicContact CD1-CG1 3.58Å; L1120-V1149 HydrophobicContact CD1-CG2 3.76Å; I1130-V1149 HydrophobicContact CD1-CG2 4.01Å; I1130-V1149 HydrophobicContact CG1-CG2 4.25Å; I1130-V1149 HydrophobicContact CG2-CG2 4.39Å
1150	W	76.2	Confident	75.1	Confident	145 Å²	145	68 Å²	68	55%	0.549	37%	0.367	S	S	.	.			trans	-94.1	115.1	177.6	-63.1	89.7	0	0	0	110.3	R1131	R1131-W1150 VanDerWaalsContact O-CD1 3.27Å
1151	H	73.9	Confident	75.3	Confident	39 Å²	39	70.8 Å²	70.8	18%	0.181	37%	0.373	C	S	.	.			trans	-88	134.3	171	-70.4	-77.8	0	0	0	110.8	V1093 A1094 L1153 F1157 F1158	V1093-H1151 WeakPolarHBondContact CG1-NE2 3.42Å; A1094-H1151 PolarHBondContact O-NE2 3.4Å; H1151-L1153 PolarHBondContact O-N 3.28Å; H1151-F1157 HydrophobicContact CB-CD1 3.89Å; H1151-F1157 HydrophobicContact CB-CE1 3.75Å; H1151-F1157 AromaticContact CG-CD1 3.77Å; H1151-F1157 AromaticContact ND1-CD1 3.82Å; H1151-F1158 AromaticContact ND1-CE1 3.86Å
1152	D	66	Low	75.7	Confident	55 Å²	55	68.2 Å²	68.2	29%	0.294	35%	0.352	S	S	.	.			trans	-83.3	101.7	172.4	-177.2	-9.1	0	0	0	108.2	S1154 K1155	D1152-S1154 PolarHBondContact O-N 2.89Å; D1152-S1154 WeakPolarHBondContact OD1-CB 3.48Å; D1152-S1154 PolarHBondContact OD1-N 2.87Å; D1152-S1154 PolarHBondContact OD1-OG 3.08Å; D1152-K1155 HydrophobicContact CB-CB 4.47Å; D1152-K1155 HydrophobicContact CB-CD 4.35Å; D1152-K1155 PolarHBondContact O-N 2.82Å; D1152-K1155 WeakPolarHBondContact OD2-CD 3.16Å; D1152-K1155 VanDerWaalsContact OD2-CE 3.24Å; D1152-K1155 WeakPolarHBondContact OD2-CE 3.21Å; D1152-K1155 IonicContact OD2-NZ 2.71Å; D1152-K1155 PolarHBondContact OD2-NZ 2.83Å
1153	L	59.9	Low	76.1	Confident	131 Å²	131	63.8 Å²	63.8	69%	0.686	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-11.9	-176.4	-60.3	179.3	0	0	0	113.7	H1151 K1155 F1157	H1151-L1153 PolarHBondContact O-N 3.28Å; L1153-K1155 VanDerWaalsContact C-N 3.26Å; L1153-F1157 HydrophobicContact CD2-CE1 3.85Å; L1153-F1157 HydrophobicContact CD2-CZ 3.49Å; L1153-F1157 VanDerWaalsContact CD2-CZ 3.49Å
1154	S	58.1	Low	76.6	Confident	100 Å²	100	67.4 Å²	67.4	70%	0.699	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-6	172.2	74	0	0	0	0	113.4	D1152	D1152-S1154 PolarHBondContact O-N 2.89Å; D1152-S1154 WeakPolarHBondContact OD1-CB 3.48Å; D1152-S1154 PolarHBondContact OD1-N 2.87Å; D1152-S1154 PolarHBondContact OD1-OG 3.08Å
1155	K	65.4	Low	76.7	Confident	121 Å²	121	66.8 Å²	66.8	53%	0.526	34%	0.339	S	S	.	.	S	Bend	trans	-123.8	155.3	-177.1	-65	179.3	-174.5	160.8	0	111	D1152 L1153 F1157	D1152-K1155 HydrophobicContact CB-CB 4.47Å; D1152-K1155 HydrophobicContact CB-CD 4.35Å; D1152-K1155 PolarHBondContact O-N 2.82Å; D1152-K1155 WeakPolarHBondContact OD2-CD 3.16Å; D1152-K1155 VanDerWaalsContact OD2-CE 3.24Å; D1152-K1155 WeakPolarHBondContact OD2-CE 3.21Å; D1152-K1155 IonicContact OD2-NZ 2.71Å; D1152-K1155 PolarHBondContact OD2-NZ 2.83Å; L1153-K1155 VanDerWaalsContact C-N 3.26Å; K1155-F1157 PolarHBondContact O-N 2.83Å
1156	P	64.8	Low	76.8	Confident	123 Å²	123	70 Å²	70	80%	0.799	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-56.8	134.3	173.1	-23.2	33.7	0	0	0	111.2	F1158	P1156-F1158 PolarHBondContact O-N 2.89Å
1157	F	69.7	Low	76.5	Confident	32 Å²	32	69.6 Å²	69.6	14%	0.14	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-61.2	129.5	172.6	-64.5	-84.3	0	0	0	110.1	V1093 H1151 L1153 K1155 F1185 P1187 V1190	V1093-F1157 HydrophobicContact CG1-CB 4.27Å; V1093-F1157 HydrophobicContact CG1-CD1 3.7Å; V1093-F1157 HydrophobicContact CG1-CE1 4.47Å; V1093-F1157 HydrophobicContact CG1-CG 4.28Å; V1093-F1157 HydrophobicContact CG2-CB 3.9Å; V1093-F1157 HydrophobicContact CG2-CG 4.46Å; H1151-F1157 HydrophobicContact CB-CD1 3.89Å; H1151-F1157 HydrophobicContact CB-CE1 3.75Å; H1151-F1157 AromaticContact CG-CD1 3.77Å; H1151-F1157 AromaticContact ND1-CD1 3.82Å; L1153-F1157 HydrophobicContact CD2-CE1 3.85Å; L1153-F1157 HydrophobicContact CD2-CZ 3.49Å; L1153-F1157 VanDerWaalsContact CD2-CZ 3.49Å; K1155-F1157 PolarHBondContact O-N 2.83Å; F1157-F1185 HydrophobicContact CD1-CE1 4.3Å; F1157-F1185 AromaticContact CE1-CE1 3.95Å; F1157-F1185 HydrophobicContact CE1-CE1 3.95Å; F1157-F1185 AromaticContact CE1-CZ 3.75Å; F1157-F1185 HydrophobicContact CE1-CZ 3.75Å; F1157-F1185 HydrophobicContact CE2-CE1 4.49Å; F1157-F1185 HydrophobicContact CE2-CZ 4.16Å; F1157-F1185 HydrophobicContact CZ-CE1 4.06Å; F1157-F1185 AromaticContact CZ-CZ 3.55Å; F1157-F1185 HydrophobicContact CZ-CZ 3.55Å; F1157-P1187 HydrophobicContact CB-CB 4.23Å; F1157-P1187 HydrophobicContact CD2-CB 3.51Å; F1157-P1187 HydrophobicContact CE2-CB 4.13Å; F1157-P1187 HydrophobicContact CG-CB 4.04Å; F1157-V1190 HydrophobicContact CE2-CB 4.09Å; F1157-V1190 HydrophobicContact CE2-CG1 4Å; F1157-V1190 HydrophobicContact CE2-CG2 4.3Å; F1157-V1190 HydrophobicContact CZ-CG1 4.44Å
1158	F	76.3	Confident	76.1	Confident	45 Å²	45	71.1 Å²	71.1	20%	0.197	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-93.6	125.2	173.4	59.1	-86	0	0	0	110.2	L1120 A1122 Y1128 H1151 P1156 S1160	L1120-F1158 HydrophobicContact CB-CE2 4.32Å; L1120-F1158 HydrophobicContact CD1-CE2 3.87Å; L1120-F1158 HydrophobicContact CD1-CZ 4.33Å; A1122-F1158 HydrophobicContact CB-CB 4.17Å; A1122-F1158 HydrophobicContact CB-CD2 4.22Å; Y1128-F1158 HydrophobicContact CD1-CD1 4.33Å; Y1128-F1158 HydrophobicContact CD1-CE1 4.27Å; Y1128-F1158 HydrophobicContact CD1-CZ 4.41Å; Y1128-F1158 AromaticContact CD2-CD2 3.93Å; Y1128-F1158 HydrophobicContact CD2-CD2 3.93Å; Y1128-F1158 HydrophobicContact CD2-CE2 4.2Å; Y1128-F1158 HydrophobicContact CD2-CG 4.27Å; Y1128-F1158 HydrophobicContact CE1-CD1 4.47Å; Y1128-F1158 HydrophobicContact CE2-CB 4.43Å; Y1128-F1158 HydrophobicContact CE2-CD2 4.39Å; Y1128-F1158 HydrophobicContact CE2-CG 4.36Å; Y1128-F1158 HydrophobicContact CG-CD2 4.09Å; Y1128-F1158 HydrophobicContact CG-CE1 4.41Å; Y1128-F1158 AromaticContact CG-CE2 3.97Å; Y1128-F1158 HydrophobicContact CG-CE2 3.97Å; Y1128-F1158 HydrophobicContact CG-CG 4.37Å; Y1128-F1158 HydrophobicContact CG-CZ 4.14Å; H1151-F1158 AromaticContact ND1-CE1 3.86Å; P1156-F1158 PolarHBondContact O-N 2.89Å; F1158-S1160 PolarHBondContact O-N 3.03Å
1159	Y	80.8	Confident	75.6	Confident	91 Å²	91	69 Å²	69	36%	0.357	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-75.2	123	173	-70.1	-96.7	0	0	0	109.3	A1091 V1093 A1122 I1123 P1187	A1091-Y1159 WeakPolarHBondContact O-CD1 3.37Å; V1093-Y1159 HydrophobicContact CG2-CD1 4.33Å; V1093-Y1159 HydrophobicContact CG2-CE1 4.23Å; A1122-Y1159 CarbonylContact C-O 3.59Å; A1122-Y1159 VanDerWaalsContact CA-O 3.26Å; A1122-Y1159 WeakPolarHBondContact CA-O 3.31Å; I1123-Y1159 HydrophobicContact CD1-CG 4.2Å; I1123-Y1159 WeakPolarHBondContact CG1-O 3.38Å; I1123-Y1159 PolarHBondContact N-O 2.88Å; I1123-Y1159 VanDerWaalsContact N-O 3.08Å; Y1159-P1187 VanDerWaalsContact OH-CG 3.3Å; Y1159-P1187 WeakPolarHBondContact OH-CG 3.48Å
1160	S	78.7	Confident	75.3	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.007	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	124.4	-178.8	-61.4	0	0	0	0	110.3	A1091 V1092 F1158	A1091-S1160 WeakPolarHBondContact CA-O 3.06Å; V1092-S1160 PolarHBondContact N-O 2.83Å; V1092-S1160 PolarHBondContact O-N 3.36Å; F1158-S1160 PolarHBondContact O-N 3.03Å
1161	K	81.4	Confident	75.2	Confident	114 Å²	114	76 Å²	76	50%	0.496	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-24.4	178.2	71.8	173.6	171.6	-157.3	0	114	A1091 I1121 A1122 I1123	A1091-K1161 HydrophobicContact CB-CB 4.4Å; I1121-K1161 HydrophobicContact CG2-CG 4.46Å; I1121-K1161 WeakPolarHBondContact O-CG 3.34Å; I1121-K1161 PolarHBondContact O-N 2.99Å; A1122-K1161 WeakPolarHBondContact O-CE 3.43Å; I1123-K1161 PolarHBondContact O-NZ 2.04Å
1162	A	80.7	Confident	75.5	Confident	45 Å²	45	74.8 Å²	74.8	37%	0.372	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	166.2	178.9	0	0	0	0	0	111.8	I1121	I1121-A1162 HydrophobicContact CB-CB 4.14Å; I1121-A1162 HydrophobicContact CG1-CB 4.34Å; I1121-A1162 PolarHBondContact N-O 3.13Å; I1121-A1162 PolarHBondContact O-N 3.48Å
1163	V	84.5	Confident	76.2	Confident	42 Å²	42	74.9 Å²	74.9	26%	0.255	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.9	176.4	179.5	0	0	0	0	107.7	V1097 V1118 L1120 V1165 V1177 L1179	V1097-V1163 HydrophobicContact CG1-CG1 3.8Å; V1097-V1163 HydrophobicContact CG1-CG2 4.1Å; V1097-V1163 HydrophobicContact CG2-CG2 4.21Å; V1118-V1163 HydrophobicContact CG1-CG1 3.49Å; V1118-V1163 VanDerWaalsContact CG1-CG1 3.49Å; L1120-V1163 HydrophobicContact CD2-CG2 4.22Å; V1163-V1165 HydrophobicContact CG1-CG2 4.06Å; V1163-V1177 HydrophobicContact CB-CG1 4.42Å; V1163-V1177 HydrophobicContact CG1-CG1 4.27Å; V1163-L1179 HydrophobicContact CG2-CD1 4.08Å
1164	R	85.7	Confident	77.3	Confident	118 Å²	118	70.5 Å²	70.5	45%	0.445	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	127.5	169.8	-177.7	-173.5	-69.2	145.6	-8.3	108.6	V1118 E1119 I1121 H1166	V1118-R1164 WeakPolarHBondContact CA-O 3.49Å; E1119-R1164 HydrophobicContact CB-CB 4.31Å; E1119-R1164 PolarHBondContact N-O 2.63Å; E1119-R1164 PolarHBondContact O-N 2.83Å; E1119-R1164 IonicContact OE2-CZ 2.75Å; E1119-R1164 IonicContact OE2-NH1 3.62Å; E1119-R1164 PolarHBondContact OE2-NH1 3.48Å; I1121-R1164 HydrophobicContact CD1-CB 4.43Å; R1164-H1166 WeakPolarHBondContact CD-NE2 3.02Å
1165	V	84.8	Confident	78.3	Confident	37 Å²	37	67.6 Å²	67.6	22%	0.224	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.5	177.8	-171	0	0	0	0	109	V1099 L1116 V1118 V1163 V1167 I1174 V1177	V1099-V1165 HydrophobicContact CG2-CG2 4.36Å; L1116-V1165 HydrophobicContact CD2-CG1 3.87Å; V1118-V1165 HydrophobicContact CG2-CG1 4.24Å; V1118-V1165 HydrophobicContact CG2-CG2 4.27Å; V1163-V1165 HydrophobicContact CG1-CG2 4.06Å; V1165-V1167 HydrophobicContact CG1-CG2 4.4Å; V1165-I1174 HydrophobicContact CB-CD1 4.2Å; V1165-I1174 HydrophobicContact CG1-CD1 3.74Å; V1165-V1177 HydrophobicContact CG2-CG2 4.47Å
1166	H	85.6	Confident	79.2	Confident	74 Å²	74	61.8 Å²	61.8	34%	0.343	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	133.9	173.2	-60.4	-99.2	0	0	0	108.7	L1116 R1117 E1119 R1164	L1116-H1166 WeakPolarHBondContact CA-O 3.4Å; R1117-H1166 HydrophobicContact CB-CB 4.24Å; R1117-H1166 PolarHBondContact N-O 2.75Å; R1117-H1166 PolarHBondContact O-N 3.05Å; E1119-H1166 IonicContact OE1-NE2 3.21Å; E1119-H1166 IonicContact OE2-NE2 2.63Å; R1164-H1166 WeakPolarHBondContact CD-NE2 3.02Å
1167	V	81.2	Confident	80.1	Confident	66 Å²	66	56.7 Å²	56.7	40%	0.4	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	123.8	-171.7	-169.5	0	0	0	0	109	L1116 V1165 S1169 I1172 I1174	L1116-V1167 HydrophobicContact CD2-CB 4.29Å; L1116-V1167 HydrophobicContact CD2-CG1 4.14Å; L1116-V1167 HydrophobicContact CD2-CG2 3.92Å; V1165-V1167 HydrophobicContact CG1-CG2 4.4Å; V1167-S1169 VanDerWaalsContact C-N 3.34Å; V1167-S1169 WeakPolarHBondContact CG1-O 3.38Å; V1167-I1172 HydrophobicContact CG1-CB 3.53Å; V1167-I1172 HydrophobicContact CG1-CD1 3.8Å; V1167-I1172 HydrophobicContact CG1-CG1 4.24Å; V1167-I1172 HydrophobicContact CG1-CG2 3.82Å; V1167-I1174 HydrophobicContact CG2-CD1 4.2Å
1168	G	78.4	Confident	80.9	Confident	35 Å²	35	55.8 Å²	55.8	36%	0.361	29%	0.288	S	S	.	.	S	Bend	trans	-82.4	-5.4	-174.6	0	0	0	0	0	115.5	Y1113 S1115	Y1113-G1168 CarbonylContact O-C 3.55Å; Y1113-G1168 VanDerWaalsContact O-C 3.26Å; S1115-G1168 WeakPolarHBondContact O-CA 3.38Å; S1115-G1168 PolarHBondContact O-N 3.13Å
1169	S	74.5	Confident	81.4	Confident	23 Å²	23	54.5 Å²	54.5	16%	0.161	28%	0.283	C	S	.	.			trans	-150.7	135.6	175.7	176.8	0	0	0	0	110.9	Y1113 V1167 R1171 I1172	Y1113-S1169 VanDerWaalsContact O-CB 3.29Å; Y1113-S1169 WeakPolarHBondContact O-CB 2.94Å; V1167-S1169 VanDerWaalsContact C-N 3.34Å; V1167-S1169 WeakPolarHBondContact CG1-O 3.38Å; S1169-R1171 PolarHBondContact O-N 2.78Å; S1169-R1171 PolarHBondContact OG-N 3.18Å; S1169-I1172 PolarHBondContact O-N 2.7Å; S1169-I1172 VanDerWaalsContact O-N 3.11Å
1170	E	74.6	Confident	81.5	Confident	178 Å²	178	51.8 Å²	51.8	83%	0.832	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-16.8	168.7	67.2	-166.7	-162.1	0	0	114.6
1171	R	74.4	Confident	81.7	Confident	126 Å²	126	52.3 Å²	52.3	48%	0.475	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-9.7	-177.9	-56.6	-175.5	-179.8	170.5	-1.2	113.9	S1103 G1105 S1169	S1103-R1171 WeakPolarHBondContact CB-O 3.48Å; S1103-R1171 PolarHBondContact OG-O 3.07Å; G1105-R1171 VanDerWaalsContact CA-O 3.32Å; G1105-R1171 WeakPolarHBondContact CA-O 3.22Å; G1105-R1171 PolarHBondContact N-O 3.06Å; S1169-R1171 PolarHBondContact O-N 2.78Å; S1169-R1171 PolarHBondContact OG-N 3.18Å
1172	I	79.9	Confident	81.4	Confident	14 Å²	14	50.4 Å²	50.4	7%	0.072	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	130.8	172.9	-63.5	161.1	0	0	0	107.9	L1101 S1103 D1104 L1116 A1138 V1167 S1169	L1101-I1172 HydrophobicContact CD2-CG2 4.1Å; S1103-I1172 WeakPolarHBondContact O-CA 3.03Å; D1104-I1172 WeakPolarHBondContact O-CG1 3.37Å; L1116-I1172 HydrophobicContact CD1-CG2 4.26Å; L1116-I1172 HydrophobicContact CD2-CG2 4.17Å; L1116-I1172 HydrophobicContact CG-CG2 4.42Å; A1138-I1172 HydrophobicContact CB-CD1 3.65Å; A1138-I1172 HydrophobicContact CB-CG1 3.9Å; A1138-I1172 HydrophobicContact CB-CG2 4.36Å; V1167-I1172 HydrophobicContact CG1-CB 3.53Å; V1167-I1172 HydrophobicContact CG1-CD1 3.8Å; V1167-I1172 HydrophobicContact CG1-CG1 4.24Å; V1167-I1172 HydrophobicContact CG1-CG2 3.82Å; S1169-I1172 PolarHBondContact O-N 2.7Å; S1169-I1172 VanDerWaalsContact O-N 3.11Å
1173	S	81.5	Confident	80.8	Confident	56 Å²	56	55.7 Å²	55.7	39%	0.392	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	131.6	179.1	-50.9	0	0	0	0	109.8	L1101 A1102 S1103	L1101-S1173 CarbonylContact C-O 3.54Å; L1101-S1173 WeakPolarHBondContact CA-O 3.08Å; A1102-S1173 PolarHBondContact N-O 3.31Å; S1103-S1173 PolarHBondContact N-O 3.29Å; S1103-S1173 PolarHBondContact O-N 3.4Å
1174	I	82.5	Confident	79.9	Confident	39 Å²	39	57.2 Å²	57.2	20%	0.2	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	126.8	-179.8	-61.4	172.9	0	0	0	108.8	A1078 V1099 Y1100 L1101 V1165 V1167 V1177	A1078-I1174 HydrophobicContact CB-CG2 4.08Å; V1099-I1174 HydrophobicContact CG1-CD1 4.05Å; V1099-I1174 HydrophobicContact CG1-CG1 4.02Å; V1099-I1174 HydrophobicContact CG1-CG2 3.94Å; Y1100-I1174 CarbonylContact O-C 3.42Å; Y1100-I1174 WeakPolarHBondContact O-CA 3.2Å; Y1100-I1174 WeakPolarHBondContact O-CG2 3.38Å; L1101-I1174 HydrophobicContact CD2-CG1 4.2Å; V1165-I1174 HydrophobicContact CB-CD1 4.2Å; V1165-I1174 HydrophobicContact CG1-CD1 3.74Å; V1167-I1174 HydrophobicContact CG2-CD1 4.2Å; I1174-V1177 HydrophobicContact CG2-CG2 3.94Å
1175	A	78.3	Confident	78.9	Confident	39 Å²	39	54.2 Å²	54.2	32%	0.322	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-33.1	179.8	0	0	0	0	0	113.1	Y1100 A1102	Y1100-A1175 PolarHBondContact O-N 2.81Å; A1102-A1175 HydrophobicContact CB-CB 4.07Å
1176	A	84.2	Confident	77.9	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	160.7	178.6	0	0	0	0	0	110.9	W1058 Y1100	W1058-A1176 HydrophobicContact CE3-CB 3.92Å; W1058-A1176 HydrophobicContact CZ3-CB 3.65Å; Y1100-A1176 HydrophobicContact CD2-CB 4.15Å; Y1100-A1176 HydrophobicContact CG-CB 4.36Å; Y1100-A1176 PolarHBondContact N-O 3.26Å
1177	V	85.1	Confident	76.9	Confident	15 Å²	15	53.3 Å²	53.3	9%	0.091	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.5	169.7	-176.7	0	0	0	0	110.1	A1059 V1097 F1098 V1163 V1165 I1174	A1059-V1177 HydrophobicContact CB-CB 4.24Å; A1059-V1177 PolarHBondContact N-O 2.99Å; V1097-V1177 HydrophobicContact CG1-CG1 3.88Å; F1098-V1177 WeakPolarHBondContact O-CA 3.45Å; V1163-V1177 HydrophobicContact CB-CG1 4.42Å; V1163-V1177 HydrophobicContact CG1-CG1 4.27Å; V1165-V1177 HydrophobicContact CG2-CG2 4.47Å; I1174-V1177 HydrophobicContact CG2-CG2 3.94Å
1178	R	85	Confident	76.3	Confident	14 Å²	14	53.7 Å²	53.7	5%	0.053	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	130.6	-179.4	-177.7	-173.5	75.4	170	-16.3	111.2	D1056 Q1057 W1058 V1097 F1098 Y1100 R1180	D1056-R1178 HydrophobicContact CB-CG 4.03Å; D1056-R1178 IonicContact OD1-NE 2.75Å; D1056-R1178 IonicContact OD2-CZ 3.25Å; D1056-R1178 IonicContact OD2-NE 3.12Å; D1056-R1178 IonicContact OD2-NH1 3.96Å; D1056-R1178 PolarHBondContact OD2-NH1 3.28Å; Q1057-R1178 CarbonylContact O-C 3.51Å; Q1057-R1178 VanDerWaalsContact O-CA 3.23Å; Q1057-R1178 WeakPolarHBondContact O-CA 3.39Å; Q1057-R1178 VanDerWaalsContact O-CG 3.26Å; Q1057-R1178 WeakPolarHBondContact O-CG 3.2Å; W1058-R1178 HydrophobicContact CD2-CB 3.96Å; W1058-R1178 HydrophobicContact CD2-CG 4.07Å; W1058-R1178 HydrophobicContact CE3-CB 3.79Å; W1058-R1178 HydrophobicContact CE3-CG 4.39Å; W1058-R1178 HydrophobicContact CH2-CB 4.18Å; W1058-R1178 HydrophobicContact CH2-CG 4.46Å; W1058-R1178 HydrophobicContact CZ2-CB 4.31Å; W1058-R1178 HydrophobicContact CZ2-CG 4.13Å; W1058-R1178 HydrophobicContact CZ3-CB 3.9Å; V1097-R1178 CarbonylContact C-O 3.5Å; V1097-R1178 WeakPolarHBondContact CA-O 3.22Å; F1098-R1178 HydrophobicContact CB-CB 4.2Å; F1098-R1178 VanDerWaalsContact CD1-NH2 3.3Å; F1098-R1178 VanDerWaalsContact CD2-NE 3.3Å; F1098-R1178 VanDerWaalsContact CD2-NH2 3.28Å; F1098-R1178 VanDerWaalsContact CG-NH2 3.33Å; F1098-R1178 PolarHBondContact N-O 2.96Å; F1098-R1178 PolarHBondContact O-N 3.42Å; Y1100-R1178 HydrophobicContact CE2-CB 3.98Å; R1178-R1180 VanDerWaalsContact NH1-NH2 3.2Å
1179	L	86.8	Confident	75.7	Confident	18 Å²	18	54.4 Å²	54.4	9%	0.094	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	117.1	177.5	-170	69.3	0	0	0	109.5	Q1057 V1092 A1094 V1097 L1120 V1163	Q1057-L1179 HydrophobicContact CB-CB 4.49Å; Q1057-L1179 PolarHBondContact N-O 3.37Å; Q1057-L1179 PolarHBondContact O-N 3.27Å; V1092-L1179 HydrophobicContact CG2-CD2 3.82Å; V1092-L1179 HydrophobicContact CG2-CG 4.28Å; A1094-L1179 HydrophobicContact CB-CD1 3.49Å; A1094-L1179 VanDerWaalsContact CB-CD1 3.49Å; A1094-L1179 HydrophobicContact CB-CD2 4.43Å; A1094-L1179 HydrophobicContact CB-CG 4.02Å; V1097-L1179 HydrophobicContact CG2-CD1 3.75Å; L1120-L1179 HydrophobicContact CD2-CD1 4.12Å; V1163-L1179 HydrophobicContact CG2-CD1 4.08Å
1180	R	84.5	Confident	75.3	Confident	33 Å²	33	54.7 Å²	54.7	13%	0.125	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	143.7	-179.3	178	168.2	-76	-173.1	-10.7	111.4	F1054 D1056 A1094 T1095 S1096 F1098 R1178	F1054-R1180 HydrophobicContact CB-CG 4.05Å; F1054-R1180 HydrophobicContact CD1-CG 3.76Å; F1054-R1180 HydrophobicContact CG-CG 4.18Å; D1056-R1180 VanDerWaalsContact OD1-CB 3.26Å; D1056-R1180 WeakPolarHBondContact OD1-CB 3.49Å; D1056-R1180 VanDerWaalsContact OD1-CG 3.24Å; D1056-R1180 WeakPolarHBondContact OD1-CG 3.33Å; D1056-R1180 IonicContact OD1-CZ 2.67Å; D1056-R1180 IonicContact OD1-NE 3.09Å; D1056-R1180 PolarHBondContact OD1-NE 3.28Å; D1056-R1180 IonicContact OD1-NH2 3.95Å; D1056-R1180 PolarHBondContact OD1-NH2 2.86Å; D1056-R1180 IonicContact OD2-CZ 3.55Å; D1056-R1180 IonicContact OD2-NE 3.63Å; D1056-R1180 IonicContact OD2-NH2 3.66Å; D1056-R1180 PolarHBondContact OD2-NH2 3.18Å; A1094-R1180 CarbonylContact C-O 3.56Å; A1094-R1180 WeakPolarHBondContact CA-O 3.2Å; T1095-R1180 PolarHBondContact N-O 3.05Å; T1095-R1180 PolarHBondContact OG1-O 3.02Å; S1096-R1180 PolarHBondContact O-N 2.75Å; F1098-R1180 HydrophobicContact CE2-CB 3.94Å; R1178-R1180 VanDerWaalsContact NH1-NH2 3.2Å
1181	S	82.5	Confident	75	Confident	13 Å²	13	49.9 Å²	49.9	9%	0.091	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	156.8	168.2	61.8	0	0	0	0	110.8	F1054 N1055 V1093	F1054-S1181 WeakPolarHBondContact CA-O 3.41Å; N1055-S1181 PolarHBondContact N-O 3.26Å; N1055-S1181 PolarHBondContact O-N 3.46Å; N1055-S1181 PolarHBondContact O-OG 3.21Å; V1093-S1181 WeakPolarHBondContact O-CB 3.28Å
1182	K	74.2	Confident	74.8	Confident	73 Å²	73	48.7 Å²	48.7	32%	0.317	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	130.8	178.6	-174	171.2	-175.2	174.5	0	110.8	F1054 T1095 F1185	F1054-K1182 HydrophobicContact CD1-CB 4.29Å; F1054-K1182 HydrophobicContact CE1-CB 4.25Å; F1054-K1182 HydrophobicContact CE1-CG 4.42Å; T1095-K1182 HydrophobicContact CG2-CB 4.21Å; K1182-F1185 HydrophobicContact CB-CB 3.9Å; K1182-F1185 HydrophobicContact CG-CB 4.26Å; K1182-F1185 PolarHBondContact O-N 3.03Å
1183	R	68.9	Low	74.4	Confident	156 Å²	156	48 Å²	48	59%	0.589	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	127.8	-179.5	-158.8	174.7	-145.9	-155.2	-2.2	109.5	P1052 E1053 N1055 F1185	P1052-R1183 WeakPolarHBondContact O-CD 3.2Å; E1053-R1183 VanDerWaalsContact C-CB 3.48Å; E1053-R1183 WeakPolarHBondContact O-CB 3.31Å; E1053-R1183 PolarHBondContact O-N 3.16Å; N1055-R1183 WeakPolarHBondContact OD1-CG 3.19Å; N1055-R1183 PolarHBondContact OD1-NE 3.11Å; N1055-R1183 VanDerWaalsContact OD1-NE 3.09Å; R1183-F1185 VanDerWaalsContact C-N 3.29Å; R1183-F1185 PolarHBondContact O-N 2.98Å
1184	G	64.4	Low	73.7	Confident	75 Å²	75	48.8 Å²	48.8	77%	0.773	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	10	-176.4	0	0	0	0	0	115.3	D1186	G1184-D1186 PolarHBondContact O-N 2.82Å
1185	F	66.1	Low	73.2	Confident	55 Å²	55	54.2 Å²	54.2	24%	0.241	30%	0.302	C	S	.	.			trans	-83.2	104.9	171.2	-176.6	-100	0	0	0	110.3	V1093 F1157 K1182 R1183 V1190	V1093-F1185 HydrophobicContact CG1-CE1 4.19Å; F1157-F1185 HydrophobicContact CD1-CE1 4.3Å; F1157-F1185 AromaticContact CE1-CE1 3.95Å; F1157-F1185 HydrophobicContact CE1-CE1 3.95Å; F1157-F1185 AromaticContact CE1-CZ 3.75Å; F1157-F1185 HydrophobicContact CE1-CZ 3.75Å; F1157-F1185 HydrophobicContact CE2-CE1 4.49Å; F1157-F1185 HydrophobicContact CE2-CZ 4.16Å; F1157-F1185 HydrophobicContact CZ-CE1 4.06Å; F1157-F1185 AromaticContact CZ-CZ 3.55Å; F1157-F1185 HydrophobicContact CZ-CZ 3.55Å; K1182-F1185 HydrophobicContact CB-CB 3.9Å; K1182-F1185 HydrophobicContact CG-CB 4.26Å; K1182-F1185 PolarHBondContact O-N 3.03Å; R1183-F1185 VanDerWaalsContact C-N 3.29Å; R1183-F1185 PolarHBondContact O-N 2.98Å; F1185-V1190 HydrophobicContact CE2-CG2 4.26Å; F1185-V1190 HydrophobicContact CZ-CG2 4.21Å
1186	D	63.9	Low	72.6	Confident	74 Å²	74	55.2 Å²	55.2	40%	0.396	31%	0.306	S	S	.	.			trans	-102.3	110.1	176.5	-174.6	-2.4	0	0	0	110.7	G1184 V1188 V1189	G1184-D1186 PolarHBondContact O-N 2.82Å; D1186-V1188 PolarHBondContact O-N 2.84Å; D1186-V1188 VanDerWaalsContact OD1-CB 3.25Å; D1186-V1188 WeakPolarHBondContact OD1-CB 3.27Å; D1186-V1188 WeakPolarHBondContact OD1-CG2 3.33Å; D1186-V1188 PolarHBondContact OD1-N 3.41Å; D1186-V1189 HydrophobicContact CB-CG2 3.96Å; D1186-V1189 PolarHBondContact O-N 3.45Å
1187	P	64.7	Low	71.9	Confident	17 Å²	17	60.1 Å²	60.1	11%	0.11	33%	0.332	C	S	.	.	H	α-helix	trans	-64.3	-19.8	176.5	28	-34.9	0	0	0	113.2	V1093 F1157 Y1159 V1190 D1191	V1093-P1187 HydrophobicContact CG2-CG 4.16Å; F1157-P1187 HydrophobicContact CB-CB 4.23Å; F1157-P1187 HydrophobicContact CD2-CB 3.51Å; F1157-P1187 HydrophobicContact CE2-CB 4.13Å; F1157-P1187 HydrophobicContact CG-CB 4.04Å; Y1159-P1187 VanDerWaalsContact OH-CG 3.3Å; Y1159-P1187 WeakPolarHBondContact OH-CG 3.48Å; P1187-V1190 PolarHBondContact O-N 3.17Å; P1187-D1191 PolarHBondContact O-N 3.45Å; P1187-D1191 VanDerWaalsContact O-N 3.08Å
1188	V	67.1	Low	71.2	Confident	75 Å²	75	62.8 Å²	62.8	46%	0.455	35%	0.345	S	S	.	.	H	α-helix	trans	-68	-35.7	175.5	-175.9	0	0	0	0	111.1	D1186 V1190 D1191 L1192	D1186-V1188 PolarHBondContact O-N 2.84Å; D1186-V1188 VanDerWaalsContact OD1-CB 3.25Å; D1186-V1188 WeakPolarHBondContact OD1-CB 3.27Å; D1186-V1188 WeakPolarHBondContact OD1-CG2 3.33Å; D1186-V1188 PolarHBondContact OD1-N 3.41Å; V1188-V1190 VanDerWaalsContact C-N 3.31Å; V1188-V1190 PolarHBondContact O-N 3.5Å; V1188-D1191 PolarHBondContact O-N 2.75Å; V1188-L1192 HydrophobicContact CG1-CD1 4.11Å; V1188-L1192 WeakPolarHBondContact O-CB 3.48Å; V1188-L1192 WeakPolarHBondContact O-CG 3.36Å; V1188-L1192 PolarHBondContact O-N 2.65Å
1189	V	67.3	Low	70.4	Confident	50 Å²	50	67.1 Å²	67.1	30%	0.303	36%	0.364	S	S	.	.	H	α-helix	trans	-67.1	-35.2	175.8	179.4	0	0	0	0	111.1	D1186 L1192 C1193 Y1200	D1186-V1189 HydrophobicContact CB-CG2 3.96Å; D1186-V1189 PolarHBondContact O-N 3.45Å; V1189-L1192 PolarHBondContact O-N 3.4Å; V1189-C1193 PolarHBondContact O-N 3Å; V1189-C1193 PolarHBondContact O-SG 3.11Å; V1189-C1193 VanDerWaalsContact O-SG 3.35Å; V1189-Y1200 HydrophobicContact CG1-CD2 3.68Å; V1189-Y1200 HydrophobicContact CG1-CE2 3.53Å; V1189-Y1200 HydrophobicContact CG1-CG 4.49Å
1190	V	65.1	Low	69.3	Low	28 Å²	28	68.5 Å²	68.5	17%	0.17	37%	0.368	C	S	.	.	H	α-helix	trans	-67.2	-44.3	175.5	-174.6	0	0	0	0	110.9	F1157 F1185 P1187 V1188 L1192 C1193 A1194 Y1200	F1157-V1190 HydrophobicContact CE2-CB 4.09Å; F1157-V1190 HydrophobicContact CE2-CG1 4Å; F1157-V1190 HydrophobicContact CE2-CG2 4.3Å; F1157-V1190 HydrophobicContact CZ-CG1 4.44Å; F1185-V1190 HydrophobicContact CE2-CG2 4.26Å; F1185-V1190 HydrophobicContact CZ-CG2 4.21Å; P1187-V1190 PolarHBondContact O-N 3.17Å; V1188-V1190 VanDerWaalsContact C-N 3.31Å; V1188-V1190 PolarHBondContact O-N 3.5Å; V1190-L1192 VanDerWaalsContact C-N 3.33Å; V1190-L1192 PolarHBondContact O-N 3.05Å; V1190-C1193 PolarHBondContact O-N 3.03Å; V1190-A1194 WeakPolarHBondContact O-CB 3.48Å; V1190-A1194 PolarHBondContact O-N 2.89Å; V1190-Y1200 HydrophobicContact CG2-CD1 4.04Å; V1190-Y1200 HydrophobicContact CG2-CG 4.34Å
1191	D	68.9	Low	68.1	Low	77 Å²	77	68.1 Å²	68.1	41%	0.412	37%	0.371	S	S	.	.	H	α-helix	trans	-63.5	-35.2	174.6	-176.6	61.1	0	0	0	112.4	P1187 V1188 A1194 K1195	P1187-D1191 PolarHBondContact O-N 3.45Å; P1187-D1191 VanDerWaalsContact O-N 3.08Å; V1188-D1191 PolarHBondContact O-N 2.75Å; D1191-A1194 PolarHBondContact O-N 2.81Å; D1191-K1195 WeakPolarHBondContact O-CB 3.48Å; D1191-K1195 WeakPolarHBondContact O-CG 3.47Å; D1191-K1195 PolarHBondContact O-N 3.15Å; D1191-K1195 IonicContact OD1-NZ 2.78Å; D1191-K1195 VanDerWaalsContact OD2-CE 3.31Å; D1191-K1195 WeakPolarHBondContact OD2-CE 3.44Å; D1191-K1195 IonicContact OD2-NZ 3.76Å; D1191-K1195 PolarHBondContact OD2-NZ 2.88Å
1192	L	70.3	Confident	66.7	Low	101 Å²	101	71.4 Å²	71.4	53%	0.529	39%	0.39	S	S	.	.	H	α-helix	trans	-67.7	-43.3	173.5	-80.8	164.2	0	0	0	113.3	V1188 V1189 V1190 A1194 K1195 S1196	V1188-L1192 HydrophobicContact CG1-CD1 4.11Å; V1188-L1192 WeakPolarHBondContact O-CB 3.48Å; V1188-L1192 WeakPolarHBondContact O-CG 3.36Å; V1188-L1192 PolarHBondContact O-N 2.65Å; V1189-L1192 PolarHBondContact O-N 3.4Å; V1190-L1192 VanDerWaalsContact C-N 3.33Å; V1190-L1192 PolarHBondContact O-N 3.05Å; L1192-A1194 VanDerWaalsContact C-N 3.34Å; L1192-K1195 PolarHBondContact O-N 2.63Å; L1192-S1196 PolarHBondContact O-N 2.86Å; L1192-S1196 PolarHBondContact O-OG 2.91Å
1193	C	71.4	Confident	65.6	Low	0 Å²	0	72.5 Å²	72.5	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-62.5	-44.8	173.2	-58.7	0	0	0	0	110.2	V1189 V1190 K1195 S1196 D1197 M1198 Y1200 C1207	V1189-C1193 PolarHBondContact O-N 3Å; V1189-C1193 PolarHBondContact O-SG 3.11Å; V1189-C1193 VanDerWaalsContact O-SG 3.35Å; V1190-C1193 PolarHBondContact O-N 3.03Å; C1193-K1195 VanDerWaalsContact C-N 3.3Å; C1193-K1195 PolarHBondContact O-N 2.67Å; C1193-S1196 WeakPolarHBondContact CA-OG 3.37Å; C1193-S1196 CarbonylContact O-C 3.49Å; C1193-S1196 WeakPolarHBondContact O-CA 3.39Å; C1193-S1196 PolarHBondContact O-N 3.34Å; C1193-S1196 PolarHBondContact O-OG 2.78Å; C1193-S1196 VanDerWaalsContact O-OG 3.09Å; C1193-D1197 PolarHBondContact O-N 3.01Å; C1193-M1198 CarbonylContact C-O 3.56Å; C1193-M1198 HydrophobicContact CB-CB 4.38Å; C1193-M1198 WeakPolarHBondContact CB-O 3.36Å; C1193-M1198 PolarHBondContact O-N 3.19Å; C1193-Y1200 VanDerWaalsContact SG-CB 3.59Å; C1193-C1207 HydrophobicContact CB-CB 3.95Å; C1193-C1207 WeakPolarHBondContact CB-SG 3.29Å; C1193-C1207 WeakPolarHBondContact SG-CB 3.38Å; C1193-C1207 CovalentContact SG-SG 2.04Å; C1193-C1207 PolarHBondContact SG-SG 3.35Å
1194	A	66.3	Low	65.3	Low	72 Å²	72	69.5 Å²	69.5	60%	0.595	41%	0.412	S	S	*	.	H	α-helix	trans	-58.9	-39.1	178.3	0	0	0	0	0	112.7	V1190 D1191 L1192 S1196	V1190-A1194 WeakPolarHBondContact O-CB 3.48Å; V1190-A1194 PolarHBondContact O-N 2.89Å; D1191-A1194 PolarHBondContact O-N 2.81Å; L1192-A1194 VanDerWaalsContact C-N 3.34Å; A1194-S1196 PolarHBondContact O-N 2.99Å
1195	K	72.7	Confident	65.1	Low	154 Å²	154	71.6 Å²	71.6	67%	0.67	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-11.2	173.4	-77.3	167.9	177.7	164.9	0	114.8	D1191 L1192 C1193	D1191-K1195 WeakPolarHBondContact O-CB 3.48Å; D1191-K1195 WeakPolarHBondContact O-CG 3.47Å; D1191-K1195 PolarHBondContact O-N 3.15Å; D1191-K1195 IonicContact OD1-NZ 2.78Å; D1191-K1195 VanDerWaalsContact OD2-CE 3.31Å; D1191-K1195 WeakPolarHBondContact OD2-CE 3.44Å; D1191-K1195 IonicContact OD2-NZ 3.76Å; D1191-K1195 PolarHBondContact OD2-NZ 2.88Å; L1192-K1195 PolarHBondContact O-N 2.63Å; C1193-K1195 VanDerWaalsContact C-N 3.3Å; C1193-K1195 PolarHBondContact O-N 2.67Å
1196	S	66.3	Low	65.2	Low	59 Å²	59	71.4 Å²	71.4	41%	0.413	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	20.9	-177.1	50.4	0	0	0	0	113.9	L1192 C1193 A1194 M1198	L1192-S1196 PolarHBondContact O-N 2.86Å; L1192-S1196 PolarHBondContact O-OG 2.91Å; C1193-S1196 WeakPolarHBondContact CA-OG 3.37Å; C1193-S1196 CarbonylContact O-C 3.49Å; C1193-S1196 WeakPolarHBondContact O-CA 3.39Å; C1193-S1196 PolarHBondContact O-N 3.34Å; C1193-S1196 PolarHBondContact O-OG 2.78Å; C1193-S1196 VanDerWaalsContact O-OG 3.09Å; A1194-S1196 PolarHBondContact O-N 2.99Å; S1196-M1198 PolarHBondContact O-N 3.41Å; S1196-M1198 WeakPolarHBondContact OG-CE 3.44Å
1197	D	68	Low	65.6	Low	104 Å²	104	70 Å²	70	56%	0.556	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	34	178.6	-155.9	17.5	0	0	0	113.2	C1193 N1210	C1193-D1197 PolarHBondContact O-N 3.01Å; D1197-N1210 PolarHBondContact OD1-ND2 3.44Å
1198	M	71.9	Confident	65.7	Low	71 Å²	71	71.6 Å²	71.6	35%	0.35	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	153.4	176.1	-65.9	-172.2	-72.7	0	0	110.3	C1193 S1196 C1207 V1208	C1193-M1198 CarbonylContact C-O 3.56Å; C1193-M1198 HydrophobicContact CB-CB 4.38Å; C1193-M1198 WeakPolarHBondContact CB-O 3.36Å; C1193-M1198 PolarHBondContact O-N 3.19Å; S1196-M1198 PolarHBondContact O-N 3.41Å; S1196-M1198 WeakPolarHBondContact OG-CE 3.44Å; M1198-C1207 HydrophobicContact CB-CB 3.78Å; M1198-C1207 HydrophobicContact CE-CB 3.68Å; M1198-C1207 HydrophobicContact CG-CB 4.38Å; M1198-C1207 HydrophobicContact SD-CB 3.7Å; M1198-V1208 CarbonylContact C-O 3.51Å; M1198-V1208 VanDerWaalsContact CA-O 3.25Å; M1198-V1208 WeakPolarHBondContact CA-O 3.28Å; M1198-V1208 WeakPolarHBondContact CB-O 3.43Å
1199	F	66.9	Low	65.5	Low	105 Å²	105	71.4 Å²	71.4	46%	0.461	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	139.1	171.7	66.3	-85.7	0	0	0	110.7	S1201 C1207 V1208 S1209	F1199-S1201 PolarHBondContact O-N 2.96Å; F1199-C1207 CarbonylContact O-C 3.6Å; F1199-C1207 WeakPolarHBondContact O-CA 3.11Å; F1199-V1208 HydrophobicContact CD1-CB 4.46Å; F1199-V1208 HydrophobicContact CD1-CG2 4.42Å; F1199-V1208 WeakPolarHBondContact CD1-O 3.39Å; F1199-V1208 HydrophobicContact CD2-CG2 3.83Å; F1199-V1208 HydrophobicContact CE1-CB 3.92Å; F1199-V1208 HydrophobicContact CE1-CG2 4.03Å; F1199-V1208 HydrophobicContact CE2-CB 4.18Å; F1199-V1208 HydrophobicContact CE2-CG2 3.38Å; F1199-V1208 HydrophobicContact CG-CG2 4.33Å; F1199-V1208 HydrophobicContact CZ-CB 3.77Å; F1199-V1208 HydrophobicContact CZ-CG2 3.49Å; F1199-V1208 VanDerWaalsContact CZ-CG2 3.49Å; F1199-V1208 PolarHBondContact N-O 3.41Å; F1199-V1208 WeakPolarHBondContact O-CG2 3.36Å; F1199-V1208 PolarHBondContact O-N 3.49Å; F1199-S1209 WeakPolarHBondContact CE1-O 3.41Å
1200	Y	63.7	Low	65	Low	46 Å²	46	74 Å²	74	18%	0.18	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	112	172.9	-172.7	-109.2	0	0	0	110	V1189 V1190 C1193 V1202 N1205	V1189-Y1200 HydrophobicContact CG1-CD2 3.68Å; V1189-Y1200 HydrophobicContact CG1-CE2 3.53Å; V1189-Y1200 HydrophobicContact CG1-CG 4.49Å; V1190-Y1200 HydrophobicContact CG2-CD1 4.04Å; V1190-Y1200 HydrophobicContact CG2-CG 4.34Å; C1193-Y1200 VanDerWaalsContact SG-CB 3.59Å; Y1200-V1202 HydrophobicContact CD1-CG2 4.32Å; Y1200-V1202 HydrophobicContact CE1-CG2 4.46Å; Y1200-N1205 PolarHBondContact OH-OD1 2.97Å; Y1200-N1205 VanDerWaalsContact OH-OD1 3.09Å
1201	S	60	Low	64.6	Low	25 Å²	25	83.2 Å²	83.2	18%	0.175	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	108.9	177.3	177.2	0	0	0	0	111.1	F1199 A1203 V1204 N1205 S1206	F1199-S1201 PolarHBondContact O-N 2.96Å; S1201-A1203 PolarHBondContact O-N 2.87Å; S1201-A1203 VanDerWaalsContact O-N 3.09Å; S1201-A1203 PolarHBondContact OG-N 3.42Å; S1201-V1204 PolarHBondContact O-N 3.31Å; S1201-V1204 VanDerWaalsContact O-N 3.16Å; S1201-N1205 WeakPolarHBondContact O-CA 3.36Å; S1201-N1205 PolarHBondContact O-N 3.39Å; S1201-S1206 PolarHBondContact N-O 3.45Å
1202	V	53.5	Low	63.5	Low	82 Å²	82	84.2 Å²	84.2	50%	0.497	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-18.6	175	-173.5	0	0	0	0	112.3	Y1200	Y1200-V1202 HydrophobicContact CD1-CG2 4.32Å; Y1200-V1202 HydrophobicContact CE1-CG2 4.46Å
1203	A	50.3	Low	62.5	Low	97 Å²	97	84.8 Å²	84.8	80%	0.802	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-26.6	178.7	0	0	0	0	0	114.2	S1201	S1201-A1203 PolarHBondContact O-N 2.87Å; S1201-A1203 VanDerWaalsContact O-N 3.09Å; S1201-A1203 PolarHBondContact OG-N 3.42Å
1204	V	63.3	Low	61.3	Low	93 Å²	93	89.1 Å²	89.1	56%	0.564	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-3	174.4	-76.9	0	0	0	0	113.5	S1201 S1206	S1201-V1204 PolarHBondContact O-N 3.31Å; S1201-V1204 VanDerWaalsContact O-N 3.16Å; V1204-S1206 VanDerWaalsContact C-N 3.27Å; V1204-S1206 WeakPolarHBondContact CG2-OG 3.29Å; V1204-S1206 PolarHBondContact O-N 2.99Å
1205	N	59.7	Low	60.9	Low	118 Å²	118	89.2 Å²	89.2	63%	0.631	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	32.7	179.7	-148.4	64	0	0	0	113.4	Y1200 S1201	Y1200-N1205 PolarHBondContact OH-OD1 2.97Å; Y1200-N1205 VanDerWaalsContact OH-OD1 3.09Å; S1201-N1205 WeakPolarHBondContact O-CA 3.36Å; S1201-N1205 PolarHBondContact O-N 3.39Å
1206	S	67.6	Low	60.7	Low	51 Å²	51	87.6 Å²	87.6	36%	0.357	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	162.6	-175.6	67	0	0	0	0	113	S1201 V1204	S1201-S1206 PolarHBondContact N-O 3.45Å; V1204-S1206 VanDerWaalsContact C-N 3.27Å; V1204-S1206 WeakPolarHBondContact CG2-OG 3.29Å; V1204-S1206 PolarHBondContact O-N 2.99Å
1207	C	73.5	Confident	61.1	Low	44 Å²	44	85.1 Å²	85.1	30%	0.297	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	140.3	168.4	-53.2	0	0	0	0	110.7	C1193 M1198 F1199	C1193-C1207 HydrophobicContact CB-CB 3.95Å; C1193-C1207 WeakPolarHBondContact CB-SG 3.29Å; C1193-C1207 WeakPolarHBondContact SG-CB 3.38Å; C1193-C1207 CovalentContact SG-SG 2.04Å; C1193-C1207 PolarHBondContact SG-SG 3.35Å; M1198-C1207 HydrophobicContact CB-CB 3.78Å; M1198-C1207 HydrophobicContact CE-CB 3.68Å; M1198-C1207 HydrophobicContact CG-CB 4.38Å; M1198-C1207 HydrophobicContact SD-CB 3.7Å; F1199-C1207 CarbonylContact O-C 3.6Å; F1199-C1207 WeakPolarHBondContact O-CA 3.11Å
1208	V	65.3	Low	61.6	Low	51 Å²	51	88.4 Å²	88.4	31%	0.309	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	151	177.7	-109.4	0	0	0	0	111.4	M1198 F1199	M1198-V1208 CarbonylContact C-O 3.51Å; M1198-V1208 VanDerWaalsContact CA-O 3.25Å; M1198-V1208 WeakPolarHBondContact CA-O 3.28Å; M1198-V1208 WeakPolarHBondContact CB-O 3.43Å; F1199-V1208 HydrophobicContact CD1-CB 4.46Å; F1199-V1208 HydrophobicContact CD1-CG2 4.42Å; F1199-V1208 WeakPolarHBondContact CD1-O 3.39Å; F1199-V1208 HydrophobicContact CD2-CG2 3.83Å; F1199-V1208 HydrophobicContact CE1-CB 3.92Å; F1199-V1208 HydrophobicContact CE1-CG2 4.03Å; F1199-V1208 HydrophobicContact CE2-CB 4.18Å; F1199-V1208 HydrophobicContact CE2-CG2 3.38Å; F1199-V1208 HydrophobicContact CG-CG2 4.33Å; F1199-V1208 HydrophobicContact CZ-CB 3.77Å; F1199-V1208 HydrophobicContact CZ-CG2 3.49Å; F1199-V1208 VanDerWaalsContact CZ-CG2 3.49Å; F1199-V1208 PolarHBondContact N-O 3.41Å; F1199-V1208 WeakPolarHBondContact O-CG2 3.36Å; F1199-V1208 PolarHBondContact O-N 3.49Å
1209	S	64	Low	62	Low	71 Å²	71	93.1 Å²	93.1	50%	0.497	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	140	-169.4	-176.1	0	0	0	0	114.2	F1199 R1211	F1199-S1209 WeakPolarHBondContact CE1-O 3.41Å; S1209-R1211 VanDerWaalsContact C-N 3.28Å; S1209-R1211 PolarHBondContact O-N 3.23Å
1210	N	56.8	Low	62.5	Low	105 Å²	105	89 Å²	89	56%	0.561	50%	0.502	S	S	*	.	S	Bend	trans	-75.7	-1.6	-177.3	-152.5	11.6	0	0	0	115	D1197 C1212	D1197-N1210 PolarHBondContact OD1-ND2 3.44Å; N1210-C1212 PolarHBondContact O-N 3.26Å
1211	R	57.5	Low	63.4	Low	221 Å²	221	97.9 Å²	97.9	83%	0.834	54%	0.536	S	S	*	.			trans	-91.5	51.4	-169.6	-65.9	-170.3	178.6	-170.7	0.4	115.4	S1209	S1209-R1211 VanDerWaalsContact C-N 3.28Å; S1209-R1211 PolarHBondContact O-N 3.23Å
1212	C	44.5	Very low	64.3	Low	99 Å²	99	97.5 Å²	97.5	67%	0.669	53%	0.532	S	S	*	.			trans	-112.9	124	172.8	-72.9	0	0	0	0	111.2	N1210 S1214	N1210-C1212 PolarHBondContact O-N 3.26Å; C1212-S1214 PolarHBondContact O-N 2.83Å
1213	S	48.6	Very low	65.6	Low	113 Å²	113	100.1 Å²	100.1	79%	0.79	54%	0.543	S	S	*	.			trans	-62.5	116.2	176.3	55.1	0	0	0	0	111.1	T1215	S1213-T1215 PolarHBondContact O-N 2.82Å
1214	S	47.5	Very low	67.2	Low	91 Å²	91	98.6 Å²	98.6	64%	0.636	52%	0.522	S	S	*	.			trans	-70.7	115.2	-177	54.1	0	0	0	0	111.9	C1212	C1212-S1214 PolarHBondContact O-N 2.83Å
1215	T	58.1	Low	68.1	Low	74 Å²	74	95.1 Å²	95.1	45%	0.454	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-95.4	128.2	165.6	33.6	0	0	0	0	109.3	S1213 G1270	S1213-T1215 PolarHBondContact O-N 2.82Å; T1215-G1270 WeakPolarHBondContact O-CA 3.49Å; T1215-G1270 PolarHBondContact O-N 2.8Å; T1215-G1270 VanDerWaalsContact O-N 3.1Å; T1215-G1270 PolarHBondContact OG1-N 3.39Å
1216	E	67.3	Low	69.3	Low	120 Å²	120	93.8 Å²	93.8	56%	0.561	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-70.3	152.3	174.8	-71.6	-169.5	110.3	0	0	112.3	S1232 G1270	E1216-S1232 CarbonylContact C-O 3.47Å; E1216-S1232 VanDerWaalsContact CA-O 3.27Å; E1216-S1232 WeakPolarHBondContact CA-O 3.37Å; E1216-S1232 WeakPolarHBondContact CB-O 3.49Å; E1216-S1232 PolarHBondContact OE1-OG 2.79Å; E1216-G1270 VanDerWaalsContact O-CA 3.31Å; E1216-G1270 WeakPolarHBondContact O-CA 3.45Å
1217	C	74.5	Confident	70.1	Confident	6 Å²	6	93 Å²	93	4%	0.041	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-94.3	141.9	170.1	-65.9	0	0	0	0	111.5	S1232 C1267 R1271 W1272	C1217-S1232 PolarHBondContact N-O 2.92Å; C1217-S1232 WeakPolarHBondContact O-CB 3.24Å; C1217-C1267 HydrophobicContact CB-CB 3.86Å; C1217-C1267 WeakPolarHBondContact CB-SG 3.34Å; C1217-C1267 WeakPolarHBondContact SG-CA 3.43Å; C1217-C1267 WeakPolarHBondContact SG-CB 3.04Å; C1217-C1267 CovalentContact SG-SG 2.03Å; C1217-C1267 PolarHBondContact SG-SG 3.42Å; C1217-R1271 PolarHBondContact SG-N 3.39Å; C1217-W1272 HydrophobicContact CB-CD2 4.21Å; C1217-W1272 HydrophobicContact CB-CH2 4.46Å; C1217-W1272 HydrophobicContact CB-CZ2 3.71Å
1218	E	78.7	Confident	70.7	Confident	174 Å²	174	96.5 Å²	96.5	81%	0.813	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-58.1	155.8	170.7	-70.4	-174.4	124.2	0	0	112.6	L1220 W1272	E1218-L1220 PolarHBondContact O-N 3.12Å; E1218-W1272 PolarHBondContact O-NE1 2.83Å
1219	H	80.7	Confident	71.6	Confident	169 Å²	169	96.3 Å²	96.3	78%	0.782	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-62.9	119.2	-178.8	-151	-68.5	0	0	0	112.2	R1221	H1219-R1221 PolarHBondContact O-N 2.86Å
1220	L	78.2	Confident	72.3	Confident	18 Å²	18	96.7 Å²	96.7	9%	0.094	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-69.4	124.9	-175	-171.7	69.1	0	0	0	111.7	E1218 V1222 V1227 C1238 V1240 V1265 W1272 P1277	E1218-L1220 PolarHBondContact O-N 3.12Å; L1220-V1222 HydrophobicContact CD1-CG2 4.44Å; L1220-V1222 HydrophobicContact CD2-CG2 4.32Å; L1220-V1222 HydrophobicContact CG-CG2 4.12Å; L1220-V1227 HydrophobicContact CB-CG1 4.24Å; L1220-V1227 HydrophobicContact CD2-CG1 3.96Å; L1220-V1227 HydrophobicContact CG-CG1 4.23Å; L1220-C1238 HydrophobicContact CB-CB 4.48Å; L1220-C1238 HydrophobicContact CD2-CB 3.48Å; L1220-C1238 VanDerWaalsContact CD2-CB 3.48Å; L1220-V1240 HydrophobicContact CD2-CG2 3.72Å; L1220-V1265 HydrophobicContact CD2-CB 4.14Å; L1220-V1265 HydrophobicContact CD2-CG1 4.34Å; L1220-V1265 HydrophobicContact CD2-CG2 4.07Å; L1220-W1272 HydrophobicContact CB-CD2 4.42Å; L1220-W1272 HydrophobicContact CB-CZ2 4.34Å; L1220-W1272 HydrophobicContact CD1-CB 4.43Å; L1220-W1272 HydrophobicContact CD1-CD2 4.41Å; L1220-W1272 HydrophobicContact CD1-CG 3.94Å; L1220-P1277 HydrophobicContact CD1-CG 4.25Å; L1220-P1277 HydrophobicContact CD2-CG 4.29Å
1221	R	81.6	Confident	73.4	Confident	234 Å²	234	93 Å²	93	88%	0.883	49%	0.49	S	S	*	.			trans	-117.8	135.5	168.2	-78.8	-177	170.2	173.9	-1.9	110	H1219	H1219-R1221 PolarHBondContact O-N 2.86Å
1222	V	78.5	Confident	74.3	Confident	17 Å²	17	84.6 Å²	84.6	10%	0.103	47%	0.465	C	S	.	.			trans	-136.7	122.6	176.9	-174.5	0	0	0	0	109.4	L1220 A1225 V1227 V1240 P1277	L1220-V1222 HydrophobicContact CD1-CG2 4.44Å; L1220-V1222 HydrophobicContact CD2-CG2 4.32Å; L1220-V1222 HydrophobicContact CG-CG2 4.12Å; V1222-A1225 HydrophobicContact CB-CB 3.93Å; V1222-A1225 HydrophobicContact CG1-CB 3.84Å; V1222-A1225 PolarHBondContact O-N 3.06Å; V1222-V1227 HydrophobicContact CB-CG2 3.92Å; V1222-V1227 HydrophobicContact CG2-CG2 3.99Å; V1222-V1240 HydrophobicContact CB-CG1 3.99Å; V1222-V1240 HydrophobicContact CG1-CG1 3.85Å; V1222-V1240 HydrophobicContact CG2-CG1 3.92Å; V1222-V1240 HydrophobicContact CG2-CG2 3.87Å; V1222-P1277 WeakPolarHBondContact CG1-O 3.12Å; V1222-P1277 HydrophobicContact CG2-CB 4.37Å; V1222-P1277 HydrophobicContact CG2-CG 3.62Å
1223	D	81.4	Confident	75.6	Confident	136 Å²	136	83.6 Å²	83.6	73%	0.727	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	140	178.9	-64.8	-37.5	0	0	0	111.4	A1225	D1223-A1225 PolarHBondContact O-N 3.12Å
1224	N	83.8	Confident	76.5	Confident	66 Å²	66	80.3 Å²	80.3	35%	0.353	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	34.3	-175.5	-46.4	-78.1	0	0	0	113.5	C1242 N1243 Y1246 C1279	N1224-C1242 CarbonylContact O-C 3.58Å; N1224-C1242 WeakPolarHBondContact O-CA 3.35Å; N1224-N1243 WeakPolarHBondContact O-CB 3.47Å; N1224-N1243 PolarHBondContact O-N 3.19Å; N1224-Y1246 HydrophobicContact CB-CD1 3.52Å; N1224-Y1246 HydrophobicContact CB-CD2 4.03Å; N1224-Y1246 HydrophobicContact CB-CE1 3.53Å; N1224-Y1246 HydrophobicContact CB-CE2 4.06Å; N1224-Y1246 HydrophobicContact CB-CG 3.79Å; N1224-Y1246 VanDerWaalsContact CG-CZ 3.44Å; N1224-Y1246 WeakPolarHBondContact ND2-CE1 3.07Å; N1224-Y1246 PolarHBondContact OD1-OH 2.78Å; N1224-C1279 HydrophobicContact CB-CB 4.47Å
1225	A	82.3	Confident	77.4	Confident	19 Å²	19	78.6 Å²	78.6	16%	0.157	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	152	172.9	0	0	0	0	0	111.9	V1222 D1223 V1227 V1240 T1241 C1279	V1222-A1225 HydrophobicContact CB-CB 3.93Å; V1222-A1225 HydrophobicContact CG1-CB 3.84Å; V1222-A1225 PolarHBondContact O-N 3.06Å; D1223-A1225 PolarHBondContact O-N 3.12Å; A1225-V1227 HydrophobicContact CB-CG2 4.33Å; A1225-V1240 HydrophobicContact CB-CG1 3.59Å; A1225-T1241 CarbonylContact C-O 3.32Å; A1225-T1241 WeakPolarHBondContact CA-O 3.26Å; A1225-C1279 VanDerWaalsContact CB-SG 3.51Å
1226	D	84.2	Confident	78.4	Confident	90 Å²	90	76.6 Å²	76.6	48%	0.481	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.3	163.3	-162.9	-8.8	0	0	0	109.2	H1228 T1241	D1226-H1228 VanDerWaalsContact CG-CE1 3.5Å; D1226-H1228 IonicContact OD1-CE1 2.88Å; D1226-H1228 PolarHBondContact OD1-CE1 2.85Å; D1226-H1228 IonicContact OD1-ND1 3.52Å; D1226-H1228 PolarHBondContact OD1-ND1 3.39Å; D1226-H1228 IonicContact OD2-CE1 3.42Å; D1226-H1228 PolarHBondContact OD2-CE1 3.5Å; D1226-T1241 PolarHBondContact N-O 2.91Å; D1226-T1241 PolarHBondContact O-N 2.89Å
1227	V	85.6	Confident	78.9	Confident	35 Å²	35	72.1 Å²	72.1	21%	0.212	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	110.7	-167.5	-175	0	0	0	0	110.3	L1220 V1222 A1225 C1238 L1239 V1240	L1220-V1227 HydrophobicContact CB-CG1 4.24Å; L1220-V1227 HydrophobicContact CD2-CG1 3.96Å; L1220-V1227 HydrophobicContact CG-CG1 4.23Å; V1222-V1227 HydrophobicContact CB-CG2 3.92Å; V1222-V1227 HydrophobicContact CG2-CG2 3.99Å; A1225-V1227 HydrophobicContact CB-CG2 4.33Å; V1227-C1238 HydrophobicContact CG1-CB 4.05Å; V1227-L1239 WeakPolarHBondContact CA-O 3.36Å; V1227-V1240 HydrophobicContact CG1-CG2 4.2Å; V1227-V1240 HydrophobicContact CG2-CG1 4.48Å; V1227-V1240 HydrophobicContact CG2-CG2 4.24Å
1228	H	86.3	Confident	79.2	Confident	118 Å²	118	71.9 Å²	71.9	55%	0.546	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	107.5	-177.9	-76.2	60.2	0	0	0	110.5	D1226 C1238 L1239	D1226-H1228 VanDerWaalsContact CG-CE1 3.5Å; D1226-H1228 IonicContact OD1-CE1 2.88Å; D1226-H1228 PolarHBondContact OD1-CE1 2.85Å; D1226-H1228 IonicContact OD1-ND1 3.52Å; D1226-H1228 PolarHBondContact OD1-ND1 3.39Å; D1226-H1228 IonicContact OD2-CE1 3.42Å; D1226-H1228 PolarHBondContact OD2-CE1 3.5Å; H1228-C1238 CarbonylContact O-C 3.58Å; H1228-C1238 WeakPolarHBondContact O-CA 3.32Å; H1228-L1239 PolarHBondContact N-O 3.3Å; H1228-L1239 PolarHBondContact O-N 3.31Å
1229	C	83	Confident	79.5	Confident	47 Å²	47	66.9 Å²	66.9	32%	0.318	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	143.4	-177.1	-56.7	0	0	0	0	112.6	G1231 C1238	C1229-G1231 VanDerWaalsContact C-N 3.32Å; C1229-C1238 HydrophobicContact CB-CB 4.08Å; C1229-C1238 WeakPolarHBondContact CB-SG 3.37Å; C1229-C1238 WeakPolarHBondContact SG-CB 3.47Å; C1229-C1238 CovalentContact SG-SG 2.04Å; C1229-C1238 PolarHBondContact SG-SG 2.81Å
1230	S	80.3	Confident	79.7	Confident	78 Å²	78	58.8 Å²	58.8	55%	0.545	34%	0.335	S	S	.	.	S	Bend	trans	-74.6	-22.9	170.1	60.3	0	0	0	0	113.4	D1236 S1237	S1230-D1236 WeakPolarHBondContact CB-OD1 3.38Å; S1230-D1236 WeakPolarHBondContact OG-CA 3.26Å; S1230-D1236 WeakPolarHBondContact OG-CB 3.28Å; S1230-D1236 PolarHBondContact OG-OD1 3.13Å; S1230-S1237 PolarHBondContact N-O 2.83Å; S1230-S1237 PolarHBondContact OG-N 3.04Å; S1230-S1237 PolarHBondContact OG-O 3.42Å
1231	G	79.2	Confident	79.9	Confident	29 Å²	29	60.1 Å²	60.1	30%	0.299	34%	0.343	S	S	.	.			trans	165.7	-163.9	-179.2	0	0	0	0	0	111.4	C1229 D1236	C1229-G1231 VanDerWaalsContact C-N 3.32Å; G1231-D1236 VanDerWaalsContact C-CG 3.43Å; G1231-D1236 WeakPolarHBondContact CA-OD2 3.43Å; G1231-D1236 PolarHBondContact N-OD1 3.34Å; G1231-D1236 WeakPolarHBondContact O-CB 3.37Å
1232	S	76.3	Confident	80	Confident	43 Å²	43	49.2 Å²	49.2	30%	0.301	30%	0.303	S	S	.	.	S	Bend	trans	-116.5	1.3	-178.7	42.1	0	0	0	0	114.3	E1216 C1217 D1236	E1216-S1232 CarbonylContact C-O 3.47Å; E1216-S1232 VanDerWaalsContact CA-O 3.27Å; E1216-S1232 WeakPolarHBondContact CA-O 3.37Å; E1216-S1232 WeakPolarHBondContact CB-O 3.49Å; E1216-S1232 PolarHBondContact OE1-OG 2.79Å; C1217-S1232 PolarHBondContact N-O 2.92Å; C1217-S1232 WeakPolarHBondContact O-CB 3.24Å; S1232-D1236 PolarHBondContact N-OD2 3.16Å; S1232-D1236 VanDerWaalsContact N-OD2 3.14Å
1233	N	71.7	Confident	80.3	Confident	78 Å²	78	52.1 Å²	52.1	42%	0.417	32%	0.318	S	S	.	.	S	Bend	trans	-83	158.8	-176.9	-73.3	-69.1	0	0	0	112.8	G1235 D1236 C1267	N1233-G1235 PolarHBondContact O-N 3.36Å; N1233-G1235 VanDerWaalsContact O-N 3.11Å; N1233-D1236 WeakPolarHBondContact CB-OD2 3.41Å; N1233-D1236 PolarHBondContact N-OD2 3.45Å; N1233-D1236 VanDerWaalsContact O-CB 3.3Å; N1233-D1236 WeakPolarHBondContact O-CB 3.48Å; N1233-D1236 PolarHBondContact O-N 3.48Å; N1233-C1267 VanDerWaalsContact O-CB 3.29Å; N1233-C1267 WeakPolarHBondContact O-CB 3.29Å; N1233-C1267 PolarHBondContact O-SG 3Å; N1233-C1267 VanDerWaalsContact O-SG 3.37Å
1234	S	67.3	Low	80.2	Confident	45 Å²	45	48.6 Å²	48.6	32%	0.315	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	116.5	172.9	-158.4	0	0	0	0	109.9	N1269	S1234-N1269 PolarHBondContact OG-N 2.62Å
1235	G	67.5	Low	79.9	Confident	54 Å²	54	45.4 Å²	45.4	56%	0.557	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.9	-22.4	-170.3	0	0	0	0	0	114.6	N1233 C1267	N1233-G1235 PolarHBondContact O-N 3.36Å; N1233-G1235 VanDerWaalsContact O-N 3.11Å; G1235-C1267 PolarHBondContact N-O 3.08Å
1236	D	78.3	Confident	80	Confident	33 Å²	33	47 Å²	47	18%	0.176	29%	0.289	C	S	.	.			trans	-64.6	152	176.3	-86	-51.5	0	0	0	111.9	S1230 G1231 S1232 N1233 I1266 C1267	S1230-D1236 WeakPolarHBondContact CB-OD1 3.38Å; S1230-D1236 WeakPolarHBondContact OG-CA 3.26Å; S1230-D1236 WeakPolarHBondContact OG-CB 3.28Å; S1230-D1236 PolarHBondContact OG-OD1 3.13Å; G1231-D1236 VanDerWaalsContact C-CG 3.43Å; G1231-D1236 WeakPolarHBondContact CA-OD2 3.43Å; G1231-D1236 PolarHBondContact N-OD1 3.34Å; G1231-D1236 WeakPolarHBondContact O-CB 3.37Å; S1232-D1236 PolarHBondContact N-OD2 3.16Å; S1232-D1236 VanDerWaalsContact N-OD2 3.14Å; N1233-D1236 WeakPolarHBondContact CB-OD2 3.41Å; N1233-D1236 PolarHBondContact N-OD2 3.45Å; N1233-D1236 VanDerWaalsContact O-CB 3.3Å; N1233-D1236 WeakPolarHBondContact O-CB 3.48Å; N1233-D1236 PolarHBondContact O-N 3.48Å; D1236-I1266 CarbonylContact O-C 3.54Å; D1236-I1266 WeakPolarHBondContact O-CA 3.33Å; D1236-C1267 PolarHBondContact O-N 2.76Å
1237	S	77.6	Confident	79.7	Confident	26 Å²	26	44.1 Å²	44.1	18%	0.182	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	132.7	-178.9	68.3	0	0	0	0	113.1	S1230 K1264 V1265	S1230-S1237 PolarHBondContact N-O 2.83Å; S1230-S1237 PolarHBondContact OG-N 3.04Å; S1230-S1237 PolarHBondContact OG-O 3.42Å; S1237-K1264 WeakPolarHBondContact OG-CE 3.44Å; S1237-V1265 CarbonylContact C-O 3.56Å; S1237-V1265 WeakPolarHBondContact CA-O 3.33Å
1238	C	81.7	Confident	79.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	131.6	167.5	-59.4	0	0	0	0	110.5	L1220 V1227 H1228 C1229 V1265 W1272	L1220-C1238 HydrophobicContact CB-CB 4.48Å; L1220-C1238 HydrophobicContact CD2-CB 3.48Å; L1220-C1238 VanDerWaalsContact CD2-CB 3.48Å; V1227-C1238 HydrophobicContact CG1-CB 4.05Å; H1228-C1238 CarbonylContact O-C 3.58Å; H1228-C1238 WeakPolarHBondContact O-CA 3.32Å; C1229-C1238 HydrophobicContact CB-CB 4.08Å; C1229-C1238 WeakPolarHBondContact CB-SG 3.37Å; C1229-C1238 WeakPolarHBondContact SG-CB 3.47Å; C1229-C1238 CovalentContact SG-SG 2.04Å; C1229-C1238 PolarHBondContact SG-SG 2.81Å; C1238-V1265 PolarHBondContact N-O 2.8Å; C1238-V1265 PolarHBondContact O-N 2.66Å; C1238-W1272 HydrophobicContact CB-CZ3 4.27Å; C1238-W1272 WeakPolarHBondContact SG-CH2 3.39Å; C1238-W1272 WeakPolarHBondContact SG-CZ3 3.43Å
1239	L	84	Confident	78	Confident	69 Å²	69	42.4 Å²	42.4	36%	0.361	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	110.1	168.1	-171.2	66	0	0	0	108.4	V1227 H1228 M1262	V1227-L1239 WeakPolarHBondContact CA-O 3.36Å; H1228-L1239 PolarHBondContact N-O 3.3Å; H1228-L1239 PolarHBondContact O-N 3.31Å; L1239-M1262 HydrophobicContact CD1-CE 4.06Å; L1239-M1262 HydrophobicContact CD2-CE 3.7Å; L1239-M1262 HydrophobicContact CG-CE 4.02Å
1240	V	84.1	Confident	76.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	116.1	177.2	177.3	0	0	0	0	107.9	L1220 V1222 A1225 V1227 M1262 A1263 V1265 P1277	L1220-V1240 HydrophobicContact CD2-CG2 3.72Å; V1222-V1240 HydrophobicContact CB-CG1 3.99Å; V1222-V1240 HydrophobicContact CG1-CG1 3.85Å; V1222-V1240 HydrophobicContact CG2-CG1 3.92Å; V1222-V1240 HydrophobicContact CG2-CG2 3.87Å; A1225-V1240 HydrophobicContact CB-CG1 3.59Å; V1227-V1240 HydrophobicContact CG1-CG2 4.2Å; V1227-V1240 HydrophobicContact CG2-CG1 4.48Å; V1227-V1240 HydrophobicContact CG2-CG2 4.24Å; V1240-M1262 CarbonylContact O-C 3.54Å; V1240-M1262 WeakPolarHBondContact O-CA 3.48Å; V1240-A1263 PolarHBondContact N-O 3.1Å; V1240-A1263 PolarHBondContact O-N 3.09Å; V1240-V1265 HydrophobicContact CB-CG2 4.46Å; V1240-V1265 HydrophobicContact CG2-CG2 3.61Å; V1240-P1277 HydrophobicContact CG2-CB 4.33Å; V1240-P1277 HydrophobicContact CG2-CG 4.14Å
1241	T	83.9	Confident	75.2	Confident	45 Å²	45	46.8 Å²	46.8	28%	0.276	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	101.8	-178	-53.1	0	0	0	0	109	A1225 D1226 N1243 R1261 M1262	A1225-T1241 CarbonylContact C-O 3.32Å; A1225-T1241 WeakPolarHBondContact CA-O 3.26Å; D1226-T1241 PolarHBondContact N-O 2.91Å; D1226-T1241 PolarHBondContact O-N 2.89Å; T1241-N1243 PolarHBondContact O-N 3.3Å; T1241-R1261 CarbonylContact C-O 3.41Å; T1241-M1262 HydrophobicContact CG2-CG 4.09Å
1242	C	83.9	Confident	73.2	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.034	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	136.2	178.6	-59.8	0	0	0	0	111.9	N1224 Y1246 H1247 T1248 R1261 C1279	N1224-C1242 CarbonylContact O-C 3.58Å; N1224-C1242 WeakPolarHBondContact O-CA 3.35Å; C1242-Y1246 WeakPolarHBondContact CB-O 3.38Å; C1242-H1247 VanDerWaalsContact SG-C 3.51Å; C1242-T1248 WeakPolarHBondContact SG-CG2 3.41Å; C1242-R1261 WeakPolarHBondContact CB-O 3.41Å; C1242-R1261 PolarHBondContact N-O 3.02Å; C1242-C1279 WeakPolarHBondContact CA-SG 3.22Å; C1242-C1279 HydrophobicContact CB-CB 3.81Å; C1242-C1279 WeakPolarHBondContact CB-SG 3.36Å; C1242-C1279 VanDerWaalsContact SG-CA 3.57Å; C1242-C1279 WeakPolarHBondContact SG-CB 3.12Å; C1242-C1279 CovalentContact SG-SG 2.03Å; C1242-C1279 PolarHBondContact SG-SG 3.47Å
1243	N	83.9	Confident	71.1	Confident	79 Å²	79	57.2 Å²	57.2	42%	0.422	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-59	159.5	176	-66.7	-5.1	0	0	0	111.1	N1224 T1241 G1245 Y1246	N1224-N1243 WeakPolarHBondContact O-CB 3.47Å; N1224-N1243 PolarHBondContact O-N 3.19Å; T1241-N1243 PolarHBondContact O-N 3.3Å; N1243-G1245 PolarHBondContact O-N 3.23Å; N1243-Y1246 HydrophobicContact CB-CD2 4.37Å; N1243-Y1246 WeakPolarHBondContact O-CB 3.28Å; N1243-Y1246 PolarHBondContact O-N 3.15Å
1244	S	79.2	Confident	69.3	Low	61 Å²	61	58.9 Å²	58.9	43%	0.427	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	128.3	-179.2	-107.3	0	0	0	0	112.3	R1261 F1302 E1344	S1244-R1261 PolarHBondContact OG-NH1 3Å; S1244-R1261 PolarHBondContact OG-NH2 3.07Å; S1244-F1302 WeakPolarHBondContact O-CE1 3.47Å; S1244-E1344 WeakPolarHBondContact CB-OE2 3.39Å; S1244-E1344 PolarHBondContact OG-OE2 3.26Å
1245	G	77.2	Confident	67.5	Low	0 Å²	0	66.5 Å²	66.5	0%	0	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	85	3.3	-175.7	0	0	0	0	0	116.5	N1243 P1281 I1282 F1302	N1243-G1245 PolarHBondContact O-N 3.23Å; G1245-P1281 CarbonylContact O-C 3.5Å; G1245-P1281 WeakPolarHBondContact O-CA 3.1Å; G1245-I1282 WeakPolarHBondContact O-CG1 3.26Å; G1245-I1282 PolarHBondContact O-N 2.75Å; G1245-F1302 VanDerWaalsContact CA-CD1 3.49Å; G1245-F1302 VanDerWaalsContact CA-CG 3.44Å; G1245-F1302 WeakPolarHBondContact O-CB 3.41Å
1246	Y	84.3	Confident	66	Low	53 Å²	53	67.6 Å²	67.6	21%	0.208	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	152.2	172.4	-64.6	-108.2	0	0	0	111.2	N1224 C1242 N1243 Q1280 P1281 F1302	N1224-Y1246 HydrophobicContact CB-CD1 3.52Å; N1224-Y1246 HydrophobicContact CB-CD2 4.03Å; N1224-Y1246 HydrophobicContact CB-CE1 3.53Å; N1224-Y1246 HydrophobicContact CB-CE2 4.06Å; N1224-Y1246 HydrophobicContact CB-CG 3.79Å; N1224-Y1246 VanDerWaalsContact CG-CZ 3.44Å; N1224-Y1246 WeakPolarHBondContact ND2-CE1 3.07Å; N1224-Y1246 PolarHBondContact OD1-OH 2.78Å; C1242-Y1246 WeakPolarHBondContact CB-O 3.38Å; N1243-Y1246 HydrophobicContact CB-CD2 4.37Å; N1243-Y1246 WeakPolarHBondContact O-CB 3.28Å; N1243-Y1246 PolarHBondContact O-N 3.15Å; Y1246-Q1280 CarbonylContact C-O 3.44Å; Y1246-Q1280 VanDerWaalsContact CA-O 3.29Å; Y1246-Q1280 WeakPolarHBondContact CA-O 3.27Å; Y1246-P1281 HydrophobicContact CD1-CB 3.89Å; Y1246-P1281 HydrophobicContact CD1-CG 4.13Å; Y1246-P1281 HydrophobicContact CE1-CB 3.77Å; Y1246-P1281 HydrophobicContact CE1-CG 3.77Å; Y1246-P1281 HydrophobicContact CG-CB 4.39Å; Y1246-F1302 HydrophobicContact CE2-CD1 4.37Å
1247	H	79.1	Confident	64.3	Low	28 Å²	28	76.2 Å²	76.2	13%	0.13	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	155.5	179.7	74	-71.7	0	0	0	110.8	C1242 Y1259 D1260 C1279 Q1280 I1282	C1242-H1247 VanDerWaalsContact SG-C 3.51Å; H1247-Y1259 HydrophobicContact CB-CD1 4.15Å; H1247-Y1259 AromaticContact CD2-CD1 3.67Å; H1247-Y1259 AromaticContact CE1-CD1 3.96Å; H1247-Y1259 AromaticContact CE1-CE1 3.97Å; H1247-Y1259 AromaticContact CG-CD1 3.63Å; H1247-Y1259 AromaticContact ND1-CD1 3.83Å; H1247-Y1259 AromaticContact NE2-CD1 3.88Å; H1247-D1260 CarbonylContact C-O 3.48Å; H1247-D1260 VanDerWaalsContact CA-O 3.26Å; H1247-D1260 WeakPolarHBondContact CA-O 3.35Å; H1247-D1260 WeakPolarHBondContact CB-O 3.08Å; H1247-C1279 CarbonylContact O-C 3.51Å; H1247-C1279 WeakPolarHBondContact O-CA 3.26Å; H1247-Q1280 PolarHBondContact N-O 3.04Å; H1247-Q1280 PolarHBondContact ND1-O 3.49Å; H1247-Q1280 PolarHBondContact O-N 2.85Å; H1247-I1282 HydrophobicContact CB-CG1 4.09Å
1248	T	72.2	Confident	63.1	Low	23 Å²	23	77 Å²	77	14%	0.141	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	137.9	-179.3	59.6	0	0	0	0	111.2	C1242 D1260 A1263	C1242-T1248 WeakPolarHBondContact SG-CG2 3.41Å; T1248-D1260 PolarHBondContact N-O 2.79Å; T1248-D1260 PolarHBondContact OG1-O 3.36Å; T1248-A1263 HydrophobicContact CG2-CB 3.61Å
1249	M	63.5	Low	62.1	Low	95 Å²	95	82 Å²	82	47%	0.468	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	132.8	159	-69.1	-155.8	-41.2	0	0	110.9	V1278 Q1280	M1249-V1278 PolarHBondContact N-O 3.15Å; M1249-Q1280 HydrophobicContact CG-CG 4.23Å; M1249-Q1280 PolarHBondContact SD-NE2 3.14Å
1250	S	53.5	Low	61.1	Low	91 Å²	91	83.8 Å²	83.8	64%	0.636	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-91.5	134.6	163.5	48.3	0	0	0	0	110.5	A1252	S1250-A1252 PolarHBondContact O-N 3.41Å
1251	D	51.3	Low	60.7	Low	125 Å²	125	87.3 Å²	87.3	67%	0.668	47%	0.467	S	S	*	.	S	Bend	trans	-68.7	122.1	169.2	-90.6	-41.3	0	0	0	109.8
1252	A	36.8	Very low	60.3	Low	78 Å²	78	90 Å²	90	65%	0.645	48%	0.477	S	S	*	.	S	Bend	trans	68.9	133.6	166.1	0	0	0	0	0	120.3	S1250 V1254	S1250-A1252 PolarHBondContact O-N 3.41Å; A1252-V1254 PolarHBondContact O-N 3.44Å
1253	F	32.4	Very low	59.7	Low	213 Å²	213	90.7 Å²	90.7	93%	0.934	48%	0.484	S	S	*	.	S	Bend	trans	77.8	1.8	151.1	-101	-85.3	0	0	0	123
1254	V	34	Very low	59.4	Low	113 Å²	113	91.8 Å²	91.8	69%	0.685	49%	0.485	S	S	*	.			trans	-115.7	114.1	173.1	-173.5	0	0	0	0	111.8	A1252 S1256	A1252-V1254 PolarHBondContact O-N 3.44Å; V1254-S1256 PolarHBondContact O-N 2.89Å
1255	Q	29.2	Very low	59.4	Low	205 Å²	205	88.9 Å²	88.9	96%	0.958	46%	0.464	S	S	*	.			trans	-76.1	48.8	175.7	-69.2	-175	-14.6	0	0	112.9
1256	S	35.7	Very low	59.5	Low	77 Å²	77	92 Å²	92	54%	0.538	48%	0.481	S	S	.	.			trans	-77.5	119.8	170.5	180	0	0	0	0	109.7	V1254 G1258	V1254-S1256 PolarHBondContact O-N 2.89Å; S1256-G1258 PolarHBondContact O-N 3.44Å; S1256-G1258 PolarHBondContact OG-N 3.38Å
1257	K	43.4	Very low	59.2	Low	215 Å²	215	89.5 Å²	89.5	94%	0.935	47%	0.471	S	S	*	.			trans	-80.4	18.3	169.7	-77.1	-175.7	173.2	179.1	0	112.9
1258	G	50.9	Low	58.7	Low	43 Å²	43	92.1 Å²	92.1	44%	0.443	49%	0.485	S	S	.	.			trans	-89.8	127	-178.1	0	0	0	0	0	113.4	S1256 D1260	S1256-G1258 PolarHBondContact O-N 3.44Å; S1256-G1258 PolarHBondContact OG-N 3.38Å; G1258-D1260 VanDerWaalsContact C-N 3.27Å; G1258-D1260 PolarHBondContact O-N 3.41Å
1259	Y	61.1	Low	58.6	Low	105 Å²	105	96.4 Å²	96.4	41%	0.412	51%	0.507	S	S	.	.			trans	-78.1	69.6	170.3	-70.6	-64.4	0	0	0	111.3	H1247 R1261 I1282 D1283	H1247-Y1259 HydrophobicContact CB-CD1 4.15Å; H1247-Y1259 AromaticContact CD2-CD1 3.67Å; H1247-Y1259 AromaticContact CE1-CD1 3.96Å; H1247-Y1259 AromaticContact CE1-CE1 3.97Å; H1247-Y1259 AromaticContact CG-CD1 3.63Å; H1247-Y1259 AromaticContact ND1-CD1 3.83Å; H1247-Y1259 AromaticContact NE2-CD1 3.88Å; Y1259-R1261 PolarHBondContact O-N 2.87Å; Y1259-I1282 HydrophobicContact CD1-CG1 4.12Å; Y1259-I1282 HydrophobicContact CD1-CG2 4.17Å; Y1259-I1282 HydrophobicContact CD2-CG2 4.11Å; Y1259-I1282 HydrophobicContact CE1-CG2 4.08Å; Y1259-I1282 HydrophobicContact CE2-CG2 4Å; Y1259-I1282 HydrophobicContact CG-CG1 4.29Å; Y1259-I1282 HydrophobicContact CG-CG2 4.19Å; Y1259-D1283 PolarHBondContact OH-O 2.78Å
1260	D	64.6	Low	59	Low	105 Å²	105	93 Å²	93	56%	0.561	50%	0.497	S	S	*	.			trans	-65.6	130.6	177.7	-89.2	-41.3	0	0	0	111.8	H1247 T1248 G1258	H1247-D1260 CarbonylContact C-O 3.48Å; H1247-D1260 VanDerWaalsContact CA-O 3.26Å; H1247-D1260 WeakPolarHBondContact CA-O 3.35Å; H1247-D1260 WeakPolarHBondContact CB-O 3.08Å; T1248-D1260 PolarHBondContact N-O 2.79Å; T1248-D1260 PolarHBondContact OG1-O 3.36Å; G1258-D1260 VanDerWaalsContact C-N 3.27Å; G1258-D1260 PolarHBondContact O-N 3.41Å
1261	R	75.6	Confident	60.1	Low	74 Å²	74	96 Å²	96	28%	0.279	49%	0.494	S	S	.	.			trans	-86.8	-9.9	176.9	-68.8	-161.2	178.7	178.6	-2.4	113.8	T1241 C1242 S1244 Y1259 E1344	T1241-R1261 CarbonylContact C-O 3.41Å; C1242-R1261 WeakPolarHBondContact CB-O 3.41Å; C1242-R1261 PolarHBondContact N-O 3.02Å; S1244-R1261 PolarHBondContact OG-NH1 3Å; S1244-R1261 PolarHBondContact OG-NH2 3.07Å; Y1259-R1261 PolarHBondContact O-N 2.87Å; R1261-E1344 IonicContact CZ-OE2 3.99Å; R1261-E1344 IonicContact NH1-OE2 3.89Å; R1261-E1344 PolarHBondContact NH2-O 3.37Å; R1261-E1344 IonicContact NH2-OE2 3.18Å; R1261-E1344 PolarHBondContact NH2-OE2 3.17Å
1262	M	74.6	Confident	61.4	Low	102 Å²	102	91.1 Å²	91.1	50%	0.502	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.1	-170.4	-62.4	177.3	82.2	0	0	111.3	L1239 V1240 T1241	L1239-M1262 HydrophobicContact CD1-CE 4.06Å; L1239-M1262 HydrophobicContact CD2-CE 3.7Å; L1239-M1262 HydrophobicContact CG-CE 4.02Å; V1240-M1262 CarbonylContact O-C 3.54Å; V1240-M1262 WeakPolarHBondContact O-CA 3.48Å; T1241-M1262 HydrophobicContact CG2-CG 4.09Å
1263	A	71	Confident	62.9	Low	20 Å²	20	91.7 Å²	91.7	17%	0.165	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133	172.1	0	0	0	0	0	110.2	V1240 T1248	V1240-A1263 PolarHBondContact N-O 3.1Å; V1240-A1263 PolarHBondContact O-N 3.09Å; T1248-A1263 HydrophobicContact CG2-CB 3.61Å
1264	K	78.3	Confident	64.5	Low	101 Å²	101	83.4 Å²	83.4	44%	0.439	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	127.9	169.5	-170.1	173.6	-176.6	175.6	0	109	S1237	S1237-K1264 WeakPolarHBondContact OG-CE 3.44Å
1265	V	79.5	Confident	65.9	Low	0 Å²	0	86.1 Å²	86.1	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132.6	-175.2	-160.6	0	0	0	0	107.2	L1220 S1237 C1238 V1240 W1272 N1273 P1277	L1220-V1265 HydrophobicContact CD2-CB 4.14Å; L1220-V1265 HydrophobicContact CD2-CG1 4.34Å; L1220-V1265 HydrophobicContact CD2-CG2 4.07Å; S1237-V1265 CarbonylContact C-O 3.56Å; S1237-V1265 WeakPolarHBondContact CA-O 3.33Å; C1238-V1265 PolarHBondContact N-O 2.8Å; C1238-V1265 PolarHBondContact O-N 2.66Å; V1240-V1265 HydrophobicContact CB-CG2 4.46Å; V1240-V1265 HydrophobicContact CG2-CG2 3.61Å; V1265-W1272 HydrophobicContact CB-CE3 4.42Å; V1265-W1272 HydrophobicContact CG1-CB 3.85Å; V1265-W1272 HydrophobicContact CG1-CE3 4.14Å; V1265-W1272 HydrophobicContact CG1-CG 4.46Å; V1265-N1273 WeakPolarHBondContact CG1-O 3.3Å; V1265-P1277 HydrophobicContact CG1-CG 4.45Å; V1265-P1277 HydrophobicContact CG2-CB 4.06Å; V1265-P1277 HydrophobicContact CG2-CG 3.89Å
1266	I	78.4	Confident	67.7	Low	67 Å²	67	86.3 Å²	86.3	34%	0.344	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	133.4	-172.7	-55.1	174.5	0	0	0	109.4	D1236 L1268 W1272 N1273	D1236-I1266 CarbonylContact O-C 3.54Å; D1236-I1266 WeakPolarHBondContact O-CA 3.33Å; I1266-L1268 HydrophobicContact CG2-CD2 4.02Å; I1266-L1268 HydrophobicContact CG2-CG 4.14Å; I1266-L1268 PolarHBondContact O-N 3.02Å; I1266-W1272 CarbonylContact O-C 3.52Å; I1266-W1272 WeakPolarHBondContact O-CA 3.4Å; I1266-N1273 PolarHBondContact N-O 3.37Å; I1266-N1273 PolarHBondContact O-N 3.02Å
1267	C	78.4	Confident	69.2	Low	0 Å²	0	83.2 Å²	83.2	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	119.9	171.1	178.6	0	0	0	0	109	C1217 N1233 G1235 D1236 W1272	C1217-C1267 HydrophobicContact CB-CB 3.86Å; C1217-C1267 WeakPolarHBondContact CB-SG 3.34Å; C1217-C1267 WeakPolarHBondContact SG-CA 3.43Å; C1217-C1267 WeakPolarHBondContact SG-CB 3.04Å; C1217-C1267 CovalentContact SG-SG 2.03Å; C1217-C1267 PolarHBondContact SG-SG 3.42Å; N1233-C1267 VanDerWaalsContact O-CB 3.29Å; N1233-C1267 WeakPolarHBondContact O-CB 3.29Å; N1233-C1267 PolarHBondContact O-SG 3Å; N1233-C1267 VanDerWaalsContact O-SG 3.37Å; G1235-C1267 PolarHBondContact N-O 3.08Å; D1236-C1267 PolarHBondContact O-N 2.76Å; C1267-W1272 HydrophobicContact CB-CD2 4.49Å; C1267-W1272 HydrophobicContact CB-CE3 3.98Å; C1267-W1272 HydrophobicContact CB-CH2 3.86Å; C1267-W1272 HydrophobicContact CB-CZ2 4.41Å; C1267-W1272 HydrophobicContact CB-CZ3 3.64Å
1268	L	68.5	Low	70.7	Confident	82 Å²	82	76.1 Å²	76.1	43%	0.429	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	112.7	177.6	-64.4	174.6	0	0	0	108.7	I1266 G1270 R1271 N1273	I1266-L1268 HydrophobicContact CG2-CD2 4.02Å; I1266-L1268 HydrophobicContact CG2-CG 4.14Å; I1266-L1268 PolarHBondContact O-N 3.02Å; L1268-G1270 PolarHBondContact O-N 2.79Å; L1268-R1271 PolarHBondContact N-O 2.95Å; L1268-R1271 PolarHBondContact O-N 3.5Å; L1268-R1271 VanDerWaalsContact O-N 3.14Å; L1268-R1271 VanDerWaalsContact O-O 3.09Å; L1268-N1273 HydrophobicContact CD1-CB 3.92Å
1269	N	69.3	Low	72.3	Confident	113 Å²	113	74.4 Å²	74.4	60%	0.604	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	55.9	177.7	-59.9	-12.1	0	0	0	112.7	S1234 R1271	S1234-N1269 PolarHBondContact OG-N 2.62Å; N1269-R1271 PolarHBondContact O-N 3.28Å
1270	G	73.2	Confident	73.2	Confident	24 Å²	24	72 Å²	72	25%	0.247	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	11.9	179.4	0	0	0	0	0	115.7	T1215 E1216 L1268	T1215-G1270 WeakPolarHBondContact O-CA 3.49Å; T1215-G1270 PolarHBondContact O-N 2.8Å; T1215-G1270 VanDerWaalsContact O-N 3.1Å; T1215-G1270 PolarHBondContact OG1-N 3.39Å; E1216-G1270 VanDerWaalsContact O-CA 3.31Å; E1216-G1270 WeakPolarHBondContact O-CA 3.45Å; L1268-G1270 PolarHBondContact O-N 2.79Å
1271	R	75.9	Confident	74.1	Confident	153 Å²	153	68.7 Å²	68.7	58%	0.577	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.9	132.3	175.4	-63.1	-176.5	177.6	174.6	0.3	111.8	C1217 L1268 N1269	C1217-R1271 PolarHBondContact SG-N 3.39Å; L1268-R1271 PolarHBondContact N-O 2.95Å; L1268-R1271 PolarHBondContact O-N 3.5Å; L1268-R1271 VanDerWaalsContact O-N 3.14Å; L1268-R1271 VanDerWaalsContact O-O 3.09Å; N1269-R1271 PolarHBondContact O-N 3.28Å
1272	W	79	Confident	74.3	Confident	23 Å²	23	65.3 Å²	65.3	9%	0.087	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	143.7	167	-65.9	108.4	0	0	0	110.9	C1217 E1218 L1220 C1238 V1265 I1266 C1267 R1275	C1217-W1272 HydrophobicContact CB-CD2 4.21Å; C1217-W1272 HydrophobicContact CB-CH2 4.46Å; C1217-W1272 HydrophobicContact CB-CZ2 3.71Å; E1218-W1272 PolarHBondContact O-NE1 2.83Å; L1220-W1272 HydrophobicContact CB-CD2 4.42Å; L1220-W1272 HydrophobicContact CB-CZ2 4.34Å; L1220-W1272 HydrophobicContact CD1-CB 4.43Å; L1220-W1272 HydrophobicContact CD1-CD2 4.41Å; L1220-W1272 HydrophobicContact CD1-CG 3.94Å; C1238-W1272 HydrophobicContact CB-CZ3 4.27Å; C1238-W1272 WeakPolarHBondContact SG-CH2 3.39Å; C1238-W1272 WeakPolarHBondContact SG-CZ3 3.43Å; V1265-W1272 HydrophobicContact CB-CE3 4.42Å; V1265-W1272 HydrophobicContact CG1-CB 3.85Å; V1265-W1272 HydrophobicContact CG1-CE3 4.14Å; V1265-W1272 HydrophobicContact CG1-CG 4.46Å; I1266-W1272 CarbonylContact O-C 3.52Å; I1266-W1272 WeakPolarHBondContact O-CA 3.4Å; C1267-W1272 HydrophobicContact CB-CD2 4.49Å; C1267-W1272 HydrophobicContact CB-CE3 3.98Å; C1267-W1272 HydrophobicContact CB-CH2 3.86Å; C1267-W1272 HydrophobicContact CB-CZ2 4.41Å; C1267-W1272 HydrophobicContact CB-CZ3 3.64Å; W1272-R1275 VanDerWaalsContact O-CA 3.24Å; W1272-R1275 WeakPolarHBondContact O-CA 3.17Å; W1272-R1275 PolarHBondContact O-N 3.13Å
1273	N	68.9	Low	74.8	Confident	91 Å²	91	62.9 Å²	62.9	49%	0.487	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	122.5	176.2	-159.1	30.4	0	0	0	110	V1265 I1266 L1268	V1265-N1273 WeakPolarHBondContact CG1-O 3.3Å; I1266-N1273 PolarHBondContact N-O 3.37Å; I1266-N1273 PolarHBondContact O-N 3.02Å; L1268-N1273 HydrophobicContact CD1-CB 3.92Å
1274	P	64.4	Low	75.3	Confident	38 Å²	38	62.8 Å²	62.8	25%	0.247	30%	0.3	C	S	.	.	S	Bend	cis	-61.1	150.4	-5.3	27.9	-36	0	0	0	112.6	R1276 P1277	P1274-R1276 VanDerWaalsContact C-N 3.27Å; P1274-R1276 PolarHBondContact O-N 3.17Å; P1274-R1276 VanDerWaalsContact O-N 3.17Å; P1274-P1277 WeakPolarHBondContact O-CD 3.1Å
1275	R	63.3	Low	75.4	Confident	170 Å²	170	59.5 Å²	59.5	64%	0.642	30%	0.295	S	S	*	.	S	Bend	trans	-61.8	-28	-167.6	-76.7	-171.1	-176.7	174.9	6.8	115.4	W1272	W1272-R1275 VanDerWaalsContact O-CA 3.24Å; W1272-R1275 WeakPolarHBondContact O-CA 3.17Å; W1272-R1275 PolarHBondContact O-N 3.13Å
1276	R	66.9	Low	75.5	Confident	210 Å²	210	65.1 Å²	65.1	79%	0.792	33%	0.325	S	S	*	.			trans	-146.5	86.2	177.9	-68.2	-169.4	178.6	-161.7	-2.1	109.1	P1274 V1278	P1274-R1276 VanDerWaalsContact C-N 3.27Å; P1274-R1276 PolarHBondContact O-N 3.17Å; P1274-R1276 VanDerWaalsContact O-N 3.17Å; R1276-V1278 PolarHBondContact O-N 2.93Å
1277	P	67	Low	75.5	Confident	11 Å²	11	62.6 Å²	62.6	7%	0.071	31%	0.312	C	S	.	.			trans	-54.8	130.1	163.6	27.8	-39.2	0	0	0	109.4	L1220 V1222 V1240 V1265 P1274	L1220-P1277 HydrophobicContact CD1-CG 4.25Å; L1220-P1277 HydrophobicContact CD2-CG 4.29Å; V1222-P1277 WeakPolarHBondContact CG1-O 3.12Å; V1222-P1277 HydrophobicContact CG2-CB 4.37Å; V1222-P1277 HydrophobicContact CG2-CG 3.62Å; V1240-P1277 HydrophobicContact CG2-CB 4.33Å; V1240-P1277 HydrophobicContact CG2-CG 4.14Å; V1265-P1277 HydrophobicContact CG1-CG 4.45Å; V1265-P1277 HydrophobicContact CG2-CB 4.06Å; V1265-P1277 HydrophobicContact CG2-CG 3.89Å; P1274-P1277 WeakPolarHBondContact O-CD 3.1Å
1278	V	76.3	Confident	75.5	Confident	67 Å²	67	71.5 Å²	71.5	41%	0.406	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	121.6	177.5	-178.2	0	0	0	0	109.1	M1249 R1276 Q1280	M1249-V1278 PolarHBondContact N-O 3.15Å; R1276-V1278 PolarHBondContact O-N 2.93Å; V1278-Q1280 HydrophobicContact CG1-CG 4.03Å; V1278-Q1280 PolarHBondContact O-N 2.95Å
1279	C	83.4	Confident	75.8	Confident	7 Å²	7	69.1 Å²	69.1	5%	0.047	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	106.1	168.1	-73.3	0	0	0	0	109.6	N1224 A1225 C1242 H1247	N1224-C1279 HydrophobicContact CB-CB 4.47Å; A1225-C1279 VanDerWaalsContact CB-SG 3.51Å; C1242-C1279 WeakPolarHBondContact CA-SG 3.22Å; C1242-C1279 HydrophobicContact CB-CB 3.81Å; C1242-C1279 WeakPolarHBondContact CB-SG 3.36Å; C1242-C1279 VanDerWaalsContact SG-CA 3.57Å; C1242-C1279 WeakPolarHBondContact SG-CB 3.12Å; C1242-C1279 CovalentContact SG-SG 2.03Å; C1242-C1279 PolarHBondContact SG-SG 3.47Å; H1247-C1279 CarbonylContact O-C 3.51Å; H1247-C1279 WeakPolarHBondContact O-CA 3.26Å
1280	Q	80.5	Confident	76	Confident	55 Å²	55	68.3 Å²	68.3	26%	0.257	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	139.5	175	-68	-157	11.8	0	0	111	Y1246 H1247 M1249 V1278 I1282	Y1246-Q1280 CarbonylContact C-O 3.44Å; Y1246-Q1280 VanDerWaalsContact CA-O 3.29Å; Y1246-Q1280 WeakPolarHBondContact CA-O 3.27Å; H1247-Q1280 PolarHBondContact N-O 3.04Å; H1247-Q1280 PolarHBondContact ND1-O 3.49Å; H1247-Q1280 PolarHBondContact O-N 2.85Å; M1249-Q1280 HydrophobicContact CG-CG 4.23Å; M1249-Q1280 PolarHBondContact SD-NE2 3.14Å; V1278-Q1280 HydrophobicContact CG1-CG 4.03Å; V1278-Q1280 PolarHBondContact O-N 2.95Å; Q1280-I1282 PolarHBondContact O-N 3.32Å
1281	P	84.1	Confident	76.2	Confident	34 Å²	34	73.9 Å²	73.9	22%	0.221	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	134.6	173.5	17.3	-18.8	0	0	0	110.2	G1245 Y1246 K1301 F1302	G1245-P1281 CarbonylContact O-C 3.5Å; G1245-P1281 WeakPolarHBondContact O-CA 3.1Å; Y1246-P1281 HydrophobicContact CD1-CB 3.89Å; Y1246-P1281 HydrophobicContact CD1-CG 4.13Å; Y1246-P1281 HydrophobicContact CE1-CB 3.77Å; Y1246-P1281 HydrophobicContact CE1-CG 3.77Å; Y1246-P1281 HydrophobicContact CG-CB 4.39Å; P1281-K1301 HydrophobicContact CB-CB 4.21Å; P1281-K1301 HydrophobicContact CB-CD 4.42Å; P1281-K1301 HydrophobicContact CG-CB 4.38Å; P1281-K1301 HydrophobicContact CG-CD 3.87Å; P1281-F1302 HydrophobicContact CB-CB 4.15Å
1282	I	79.9	Confident	76.4	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.021	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-56.3	142.1	-178.2	-68.9	169.6	0	0	0	109.8	G1245 H1247 Y1259 Q1280 K1301 F1302 E1344 G1346	G1245-I1282 WeakPolarHBondContact O-CG1 3.26Å; G1245-I1282 PolarHBondContact O-N 2.75Å; H1247-I1282 HydrophobicContact CB-CG1 4.09Å; Y1259-I1282 HydrophobicContact CD1-CG1 4.12Å; Y1259-I1282 HydrophobicContact CD1-CG2 4.17Å; Y1259-I1282 HydrophobicContact CD2-CG2 4.11Å; Y1259-I1282 HydrophobicContact CE1-CG2 4.08Å; Y1259-I1282 HydrophobicContact CE2-CG2 4Å; Y1259-I1282 HydrophobicContact CG-CG1 4.29Å; Y1259-I1282 HydrophobicContact CG-CG2 4.19Å; Q1280-I1282 PolarHBondContact O-N 3.32Å; I1282-K1301 CarbonylContact O-C 3.53Å; I1282-K1301 VanDerWaalsContact O-C 3.28Å; I1282-K1301 WeakPolarHBondContact O-CA 3.42Å; I1282-F1302 PolarHBondContact O-N 2.99Å; I1282-E1344 VanDerWaalsContact CD1-O 3.28Å; I1282-E1344 WeakPolarHBondContact CD1-O 3.44Å; I1282-G1346 VanDerWaalsContact CG2-CA 3.5Å
1283	D	84.4	Confident	76.5	Confident	51 Å²	51	70.3 Å²	70.3	27%	0.273	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-110	114.4	-177.1	-153.5	-46.6	0	0	0	111.4	Y1259 G1285 T1300 K1301	Y1259-D1283 PolarHBondContact OH-O 2.78Å; D1283-G1285 PolarHBondContact O-N 2.81Å; D1283-G1285 PolarHBondContact OD1-N 2.83Å; D1283-T1300 VanDerWaalsContact CG-OG1 3.3Å; D1283-T1300 WeakPolarHBondContact OD1-CB 3.49Å; D1283-T1300 PolarHBondContact OD1-OG1 2.95Å; D1283-T1300 PolarHBondContact OD2-OG1 2.81Å; D1283-K1301 HydrophobicContact CB-CG 4.37Å; D1283-K1301 WeakPolarHBondContact OD2-CG 3.21Å
1284	C	82.2	Confident	77.2	Confident	17 Å²	17	68.3 Å²	68.3	12%	0.115	34%	0.339	C	S	.	.			trans	-77.8	-0.8	176.9	-62.9	0	0	0	0	113.5	T1300 C1342 G1346 V1347 W1348	C1284-T1300 PolarHBondContact N-O 2.82Å; C1284-C1342 HydrophobicContact CB-CB 3.78Å; C1284-C1342 WeakPolarHBondContact CB-SG 3.46Å; C1284-C1342 WeakPolarHBondContact SG-CA 3.5Å; C1284-C1342 WeakPolarHBondContact SG-CB 3.48Å; C1284-C1342 CovalentContact SG-SG 2.02Å; C1284-C1342 PolarHBondContact SG-SG 3.35Å; C1284-G1346 WeakPolarHBondContact SG-CA 3.41Å; C1284-V1347 PolarHBondContact SG-N 2.8Å; C1284-W1348 HydrophobicContact CB-CD2 4.11Å; C1284-W1348 VanDerWaalsContact CB-CE2 3.48Å; C1284-W1348 HydrophobicContact CB-CG 4.24Å; C1284-W1348 HydrophobicContact CB-CZ2 3.86Å; C1284-W1348 VanDerWaalsContact CB-NE1 3.28Å; C1284-W1348 PolarHBondContact O-NE1 2.87Å
1285	G	79.7	Confident	78	Confident	32 Å²	32	68.9 Å²	68.9	33%	0.33	34%	0.344	S	S	.	.			trans	63.6	-174.1	-172.7	0	0	0	0	0	113	D1283 T1300 W1348	D1283-G1285 PolarHBondContact O-N 2.81Å; D1283-G1285 PolarHBondContact OD1-N 2.83Å; G1285-T1300 VanDerWaalsContact C-CG2 3.44Å; G1285-T1300 VanDerWaalsContact O-CB 3.27Å; G1285-T1300 WeakPolarHBondContact O-CB 3.01Å; G1285-T1300 WeakPolarHBondContact O-CG2 3.43Å; G1285-W1348 VanDerWaalsContact O-CE2 3.3Å; G1285-W1348 WeakPolarHBondContact O-CZ2 3.49Å; G1285-W1348 PolarHBondContact O-NE1 2.93Å
1286	L	82.1	Confident	79.1	Confident	119 Å²	119	61.9 Å²	61.9	62%	0.623	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-78.4	129.9	172.8	-83.1	163	0	0	0	109.9	T1300	L1286-T1300 HydrophobicContact CD2-CG2 4.18Å; L1286-T1300 HydrophobicContact CG-CG2 4.1Å
1287	P	78.7	Confident	79.7	Confident	13 Å²	13	53.4 Å²	53.4	8%	0.084	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-69.2	145.6	174.1	7.6	-1.2	0	0	0	111.3	L1294 C1306 I1340 W1348	P1287-L1294 HydrophobicContact CB-CD2 3.67Å; P1287-L1294 HydrophobicContact CG-CD2 3.51Å; P1287-L1294 WeakPolarHBondContact O-CD1 3.14Å; P1287-L1294 WeakPolarHBondContact O-CD2 3.37Å; P1287-C1306 VanDerWaalsContact CD-SG 3.57Å; P1287-C1306 HydrophobicContact CG-CB 3.87Å; P1287-C1306 VanDerWaalsContact CG-SG 3.59Å; P1287-I1340 HydrophobicContact CB-CD1 3.45Å; P1287-I1340 VanDerWaalsContact CB-CD1 3.45Å; P1287-I1340 HydrophobicContact CG-CD1 3.37Å; P1287-I1340 HydrophobicContact CG-CG1 4.41Å; P1287-W1348 HydrophobicContact CB-CB 4.45Å; P1287-W1348 HydrophobicContact CB-CD2 4.18Å; P1287-W1348 HydrophobicContact CB-CG 3.83Å; P1287-W1348 HydrophobicContact CG-CD2 3.63Å; P1287-W1348 HydrophobicContact CG-CE3 4.18Å; P1287-W1348 HydrophobicContact CG-CG 3.84Å; P1287-W1348 HydrophobicContact CG-CZ2 4.12Å
1288	E	77.6	Confident	80.3	Confident	188 Å²	188	56.9 Å²	56.9	88%	0.879	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-97.3	121.9	168.4	-74.6	-167.6	131.3	0	0	110.6
1289	I	75.5	Confident	80.6	Confident	31 Å²	31	54.3 Å²	54.3	16%	0.159	30%	0.298	C	S	.	.			trans	-132	121.6	172.4	-63.8	179	0	0	0	108.4	A1292 L1294 F1308 I1340 P1351	I1289-A1292 HydrophobicContact CB-CB 4.09Å; I1289-A1292 HydrophobicContact CG2-CB 3.69Å; I1289-A1292 PolarHBondContact O-N 3Å; I1289-L1294 HydrophobicContact CB-CD2 4.46Å; I1289-L1294 HydrophobicContact CD1-CD2 4.1Å; I1289-L1294 HydrophobicContact CG1-CD2 4.17Å; I1289-F1308 HydrophobicContact CD1-CB 3.84Å; I1289-F1308 HydrophobicContact CD1-CD1 3.32Å; I1289-F1308 HydrophobicContact CD1-CD2 4.21Å; I1289-F1308 HydrophobicContact CD1-CE1 3.89Å; I1289-F1308 HydrophobicContact CD1-CG 3.52Å; I1289-F1308 HydrophobicContact CG2-CD2 4.02Å; I1289-F1308 HydrophobicContact CG2-CG 4.26Å; I1289-I1340 HydrophobicContact CD1-CD1 3.89Å; I1289-P1351 HydrophobicContact CD1-CB 4.09Å; I1289-P1351 HydrophobicContact CD1-CG 4.11Å
1290	S	73.7	Confident	80.7	Confident	97 Å²	97	55.4 Å²	55.4	68%	0.678	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	141.3	-174.3	69.3	0	0	0	0	111.8	A1292	S1290-A1292 PolarHBondContact O-N 2.78Å; S1290-A1292 VanDerWaalsContact O-N 3.07Å
1291	R	77.1	Confident	80.9	Confident	140 Å²	140	56.3 Å²	56.3	53%	0.528	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	27.6	-176.1	-52	-179.5	-175.9	-88.2	5.4	113.9	C1310 V1311 A1314 C1355	R1291-C1310 WeakPolarHBondContact O-CA 3.48Å; R1291-V1311 PolarHBondContact O-N 3.11Å; R1291-A1314 HydrophobicContact CB-CB 3.89Å; R1291-C1355 HydrophobicContact CB-CB 4.15Å
1292	A	79.7	Confident	81	Confident	14 Å²	14	57.7 Å²	57.7	12%	0.116	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	138	178.3	0	0	0	0	0	112.7	I1289 S1290 F1308 H1309	I1289-A1292 HydrophobicContact CB-CB 4.09Å; I1289-A1292 HydrophobicContact CG2-CB 3.69Å; I1289-A1292 PolarHBondContact O-N 3Å; S1290-A1292 PolarHBondContact O-N 2.78Å; S1290-A1292 VanDerWaalsContact O-N 3.07Å; A1292-F1308 HydrophobicContact CB-CB 3.97Å; A1292-F1308 HydrophobicContact CB-CD2 4.08Å; A1292-F1308 HydrophobicContact CB-CG 4.47Å; A1292-H1309 CarbonylContact C-O 3.55Å; A1292-H1309 WeakPolarHBondContact CA-O 3.19Å
1293	K	80.9	Confident	81.2	Confident	88 Å²	88	60.1 Å²	60.1	38%	0.383	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	116.3	169.5	-128.7	-175.1	-176.2	-175.3	0	108	H1309 V1311 K1795	K1293-H1309 PolarHBondContact N-O 3.07Å; K1293-H1309 PolarHBondContact O-N 3.44Å; K1293-V1311 HydrophobicContact CB-CG2 4.07Å; K1293-K1795 PolarHBondContact NZ-O 2.79Å
1294	L	83.1	Confident	81.2	Confident	48 Å²	48	57.9 Å²	57.9	25%	0.251	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	139.7	-179.7	-62.3	102.6	0	0	0	111.6	P1287 I1289 F1308 I1340	P1287-L1294 HydrophobicContact CB-CD2 3.67Å; P1287-L1294 HydrophobicContact CG-CD2 3.51Å; P1287-L1294 WeakPolarHBondContact O-CD1 3.14Å; P1287-L1294 WeakPolarHBondContact O-CD2 3.37Å; I1289-L1294 HydrophobicContact CB-CD2 4.46Å; I1289-L1294 HydrophobicContact CD1-CD2 4.1Å; I1289-L1294 HydrophobicContact CG1-CD2 4.17Å; L1294-F1308 HydrophobicContact CD2-CB 4.27Å; L1294-F1308 HydrophobicContact CG-CB 4.11Å; L1294-I1340 HydrophobicContact CD2-CD1 4.49Å
1295	S	82.9	Confident	81.4	Confident	50 Å²	50	61 Å²	61	35%	0.35	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	104.2	177.5	172.6	0	0	0	0	107.5	P1297 Y1307	S1295-P1297 VanDerWaalsContact C-CD 3.47Å; S1295-P1297 WeakPolarHBondContact O-CD 3.4Å; S1295-Y1307 WeakPolarHBondContact CA-O 3.49Å; S1295-Y1307 WeakPolarHBondContact CB-O 3.5Å; S1295-Y1307 PolarHBondContact N-O 3.41Å; S1295-Y1307 PolarHBondContact O-N 3.3Å
1296	C	84.7	Confident	81.6	Confident	23 Å²	23	59.4 Å²	59.4	16%	0.155	32%	0.315	C	S	.	.			trans	-104	87.8	-179.2	-54.6	0	0	0	0	109.8	G1299 C1306 R1766	C1296-G1299 WeakPolarHBondContact CB-O 3.5Å; C1296-C1306 HydrophobicContact CB-CB 4.06Å; C1296-C1306 WeakPolarHBondContact CB-SG 3.34Å; C1296-C1306 WeakPolarHBondContact SG-CB 3.28Å; C1296-C1306 CovalentContact SG-SG 2.03Å; C1296-C1306 PolarHBondContact SG-SG 2.98Å; C1296-R1766 PolarHBondContact O-NH2 3.24Å
1297	P	81	Confident	81.8	Confident	32 Å²	32	57.3 Å²	57.3	21%	0.208	30%	0.299	C	S	.	.	S	Bend	trans	-80.9	-9.5	-179.2	34.8	-39.9	0	0	0	114.1	S1295 K1305 Y1307 R1766	S1295-P1297 VanDerWaalsContact C-CD 3.47Å; S1295-P1297 WeakPolarHBondContact O-CD 3.4Å; P1297-K1305 WeakPolarHBondContact CD-O 3.49Å; P1297-Y1307 HydrophobicContact CG-CD2 3.71Å; P1297-Y1307 HydrophobicContact CG-CE2 3.65Å; P1297-R1766 HydrophobicContact CB-CG 4.36Å; P1297-R1766 WeakPolarHBondContact O-CD 3.47Å; P1297-R1766 WeakPolarHBondContact O-CG 3.47Å; P1297-R1766 PolarHBondContact O-NE 3.47Å; P1297-R1766 PolarHBondContact O-NH1 3.37Å
1298	D	79.4	Confident	82	Confident	84 Å²	84	56.7 Å²	56.7	45%	0.449	30%	0.295	S	S	.	.	S	Bend	trans	-102.5	-24.6	177.3	-57.8	-26.4	0	0	0	111.4	A1304 K1305 R1766	D1298-A1304 VanDerWaalsContact CB-CA 3.49Å; D1298-A1304 HydrophobicContact CB-CB 3.64Å; D1298-K1305 VanDerWaalsContact OD2-CB 3.23Å; D1298-K1305 WeakPolarHBondContact OD2-CB 3.4Å; D1298-K1305 WeakPolarHBondContact OD2-CG 3.44Å; D1298-K1305 PolarHBondContact OD2-N 3.12Å; D1298-R1766 PolarHBondContact O-NH1 2.04Å
1299	G	81.3	Confident	82.2	Confident	13 Å²	13	51.3 Å²	51.3	13%	0.134	27%	0.27	C	S	.	.			trans	141.8	-167.7	180	0	0	0	0	0	109.5	C1296 A1304 R1766	C1296-G1299 WeakPolarHBondContact CB-O 3.5Å; G1299-A1304 WeakPolarHBondContact O-CB 3.24Å; G1299-R1766 VanDerWaalsContact CA-NH2 3.26Å
1300	T	86.5	Confident	82.4	Confident	31 Å²	31	51.2 Å²	51.2	19%	0.19	27%	0.272	C	S	.	.	S	Bend	trans	-106.6	-0.3	157.4	49.3	0	0	0	0	111.1	D1283 C1284 G1285 L1286 C1342 W1348	D1283-T1300 VanDerWaalsContact CG-OG1 3.3Å; D1283-T1300 WeakPolarHBondContact OD1-CB 3.49Å; D1283-T1300 PolarHBondContact OD1-OG1 2.95Å; D1283-T1300 PolarHBondContact OD2-OG1 2.81Å; C1284-T1300 PolarHBondContact N-O 2.82Å; G1285-T1300 VanDerWaalsContact C-CG2 3.44Å; G1285-T1300 VanDerWaalsContact O-CB 3.27Å; G1285-T1300 WeakPolarHBondContact O-CB 3.01Å; G1285-T1300 WeakPolarHBondContact O-CG2 3.43Å; L1286-T1300 HydrophobicContact CD2-CG2 4.18Å; L1286-T1300 HydrophobicContact CG-CG2 4.1Å; T1300-C1342 PolarHBondContact O-SG 3.17Å; T1300-W1348 HydrophobicContact CG2-CZ2 4.26Å
1301	K	85.4	Confident	82.5	Confident	73 Å²	73	50 Å²	50	32%	0.317	26%	0.261	S	S	.	.	B	Isolated β-bridge	trans	-81.2	167.2	-177.7	-59.6	-158.1	172.3	-148.9	0	113.5	P1281 I1282 D1283 A1303 A1304 C1342	P1281-K1301 HydrophobicContact CB-CB 4.21Å; P1281-K1301 HydrophobicContact CB-CD 4.42Å; P1281-K1301 HydrophobicContact CG-CB 4.38Å; P1281-K1301 HydrophobicContact CG-CD 3.87Å; I1282-K1301 CarbonylContact O-C 3.53Å; I1282-K1301 VanDerWaalsContact O-C 3.28Å; I1282-K1301 WeakPolarHBondContact O-CA 3.42Å; D1283-K1301 HydrophobicContact CB-CG 4.37Å; D1283-K1301 WeakPolarHBondContact OD2-CG 3.21Å; K1301-A1303 PolarHBondContact O-N 2.87Å; K1301-A1304 WeakPolarHBondContact O-CA 3.47Å; K1301-A1304 WeakPolarHBondContact O-CB 3.45Å; K1301-A1304 PolarHBondContact O-N 3.03Å; K1301-C1342 WeakPolarHBondContact O-CB 3.29Å; K1301-C1342 PolarHBondContact O-SG 3.43Å
1302	F	85.6	Confident	82	Confident	64 Å²	64	50.2 Å²	50.2	28%	0.281	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.8	137.9	-177.3	173.9	-116.3	0	0	0	113.5	S1244 G1245 Y1246 P1281 I1282 A1304 E1344	S1244-F1302 WeakPolarHBondContact O-CE1 3.47Å; G1245-F1302 VanDerWaalsContact CA-CD1 3.49Å; G1245-F1302 VanDerWaalsContact CA-CG 3.44Å; G1245-F1302 WeakPolarHBondContact O-CB 3.41Å; Y1246-F1302 HydrophobicContact CE2-CD1 4.37Å; P1281-F1302 HydrophobicContact CB-CB 4.15Å; I1282-F1302 PolarHBondContact O-N 2.99Å; F1302-A1304 PolarHBondContact O-N 2.03Å; F1302-E1344 HydrophobicContact CD2-CB 4.05Å; F1302-E1344 HydrophobicContact CE2-CB 3.5Å; F1302-E1344 VanDerWaalsContact CE2-CB 3.5Å; F1302-E1344 HydrophobicContact CZ-CB 4.14Å
1303	A	83.9	Confident	81.3	Confident	54 Å²	54	50.7 Å²	50.7	45%	0.446	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	-0.7	-173.8	0	0	0	0	0	115.7	K1301 C1342	K1301-A1303 PolarHBondContact O-N 2.87Å; A1303-C1342 PolarHBondContact N-O 2.64Å
1304	A	85.6	Confident	80.9	Confident	4 Å²	4	46.8 Å²	46.8	3%	0.033	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-64.4	140.3	172.4	0	0	0	0	0	111.3	D1298 G1299 K1301 F1302 V1341 C1342 W1348	D1298-A1304 VanDerWaalsContact CB-CA 3.49Å; D1298-A1304 HydrophobicContact CB-CB 3.64Å; G1299-A1304 WeakPolarHBondContact O-CB 3.24Å; K1301-A1304 WeakPolarHBondContact O-CA 3.47Å; K1301-A1304 WeakPolarHBondContact O-CB 3.45Å; K1301-A1304 PolarHBondContact O-N 3.03Å; F1302-A1304 PolarHBondContact O-N 2.03Å; A1304-V1341 WeakPolarHBondContact O-CA 3.18Å; A1304-C1342 PolarHBondContact O-N 3.21Å; A1304-W1348 HydrophobicContact CB-CH2 4.38Å; A1304-W1348 WeakPolarHBondContact O-CZ3 3.22Å
1305	K	84.8	Confident	80.3	Confident	82 Å²	82	46.2 Å²	46.2	36%	0.357	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	133.7	170	-50.5	-177.5	179.3	175.7	0	110.3	P1297 D1298 Y1307 I1340 V1341	P1297-K1305 WeakPolarHBondContact CD-O 3.49Å; D1298-K1305 VanDerWaalsContact OD2-CB 3.23Å; D1298-K1305 WeakPolarHBondContact OD2-CB 3.4Å; D1298-K1305 WeakPolarHBondContact OD2-CG 3.44Å; D1298-K1305 PolarHBondContact OD2-N 3.12Å; K1305-Y1307 HydrophobicContact CB-CE2 3.9Å; K1305-I1340 CarbonylContact C-O 3.5Å; K1305-I1340 VanDerWaalsContact CA-O 3.3Å; K1305-I1340 WeakPolarHBondContact CA-O 3.34Å; K1305-V1341 HydrophobicContact CG-CG1 4.38Å; K1305-V1341 HydrophobicContact CG-CG2 4.17Å
1306	C	85.4	Confident	79.9	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	140.7	159.2	-69	0	0	0	0	109.1	P1287 C1296 N1339 I1340 W1348	P1287-C1306 VanDerWaalsContact CD-SG 3.57Å; P1287-C1306 HydrophobicContact CG-CB 3.87Å; P1287-C1306 VanDerWaalsContact CG-SG 3.59Å; C1296-C1306 HydrophobicContact CB-CB 4.06Å; C1296-C1306 WeakPolarHBondContact CB-SG 3.34Å; C1296-C1306 WeakPolarHBondContact SG-CB 3.28Å; C1296-C1306 CovalentContact SG-SG 2.03Å; C1296-C1306 PolarHBondContact SG-SG 2.98Å; C1306-N1339 CarbonylContact O-C 3.53Å; C1306-N1339 WeakPolarHBondContact O-CA 3.49Å; C1306-I1340 HydrophobicContact CB-CD1 4.23Å; C1306-I1340 HydrophobicContact CB-CG1 3.87Å; C1306-I1340 PolarHBondContact N-O 3.11Å; C1306-I1340 WeakPolarHBondContact O-CG1 3.45Å; C1306-I1340 PolarHBondContact O-N 3.17Å; C1306-W1348 HydrophobicContact CB-CE3 4.35Å; C1306-W1348 HydrophobicContact CB-CH2 4.14Å; C1306-W1348 HydrophobicContact CB-CZ3 3.87Å; C1306-W1348 WeakPolarHBondContact SG-CH2 3.45Å; C1306-W1348 VanDerWaalsContact SG-CZ2 3.52Å; C1306-W1348 VanDerWaalsContact SG-CZ3 3.51Å
1307	Y	85.9	Confident	79.2	Confident	74 Å²	74	48.9 Å²	48.9	29%	0.29	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.9	172.2	-59.8	-94.4	0	0	0	107.5	S1295 P1297 K1305 N1338 N1339	S1295-Y1307 WeakPolarHBondContact CA-O 3.49Å; S1295-Y1307 WeakPolarHBondContact CB-O 3.5Å; S1295-Y1307 PolarHBondContact N-O 3.41Å; S1295-Y1307 PolarHBondContact O-N 3.3Å; P1297-Y1307 HydrophobicContact CG-CD2 3.71Å; P1297-Y1307 HydrophobicContact CG-CE2 3.65Å; K1305-Y1307 HydrophobicContact CB-CE2 3.9Å; Y1307-N1338 WeakPolarHBondContact CA-O 3.33Å; Y1307-N1339 HydrophobicContact CD1-CB 3.74Å; Y1307-N1339 HydrophobicContact CE1-CB 3.56Å
1308	F	83.2	Confident	78.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	141.6	175.5	62	-83.6	0	0	0	110.3	I1289 A1292 L1294 M1316 N1338 I1340 P1351 A1353	I1289-F1308 HydrophobicContact CD1-CB 3.84Å; I1289-F1308 HydrophobicContact CD1-CD1 3.32Å; I1289-F1308 HydrophobicContact CD1-CD2 4.21Å; I1289-F1308 HydrophobicContact CD1-CE1 3.89Å; I1289-F1308 HydrophobicContact CD1-CG 3.52Å; I1289-F1308 HydrophobicContact CG2-CD2 4.02Å; I1289-F1308 HydrophobicContact CG2-CG 4.26Å; A1292-F1308 HydrophobicContact CB-CB 3.97Å; A1292-F1308 HydrophobicContact CB-CD2 4.08Å; A1292-F1308 HydrophobicContact CB-CG 4.47Å; L1294-F1308 HydrophobicContact CD2-CB 4.27Å; L1294-F1308 HydrophobicContact CG-CB 4.11Å; F1308-M1316 HydrophobicContact CD2-CE 4.09Å; F1308-M1316 HydrophobicContact CE2-CE 3.93Å; F1308-M1316 VanDerWaalsContact O-CE 3.29Å; F1308-M1316 WeakPolarHBondContact O-CE 3.42Å; F1308-N1338 HydrophobicContact CD1-CB 4.46Å; F1308-N1338 WeakPolarHBondContact CD1-O 3.17Å; F1308-N1338 VanDerWaalsContact CE1-C 3.48Å; F1308-N1338 HydrophobicContact CE1-CB 4.12Å; F1308-N1338 WeakPolarHBondContact CE1-O 3.07Å; F1308-N1338 HydrophobicContact CE2-CB 4.38Å; F1308-N1338 HydrophobicContact CZ-CB 4.07Å; F1308-N1338 PolarHBondContact N-O 3.31Å; F1308-N1338 VanDerWaalsContact N-O 3.16Å; F1308-N1338 PolarHBondContact O-ND2 3.04Å; F1308-I1340 HydrophobicContact CE1-CG2 4.43Å; F1308-P1351 HydrophobicContact CD1-CB 4.33Å; F1308-P1351 HydrophobicContact CE1-CB 3.42Å; F1308-P1351 VanDerWaalsContact CE1-CB 3.42Å; F1308-P1351 HydrophobicContact CZ-CB 3.64Å; F1308-A1353 HydrophobicContact CE2-CB 4.09Å; F1308-A1353 VanDerWaalsContact CE2-O 3.32Å; F1308-A1353 WeakPolarHBondContact CE2-O 3.43Å; F1308-A1353 HydrophobicContact CZ-CB 3.76Å; F1308-A1353 WeakPolarHBondContact CZ-O 3.45Å
1309	H	80.8	Confident	76.6	Confident	76 Å²	76	50.4 Å²	50.4	35%	0.352	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	124.8	176.4	-62.5	-69.5	0	0	0	108.7	A1292 K1293 V1311	A1292-H1309 CarbonylContact C-O 3.55Å; A1292-H1309 WeakPolarHBondContact CA-O 3.19Å; K1293-H1309 PolarHBondContact N-O 3.07Å; K1293-H1309 PolarHBondContact O-N 3.44Å; H1309-V1311 PolarHBondContact O-N 3.13Å
1310	C	79.7	Confident	74.9	Confident	28 Å²	28	55.1 Å²	55.1	19%	0.189	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	134.6	180	-54.9	0	0	0	0	111.6	R1291 Y1312 A1314 M1316 C1355	R1291-C1310 WeakPolarHBondContact O-CA 3.48Å; C1310-Y1312 PolarHBondContact O-N 3.08Å; C1310-A1314 HydrophobicContact CB-CB 4.12Å; C1310-A1314 WeakPolarHBondContact CB-O 3.3Å; C1310-M1316 VanDerWaalsContact SG-CA 3.52Å; C1310-C1355 WeakPolarHBondContact CA-SG 3.45Å; C1310-C1355 HydrophobicContact CB-CB 3.65Å; C1310-C1355 WeakPolarHBondContact CB-SG 3.27Å; C1310-C1355 WeakPolarHBondContact SG-CA 3.34Å; C1310-C1355 WeakPolarHBondContact SG-CB 3.48Å; C1310-C1355 CovalentContact SG-SG 2.04Å; C1310-C1355 PolarHBondContact SG-SG 3.12Å
1311	V	75.6	Confident	72.5	Confident	73 Å²	73	58.4 Å²	58.4	44%	0.442	31%	0.313	S	S	.	.			trans	-80.3	113.4	174.9	-178.7	0	0	0	0	106.6	R1291 K1293 H1309 A1314	R1291-V1311 PolarHBondContact O-N 3.11Å; K1293-V1311 HydrophobicContact CB-CG2 4.07Å; H1309-V1311 PolarHBondContact O-N 3.13Å; V1311-A1314 WeakPolarHBondContact O-CA 3.47Å; V1311-A1314 VanDerWaalsContact O-CB 3.26Å; V1311-A1314 WeakPolarHBondContact O-CB 3.3Å; V1311-A1314 PolarHBondContact O-N 3.38Å
1312	Y	66.2	Low	69.9	Low	144 Å²	144	63.5 Å²	63.5	57%	0.565	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	133.9	174.4	175.6	-87.2	0	0	0	110.6	C1310 S1360	C1310-Y1312 PolarHBondContact O-N 3.08Å; Y1312-S1360 WeakPolarHBondContact OH-CB 3.42Å
1313	P	66.1	Low	67.4	Low	24 Å²	24	71.1 Å²	71.1	16%	0.156	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	cis	-91.2	23	11	35.1	-34.4	0	0	0	115.6	L1357 S1358 T1423 G1424 T1425	P1313-L1357 HydrophobicContact CG-CD2 3.94Å; P1313-S1358 PolarHBondContact O-N 2.94Å; P1313-T1423 WeakPolarHBondContact CG-O 3.06Å; P1313-G1424 WeakPolarHBondContact CB-O 3.35Å; P1313-G1424 WeakPolarHBondContact CG-O 3.18Å; P1313-T1425 HydrophobicContact CG-CG2 4.36Å
1314	A	72.2	Confident	64.9	Low	6 Å²	6	77.8 Å²	77.8	5%	0.05	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	133.8	165.5	0	0	0	0	0	111.3	R1291 C1310 V1311 C1355 Q1356 L1357	R1291-A1314 HydrophobicContact CB-CB 3.89Å; C1310-A1314 HydrophobicContact CB-CB 4.12Å; C1310-A1314 WeakPolarHBondContact CB-O 3.3Å; V1311-A1314 WeakPolarHBondContact O-CA 3.47Å; V1311-A1314 VanDerWaalsContact O-CB 3.26Å; V1311-A1314 WeakPolarHBondContact O-CB 3.3Å; V1311-A1314 PolarHBondContact O-N 3.38Å; A1314-C1355 HydrophobicContact CB-CB 3.91Å; A1314-Q1356 CarbonylContact C-O 3.58Å; A1314-Q1356 WeakPolarHBondContact CA-O 2.99Å; A1314-L1357 HydrophobicContact CB-CD2 4.43Å
1315	V	70.9	Confident	62.3	Low	35 Å²	35	84.4 Å²	84.4	21%	0.212	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	146.2	177	178.8	0	0	0	0	108.7	Q1356 S1358	V1315-Q1356 PolarHBondContact N-O 3.13Å; V1315-Q1356 PolarHBondContact O-N 3.44Å; V1315-S1358 WeakPolarHBondContact CB-OG 3.49Å; V1315-S1358 WeakPolarHBondContact CG2-OG 3.27Å
1316	M	73.5	Confident	59.9	Low	47 Å²	47	85.7 Å²	85.7	23%	0.232	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	132.2	-176.2	-168.3	167.7	-74.8	0	0	111.6	F1308 C1310 V1336 N1338 A1353 Y1354	F1308-M1316 HydrophobicContact CD2-CE 4.09Å; F1308-M1316 HydrophobicContact CE2-CE 3.93Å; F1308-M1316 VanDerWaalsContact O-CE 3.29Å; F1308-M1316 WeakPolarHBondContact O-CE 3.42Å; C1310-M1316 VanDerWaalsContact SG-CA 3.52Å; M1316-V1336 HydrophobicContact CG-CB 4.42Å; M1316-V1336 HydrophobicContact SD-CB 4.36Å; M1316-N1338 HydrophobicContact CE-CB 3.52Å; M1316-N1338 HydrophobicContact SD-CB 3.59Å; M1316-N1338 VanDerWaalsContact SD-CB 3.59Å; M1316-A1353 HydrophobicContact CG-CB 3.74Å; M1316-A1353 HydrophobicContact SD-CB 4.01Å; M1316-Y1354 WeakPolarHBondContact CA-O 3.26Å
1317	K	69.9	Low	57.3	Low	82 Å²	82	91.7 Å²	91.7	36%	0.357	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	152.6	174.1	-65.7	-71.3	-174.8	176.1	0	108.3	A1353 Y1354 Q1356	K1317-A1353 CarbonylContact O-C 3.54Å; K1317-A1353 WeakPolarHBondContact O-CA 3.15Å; K1317-A1353 WeakPolarHBondContact O-CB 3.32Å; K1317-Y1354 HydrophobicContact CB-CD1 4.17Å; K1317-Y1354 HydrophobicContact CB-CD2 4.12Å; K1317-Y1354 HydrophobicContact CB-CE1 3.66Å; K1317-Y1354 HydrophobicContact CB-CE2 3.61Å; K1317-Y1354 HydrophobicContact CB-CG 4.38Å; K1317-Y1354 HydrophobicContact CG-CE2 4.21Å; K1317-Y1354 PolarHBondContact N-O 3.26Å; K1317-Y1354 WeakPolarHBondContact O-CD1 3.35Å; K1317-Y1354 PolarHBondContact O-N 3.34Å; K1317-Q1356 VanDerWaalsContact CE-OE1 3.25Å; K1317-Q1356 HydrophobicContact CG-CB 3.8Å
1318	G	58	Low	55.2	Low	25 Å²	25	96.2 Å²	96.2	26%	0.258	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	169.6	153.4	179.4	0	0	0	0	0	109.9	E1352	G1318-E1352 WeakPolarHBondContact CA-O 3.39Å
1319	T	48.5	Very low	53	Low	124 Å²	124	104.6 Å²	104.6	76%	0.761	55%	0.552	S	S	*	*			trans	-76	128	179.5	30.2	0	0	0	0	110	S1321	T1319-S1321 PolarHBondContact O-N 2.88Å
1320	I	45.8	Very low	50.5	Low	111 Å²	111	106.1 Å²	106.1	57%	0.569	57%	0.571	S	S	*	*			trans	-67.3	128.9	165.3	-63	171.3	0	0	0	106.6	E1322	I1320-E1322 HydrophobicContact CB-CG 4.47Å; I1320-E1322 HydrophobicContact CG2-CG 4.05Å; I1320-E1322 PolarHBondContact O-N 3.39Å
1321	S	35	Very low	48.2	Very low	101 Å²	101	111.1 Å²	111.1	71%	0.706	60%	0.595	S	S	*	*			trans	-72.7	81.5	169.4	64	0	0	0	0	109.3	T1319 R1323	T1319-S1321 PolarHBondContact O-N 2.88Å; S1321-R1323 VanDerWaalsContact C-N 3.33Å; S1321-R1323 PolarHBondContact O-N 3.42Å
1322	E	31.9	Very low	46.1	Very low	179 Å²	179	116.8 Å²	116.8	84%	0.836	61%	0.614	S	S	*	*			trans	-67.3	89.9	173.6	-70.8	-170.1	168	0	0	110.2	I1320	I1320-E1322 HydrophobicContact CB-CG 4.47Å; I1320-E1322 HydrophobicContact CG2-CG 4.05Å; I1320-E1322 PolarHBondContact O-N 3.39Å
1323	R	32.7	Very low	44.4	Very low	225 Å²	225	115 Å²	115	85%	0.849	62%	0.618	S	S	*	*			trans	-123.1	105.7	161.1	-124.2	-174.5	-79.5	-140.3	-0.8	108.3	S1321	S1321-R1323 VanDerWaalsContact C-N 3.33Å; S1321-R1323 PolarHBondContact O-N 3.42Å
1324	F	30.7	Very low	43.1	Very low	194 Å²	194	120.7 Å²	120.7	85%	0.851	65%	0.646	S	S	*	*	S	Bend	trans	58.3	91	171.9	-69.9	-97.5	0	0	0	118.2
1325	V	32	Very low	41.8	Very low	142 Å²	142	123.8 Å²	123.8	86%	0.861	68%	0.678	S	S	*	*				-151.7	127.8	123.2	-169	0	0	0	0	109.4
1326	P	33.7	Very low	41.2	Very low	109 Å²	109	124.4 Å²	124.4	71%	0.708	68%	0.682	S	S	*	*			trans	-74.7	162.8	175.2	29.5	-34.3	0	0	0	114
1327	P	30.8	Very low	40.9	Very low	126 Å²	126	124.9 Å²	124.9	82%	0.818	69%	0.686	S	S	*	*	S	Bend	trans	-79.7	127.8	-168.3	31	-35.3	0	0	0	113.4
1328	L	42.5	Very low	41.1	Very low	169 Å²	169	122.3 Å²	122.3	89%	0.885	68%	0.676	S	S	*	*			trans	-170.8	-11.4	153.4	-109.5	166.3	0	0	0	115.5
1329	L	36.4	Very low	42.3	Very low	177 Å²	177	123 Å²	123	93%	0.927	67%	0.673	S	S	*	*			trans	-115.3	105.5	177.3	-85.2	121.3	0	0	0	112.8
1330	S	28.4	Very low	44.1	Very low	108 Å²	108	117.2 Å²	117.2	76%	0.755	64%	0.638	S	S	*	*			trans	-83.4	124	163.5	50.2	0	0	0	0	109.8
1331	L	31	Very low	46	Very low	133 Å²	133	114 Å²	114	70%	0.696	62%	0.623	S	S	*	*			trans	177.8	-12.3	140.6	-121.1	78.2	0	0	0	115.5
1332	F	32.3	Very low	48.4	Very low	191 Å²	191	109.2 Å²	109.2	84%	0.838	59%	0.59	S	S	*	*			trans	-95.1	121.1	-174.9	-80.2	-89.1	0	0	0	113.7	L1334	F1332-L1334 PolarHBondContact O-N 2.88Å; F1332-L1334 VanDerWaalsContact O-N 3.17Å
1333	V	29.4	Very low	50.6	Low	108 Å²	108	102.1 Å²	102.1	66%	0.655	57%	0.565	S	S	*	*			trans	-74.2	99.8	172.6	180	0	0	0	0	109
1334	L	39.3	Very low	52.8	Low	143 Å²	143	94.9 Å²	94.9	75%	0.749	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-87.8	118.5	177.6	-65.5	170.5	0	0	0	109.6	F1332	F1332-L1334 PolarHBondContact O-N 2.88Å; F1332-L1334 VanDerWaalsContact O-N 3.17Å
1335	G	45.4	Very low	54.7	Low	70 Å²	70	92.5 Å²	92.5	72%	0.722	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-81.8	146.3	-168.8	0	0	0	0	0	114.5
1336	V	58.6	Low	56.8	Low	49 Å²	49	86.6 Å²	86.6	30%	0.297	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-63.8	134.1	171.3	-153.3	0	0	0	0	109.7	M1316 N1338 A1353	M1316-V1336 HydrophobicContact CG-CB 4.42Å; M1316-V1336 HydrophobicContact SD-CB 4.36Å; V1336-N1338 PolarHBondContact O-N 3.46Å; V1336-A1353 HydrophobicContact CB-CB 4.41Å; V1336-A1353 HydrophobicContact CG1-CB 3.69Å
1337	N	66.3	Low	58.9	Low	56 Å²	56	86.1 Å²	86.1	30%	0.299	50%	0.495	S	S	.	.			trans	-76.6	108.4	-175.1	-172.7	18.3	0	0	0	111.5	N1339 E1352	N1337-N1339 VanDerWaalsContact OD1-CG 3.31Å; N1337-N1339 PolarHBondContact OD1-N 3.09Å; N1337-N1339 PolarHBondContact OD1-ND2 3Å; N1337-E1352 HydrophobicContact CB-CB 4.29Å; N1337-E1352 WeakPolarHBondContact CB-OE2 3.48Å; N1337-E1352 PolarHBondContact ND2-OE2 3.04Å
1338	N	75.4	Confident	61.3	Low	29 Å²	29	81.9 Å²	81.9	16%	0.155	46%	0.462	C	S	.	.			trans	-105.5	16	-177.8	77.7	-39.1	0	0	0	113.5	Y1307 F1308 M1316 V1336	Y1307-N1338 WeakPolarHBondContact CA-O 3.33Å; F1308-N1338 HydrophobicContact CD1-CB 4.46Å; F1308-N1338 WeakPolarHBondContact CD1-O 3.17Å; F1308-N1338 VanDerWaalsContact CE1-C 3.48Å; F1308-N1338 HydrophobicContact CE1-CB 4.12Å; F1308-N1338 WeakPolarHBondContact CE1-O 3.07Å; F1308-N1338 HydrophobicContact CE2-CB 4.38Å; F1308-N1338 HydrophobicContact CZ-CB 4.07Å; F1308-N1338 PolarHBondContact N-O 3.31Å; F1308-N1338 VanDerWaalsContact N-O 3.16Å; F1308-N1338 PolarHBondContact O-ND2 3.04Å; M1316-N1338 HydrophobicContact CE-CB 3.52Å; M1316-N1338 HydrophobicContact SD-CB 3.59Å; M1316-N1338 VanDerWaalsContact SD-CB 3.59Å; V1336-N1338 PolarHBondContact O-N 3.46Å
1339	N	82.5	Confident	63.1	Low	38 Å²	38	76.2 Å²	76.2	20%	0.203	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	146.2	177.2	89.3	64.6	0	0	0	111	C1306 Y1307 N1337	C1306-N1339 CarbonylContact O-C 3.53Å; C1306-N1339 WeakPolarHBondContact O-CA 3.49Å; Y1307-N1339 HydrophobicContact CD1-CB 3.74Å; Y1307-N1339 HydrophobicContact CE1-CB 3.56Å; N1337-N1339 VanDerWaalsContact OD1-CG 3.31Å; N1337-N1339 PolarHBondContact OD1-N 3.09Å; N1337-N1339 PolarHBondContact OD1-ND2 3Å
1340	I	86.2	Confident	64.9	Low	3 Å²	3	73.8 Å²	73.8	2%	0.015	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	144.6	167.5	51.7	168.1	0	0	0	108.3	P1287 I1289 L1294 K1305 C1306 F1308 W1348 S1349 P1351	P1287-I1340 HydrophobicContact CB-CD1 3.45Å; P1287-I1340 VanDerWaalsContact CB-CD1 3.45Å; P1287-I1340 HydrophobicContact CG-CD1 3.37Å; P1287-I1340 HydrophobicContact CG-CG1 4.41Å; I1289-I1340 HydrophobicContact CD1-CD1 3.89Å; L1294-I1340 HydrophobicContact CD2-CD1 4.49Å; K1305-I1340 CarbonylContact C-O 3.5Å; K1305-I1340 VanDerWaalsContact CA-O 3.3Å; K1305-I1340 WeakPolarHBondContact CA-O 3.34Å; C1306-I1340 HydrophobicContact CB-CD1 4.23Å; C1306-I1340 HydrophobicContact CB-CG1 3.87Å; C1306-I1340 PolarHBondContact N-O 3.11Å; C1306-I1340 WeakPolarHBondContact O-CG1 3.45Å; C1306-I1340 PolarHBondContact O-N 3.17Å; F1308-I1340 HydrophobicContact CE1-CG2 4.43Å; I1340-W1348 HydrophobicContact CB-CE3 4.4Å; I1340-W1348 HydrophobicContact CD1-CB 4.2Å; I1340-W1348 HydrophobicContact CD1-CD2 4.3Å; I1340-W1348 HydrophobicContact CD1-CE3 4.14Å; I1340-W1348 HydrophobicContact CD1-CG 4.31Å; I1340-W1348 HydrophobicContact CG1-CE3 4.04Å; I1340-S1349 VanDerWaalsContact CA-OG 3.3Å; I1340-S1349 WeakPolarHBondContact CA-OG 3.29Å; I1340-S1349 WeakPolarHBondContact CB-O 3.3Å; I1340-S1349 WeakPolarHBondContact CG2-O 3.27Å; I1340-P1351 VanDerWaalsContact CG2-CA 3.48Å; I1340-P1351 HydrophobicContact CG2-CB 3.65Å; I1340-P1351 HydrophobicContact CG2-CG 4.46Å
1341	V	86	Confident	67	Low	43 Å²	43	71 Å²	71	26%	0.261	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	136.4	-169.8	-165.8	0	0	0	0	110.1	A1304 K1305 G1343 W1348 S1349	A1304-V1341 WeakPolarHBondContact O-CA 3.18Å; K1305-V1341 HydrophobicContact CG-CG1 4.38Å; K1305-V1341 HydrophobicContact CG-CG2 4.17Å; V1341-G1343 PolarHBondContact O-N 3.15Å; V1341-W1348 VanDerWaalsContact C-CE3 3.45Å; V1341-W1348 CarbonylContact O-C 3.57Å; V1341-W1348 WeakPolarHBondContact O-CA 3.34Å; V1341-S1349 PolarHBondContact N-OG 2.98Å; V1341-S1349 PolarHBondContact O-N 3.36Å
1342	C	86	Confident	68.8	Low	1 Å²	1	69.4 Å²	69.4	1%	0.007	40%	0.398	C	S	.	.	B	Isolated β-bridge	trans	-72.1	109	173.8	175.5	0	0	0	0	109.9	C1284 T1300 K1301 A1303 A1304 W1348	C1284-C1342 HydrophobicContact CB-CB 3.78Å; C1284-C1342 WeakPolarHBondContact CB-SG 3.46Å; C1284-C1342 WeakPolarHBondContact SG-CA 3.5Å; C1284-C1342 WeakPolarHBondContact SG-CB 3.48Å; C1284-C1342 CovalentContact SG-SG 2.02Å; C1284-C1342 PolarHBondContact SG-SG 3.35Å; T1300-C1342 PolarHBondContact O-SG 3.17Å; K1301-C1342 WeakPolarHBondContact O-CB 3.29Å; K1301-C1342 PolarHBondContact O-SG 3.43Å; A1303-C1342 PolarHBondContact N-O 2.64Å; A1304-C1342 PolarHBondContact O-N 3.21Å; C1342-W1348 HydrophobicContact CB-CD2 4.42Å; C1342-W1348 HydrophobicContact CB-CE3 4.12Å; C1342-W1348 HydrophobicContact CB-CH2 3.75Å; C1342-W1348 HydrophobicContact CB-CZ2 4.11Å; C1342-W1348 HydrophobicContact CB-CZ3 3.79Å; C1342-W1348 VanDerWaalsContact N-CZ3 3.3Å
1343	G	77.6	Confident	70.7	Confident	30 Å²	30	60.5 Å²	60.5	31%	0.309	36%	0.359	S	S	.	.			trans	-74.7	167.4	-179.6	0	0	0	0	0	113.4	V1341 H1345 G1346 V1347	V1341-G1343 PolarHBondContact O-N 3.15Å; G1343-H1345 PolarHBondContact O-N 2.81Å; G1343-G1346 PolarHBondContact O-N 3.47Å; G1343-V1347 PolarHBondContact N-O 2.03Å
1344	E	78.9	Confident	72.9	Confident	73 Å²	73	61.8 Å²	61.8	34%	0.341	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	5.4	-173.5	70.1	173.6	134.6	0	0	116	S1244 R1261 I1282 F1302	S1244-E1344 WeakPolarHBondContact CB-OE2 3.39Å; S1244-E1344 PolarHBondContact OG-OE2 3.26Å; R1261-E1344 IonicContact CZ-OE2 3.99Å; R1261-E1344 IonicContact NH1-OE2 3.89Å; R1261-E1344 PolarHBondContact NH2-O 3.37Å; R1261-E1344 IonicContact NH2-OE2 3.18Å; R1261-E1344 PolarHBondContact NH2-OE2 3.17Å; I1282-E1344 VanDerWaalsContact CD1-O 3.28Å; I1282-E1344 WeakPolarHBondContact CD1-O 3.44Å; F1302-E1344 HydrophobicContact CD2-CB 4.05Å; F1302-E1344 HydrophobicContact CE2-CB 3.5Å; F1302-E1344 VanDerWaalsContact CE2-CB 3.5Å; F1302-E1344 HydrophobicContact CZ-CB 4.14Å
1345	H	71	Confident	74.9	Confident	144 Å²	144	55.7 Å²	55.7	67%	0.667	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.1	8.3	-179.5	-56.9	-51	0	0	0	113.2	G1343	G1343-H1345 PolarHBondContact O-N 2.81Å
1346	G	74.4	Confident	76.3	Confident	19 Å²	19	56.4 Å²	56.4	20%	0.196	31%	0.307	C	S	.	.	S	Bend	trans	81	23.1	179.1	0	0	0	0	0	114.5	I1282 C1284 G1343	I1282-G1346 VanDerWaalsContact CG2-CA 3.5Å; C1284-G1346 WeakPolarHBondContact SG-CA 3.41Å; G1343-G1346 PolarHBondContact O-N 3.47Å
1347	V	77.9	Confident	77.2	Confident	99 Å²	99	55.1 Å²	55.1	60%	0.6	30%	0.298	S	S	*	.			trans	-123.9	139.9	178.6	-163.2	0	0	0	0	110	C1284 G1343	C1284-V1347 PolarHBondContact SG-N 2.8Å; G1343-V1347 PolarHBondContact N-O 2.03Å
1348	W	83	Confident	77.4	Confident	36 Å²	36	52.6 Å²	52.6	14%	0.136	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-74.6	143.8	173.6	-68.3	98.1	0	0	0	112	C1284 G1285 P1287 T1300 A1304 C1306 I1340 V1341 C1342	C1284-W1348 HydrophobicContact CB-CD2 4.11Å; C1284-W1348 VanDerWaalsContact CB-CE2 3.48Å; C1284-W1348 HydrophobicContact CB-CG 4.24Å; C1284-W1348 HydrophobicContact CB-CZ2 3.86Å; C1284-W1348 VanDerWaalsContact CB-NE1 3.28Å; C1284-W1348 PolarHBondContact O-NE1 2.87Å; G1285-W1348 VanDerWaalsContact O-CE2 3.3Å; G1285-W1348 WeakPolarHBondContact O-CZ2 3.49Å; G1285-W1348 PolarHBondContact O-NE1 2.93Å; P1287-W1348 HydrophobicContact CB-CB 4.45Å; P1287-W1348 HydrophobicContact CB-CD2 4.18Å; P1287-W1348 HydrophobicContact CB-CG 3.83Å; P1287-W1348 HydrophobicContact CG-CD2 3.63Å; P1287-W1348 HydrophobicContact CG-CE3 4.18Å; P1287-W1348 HydrophobicContact CG-CG 3.84Å; P1287-W1348 HydrophobicContact CG-CZ2 4.12Å; T1300-W1348 HydrophobicContact CG2-CZ2 4.26Å; A1304-W1348 HydrophobicContact CB-CH2 4.38Å; A1304-W1348 WeakPolarHBondContact O-CZ3 3.22Å; C1306-W1348 HydrophobicContact CB-CE3 4.35Å; C1306-W1348 HydrophobicContact CB-CH2 4.14Å; C1306-W1348 HydrophobicContact CB-CZ3 3.87Å; C1306-W1348 WeakPolarHBondContact SG-CH2 3.45Å; C1306-W1348 VanDerWaalsContact SG-CZ2 3.52Å; C1306-W1348 VanDerWaalsContact SG-CZ3 3.51Å; I1340-W1348 HydrophobicContact CB-CE3 4.4Å; I1340-W1348 HydrophobicContact CD1-CB 4.2Å; I1340-W1348 HydrophobicContact CD1-CD2 4.3Å; I1340-W1348 HydrophobicContact CD1-CE3 4.14Å; I1340-W1348 HydrophobicContact CD1-CG 4.31Å; I1340-W1348 HydrophobicContact CG1-CE3 4.04Å; V1341-W1348 VanDerWaalsContact C-CE3 3.45Å; V1341-W1348 CarbonylContact O-C 3.57Å; V1341-W1348 WeakPolarHBondContact O-CA 3.34Å; C1342-W1348 HydrophobicContact CB-CD2 4.42Å; C1342-W1348 HydrophobicContact CB-CE3 4.12Å; C1342-W1348 HydrophobicContact CB-CH2 3.75Å; C1342-W1348 HydrophobicContact CB-CZ2 4.11Å; C1342-W1348 HydrophobicContact CB-CZ3 3.79Å; C1342-W1348 VanDerWaalsContact N-CZ3 3.3Å
1349	S	80.1	Confident	77.4	Confident	50 Å²	50	51.3 Å²	51.3	35%	0.35	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-62.3	152.8	169.5	71.7	0	0	0	0	111.6	I1340 V1341	I1340-S1349 VanDerWaalsContact CA-OG 3.3Å; I1340-S1349 WeakPolarHBondContact CA-OG 3.29Å; I1340-S1349 WeakPolarHBondContact CB-O 3.3Å; I1340-S1349 WeakPolarHBondContact CG2-O 3.27Å; V1341-S1349 PolarHBondContact N-OG 2.98Å; V1341-S1349 PolarHBondContact O-N 3.36Å
1350	V	73.5	Confident	76.7	Confident	127 Å²	127	49.8 Å²	49.8	77%	0.77	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-64.6	135.4	177.4	-174.2	0	0	0	0	109.8
1351	P	72.7	Confident	75.7	Confident	49 Å²	49	51.8 Å²	51.8	32%	0.318	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-74.9	128.6	177.3	29	-34.1	0	0	0	112	I1289 F1308 I1340 A1353	I1289-P1351 HydrophobicContact CD1-CB 4.09Å; I1289-P1351 HydrophobicContact CD1-CG 4.11Å; F1308-P1351 HydrophobicContact CD1-CB 4.33Å; F1308-P1351 HydrophobicContact CE1-CB 3.42Å; F1308-P1351 VanDerWaalsContact CE1-CB 3.42Å; F1308-P1351 HydrophobicContact CZ-CB 3.64Å; I1340-P1351 VanDerWaalsContact CG2-CA 3.48Å; I1340-P1351 HydrophobicContact CG2-CB 3.65Å; I1340-P1351 HydrophobicContact CG2-CG 4.46Å; P1351-A1353 PolarHBondContact O-N 2.75Å
1352	E	69.6	Low	74.7	Confident	100 Å²	100	53.2 Å²	53.2	47%	0.467	29%	0.289	S	S	.	.	S	Bend	trans	-74.8	-7.3	175.4	-66.2	-178.5	159.6	0	0	113.4	G1318 N1337	G1318-E1352 WeakPolarHBondContact CA-O 3.39Å; N1337-E1352 HydrophobicContact CB-CB 4.29Å; N1337-E1352 WeakPolarHBondContact CB-OE2 3.48Å; N1337-E1352 PolarHBondContact ND2-OE2 3.04Å
1353	A	71.3	Confident	73.9	Confident	3 Å²	3	53.2 Å²	53.2	3%	0.025	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	157.6	175.6	0	0	0	0	0	112.4	F1308 M1316 K1317 V1336 P1351	F1308-A1353 HydrophobicContact CE2-CB 4.09Å; F1308-A1353 VanDerWaalsContact CE2-O 3.32Å; F1308-A1353 WeakPolarHBondContact CE2-O 3.43Å; F1308-A1353 HydrophobicContact CZ-CB 3.76Å; F1308-A1353 WeakPolarHBondContact CZ-O 3.45Å; M1316-A1353 HydrophobicContact CG-CB 3.74Å; M1316-A1353 HydrophobicContact SD-CB 4.01Å; K1317-A1353 CarbonylContact O-C 3.54Å; K1317-A1353 WeakPolarHBondContact O-CA 3.15Å; K1317-A1353 WeakPolarHBondContact O-CB 3.32Å; V1336-A1353 HydrophobicContact CB-CB 4.41Å; V1336-A1353 HydrophobicContact CG1-CB 3.69Å; P1351-A1353 PolarHBondContact O-N 2.75Å
1354	Y	74.8	Confident	73.5	Confident	136 Å²	136	54.8 Å²	54.8	53%	0.533	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	168	179.2	63.9	-83.4	0	0	0	110.6	M1316 K1317 Q1356	M1316-Y1354 WeakPolarHBondContact CA-O 3.26Å; K1317-Y1354 HydrophobicContact CB-CD1 4.17Å; K1317-Y1354 HydrophobicContact CB-CD2 4.12Å; K1317-Y1354 HydrophobicContact CB-CE1 3.66Å; K1317-Y1354 HydrophobicContact CB-CE2 3.61Å; K1317-Y1354 HydrophobicContact CB-CG 4.38Å; K1317-Y1354 HydrophobicContact CG-CE2 4.21Å; K1317-Y1354 PolarHBondContact N-O 3.26Å; K1317-Y1354 WeakPolarHBondContact O-CD1 3.35Å; K1317-Y1354 PolarHBondContact O-N 3.34Å; Y1354-Q1356 HydrophobicContact CE2-CB 4.25Å
1355	C	81.3	Confident	73	Confident	14 Å²	14	60.6 Å²	60.6	10%	0.095	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	101.2	-171.3	-67.2	0	0	0	0	111.9	R1291 C1310 A1314	R1291-C1355 HydrophobicContact CB-CB 4.15Å; C1310-C1355 WeakPolarHBondContact CA-SG 3.45Å; C1310-C1355 HydrophobicContact CB-CB 3.65Å; C1310-C1355 WeakPolarHBondContact CB-SG 3.27Å; C1310-C1355 WeakPolarHBondContact SG-CA 3.34Å; C1310-C1355 WeakPolarHBondContact SG-CB 3.48Å; C1310-C1355 CovalentContact SG-SG 2.04Å; C1310-C1355 PolarHBondContact SG-SG 3.12Å; A1314-C1355 HydrophobicContact CB-CB 3.91Å
1356	Q	75.9	Confident	72.7	Confident	86 Å²	86	58 Å²	58	40%	0.402	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	129.8	-178.2	-171.5	-178.6	15.2	0	0	111.6	A1314 V1315 K1317 Y1354 S1358	A1314-Q1356 CarbonylContact C-O 3.58Å; A1314-Q1356 WeakPolarHBondContact CA-O 2.99Å; V1315-Q1356 PolarHBondContact N-O 3.13Å; V1315-Q1356 PolarHBondContact O-N 3.44Å; K1317-Q1356 VanDerWaalsContact CE-OE1 3.25Å; K1317-Q1356 HydrophobicContact CG-CB 3.8Å; Y1354-Q1356 HydrophobicContact CE2-CB 4.25Å; Q1356-S1358 PolarHBondContact O-N 2.83Å
1357	L	76.7	Confident	72.7	Confident	21 Å²	21	57.3 Å²	57.3	11%	0.11	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	133	172.8	-78.1	-178.2	0	0	0	112.4	P1313 A1314 V1392 S1422 T1423	P1313-L1357 HydrophobicContact CG-CD2 3.94Å; A1314-L1357 HydrophobicContact CB-CD2 4.43Å; L1357-V1392 HydrophobicContact CB-CG2 4.18Å; L1357-S1422 WeakPolarHBondContact CD1-O 3.43Å; L1357-T1423 WeakPolarHBondContact CD2-O 3.33Å
1358	S	70.6	Confident	72.8	Confident	4 Å²	4	55.1 Å²	55.1	3%	0.028	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	144	173.9	46.5	0	0	0	0	111.4	P1313 V1315 Q1356 S1389 F1390	P1313-S1358 PolarHBondContact O-N 2.94Å; V1315-S1358 WeakPolarHBondContact CB-OG 3.49Å; V1315-S1358 WeakPolarHBondContact CG2-OG 3.27Å; Q1356-S1358 PolarHBondContact O-N 2.83Å; S1358-S1389 VanDerWaalsContact OG-CB 3.29Å; S1358-S1389 WeakPolarHBondContact OG-CB 3.2Å; S1358-S1389 PolarHBondContact OG-OG 3.22Å; S1358-S1389 VanDerWaalsContact OG-OG 3.1Å; S1358-F1390 CarbonylContact C-O 3.37Å; S1358-F1390 WeakPolarHBondContact CA-O 3.48Å; S1358-F1390 WeakPolarHBondContact CB-O 3.46Å
1359	C	76.2	Confident	72.6	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.007	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	146.5	-176.3	-62.7	0	0	0	0	112.7	F1390 C1420 G1424 T1425 W1426	C1359-F1390 HydrophobicContact CB-CB 4.43Å; C1359-F1390 PolarHBondContact N-O 3.44Å; C1359-F1390 PolarHBondContact O-N 2.89Å; C1359-C1420 HydrophobicContact CB-CB 3.81Å; C1359-C1420 WeakPolarHBondContact CB-SG 3.5Å; C1359-C1420 WeakPolarHBondContact SG-CA 3.27Å; C1359-C1420 WeakPolarHBondContact SG-CB 3.4Å; C1359-C1420 CovalentContact SG-SG 2.02Å; C1359-C1420 PolarHBondContact SG-SG 3.24Å; C1359-G1424 WeakPolarHBondContact CA-O 3.09Å; C1359-G1424 PolarHBondContact SG-O 2.84Å; C1359-T1425 PolarHBondContact SG-O 3.48Å; C1359-T1425 VanDerWaalsContact SG-O 3.39Å; C1359-W1426 HydrophobicContact CB-CD2 4.03Å; C1359-W1426 HydrophobicContact CB-CG 4.14Å; C1359-W1426 HydrophobicContact CB-CZ2 4.08Å
1360	S	66.7	Low	72.7	Confident	7 Å²	7	58.5 Å²	58.5	5%	0.049	28%	0.278	C	S	.	.			trans	-47.4	134.1	177.4	171.3	0	0	0	0	112.8	Y1312 L1362 E1366 W1426	Y1312-S1360 WeakPolarHBondContact OH-CB 3.42Å; S1360-L1362 PolarHBondContact O-N 3.26Å; S1360-L1362 WeakPolarHBondContact OG-CB 3.18Å; S1360-L1362 PolarHBondContact OG-N 3.47Å; S1360-E1366 VanDerWaalsContact CB-OE1 3.25Å; S1360-E1366 WeakPolarHBondContact CB-OE1 3.16Å; S1360-E1366 PolarHBondContact OG-OE1 3.03Å; S1360-W1426 PolarHBondContact O-NE1 3.44Å
1361	P	65.6	Low	72.9	Confident	44 Å²	44	52.5 Å²	52.5	29%	0.286	24%	0.241	S	C	.	.	S	Bend	trans	-70.2	-16.3	171.2	31.8	-37.2	0	0	0	112.7	L1363 P1385 V1388 F1390	P1361-L1363 PolarHBondContact O-N 3.04Å; P1361-P1385 WeakPolarHBondContact CG-O 3.44Å; P1361-V1388 HydrophobicContact CB-CB 4.25Å; P1361-V1388 HydrophobicContact CB-CG1 4.36Å; P1361-V1388 VanDerWaalsContact CB-O 3.25Å; P1361-V1388 WeakPolarHBondContact CB-O 3.46Å; P1361-V1388 VanDerWaalsContact CD-O 3.31Å; P1361-V1388 WeakPolarHBondContact CD-O 3.49Å; P1361-V1388 WeakPolarHBondContact CG-O 3.47Å; P1361-F1390 HydrophobicContact CB-CE2 4.4Å
1362	L	66	Low	73.2	Confident	73 Å²	73	53.4 Å²	53.4	38%	0.382	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	26	-170.8	-58.5	174.8	0	0	0	113.6	S1360 E1364 R1365 E1366	S1360-L1362 PolarHBondContact O-N 3.26Å; S1360-L1362 WeakPolarHBondContact OG-CB 3.18Å; S1360-L1362 PolarHBondContact OG-N 3.47Å; L1362-E1364 VanDerWaalsContact C-N 3.3Å; L1362-E1364 PolarHBondContact O-N 3.28Å; L1362-R1365 HydrophobicContact CB-CB 4.4Å; L1362-R1365 WeakPolarHBondContact O-CA 2.96Å; L1362-R1365 PolarHBondContact O-N 2.9Å; L1362-E1366 HydrophobicContact CB-CG 4.21Å; L1362-E1366 PolarHBondContact O-N 2.83Å
1363	L	68.6	Low	73.4	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-54.7	-40.8	-172.9	-169	66	0	0	0	113	P1361 R1365 L1367 C1396 I1398 W1426	P1361-L1363 PolarHBondContact O-N 3.04Å; L1363-R1365 VanDerWaalsContact C-N 3.33Å; L1363-R1365 PolarHBondContact O-N 3.2Å; L1363-L1367 HydrophobicContact CD1-CD1 3.47Å; L1363-L1367 VanDerWaalsContact CD1-CD1 3.47Å; L1363-L1367 HydrophobicContact CD1-CG 4.28Å; L1363-L1367 HydrophobicContact CG-CD1 3.8Å; L1363-L1367 VanDerWaalsContact O-CB 3.25Å; L1363-L1367 WeakPolarHBondContact O-CB 3.42Å; L1363-L1367 VanDerWaalsContact O-CD1 3.29Å; L1363-L1367 WeakPolarHBondContact O-CD1 3.47Å; L1363-L1367 WeakPolarHBondContact O-CG 3.37Å; L1363-L1367 PolarHBondContact O-N 3.36Å; L1363-C1396 HydrophobicContact CD2-CB 3.38Å; L1363-I1398 HydrophobicContact CD2-CD1 3.71Å; L1363-I1398 HydrophobicContact CD2-CG1 4.11Å; L1363-I1398 HydrophobicContact CG-CD1 3.68Å; L1363-I1398 HydrophobicContact CG-CG1 4.21Å; L1363-W1426 HydrophobicContact CD1-CB 4.33Å; L1363-W1426 HydrophobicContact CD1-CD2 3.61Å; L1363-W1426 HydrophobicContact CD1-CE3 4.2Å; L1363-W1426 HydrophobicContact CD1-CG 3.66Å; L1363-W1426 HydrophobicContact CD1-CZ2 4.33Å; L1363-W1426 HydrophobicContact CD2-CD2 4.43Å; L1363-W1426 HydrophobicContact CD2-CE3 4.48Å; L1363-W1426 HydrophobicContact CD2-CH2 4.06Å; L1363-W1426 HydrophobicContact CD2-CZ2 3.94Å; L1363-W1426 HydrophobicContact CD2-CZ3 4.31Å
1364	E	68.6	Low	73.3	Confident	64 Å²	64	59.5 Å²	59.5	30%	0.299	27%	0.272	S	S	.	.	H	α-helix	trans	-66.3	-33.6	174.6	-62.9	-157.3	157.3	0	0	113.2	L1362 G1369 R1370 A1371	L1362-E1364 VanDerWaalsContact C-N 3.3Å; L1362-E1364 PolarHBondContact O-N 3.28Å; E1364-G1369 CarbonylContact C-O 3.49Å; E1364-G1369 WeakPolarHBondContact CA-O 3.31Å; E1364-G1369 WeakPolarHBondContact CB-O 3.44Å; E1364-G1369 PolarHBondContact O-N 3.3Å; E1364-R1370 WeakPolarHBondContact OE1-CA 3.38Å; E1364-R1370 VanDerWaalsContact OE1-CG 3.29Å; E1364-R1370 WeakPolarHBondContact OE1-CG 3.09Å; E1364-A1371 HydrophobicContact CG-CB 4.21Å; E1364-A1371 PolarHBondContact OE1-N 3Å
1365	R	67.5	Low	73	Confident	195 Å²	195	59.2 Å²	59.2	74%	0.736	28%	0.277	S	S	*	.	H	α-helix	trans	-86.2	-39.6	-172.4	-163.4	178.4	-178.9	-171.3	0.4	112.3	L1362 L1363 L1367	L1362-R1365 HydrophobicContact CB-CB 4.4Å; L1362-R1365 WeakPolarHBondContact O-CA 2.96Å; L1362-R1365 PolarHBondContact O-N 2.9Å; L1363-R1365 VanDerWaalsContact C-N 3.33Å; L1363-R1365 PolarHBondContact O-N 3.2Å; R1365-L1367 VanDerWaalsContact C-N 3.29Å; R1365-L1367 PolarHBondContact O-N 3.46Å
1366	E	66.2	Low	72.6	Confident	90 Å²	90	59 Å²	59	42%	0.421	28%	0.276	S	S	.	.	H	α-helix	trans	-66.3	-31.1	174.2	-71.7	173.7	-156.3	0	0	112.3	S1360 L1362	S1360-E1366 VanDerWaalsContact CB-OE1 3.25Å; S1360-E1366 WeakPolarHBondContact CB-OE1 3.16Å; S1360-E1366 PolarHBondContact OG-OE1 3.03Å; L1362-E1366 HydrophobicContact CB-CG 4.21Å; L1362-E1366 PolarHBondContact O-N 2.83Å
1367	L	74.7	Confident	72.1	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.021	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-2.9	-171.7	-63.1	176.8	0	0	0	115.4	L1363 R1365 G1369 I1398 F1416 R1418 R1430 C1431	L1363-L1367 HydrophobicContact CD1-CD1 3.47Å; L1363-L1367 VanDerWaalsContact CD1-CD1 3.47Å; L1363-L1367 HydrophobicContact CD1-CG 4.28Å; L1363-L1367 HydrophobicContact CG-CD1 3.8Å; L1363-L1367 VanDerWaalsContact O-CB 3.25Å; L1363-L1367 WeakPolarHBondContact O-CB 3.42Å; L1363-L1367 VanDerWaalsContact O-CD1 3.29Å; L1363-L1367 WeakPolarHBondContact O-CD1 3.47Å; L1363-L1367 WeakPolarHBondContact O-CG 3.37Å; L1363-L1367 PolarHBondContact O-N 3.36Å; R1365-L1367 VanDerWaalsContact C-N 3.29Å; R1365-L1367 PolarHBondContact O-N 3.46Å; L1367-G1369 PolarHBondContact O-N 2.81Å; L1367-I1398 HydrophobicContact CB-CG2 4.39Å; L1367-I1398 HydrophobicContact CD1-CB 4.37Å; L1367-I1398 HydrophobicContact CD1-CD1 4.12Å; L1367-I1398 HydrophobicContact CD1-CG1 3.77Å; L1367-I1398 HydrophobicContact CD1-CG2 4.11Å; L1367-F1416 HydrophobicContact CB-CZ 4.32Å; L1367-F1416 HydrophobicContact CD1-CE2 3.97Å; L1367-F1416 HydrophobicContact CD1-CZ 3.9Å; L1367-F1416 HydrophobicContact CG-CZ 4.5Å; L1367-R1418 VanDerWaalsContact CD1-CD 3.5Å; L1367-R1418 HydrophobicContact CD1-CG 4.32Å; L1367-R1430 HydrophobicContact CD2-CB 3.56Å; L1367-C1431 WeakPolarHBondContact O-CB 3.47Å; L1367-C1431 PolarHBondContact O-N 2.76Å; L1367-C1431 VanDerWaalsContact O-N 3.16Å; L1367-C1431 PolarHBondContact O-SG 2.59Å
1368	N	78.2	Confident	71	Confident	53 Å²	53	63.2 Å²	63.2	28%	0.283	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	38.6	-167.4	-64.2	-58.6	0	0	0	113	K1401 Y1404 C1431	N1368-K1401 WeakPolarHBondContact O-CB 3.02Å; N1368-K1401 WeakPolarHBondContact O-CG 3.04Å; N1368-K1401 PolarHBondContact O-N 3.42Å; N1368-Y1404 HydrophobicContact CB-CD1 3.53Å; N1368-Y1404 HydrophobicContact CB-CD2 4.33Å; N1368-Y1404 HydrophobicContact CB-CE1 3.59Å; N1368-Y1404 HydrophobicContact CB-CE2 4.39Å; N1368-Y1404 HydrophobicContact CB-CG 3.94Å; N1368-Y1404 VanDerWaalsContact CG-CE1 3.4Å; N1368-Y1404 VanDerWaalsContact ND2-CE1 3.32Å; N1368-Y1404 WeakPolarHBondContact ND2-CE1 3.46Å; N1368-C1431 HydrophobicContact CB-CB 4.22Å
1369	G	78.8	Confident	70	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	-173.1	-178.1	0	0	0	0	0	112.6	E1364 L1367 V1399	E1364-G1369 CarbonylContact C-O 3.49Å; E1364-G1369 WeakPolarHBondContact CA-O 3.31Å; E1364-G1369 WeakPolarHBondContact CB-O 3.44Å; E1364-G1369 PolarHBondContact O-N 3.3Å; L1367-G1369 PolarHBondContact O-N 2.81Å; G1369-V1399 CarbonylContact C-O 3.46Å; G1369-V1399 VanDerWaalsContact C-O 3.31Å; G1369-V1399 WeakPolarHBondContact CA-O 3.5Å
1370	R	83.2	Confident	68.3	Low	157 Å²	157	76.4 Å²	76.4	59%	0.592	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.2	131	179.8	-151.2	177.2	-165.7	-178.1	4.5	108.9	E1364 I1398 V1399	E1364-R1370 WeakPolarHBondContact OE1-CA 3.38Å; E1364-R1370 VanDerWaalsContact OE1-CG 3.29Å; E1364-R1370 WeakPolarHBondContact OE1-CG 3.09Å; R1370-I1398 CarbonylContact O-C 3.47Å; R1370-I1398 WeakPolarHBondContact O-CA 3.45Å; R1370-V1399 HydrophobicContact CB-CG1 4.43Å; R1370-V1399 PolarHBondContact N-O 2.87Å; R1370-V1399 PolarHBondContact O-N 3.5Å
1371	A	76.8	Confident	67	Low	0 Å²	0	86.1 Å²	86.1	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	148.6	179.4	0	0	0	0	0	110.6	E1364 C1376 R1377 R1397 I1398	E1364-A1371 HydrophobicContact CG-CB 4.21Å; E1364-A1371 PolarHBondContact OE1-N 3Å; A1371-C1376 HydrophobicContact CB-CB 3.87Å; A1371-C1376 WeakPolarHBondContact CB-O 3.39Å; A1371-R1377 HydrophobicContact CB-CG 3.88Å; A1371-R1377 VanDerWaalsContact O-CZ 3.28Å; A1371-R1377 PolarHBondContact O-NE 3.42Å; A1371-R1377 PolarHBondContact O-NH2 2.76Å; A1371-R1397 CarbonylContact C-O 3.58Å; A1371-R1397 WeakPolarHBondContact CA-O 3.38Å; A1371-I1398 HydrophobicContact CB-CD1 3.99Å
1372	V	80.7	Confident	65.7	Low	68 Å²	68	87.8 Å²	87.8	41%	0.412	41%	0.406	S	S	.	.			trans	-102.4	-41.5	175.1	-172.5	0	0	0	0	110.4	K1374 R1397 V1399 L1415	V1372-K1374 PolarHBondContact O-N 2.84Å; V1372-R1397 HydrophobicContact CB-CB 4.08Å; V1372-R1397 HydrophobicContact CG2-CB 4.29Å; V1372-R1397 PolarHBondContact N-O 2.93Å; V1372-V1399 HydrophobicContact CG2-CB 4.47Å; V1372-L1415 HydrophobicContact CG2-CD1 3.71Å
1373	N	72	Confident	64.6	Low	48 Å²	48	90.8 Å²	90.8	26%	0.257	42%	0.421	S	S	.	.	S	Bend	trans	-68	129.4	-179.5	-58.2	11.3	0	0	0	110.2	M1375 C1376 R1377 K1395 R1397	N1373-M1375 VanDerWaalsContact C-N 3.33Å; N1373-M1375 PolarHBondContact O-N 2.92Å; N1373-C1376 HydrophobicContact CB-CB 4.19Å; N1373-C1376 PolarHBondContact O-N 3.37Å; N1373-R1377 PolarHBondContact O-N 3.11Å; N1373-R1377 VanDerWaalsContact O-N 3.15Å; N1373-K1395 PolarHBondContact ND2-O 3.04Å; N1373-K1395 VanDerWaalsContact ND2-O 3.13Å; N1373-R1397 WeakPolarHBondContact OD1-CB 3.16Å
1374	K	70.7	Confident	63.4	Low	183 Å²	183	93.4 Å²	93.4	80%	0.796	44%	0.435	S	S	*	.	H	α-helix	trans	-51.5	-49.1	177.2	-101.3	-174	177.9	-179.8	0	112	V1372 C1376 R1377 I1378	V1372-K1374 PolarHBondContact O-N 2.84Å; K1374-C1376 PolarHBondContact O-N 2.77Å; K1374-C1376 VanDerWaalsContact O-N 3.1Å; K1374-R1377 CarbonylContact O-C 3.57Å; K1374-R1377 WeakPolarHBondContact O-CA 3.48Å; K1374-R1377 WeakPolarHBondContact O-CB 3.35Å; K1374-R1377 PolarHBondContact O-N 3.2Å; K1374-I1378 WeakPolarHBondContact O-CG1 3.06Å; K1374-I1378 PolarHBondContact O-N 2.98Å; K1374-I1378 VanDerWaalsContact O-N 3.14Å
1375	M	67.5	Low	62.2	Low	131 Å²	131	94.6 Å²	94.6	65%	0.645	45%	0.449	S	S	*	.	H	α-helix	trans	-49.9	-36.3	176.9	-163.9	113.6	159.9	0	0	113.5	N1373 F1390	N1373-M1375 VanDerWaalsContact C-N 3.33Å; N1373-M1375 PolarHBondContact O-N 2.92Å; M1375-F1390 WeakPolarHBondContact O-CE1 3.45Å
1376	C	72.4	Confident	61.3	Low	10 Å²	10	92.3 Å²	92.3	7%	0.068	45%	0.446	C	S	.	.	H	α-helix	trans	-90.8	-6.3	-179	-53	0	0	0	0	113.6	A1371 N1373 K1374 C1396	A1371-C1376 HydrophobicContact CB-CB 3.87Å; A1371-C1376 WeakPolarHBondContact CB-O 3.39Å; N1373-C1376 HydrophobicContact CB-CB 4.19Å; N1373-C1376 PolarHBondContact O-N 3.37Å; K1374-C1376 PolarHBondContact O-N 2.77Å; K1374-C1376 VanDerWaalsContact O-N 3.1Å; C1376-C1396 HydrophobicContact CB-CB 3.68Å; C1376-C1396 WeakPolarHBondContact CB-SG 3.35Å; C1376-C1396 WeakPolarHBondContact SG-CA 3.15Å; C1376-C1396 WeakPolarHBondContact SG-CB 3.43Å; C1376-C1396 CovalentContact SG-SG 2.02Å; C1376-C1396 PolarHBondContact SG-SG 2.95Å
1377	R	66.5	Low	60.5	Low	133 Å²	133	90.7 Å²	90.7	50%	0.502	45%	0.445	S	S	.	.	H	α-helix	trans	-96.2	-9.6	169.2	-74.7	-172.9	173.1	175.8	4.7	112.9	A1371 N1373 K1374 N1379	A1371-R1377 HydrophobicContact CB-CG 3.88Å; A1371-R1377 VanDerWaalsContact O-CZ 3.28Å; A1371-R1377 PolarHBondContact O-NE 3.42Å; A1371-R1377 PolarHBondContact O-NH2 2.76Å; N1373-R1377 PolarHBondContact O-N 3.11Å; N1373-R1377 VanDerWaalsContact O-N 3.15Å; K1374-R1377 CarbonylContact O-C 3.57Å; K1374-R1377 WeakPolarHBondContact O-CA 3.48Å; K1374-R1377 WeakPolarHBondContact O-CB 3.35Å; K1374-R1377 PolarHBondContact O-N 3.2Å; R1377-N1379 VanDerWaalsContact C-N 3.31Å; R1377-N1379 PolarHBondContact O-N 2.96Å
1378	I	53.1	Low	59.7	Low	62 Å²	62	92.1 Å²	92.1	32%	0.318	45%	0.454	S	S	.	.			trans	-75	88.9	-171.5	-33.3	-177.4	0	0	0	110	K1374 F1380	K1374-I1378 WeakPolarHBondContact O-CG1 3.06Å; K1374-I1378 PolarHBondContact O-N 2.98Å; K1374-I1378 VanDerWaalsContact O-N 3.14Å; I1378-F1380 HydrophobicContact CB-CD2 3.86Å; I1378-F1380 HydrophobicContact CB-CE2 4.03Å; I1378-F1380 HydrophobicContact CD1-CD2 4.46Å; I1378-F1380 HydrophobicContact CD1-CE2 3.74Å; I1378-F1380 HydrophobicContact CD1-CZ 4.19Å; I1378-F1380 HydrophobicContact CG1-CE2 4.46Å; I1378-F1380 HydrophobicContact CG2-CB 4.34Å; I1378-F1380 HydrophobicContact CG2-CD1 4.19Å; I1378-F1380 HydrophobicContact CG2-CD2 3.39Å; I1378-F1380 HydrophobicContact CG2-CE1 4.37Å; I1378-F1380 HydrophobicContact CG2-CE2 3.61Å; I1378-F1380 HydrophobicContact CG2-CG 3.71Å; I1378-F1380 HydrophobicContact CG2-CZ 4.1Å; I1378-F1380 PolarHBondContact O-N 3.37Å
1379	N	49.2	Very low	58.9	Low	148 Å²	148	90.7 Å²	90.7	79%	0.791	45%	0.448	S	S	*	.			trans	-57.6	86.9	138.9	-71.3	-15.9	0	0	0	106.6	R1377	R1377-N1379 VanDerWaalsContact C-N 3.31Å; R1377-N1379 PolarHBondContact O-N 2.96Å
1380	F	40.5	Very low	58.6	Low	133 Å²	133	91.6 Å²	91.6	58%	0.583	45%	0.452	S	S	*	.			trans	-61.1	147.6	163.3	-94.6	-76.6	0	0	0	106.8	I1378 T1382	I1378-F1380 HydrophobicContact CB-CD2 3.86Å; I1378-F1380 HydrophobicContact CB-CE2 4.03Å; I1378-F1380 HydrophobicContact CD1-CD2 4.46Å; I1378-F1380 HydrophobicContact CD1-CE2 3.74Å; I1378-F1380 HydrophobicContact CD1-CZ 4.19Å; I1378-F1380 HydrophobicContact CG1-CE2 4.46Å; I1378-F1380 HydrophobicContact CG2-CB 4.34Å; I1378-F1380 HydrophobicContact CG2-CD1 4.19Å; I1378-F1380 HydrophobicContact CG2-CD2 3.39Å; I1378-F1380 HydrophobicContact CG2-CE1 4.37Å; I1378-F1380 HydrophobicContact CG2-CE2 3.61Å; I1378-F1380 HydrophobicContact CG2-CG 3.71Å; I1378-F1380 HydrophobicContact CG2-CZ 4.1Å; I1378-F1380 PolarHBondContact O-N 3.37Å; F1380-T1382 PolarHBondContact O-N 2.95Å
1381	F	40.2	Very low	58.1	Low	212 Å²	212	87.8 Å²	87.8	93%	0.93	45%	0.447	S	S	*	.	S	Bend	trans	-68.6	21.5	-170.4	-77.6	-100.8	0	0	0	114.4
1382	T	38.8	Very low	58.1	Low	79 Å²	79	91 Å²	91	49%	0.485	47%	0.467	S	S	.	.			trans	-76.8	122.9	172.3	51.9	0	0	0	0	109.9	F1380 D1384 S1387	F1380-T1382 PolarHBondContact O-N 2.95Å; T1382-D1384 PolarHBondContact O-N 2.97Å; T1382-S1387 PolarHBondContact OG1-OG 2.74Å
1383	L	42.9	Very low	58	Low	135 Å²	135	90 Å²	90	71%	0.707	47%	0.47	S	S	*	.	S	Bend	trans	-63.9	4.6	-175.9	-81.1	149.6	0	0	0	115.5
1384	D	42.4	Very low	58.4	Low	56 Å²	56	88.7 Å²	88.7	30%	0.299	46%	0.464	S	S	.	.			trans	-119.3	107.7	178.9	-175.3	6.2	0	0	0	111.7	T1382 H1386 S1387	T1382-D1384 PolarHBondContact O-N 2.97Å; D1384-H1386 PolarHBondContact O-N 3.14Å; D1384-H1386 VanDerWaalsContact OD1-CB 3.28Å; D1384-H1386 WeakPolarHBondContact OD1-CB 3.3Å; D1384-H1386 IonicContact OD1-CD2 3.1Å; D1384-H1386 PolarHBondContact OD1-CD2 3.23Å; D1384-H1386 VanDerWaalsContact OD1-CD2 3.29Å; D1384-H1386 IonicContact OD1-CG 3.34Å; D1384-H1386 PolarHBondContact OD1-N 2.82Å; D1384-S1387 WeakPolarHBondContact O-CB 3.17Å; D1384-S1387 PolarHBondContact O-N 2.75Å; D1384-S1387 PolarHBondContact O-OG 3.29Å
1385	P	44.4	Very low	59.1	Low	89 Å²	89	86 Å²	86	58%	0.578	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-10.4	172.4	-24.2	34.7	0	0	0	115.2	P1361	P1361-P1385 WeakPolarHBondContact CG-O 3.44Å
1386	H	47.8	Very low	59.8	Low	148 Å²	148	79.7 Å²	79.7	69%	0.685	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-10.1	174.8	-57	-65.7	0	0	0	113.8	D1384	D1384-H1386 PolarHBondContact O-N 3.14Å; D1384-H1386 VanDerWaalsContact OD1-CB 3.28Å; D1384-H1386 WeakPolarHBondContact OD1-CB 3.3Å; D1384-H1386 IonicContact OD1-CD2 3.1Å; D1384-H1386 PolarHBondContact OD1-CD2 3.23Å; D1384-H1386 VanDerWaalsContact OD1-CD2 3.29Å; D1384-H1386 IonicContact OD1-CG 3.34Å; D1384-H1386 PolarHBondContact OD1-N 2.82Å
1387	S	48.7	Very low	60.5	Low	55 Å²	55	85.6 Å²	85.6	39%	0.385	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-31.8	-178.4	66.9	0	0	0	0	114	T1382 D1384	T1382-S1387 PolarHBondContact OG1-OG 2.74Å; D1384-S1387 WeakPolarHBondContact O-CB 3.17Å; D1384-S1387 PolarHBondContact O-N 2.75Å; D1384-S1387 PolarHBondContact O-OG 3.29Å
1388	V	58.3	Low	61.5	Low	35 Å²	35	79.2 Å²	79.2	21%	0.212	42%	0.418	C	S	.	.			trans	-77.9	123.6	174	-173.1	0	0	0	0	108	P1361	P1361-V1388 HydrophobicContact CB-CB 4.25Å; P1361-V1388 HydrophobicContact CB-CG1 4.36Å; P1361-V1388 VanDerWaalsContact CB-O 3.25Å; P1361-V1388 WeakPolarHBondContact CB-O 3.46Å; P1361-V1388 VanDerWaalsContact CD-O 3.31Å; P1361-V1388 WeakPolarHBondContact CD-O 3.49Å; P1361-V1388 WeakPolarHBondContact CG-O 3.47Å
1389	S	61.2	Low	63.2	Low	23 Å²	23	79 Å²	79	16%	0.161	42%	0.419	C	S	.	.			trans	-145	143.2	173.2	54.7	0	0	0	0	109.1	S1358	S1358-S1389 VanDerWaalsContact OG-CB 3.29Å; S1358-S1389 WeakPolarHBondContact OG-CB 3.2Å; S1358-S1389 PolarHBondContact OG-OG 3.22Å; S1358-S1389 VanDerWaalsContact OG-OG 3.1Å
1390	F	73.4	Confident	65	Low	19 Å²	19	72 Å²	72	8%	0.083	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.7	-174.5	-69.9	-72.7	0	0	0	109.4	S1358 C1359 P1361 M1375 T1394 C1420 W1426	S1358-F1390 CarbonylContact C-O 3.37Å; S1358-F1390 WeakPolarHBondContact CA-O 3.48Å; S1358-F1390 WeakPolarHBondContact CB-O 3.46Å; C1359-F1390 HydrophobicContact CB-CB 4.43Å; C1359-F1390 PolarHBondContact N-O 3.44Å; C1359-F1390 PolarHBondContact O-N 2.89Å; P1361-F1390 HydrophobicContact CB-CE2 4.4Å; M1375-F1390 WeakPolarHBondContact O-CE1 3.45Å; F1390-T1394 HydrophobicContact CB-CG2 4.14Å; F1390-T1394 HydrophobicContact CD1-CG2 3.79Å; F1390-T1394 HydrophobicContact CG-CG2 4.23Å; F1390-C1420 PolarHBondContact O-SG 3.39Å; F1390-W1426 HydrophobicContact CB-CH2 4.14Å; F1390-W1426 HydrophobicContact CB-CZ2 3.77Å; F1390-W1426 HydrophobicContact CD2-CH2 4.33Å; F1390-W1426 AromaticContact CD2-CZ2 3.54Å; F1390-W1426 HydrophobicContact CD2-CZ2 3.54Å; F1390-W1426 HydrophobicContact CE2-CZ2 4.28Å; F1390-W1426 HydrophobicContact CG-CH2 4.2Å; F1390-W1426 AromaticContact CG-CZ2 3.78Å; F1390-W1426 HydrophobicContact CG-CZ2 3.78Å
1391	P	72.1	Confident	67.1	Low	76 Å²	76	70.3 Å²	70.3	49%	0.494	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	150.9	178.7	25.4	-33.3	0	0	0	110.8	G1393 T1394	P1391-G1393 PolarHBondContact O-N 3.32Å; P1391-T1394 WeakPolarHBondContact CD-OG1 3.33Å; P1391-T1394 WeakPolarHBondContact O-CB 3.46Å; P1391-T1394 PolarHBondContact O-N 3.04Å; P1391-T1394 VanDerWaalsContact O-N 3.09Å; P1391-T1394 PolarHBondContact O-OG1 3.02Å
1392	V	77.8	Confident	69.1	Low	68 Å²	68	64.1 Å²	64.1	41%	0.412	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.1	131	169.5	173.8	0	0	0	0	109.5	L1357 D1421	L1357-V1392 HydrophobicContact CB-CG2 4.18Å; V1392-D1421 WeakPolarHBondContact CG2-O 3.39Å
1393	G	78.3	Confident	71.2	Confident	47 Å²	47	61.5 Å²	61.5	49%	0.485	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.2	-16.6	-175.2	0	0	0	0	0	115.9	P1391 C1420	P1391-G1393 PolarHBondContact O-N 3.32Å; G1393-C1420 WeakPolarHBondContact CA-O 3.43Å; G1393-C1420 PolarHBondContact N-O 3.42Å
1394	T	80.8	Confident	73.3	Confident	20 Å²	20	57.6 Å²	57.6	12%	0.123	33%	0.327	C	S	.	.			trans	-60.2	136.1	-178.9	-56.5	0	0	0	0	112.5	F1390 P1391 S1419 C1420 W1426	F1390-T1394 HydrophobicContact CB-CG2 4.14Å; F1390-T1394 HydrophobicContact CD1-CG2 3.79Å; F1390-T1394 HydrophobicContact CG-CG2 4.23Å; P1391-T1394 WeakPolarHBondContact CD-OG1 3.33Å; P1391-T1394 WeakPolarHBondContact O-CB 3.46Å; P1391-T1394 PolarHBondContact O-N 3.04Å; P1391-T1394 VanDerWaalsContact O-N 3.09Å; P1391-T1394 PolarHBondContact O-OG1 3.02Å; T1394-S1419 CarbonylContact O-C 3.6Å; T1394-S1419 WeakPolarHBondContact O-CA 3.49Å; T1394-C1420 PolarHBondContact O-N 2.78Å; T1394-W1426 HydrophobicContact CG2-CH2 4Å; T1394-W1426 WeakPolarHBondContact O-CZ3 3.45Å
1395	K	84.8	Confident	75.4	Confident	126 Å²	126	56.4 Å²	56.4	55%	0.548	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126	-179.2	-61.3	-179.7	-176.1	173	0	112.8	N1373 R1418	N1373-K1395 PolarHBondContact ND2-O 3.04Å; N1373-K1395 VanDerWaalsContact ND2-O 3.13Å; K1395-R1418 CarbonylContact C-O 3.41Å; K1395-R1418 WeakPolarHBondContact CA-O 3.5Å
1396	C	82.7	Confident	77.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	131.5	-172.9	-66.8	0	0	0	0	113.4	L1363 C1376 K1417 R1418 W1426	L1363-C1396 HydrophobicContact CD2-CB 3.38Å; C1376-C1396 HydrophobicContact CB-CB 3.68Å; C1376-C1396 WeakPolarHBondContact CB-SG 3.35Å; C1376-C1396 WeakPolarHBondContact SG-CA 3.15Å; C1376-C1396 WeakPolarHBondContact SG-CB 3.43Å; C1376-C1396 CovalentContact SG-SG 2.02Å; C1376-C1396 PolarHBondContact SG-SG 2.95Å; C1396-K1417 CarbonylContact O-C 3.4Å; C1396-K1417 VanDerWaalsContact O-CA 3.28Å; C1396-K1417 WeakPolarHBondContact O-CA 3.21Å; C1396-R1418 PolarHBondContact N-O 3.15Å; C1396-R1418 PolarHBondContact O-N 3.08Å; C1396-W1426 HydrophobicContact CB-CH2 4.2Å; C1396-W1426 HydrophobicContact CB-CZ3 4.19Å; C1396-W1426 WeakPolarHBondContact SG-CH2 3.48Å
1397	R	87.3	Confident	79.1	Confident	133 Å²	133	48.7 Å²	48.7	50%	0.502	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	139	167.3	-69.9	174.7	165.9	152.4	-5.6	110.9	A1371 V1372 N1373 F1416 K1417	A1371-R1397 CarbonylContact C-O 3.58Å; A1371-R1397 WeakPolarHBondContact CA-O 3.38Å; V1372-R1397 HydrophobicContact CB-CB 4.08Å; V1372-R1397 HydrophobicContact CG2-CB 4.29Å; V1372-R1397 PolarHBondContact N-O 2.93Å; N1373-R1397 WeakPolarHBondContact OD1-CB 3.16Å; R1397-F1416 CarbonylContact C-O 3.54Å; R1397-F1416 VanDerWaalsContact CA-O 3.29Å; R1397-F1416 WeakPolarHBondContact CA-O 3.45Å; R1397-K1417 HydrophobicContact CG-CB 4.38Å; R1397-K1417 HydrophobicContact CG-CG 4.18Å
1398	I	86.4	Confident	80.6	Confident	0 Å²	0	50 Å²	50	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	137.9	-175.8	-62.1	-77.8	0	0	0	109.9	L1363 L1367 R1370 A1371 L1415 F1416	L1363-I1398 HydrophobicContact CD2-CD1 3.71Å; L1363-I1398 HydrophobicContact CD2-CG1 4.11Å; L1363-I1398 HydrophobicContact CG-CD1 3.68Å; L1363-I1398 HydrophobicContact CG-CG1 4.21Å; L1367-I1398 HydrophobicContact CB-CG2 4.39Å; L1367-I1398 HydrophobicContact CD1-CB 4.37Å; L1367-I1398 HydrophobicContact CD1-CD1 4.12Å; L1367-I1398 HydrophobicContact CD1-CG1 3.77Å; L1367-I1398 HydrophobicContact CD1-CG2 4.11Å; R1370-I1398 CarbonylContact O-C 3.47Å; R1370-I1398 WeakPolarHBondContact O-CA 3.45Å; A1371-I1398 HydrophobicContact CB-CD1 3.99Å; I1398-L1415 WeakPolarHBondContact O-CA 3.41Å; I1398-F1416 HydrophobicContact CB-CD1 4.28Å; I1398-F1416 HydrophobicContact CB-CD2 4.47Å; I1398-F1416 HydrophobicContact CB-CE1 3.75Å; I1398-F1416 HydrophobicContact CB-CE2 3.95Å; I1398-F1416 HydrophobicContact CB-CZ 3.59Å; I1398-F1416 HydrophobicContact CG1-CE2 4.41Å; I1398-F1416 HydrophobicContact CG1-CZ 4.37Å; I1398-F1416 HydrophobicContact CG2-CD1 4.42Å; I1398-F1416 HydrophobicContact CG2-CE1 3.49Å; I1398-F1416 VanDerWaalsContact CG2-CE1 3.49Å; I1398-F1416 HydrophobicContact CG2-CE2 4.23Å; I1398-F1416 HydrophobicContact CG2-CZ 3.4Å; I1398-F1416 PolarHBondContact N-O 2.73Å; I1398-F1416 WeakPolarHBondContact O-CD1 3.16Å; I1398-F1416 PolarHBondContact O-N 3.26Å
1399	V	89.1	Confident	81.8	Confident	56 Å²	56	54 Å²	54	34%	0.339	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.1	173.2	102.4	0	0	0	0	111.4	G1369 R1370 V1372 R1414 L1415	G1369-V1399 CarbonylContact C-O 3.46Å; G1369-V1399 VanDerWaalsContact C-O 3.31Å; G1369-V1399 WeakPolarHBondContact CA-O 3.5Å; R1370-V1399 HydrophobicContact CB-CG1 4.43Å; R1370-V1399 PolarHBondContact N-O 2.87Å; R1370-V1399 PolarHBondContact O-N 3.5Å; V1372-V1399 HydrophobicContact CG2-CB 4.47Å; V1399-R1414 CarbonylContact C-O 3.28Å; V1399-R1414 WeakPolarHBondContact CA-O 3.3Å; V1399-R1414 HydrophobicContact CG2-CB 4.31Å; V1399-L1415 HydrophobicContact CB-CD1 4.09Å; V1399-L1415 HydrophobicContact CG2-CB 4.04Å; V1399-L1415 HydrophobicContact CG2-CD1 3.85Å
1400	C	87.3	Confident	82.7	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.007	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	143.7	-175.8	-62	0	0	0	0	113.6	Y1404 R1414 C1431	C1400-Y1404 WeakPolarHBondContact CB-O 3.45Å; C1400-R1414 HydrophobicContact CB-CB 4.18Å; C1400-R1414 HydrophobicContact CB-CG 4.36Å; C1400-R1414 PolarHBondContact N-O 3.4Å; C1400-R1414 PolarHBondContact O-NE 3.22Å; C1400-R1414 PolarHBondContact O-NH2 2.81Å; C1400-R1414 PolarHBondContact SG-O 3.22Å; C1400-C1431 WeakPolarHBondContact CA-SG 3.33Å; C1400-C1431 HydrophobicContact CB-CB 3.68Å; C1400-C1431 WeakPolarHBondContact CB-SG 3.36Å; C1400-C1431 WeakPolarHBondContact SG-CB 3.44Å; C1400-C1431 CovalentContact SG-SG 2.03Å; C1400-C1431 PolarHBondContact SG-SG 3.41Å
1401	K	84.2	Confident	83.1	Confident	98 Å²	98	59.1 Å²	59.1	43%	0.426	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-65.3	163.7	173.4	-69.6	173.4	-175.7	175.7	0	111.1	N1368 Y1404	N1368-K1401 WeakPolarHBondContact O-CB 3.02Å; N1368-K1401 WeakPolarHBondContact O-CG 3.04Å; N1368-K1401 PolarHBondContact O-N 3.42Å; K1401-Y1404 HydrophobicContact CB-CD2 4.32Å; K1401-Y1404 PolarHBondContact O-N 2.83Å
1402	A	83	Confident	83.6	Confident	82 Å²	82	60.6 Å²	60.6	68%	0.678	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	141.8	175.1	0	0	0	0	0	110.4	Y1404	A1402-Y1404 VanDerWaalsContact C-N 3.3Å; A1402-Y1404 WeakPolarHBondContact O-CD2 3.46Å
1403	G	82.3	Confident	84	Confident	24 Å²	24	61.9 Å²	61.9	25%	0.247	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	80	4.9	-171.3	0	0	0	0	0	115.1	I1434	G1403-I1434 PolarHBondContact O-N 2.77Å
1404	Y	87.2	Confident	84.4	Confident	54 Å²	54	64.9 Å²	64.9	21%	0.212	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	144.9	178.2	-64	-105.4	0	0	0	111.6	N1368 C1400 K1401 A1402 C1431 V1432 K1433	N1368-Y1404 HydrophobicContact CB-CD1 3.53Å; N1368-Y1404 HydrophobicContact CB-CD2 4.33Å; N1368-Y1404 HydrophobicContact CB-CE1 3.59Å; N1368-Y1404 HydrophobicContact CB-CE2 4.39Å; N1368-Y1404 HydrophobicContact CB-CG 3.94Å; N1368-Y1404 VanDerWaalsContact CG-CE1 3.4Å; N1368-Y1404 VanDerWaalsContact ND2-CE1 3.32Å; N1368-Y1404 WeakPolarHBondContact ND2-CE1 3.46Å; C1400-Y1404 WeakPolarHBondContact CB-O 3.45Å; K1401-Y1404 HydrophobicContact CB-CD2 4.32Å; K1401-Y1404 PolarHBondContact O-N 2.83Å; A1402-Y1404 VanDerWaalsContact C-N 3.3Å; A1402-Y1404 WeakPolarHBondContact O-CD2 3.46Å; Y1404-C1431 HydrophobicContact CD1-CB 4.43Å; Y1404-V1432 CarbonylContact C-O 3.57Å; Y1404-V1432 WeakPolarHBondContact CA-O 3.38Å; Y1404-V1432 WeakPolarHBondContact CB-O 3.35Å; Y1404-K1433 HydrophobicContact CD1-CB 4.1Å; Y1404-K1433 HydrophobicContact CD1-CG 4.21Å; Y1404-K1433 HydrophobicContact CE1-CB 3.87Å; Y1404-K1433 HydrophobicContact CE1-CD 4.47Å; Y1404-K1433 HydrophobicContact CE1-CG 3.76Å; Y1404-K1433 HydrophobicContact CE2-CG 4.26Å
1405	H	87.4	Confident	84.8	Confident	31 Å²	31	67.8 Å²	67.8	14%	0.144	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	167.6	174.4	72.4	110.7	0	0	0	110.6	Y1409 C1431 V1432	H1405-Y1409 PolarHBondContact CE1-O 2.82Å; H1405-Y1409 PolarHBondContact ND1-O 2.83Å; H1405-C1431 CarbonylContact O-C 3.56Å; H1405-C1431 WeakPolarHBondContact O-CA 3.47Å; H1405-V1432 PolarHBondContact N-O 3.31Å; H1405-V1432 PolarHBondContact O-N 2.74Å
1406	V	87	Confident	84.9	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	130.1	178.6	-173.1	0	0	0	0	110	G1408 Y1409 K1413 F1416 P1429	V1406-G1408 PolarHBondContact O-N 3Å; V1406-Y1409 HydrophobicContact CB-CD2 4.01Å; V1406-Y1409 HydrophobicContact CB-CG 4.48Å; V1406-Y1409 HydrophobicContact CG1-CD2 3.6Å; V1406-Y1409 HydrophobicContact CG1-CE2 4.08Å; V1406-Y1409 HydrophobicContact CG1-CG 4.5Å; V1406-Y1409 PolarHBondContact O-N 2.87Å; V1406-K1413 HydrophobicContact CB-CG 4.28Å; V1406-K1413 HydrophobicContact CG2-CG 4.18Å; V1406-K1413 WeakPolarHBondContact CG2-O 3.35Å; V1406-K1413 PolarHBondContact N-O 3.42Å; V1406-F1416 HydrophobicContact CB-CD1 4.45Å; V1406-F1416 HydrophobicContact CG1-CB 4.09Å; V1406-F1416 HydrophobicContact CG1-CD1 4.08Å; V1406-F1416 HydrophobicContact CG1-CG 4.13Å; V1406-F1416 HydrophobicContact CG2-CB 4.25Å; V1406-F1416 HydrophobicContact CG2-CD1 3.48Å; V1406-F1416 VanDerWaalsContact CG2-CD1 3.48Å; V1406-F1416 HydrophobicContact CG2-CE1 4.16Å; V1406-F1416 HydrophobicContact CG2-CG 4.2Å; V1406-P1429 HydrophobicContact CG1-CB 3.85Å; V1406-P1429 HydrophobicContact CG1-CG 3.91Å
1407	E	81.5	Confident	85.2	Confident	74 Å²	74	67.7 Å²	67.7	35%	0.346	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	130	176.3	-174	164.7	-123.8	0	0	111.7	Y1409 R1430 V1432	E1407-Y1409 VanDerWaalsContact C-N 3.31Å; E1407-Y1409 WeakPolarHBondContact O-CD2 3.37Å; E1407-Y1409 PolarHBondContact O-N 2.97Å; E1407-R1430 HydrophobicContact CB-CG 4.19Å; E1407-R1430 WeakPolarHBondContact CB-O 3.46Å; E1407-R1430 VanDerWaalsContact CD-NE 3.27Å; E1407-R1430 PolarHBondContact N-O 2.96Å; E1407-R1430 IonicContact OE1-CZ 3.84Å; E1407-R1430 VanDerWaalsContact OE1-CZ 3.25Å; E1407-R1430 IonicContact OE1-NE 3.99Å; E1407-R1430 PolarHBondContact OE1-NE 3.27Å; E1407-R1430 VanDerWaalsContact OE1-NE 3.08Å; E1407-R1430 IonicContact OE1-NH2 3.41Å; E1407-R1430 PolarHBondContact OE1-NH2 3.18Å; E1407-R1430 WeakPolarHBondContact OE2-CD 3.24Å; E1407-R1430 WeakPolarHBondContact OE2-CG 3.49Å; E1407-R1430 IonicContact OE2-CZ 3.74Å; E1407-R1430 IonicContact OE2-NE 3.69Å; E1407-R1430 PolarHBondContact OE2-NE 3.43Å; E1407-R1430 IonicContact OE2-NH2 2.79Å; E1407-V1432 HydrophobicContact CB-CG1 3.94Å; E1407-V1432 HydrophobicContact CB-CG2 4.08Å; E1407-V1432 HydrophobicContact CG-CG1 4.04Å; E1407-V1432 WeakPolarHBondContact OE1-CG1 3.31Å
1408	G	80.4	Confident	85.1	Confident	82 Å²	82	63.2 Å²	63.2	85%	0.845	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	-1	-176.5	0	0	0	0	0	115.6	V1406	V1406-G1408 PolarHBondContact O-N 3Å
1409	Y	82.7	Confident	85.1	Confident	119 Å²	119	65.3 Å²	65.3	47%	0.467	37%	0.365	S	S	.	.	S	Bend	trans	-119.8	158.5	179.4	-66.3	-94.7	0	0	0	112.2	H1405 V1406 E1407 K1413	H1405-Y1409 PolarHBondContact CE1-O 2.82Å; H1405-Y1409 PolarHBondContact ND1-O 2.83Å; V1406-Y1409 HydrophobicContact CB-CD2 4.01Å; V1406-Y1409 HydrophobicContact CB-CG 4.48Å; V1406-Y1409 HydrophobicContact CG1-CD2 3.6Å; V1406-Y1409 HydrophobicContact CG1-CE2 4.08Å; V1406-Y1409 HydrophobicContact CG1-CG 4.5Å; V1406-Y1409 PolarHBondContact O-N 2.87Å; E1407-Y1409 VanDerWaalsContact C-N 3.31Å; E1407-Y1409 WeakPolarHBondContact O-CD2 3.37Å; E1407-Y1409 PolarHBondContact O-N 2.97Å; Y1409-K1413 VanDerWaalsContact CB-CB 3.5Å; Y1409-K1413 HydrophobicContact CD1-CD 4.36Å; Y1409-K1413 HydrophobicContact CD1-CG 3.98Å; Y1409-K1413 HydrophobicContact CG-CB 4.24Å; Y1409-K1413 HydrophobicContact CG-CG 3.84Å
1410	P	81.6	Confident	84.8	Confident	89 Å²	89	62.9 Å²	62.9	58%	0.578	35%	0.35	S	S	*	.			trans	-53.1	156.1	175.8	-27	35.1	0	0	0	113.2	S1412 K1413	P1410-S1412 PolarHBondContact O-N 3.32Å; P1410-K1413 WeakPolarHBondContact O-CB 3.44Å; P1410-K1413 PolarHBondContact O-N 3.07Å
1411	V	80.9	Confident	84.4	Confident	62 Å²	62	64.1 Å²	64.1	38%	0.376	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-26.5	-177.5	-174.4	0	0	0	0	112.9	I1434	V1411-I1434 HydrophobicContact CG1-CD1 3.63Å; V1411-I1434 HydrophobicContact CG1-CG1 3.95Å; V1411-I1434 HydrophobicContact CG1-CG2 4.47Å
1412	S	82.2	Confident	84	Confident	107 Å²	107	64 Å²	64	75%	0.748	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-25.9	173.9	59	0	0	0	0	114.5	P1410 R1414	P1410-S1412 PolarHBondContact O-N 3.32Å; S1412-R1414 PolarHBondContact O-N 3.4Å
1413	K	86	Confident	83.5	Confident	95 Å²	95	63.6 Å²	63.6	41%	0.413	36%	0.357	S	S	.	.			trans	-77.8	111.9	-178.6	-169	77.9	170.5	-165.7	0	110	V1406 Y1409 P1410 L1415	V1406-K1413 HydrophobicContact CB-CG 4.28Å; V1406-K1413 HydrophobicContact CG2-CG 4.18Å; V1406-K1413 WeakPolarHBondContact CG2-O 3.35Å; V1406-K1413 PolarHBondContact N-O 3.42Å; Y1409-K1413 VanDerWaalsContact CB-CB 3.5Å; Y1409-K1413 HydrophobicContact CD1-CD 4.36Å; Y1409-K1413 HydrophobicContact CD1-CG 3.98Å; Y1409-K1413 HydrophobicContact CG-CB 4.24Å; Y1409-K1413 HydrophobicContact CG-CG 3.84Å; P1410-K1413 WeakPolarHBondContact O-CB 3.44Å; P1410-K1413 PolarHBondContact O-N 3.07Å; K1413-L1415 WeakPolarHBondContact CE-O 3.33Å
1414	R	87.4	Confident	83.1	Confident	109 Å²	109	62.5 Å²	62.5	41%	0.411	35%	0.346	S	S	.	.			trans	-116.1	-15.5	178.1	-65.1	177.4	66	-172.3	-2.6	114.6	V1399 C1400 S1412	V1399-R1414 CarbonylContact C-O 3.28Å; V1399-R1414 WeakPolarHBondContact CA-O 3.3Å; V1399-R1414 HydrophobicContact CG2-CB 4.31Å; C1400-R1414 HydrophobicContact CB-CB 4.18Å; C1400-R1414 HydrophobicContact CB-CG 4.36Å; C1400-R1414 PolarHBondContact N-O 3.4Å; C1400-R1414 PolarHBondContact O-NE 3.22Å; C1400-R1414 PolarHBondContact O-NH2 2.81Å; C1400-R1414 PolarHBondContact SG-O 3.22Å; S1412-R1414 PolarHBondContact O-N 3.4Å
1415	L	89.5	Confident	82.7	Confident	81 Å²	81	62.3 Å²	62.3	42%	0.424	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	135.1	-177.4	-173.3	74.8	0	0	0	112.8	V1372 I1398 V1399 K1413	V1372-L1415 HydrophobicContact CG2-CD1 3.71Å; I1398-L1415 WeakPolarHBondContact O-CA 3.41Å; V1399-L1415 HydrophobicContact CB-CD1 4.09Å; V1399-L1415 HydrophobicContact CG2-CB 4.04Å; V1399-L1415 HydrophobicContact CG2-CD1 3.85Å; K1413-L1415 WeakPolarHBondContact CE-O 3.33Å
1416	F	87.3	Confident	82.4	Confident	19 Å²	19	61.5 Å²	61.5	8%	0.083	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	-177.5	174.9	65.1	-76.8	0	0	0	112.3	L1367 R1397 I1398 V1406 R1418 P1429 C1431	L1367-F1416 HydrophobicContact CB-CZ 4.32Å; L1367-F1416 HydrophobicContact CD1-CE2 3.97Å; L1367-F1416 HydrophobicContact CD1-CZ 3.9Å; L1367-F1416 HydrophobicContact CG-CZ 4.5Å; R1397-F1416 CarbonylContact C-O 3.54Å; R1397-F1416 VanDerWaalsContact CA-O 3.29Å; R1397-F1416 WeakPolarHBondContact CA-O 3.45Å; I1398-F1416 HydrophobicContact CB-CD1 4.28Å; I1398-F1416 HydrophobicContact CB-CD2 4.47Å; I1398-F1416 HydrophobicContact CB-CE1 3.75Å; I1398-F1416 HydrophobicContact CB-CE2 3.95Å; I1398-F1416 HydrophobicContact CB-CZ 3.59Å; I1398-F1416 HydrophobicContact CG1-CE2 4.41Å; I1398-F1416 HydrophobicContact CG1-CZ 4.37Å; I1398-F1416 HydrophobicContact CG2-CD1 4.42Å; I1398-F1416 HydrophobicContact CG2-CE1 3.49Å; I1398-F1416 VanDerWaalsContact CG2-CE1 3.49Å; I1398-F1416 HydrophobicContact CG2-CE2 4.23Å; I1398-F1416 HydrophobicContact CG2-CZ 3.4Å; I1398-F1416 PolarHBondContact N-O 2.73Å; I1398-F1416 WeakPolarHBondContact O-CD1 3.16Å; I1398-F1416 PolarHBondContact O-N 3.26Å; V1406-F1416 HydrophobicContact CB-CD1 4.45Å; V1406-F1416 HydrophobicContact CG1-CB 4.09Å; V1406-F1416 HydrophobicContact CG1-CD1 4.08Å; V1406-F1416 HydrophobicContact CG1-CG 4.13Å; V1406-F1416 HydrophobicContact CG2-CB 4.25Å; V1406-F1416 HydrophobicContact CG2-CD1 3.48Å; V1406-F1416 VanDerWaalsContact CG2-CD1 3.48Å; V1406-F1416 HydrophobicContact CG2-CE1 4.16Å; V1406-F1416 HydrophobicContact CG2-CG 4.2Å; F1416-R1418 HydrophobicContact CD2-CG 4.14Å; F1416-R1418 HydrophobicContact CE2-CG 3.81Å; F1416-P1429 HydrophobicContact CB-CG 3.92Å; F1416-P1429 HydrophobicContact CD2-CG 3.73Å; F1416-P1429 WeakPolarHBondContact CE2-O 3.41Å; F1416-P1429 HydrophobicContact CG-CG 4.02Å; F1416-C1431 VanDerWaalsContact CE1-SG 3.52Å
1417	K	87.6	Confident	82.2	Confident	105 Å²	105	68.1 Å²	68.1	46%	0.457	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	144.4	-179.7	-165.1	178.9	179.2	-177.1	0	110.5	C1396 R1397	C1396-K1417 CarbonylContact O-C 3.4Å; C1396-K1417 VanDerWaalsContact O-CA 3.28Å; C1396-K1417 WeakPolarHBondContact O-CA 3.21Å; R1397-K1417 HydrophobicContact CG-CB 4.38Å; R1397-K1417 HydrophobicContact CG-CG 4.18Å
1418	R	86	Confident	82.1	Confident	40 Å²	40	66.5 Å²	66.5	15%	0.151	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	154.8	169.4	-65.4	-162.5	99.6	-166.6	7.6	111.5	L1367 K1395 C1396 F1416 W1426 R1427 G1428 P1429	L1367-R1418 VanDerWaalsContact CD1-CD 3.5Å; L1367-R1418 HydrophobicContact CD1-CG 4.32Å; K1395-R1418 CarbonylContact C-O 3.41Å; K1395-R1418 WeakPolarHBondContact CA-O 3.5Å; C1396-R1418 PolarHBondContact N-O 3.15Å; C1396-R1418 PolarHBondContact O-N 3.08Å; F1416-R1418 HydrophobicContact CD2-CG 4.14Å; F1416-R1418 HydrophobicContact CE2-CG 3.81Å; R1418-W1426 HydrophobicContact CB-CE3 3.87Å; R1418-W1426 VanDerWaalsContact NH1-CB 3.32Å; R1418-W1426 PolarHBondContact NH2-O 3.05Å; R1418-R1427 CarbonylContact C-O 3.31Å; R1418-R1427 WeakPolarHBondContact CA-O 3.33Å; R1418-R1427 WeakPolarHBondContact CB-O 3.27Å; R1418-R1427 WeakPolarHBondContact CG-O 3.45Å; R1418-R1427 PolarHBondContact NE-O 2.94Å; R1418-G1428 VanDerWaalsContact CZ-O 3.27Å; R1418-G1428 PolarHBondContact NE-O 3.4Å; R1418-G1428 PolarHBondContact NH2-O 2.66Å; R1418-P1429 WeakPolarHBondContact CD-O 3.33Å; R1418-P1429 PolarHBondContact NE-O 2.88Å
1419	S	86.5	Confident	82.3	Confident	44 Å²	44	64.5 Å²	64.5	31%	0.308	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.3	-179.8	-55.3	0	0	0	0	109.5	T1394 W1426 R1427	T1394-S1419 CarbonylContact O-C 3.6Å; T1394-S1419 WeakPolarHBondContact O-CA 3.49Å; S1419-W1426 VanDerWaalsContact C-CE3 3.47Å; S1419-W1426 CarbonylContact O-C 3.53Å; S1419-W1426 WeakPolarHBondContact O-CA 3.25Å; S1419-R1427 PolarHBondContact N-O 2.72Å; S1419-R1427 PolarHBondContact O-N 3.37Å
1420	C	82.6	Confident	82.3	Confident	5 Å²	5	64.7 Å²	64.7	3%	0.034	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	119.8	173.1	-177.6	0	0	0	0	109.4	C1359 F1390 G1393 T1394 W1426	C1359-C1420 HydrophobicContact CB-CB 3.81Å; C1359-C1420 WeakPolarHBondContact CB-SG 3.5Å; C1359-C1420 WeakPolarHBondContact SG-CA 3.27Å; C1359-C1420 WeakPolarHBondContact SG-CB 3.4Å; C1359-C1420 CovalentContact SG-SG 2.02Å; C1359-C1420 PolarHBondContact SG-SG 3.24Å; F1390-C1420 PolarHBondContact O-SG 3.39Å; G1393-C1420 WeakPolarHBondContact CA-O 3.43Å; G1393-C1420 PolarHBondContact N-O 3.42Å; T1394-C1420 PolarHBondContact O-N 2.78Å; C1420-W1426 HydrophobicContact CB-CE3 4.17Å; C1420-W1426 HydrophobicContact CB-CH2 4.29Å; C1420-W1426 HydrophobicContact CB-CZ3 4.05Å
1421	D	78.2	Confident	82.6	Confident	27 Å²	27	60.7 Å²	60.7	14%	0.144	32%	0.32	C	S	.	.			trans	-95.7	175.5	-174.3	76	15.6	0	0	0	113.9	V1392 T1423 G1424 T1425 R1427	V1392-D1421 WeakPolarHBondContact CG2-O 3.39Å; D1421-T1423 PolarHBondContact O-N 2.78Å; D1421-T1423 VanDerWaalsContact O-N 3.15Å; D1421-T1423 WeakPolarHBondContact OD1-CA 3.48Å; D1421-T1423 WeakPolarHBondContact OD1-CB 3.21Å; D1421-T1423 PolarHBondContact OD1-N 2.62Å; D1421-T1423 PolarHBondContact OD1-OG1 3.29Å; D1421-G1424 PolarHBondContact O-N 3.06Å; D1421-G1424 PolarHBondContact OD1-N 2.83Å; D1421-T1425 VanDerWaalsContact CG-O 3.29Å; D1421-T1425 PolarHBondContact N-O 3.4Å; D1421-T1425 PolarHBondContact OD1-N 2.81Å; D1421-T1425 VanDerWaalsContact OD1-N 3.12Å; D1421-T1425 PolarHBondContact OD1-OG1 3.12Å; D1421-T1425 PolarHBondContact OD2-OG1 3.45Å; D1421-R1427 HydrophobicContact CB-CG 4.41Å; D1421-R1427 WeakPolarHBondContact OD2-CG 3.16Å; D1421-R1427 IonicContact OD2-NE 3.22Å
1422	S	75.9	Confident	82.8	Confident	95 Å²	95	59.2 Å²	59.2	66%	0.664	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.9	-177.8	54.8	0	0	0	0	114.7	L1357 G1424	L1357-S1422 WeakPolarHBondContact CD1-O 3.43Å; S1422-G1424 VanDerWaalsContact C-N 3.34Å
1423	T	74.4	Confident	82.9	Confident	74 Å²	74	57 Å²	57	45%	0.454	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-6.5	172.8	73	0	0	0	0	112.5	P1313 L1357 D1421 T1425	P1313-T1423 WeakPolarHBondContact CG-O 3.06Å; L1357-T1423 WeakPolarHBondContact CD2-O 3.33Å; D1421-T1423 PolarHBondContact O-N 2.78Å; D1421-T1423 VanDerWaalsContact O-N 3.15Å; D1421-T1423 WeakPolarHBondContact OD1-CA 3.48Å; D1421-T1423 WeakPolarHBondContact OD1-CB 3.21Å; D1421-T1423 PolarHBondContact OD1-N 2.62Å; D1421-T1423 PolarHBondContact OD1-OG1 3.29Å; T1423-T1425 PolarHBondContact OG1-OG1 2.86Å
1424	G	72.5	Confident	82.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	79.2	21.3	-171.6	0	0	0	0	0	112.9	P1313 C1359 D1421 S1422	P1313-G1424 WeakPolarHBondContact CB-O 3.35Å; P1313-G1424 WeakPolarHBondContact CG-O 3.18Å; C1359-G1424 WeakPolarHBondContact CA-O 3.09Å; C1359-G1424 PolarHBondContact SG-O 2.84Å; D1421-G1424 PolarHBondContact O-N 3.06Å; D1421-G1424 PolarHBondContact OD1-N 2.83Å; S1422-G1424 VanDerWaalsContact C-N 3.34Å
1425	T	79.6	Confident	82.7	Confident	50 Å²	50	54 Å²	54	31%	0.307	28%	0.279	S	S	.	.			trans	-114	153.4	175.6	75.7	0	0	0	0	112.7	P1313 C1359 D1421 T1423 R1427	P1313-T1425 HydrophobicContact CG-CG2 4.36Å; C1359-T1425 PolarHBondContact SG-O 3.48Å; C1359-T1425 VanDerWaalsContact SG-O 3.39Å; D1421-T1425 VanDerWaalsContact CG-O 3.29Å; D1421-T1425 PolarHBondContact N-O 3.4Å; D1421-T1425 PolarHBondContact OD1-N 2.81Å; D1421-T1425 VanDerWaalsContact OD1-N 3.12Å; D1421-T1425 PolarHBondContact OD1-OG1 3.12Å; D1421-T1425 PolarHBondContact OD2-OG1 3.45Å; T1423-T1425 PolarHBondContact OG1-OG1 2.86Å; T1425-R1427 PolarHBondContact O-N 2.82Å
1426	W	80.1	Confident	82.5	Confident	15 Å²	15	50.6 Å²	50.6	6%	0.057	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	119.2	174	-72.7	109.8	0	0	0	110.1	C1359 S1360 L1363 F1390 T1394 C1396 R1418 S1419 C1420	C1359-W1426 HydrophobicContact CB-CD2 4.03Å; C1359-W1426 HydrophobicContact CB-CG 4.14Å; C1359-W1426 HydrophobicContact CB-CZ2 4.08Å; S1360-W1426 PolarHBondContact O-NE1 3.44Å; L1363-W1426 HydrophobicContact CD1-CB 4.33Å; L1363-W1426 HydrophobicContact CD1-CD2 3.61Å; L1363-W1426 HydrophobicContact CD1-CE3 4.2Å; L1363-W1426 HydrophobicContact CD1-CG 3.66Å; L1363-W1426 HydrophobicContact CD1-CZ2 4.33Å; L1363-W1426 HydrophobicContact CD2-CD2 4.43Å; L1363-W1426 HydrophobicContact CD2-CE3 4.48Å; L1363-W1426 HydrophobicContact CD2-CH2 4.06Å; L1363-W1426 HydrophobicContact CD2-CZ2 3.94Å; L1363-W1426 HydrophobicContact CD2-CZ3 4.31Å; F1390-W1426 HydrophobicContact CB-CH2 4.14Å; F1390-W1426 HydrophobicContact CB-CZ2 3.77Å; F1390-W1426 HydrophobicContact CD2-CH2 4.33Å; F1390-W1426 AromaticContact CD2-CZ2 3.54Å; F1390-W1426 HydrophobicContact CD2-CZ2 3.54Å; F1390-W1426 HydrophobicContact CE2-CZ2 4.28Å; F1390-W1426 HydrophobicContact CG-CH2 4.2Å; F1390-W1426 AromaticContact CG-CZ2 3.78Å; F1390-W1426 HydrophobicContact CG-CZ2 3.78Å; T1394-W1426 HydrophobicContact CG2-CH2 4Å; T1394-W1426 WeakPolarHBondContact O-CZ3 3.45Å; C1396-W1426 HydrophobicContact CB-CH2 4.2Å; C1396-W1426 HydrophobicContact CB-CZ3 4.19Å; C1396-W1426 WeakPolarHBondContact SG-CH2 3.48Å; R1418-W1426 HydrophobicContact CB-CE3 3.87Å; R1418-W1426 VanDerWaalsContact NH1-CB 3.32Å; R1418-W1426 PolarHBondContact NH2-O 3.05Å; S1419-W1426 VanDerWaalsContact C-CE3 3.47Å; S1419-W1426 CarbonylContact O-C 3.53Å; S1419-W1426 WeakPolarHBondContact O-CA 3.25Å; C1420-W1426 HydrophobicContact CB-CE3 4.17Å; C1420-W1426 HydrophobicContact CB-CH2 4.29Å; C1420-W1426 HydrophobicContact CB-CZ3 4.05Å
1427	R	84.1	Confident	82.3	Confident	138 Å²	138	53.8 Å²	53.8	52%	0.521	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	156	165.4	-88.8	-171.3	178.4	-138	1.2	112.1	R1418 S1419 D1421 T1425	R1418-R1427 CarbonylContact C-O 3.31Å; R1418-R1427 WeakPolarHBondContact CA-O 3.33Å; R1418-R1427 WeakPolarHBondContact CB-O 3.27Å; R1418-R1427 WeakPolarHBondContact CG-O 3.45Å; R1418-R1427 PolarHBondContact NE-O 2.94Å; S1419-R1427 PolarHBondContact N-O 2.72Å; S1419-R1427 PolarHBondContact O-N 3.37Å; D1421-R1427 HydrophobicContact CB-CG 4.41Å; D1421-R1427 WeakPolarHBondContact OD2-CG 3.16Å; D1421-R1427 IonicContact OD2-NE 3.22Å; T1425-R1427 PolarHBondContact O-N 2.82Å
1428	G	79.1	Confident	82.1	Confident	40 Å²	40	55.1 Å²	55.1	41%	0.412	29%	0.292	S	S	.	.	S	Bend	trans	107	169.4	-176.6	0	0	0	0	0	113	R1418	R1418-G1428 VanDerWaalsContact CZ-O 3.27Å; R1418-G1428 PolarHBondContact NE-O 3.4Å; R1418-G1428 PolarHBondContact NH2-O 2.66Å
1429	P	83.2	Confident	81.8	Confident	41 Å²	41	53.8 Å²	53.8	27%	0.266	29%	0.288	S	S	.	.			trans	-69.9	-178.4	-170.9	27.5	-34.1	0	0	0	113.5	V1406 F1416 R1418	V1406-P1429 HydrophobicContact CG1-CB 3.85Å; V1406-P1429 HydrophobicContact CG1-CG 3.91Å; F1416-P1429 HydrophobicContact CB-CG 3.92Å; F1416-P1429 HydrophobicContact CD2-CG 3.73Å; F1416-P1429 WeakPolarHBondContact CE2-O 3.41Å; F1416-P1429 HydrophobicContact CG-CG 4.02Å; R1418-P1429 WeakPolarHBondContact CD-O 3.33Å; R1418-P1429 PolarHBondContact NE-O 2.88Å
1430	R	84.5	Confident	81.5	Confident	123 Å²	123	55.8 Å²	55.8	46%	0.464	30%	0.295	S	S	.	.			trans	-136	169.3	178.4	58.2	171	-175.6	146.8	3.1	111.8	L1367 E1407	L1367-R1430 HydrophobicContact CD2-CB 3.56Å; E1407-R1430 HydrophobicContact CB-CG 4.19Å; E1407-R1430 WeakPolarHBondContact CB-O 3.46Å; E1407-R1430 VanDerWaalsContact CD-NE 3.27Å; E1407-R1430 PolarHBondContact N-O 2.96Å; E1407-R1430 IonicContact OE1-CZ 3.84Å; E1407-R1430 VanDerWaalsContact OE1-CZ 3.25Å; E1407-R1430 IonicContact OE1-NE 3.99Å; E1407-R1430 PolarHBondContact OE1-NE 3.27Å; E1407-R1430 VanDerWaalsContact OE1-NE 3.08Å; E1407-R1430 IonicContact OE1-NH2 3.41Å; E1407-R1430 PolarHBondContact OE1-NH2 3.18Å; E1407-R1430 WeakPolarHBondContact OE2-CD 3.24Å; E1407-R1430 WeakPolarHBondContact OE2-CG 3.49Å; E1407-R1430 IonicContact OE2-CZ 3.74Å; E1407-R1430 IonicContact OE2-NE 3.69Å; E1407-R1430 PolarHBondContact OE2-NE 3.43Å; E1407-R1430 IonicContact OE2-NH2 2.79Å
1431	C	87	Confident	81.3	Confident	4 Å²	4	58.1 Å²	58.1	3%	0.027	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	122.3	169.2	-45.5	0	0	0	0	111.3	L1367 N1368 C1400 Y1404 H1405 F1416	L1367-C1431 WeakPolarHBondContact O-CB 3.47Å; L1367-C1431 PolarHBondContact O-N 2.76Å; L1367-C1431 VanDerWaalsContact O-N 3.16Å; L1367-C1431 PolarHBondContact O-SG 2.59Å; N1368-C1431 HydrophobicContact CB-CB 4.22Å; C1400-C1431 WeakPolarHBondContact CA-SG 3.33Å; C1400-C1431 HydrophobicContact CB-CB 3.68Å; C1400-C1431 WeakPolarHBondContact CB-SG 3.36Å; C1400-C1431 WeakPolarHBondContact SG-CB 3.44Å; C1400-C1431 CovalentContact SG-SG 2.03Å; C1400-C1431 PolarHBondContact SG-SG 3.41Å; Y1404-C1431 HydrophobicContact CD1-CB 4.43Å; H1405-C1431 CarbonylContact O-C 3.56Å; H1405-C1431 WeakPolarHBondContact O-CA 3.47Å; F1416-C1431 VanDerWaalsContact CE1-SG 3.52Å
1432	V	84.9	Confident	81.5	Confident	31 Å²	31	57 Å²	57	19%	0.188	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	150.8	170.4	-71.8	0	0	0	0	109.7	Y1404 H1405 E1407	Y1404-V1432 CarbonylContact C-O 3.57Å; Y1404-V1432 WeakPolarHBondContact CA-O 3.38Å; Y1404-V1432 WeakPolarHBondContact CB-O 3.35Å; H1405-V1432 PolarHBondContact N-O 3.31Å; H1405-V1432 PolarHBondContact O-N 2.74Å; E1407-V1432 HydrophobicContact CB-CG1 3.94Å; E1407-V1432 HydrophobicContact CB-CG2 4.08Å; E1407-V1432 HydrophobicContact CG-CG1 4.04Å; E1407-V1432 WeakPolarHBondContact OE1-CG1 3.31Å
1433	K	84.6	Confident	82	Confident	60 Å²	60	52.6 Å²	52.6	26%	0.261	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	140.8	179	-142	177.2	-178.2	-174.9	0	108.8	Y1404 K1435 E1454 V1455	Y1404-K1433 HydrophobicContact CD1-CB 4.1Å; Y1404-K1433 HydrophobicContact CD1-CG 4.21Å; Y1404-K1433 HydrophobicContact CE1-CB 3.87Å; Y1404-K1433 HydrophobicContact CE1-CD 4.47Å; Y1404-K1433 HydrophobicContact CE1-CG 3.76Å; Y1404-K1433 HydrophobicContact CE2-CG 4.26Å; K1433-K1435 PolarHBondContact O-N 2.78Å; K1433-E1454 HydrophobicContact CD-CB 4.25Å; K1433-E1454 HydrophobicContact CD-CG 4.26Å; K1433-E1454 VanDerWaalsContact CD-OE2 3.27Å; K1433-E1454 WeakPolarHBondContact CD-OE2 2.98Å; K1433-E1454 WeakPolarHBondContact CE-OE2 3.06Å; K1433-E1454 IonicContact NZ-OE2 3.93Å; K1433-E1454 PolarHBondContact NZ-OE2 3.09Å; K1433-V1455 HydrophobicContact CG-CG1 4.25Å
1434	I	84.7	Confident	82	Confident	9 Å²	9	54.9 Å²	54.9	5%	0.046	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-59.8	130.7	173.7	-63.5	173	0	0	0	108.1	G1403 V1411 V1455 S1474	G1403-I1434 PolarHBondContact O-N 2.77Å; V1411-I1434 HydrophobicContact CG1-CD1 3.63Å; V1411-I1434 HydrophobicContact CG1-CG1 3.95Å; V1411-I1434 HydrophobicContact CG1-CG2 4.47Å; I1434-V1455 HydrophobicContact CB-CB 4.39Å; I1434-V1455 HydrophobicContact CB-CG1 4.47Å; I1434-V1455 PolarHBondContact O-N 2.59Å; I1434-S1474 VanDerWaalsContact CD1-O 3.31Å; I1434-S1474 WeakPolarHBondContact CD1-O 3.31Å
1435	K	84.4	Confident	82.2	Confident	134 Å²	134	58 Å²	58	58%	0.583	30%	0.304	S	S	*	.	B	Isolated β-bridge	trans	-123.1	144.7	175.6	-71	-178.6	177.7	-177.1	0	109.3	K1433 F1453 E1454	K1433-K1435 PolarHBondContact O-N 2.78Å; K1435-F1453 CarbonylContact C-O 3.58Å; K1435-F1453 WeakPolarHBondContact CA-O 3.38Å; K1435-F1453 WeakPolarHBondContact CB-O 3.27Å; K1435-E1454 HydrophobicContact CG-CG 4.35Å
1436	C	85.8	Confident	82.4	Confident	8 Å²	8	57.4 Å²	57.4	5%	0.054	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-82.1	157.9	168.2	-62.8	0	0	0	0	110.6	F1453 C1472 G1476 T1477 W1478	C1436-F1453 PolarHBondContact N-O 2.77Å; C1436-F1453 WeakPolarHBondContact O-CB 3.4Å; C1436-C1472 HydrophobicContact CB-CB 3.86Å; C1436-C1472 WeakPolarHBondContact CB-SG 3.5Å; C1436-C1472 PolarHBondContact N-SG 3.2Å; C1436-C1472 WeakPolarHBondContact SG-CA 3.38Å; C1436-C1472 WeakPolarHBondContact SG-CB 3.44Å; C1436-C1472 CovalentContact SG-SG 2.03Å; C1436-C1472 PolarHBondContact SG-SG 3.45Å; C1436-G1476 WeakPolarHBondContact CA-O 3.27Å; C1436-G1476 PolarHBondContact SG-O 3.18Å; C1436-T1477 PolarHBondContact SG-O 3.22Å; C1436-W1478 HydrophobicContact CB-CD2 3.94Å; C1436-W1478 VanDerWaalsContact CB-CE2 3.48Å; C1436-W1478 HydrophobicContact CB-CG 4.23Å; C1436-W1478 HydrophobicContact CB-CH2 4.42Å; C1436-W1478 HydrophobicContact CB-CZ2 3.75Å
1437	P	82.8	Confident	82.7	Confident	87 Å²	87	59 Å²	59	57%	0.565	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-52.7	151.7	172	-25.9	34.1	0	0	0	111.8	G1476 W1478	P1437-G1476 VanDerWaalsContact CD-O 3.29Å; P1437-G1476 WeakPolarHBondContact CD-O 3.29Å; P1437-W1478 PolarHBondContact O-NE1 2.95Å
1438	E	82.6	Confident	82.6	Confident	132 Å²	132	58 Å²	58	62%	0.617	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-61.7	137.3	169.8	-176.6	155	-134.9	0	0	109.7	N1440 Y1447 F1453	E1438-N1440 PolarHBondContact O-N 2.78Å; E1438-Y1447 PolarHBondContact OE1-OH 3.49Å; E1438-F1453 HydrophobicContact CB-CD2 4.19Å; E1438-F1453 HydrophobicContact CB-CE2 3.75Å; E1438-F1453 HydrophobicContact CB-CZ 4.19Å; E1438-F1453 HydrophobicContact CG-CD2 4.46Å; E1438-F1453 HydrophobicContact CG-CE2 3.57Å; E1438-F1453 HydrophobicContact CG-CZ 3.62Å; E1438-F1453 WeakPolarHBondContact OE1-CE2 3.08Å; E1438-F1453 WeakPolarHBondContact OE1-CZ 3.05Å
1439	P	80.5	Confident	82.9	Confident	12 Å²	12	57.1 Å²	57.1	8%	0.078	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-57.2	141.3	178.2	-24.9	33.4	0	0	0	111.8	Y1443 Y1447 F1453 F1461 W1478	P1439-Y1443 HydrophobicContact CB-CD2 4.37Å; P1439-Y1447 HydrophobicContact CB-CD1 3.98Å; P1439-Y1447 HydrophobicContact CB-CE1 3.71Å; P1439-Y1447 HydrophobicContact CG-CD1 4.23Å; P1439-Y1447 HydrophobicContact CG-CD2 4.31Å; P1439-Y1447 HydrophobicContact CG-CE1 3.97Å; P1439-Y1447 HydrophobicContact CG-CE2 4.06Å; P1439-Y1447 HydrophobicContact CG-CG 4.39Å; P1439-F1453 HydrophobicContact CG-CD1 4.49Å; P1439-F1453 HydrophobicContact CG-CE1 4.07Å; P1439-F1461 HydrophobicContact CB-CE1 3.68Å; P1439-F1461 HydrophobicContact CB-CZ 3.68Å; P1439-F1461 HydrophobicContact CG-CE1 4.16Å; P1439-F1461 HydrophobicContact CG-CZ 3.72Å; P1439-W1478 HydrophobicContact CG-CZ2 4.28Å
1440	N	79.6	Confident	83	Confident	86 Å²	86	59.6 Å²	59.6	46%	0.46	31%	0.313	S	S	.	.			trans	-44.7	137.8	-173.7	-173.1	-38.4	0	0	0	112.6	E1438 V1442 Y1443	E1438-N1440 PolarHBondContact O-N 2.78Å; N1440-V1442 PolarHBondContact O-N 2.8Å; N1440-V1442 WeakPolarHBondContact OD1-CG2 3.3Å; N1440-V1442 PolarHBondContact OD1-N 2.79Å; N1440-V1442 VanDerWaalsContact OD1-N 3.13Å; N1440-Y1443 HydrophobicContact CB-CD2 3.96Å; N1440-Y1443 HydrophobicContact CB-CE2 3.88Å; N1440-Y1443 WeakPolarHBondContact O-CD2 3.44Å; N1440-Y1443 PolarHBondContact O-N 2.81Å
1441	V	78.3	Confident	82.8	Confident	55 Å²	55	60.9 Å²	60.9	33%	0.333	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-45.5	-29.4	179.2	174.3	0	0	0	0	113.4	Y1443 R1444 E1557	V1441-Y1443 PolarHBondContact O-N 2.85Å; V1441-Y1443 VanDerWaalsContact O-N 3.14Å; V1441-R1444 WeakPolarHBondContact O-CB 3.18Å; V1441-R1444 PolarHBondContact O-N 3.21Å; V1441-E1557 HydrophobicContact CG1-CB 3.48Å; V1441-E1557 VanDerWaalsContact CG1-CB 3.48Å
1442	V	83.7	Confident	82.4	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.024	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-48.3	-36.6	169.9	171.7	0	0	0	0	114.3	N1440 L1486 T1549 L1552	N1440-V1442 PolarHBondContact O-N 2.8Å; N1440-V1442 WeakPolarHBondContact OD1-CG2 3.3Å; N1440-V1442 PolarHBondContact OD1-N 2.79Å; N1440-V1442 VanDerWaalsContact OD1-N 3.13Å; V1442-L1486 HydrophobicContact CG1-CD1 4.25Å; V1442-L1486 HydrophobicContact CG1-CD2 3.43Å; V1442-L1486 VanDerWaalsContact CG1-CD2 3.43Å; V1442-T1549 HydrophobicContact CG2-CG2 3.57Å; V1442-L1552 HydrophobicContact CG1-CD1 4.08Å; V1442-L1552 HydrophobicContact CG1-CG 4.22Å; V1442-L1552 PolarHBondContact O-N 2.69Å
1443	Y	85.3	Confident	82.5	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.008	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-94.7	6	-177	-47.5	-61.7	0	0	0	113.4	P1439 N1440 V1441 G1445 L1446 Y1447 F1461 N1482 C1484 L1486 L1552	P1439-Y1443 HydrophobicContact CB-CD2 4.37Å; N1440-Y1443 HydrophobicContact CB-CD2 3.96Å; N1440-Y1443 HydrophobicContact CB-CE2 3.88Å; N1440-Y1443 WeakPolarHBondContact O-CD2 3.44Å; N1440-Y1443 PolarHBondContact O-N 2.81Å; V1441-Y1443 PolarHBondContact O-N 2.85Å; V1441-Y1443 VanDerWaalsContact O-N 3.14Å; Y1443-G1445 PolarHBondContact O-N 2.85Å; Y1443-L1446 PolarHBondContact O-N 2.71Å; Y1443-Y1447 VanDerWaalsContact O-CD1 3.27Å; Y1443-Y1447 WeakPolarHBondContact O-CD1 3.46Å; Y1443-F1461 HydrophobicContact CD1-CD1 4.28Å; Y1443-F1461 HydrophobicContact CD2-CD1 4.38Å; Y1443-F1461 AromaticContact CD2-CE1 3.95Å; Y1443-F1461 HydrophobicContact CD2-CE1 3.95Å; Y1443-F1461 AromaticContact CG-CD1 3.97Å; Y1443-F1461 HydrophobicContact CG-CD1 3.97Å; Y1443-F1461 AromaticContact CG-CE1 3.94Å; Y1443-F1461 HydrophobicContact CG-CE1 3.94Å; Y1443-N1482 WeakPolarHBondContact OH-CA 3.47Å; Y1443-N1482 PolarHBondContact OH-OD1 3.18Å; Y1443-C1484 HydrophobicContact CD1-CB 4.34Å; Y1443-C1484 HydrophobicContact CE1-CB 3.81Å; Y1443-L1486 HydrophobicContact CE1-CD2 4.05Å; Y1443-L1552 HydrophobicContact CD1-CD1 3.59Å; Y1443-L1552 HydrophobicContact CE1-CD1 4Å
1444	R	75.8	Confident	82.4	Confident	122 Å²	122	63 Å²	63	46%	0.46	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	123.6	-177.9	-157.8	177.1	-136.6	-168.5	4	109.9	V1441 E1557	V1441-R1444 WeakPolarHBondContact O-CB 3.18Å; V1441-R1444 PolarHBondContact O-N 3.21Å; R1444-E1557 WeakPolarHBondContact CD-OE2 3.39Å; R1444-E1557 IonicContact CZ-OE2 3.78Å; R1444-E1557 IonicContact NE-OE2 3.79Å; R1444-E1557 IonicContact NH1-OE2 2.7Å; R1444-E1557 PolarHBondContact NH1-OE2 3.43Å
1445	G	76.2	Confident	82.5	Confident	64 Å²	64	64.1 Å²	64.1	66%	0.66	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	7.4	-176.3	0	0	0	0	0	116.6	Y1443	Y1443-G1445 PolarHBondContact O-N 2.85Å
1446	L	83	Confident	82.5	Confident	38 Å²	38	59.1 Å²	59.1	20%	0.199	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	-4.9	-179.3	-68.9	172.6	0	0	0	115.5	Y1443 H1462 L1552	Y1443-L1446 PolarHBondContact O-N 2.71Å; L1446-H1462 WeakPolarHBondContact O-CB 3.5Å; L1446-H1462 PolarHBondContact O-N 3.28Å; L1446-L1552 HydrophobicContact CD1-CB 3.22Å; L1446-L1552 HydrophobicContact CD1-CD1 3.71Å; L1446-L1552 HydrophobicContact CD1-CG 4.05Å
1447	Y	86.5	Confident	82.5	Confident	50 Å²	50	58.8 Å²	58.8	20%	0.196	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	150.7	176.1	65	-99.3	0	0	0	111.7	E1438 P1439 Y1443 C1449 F1453 S1460 F1461	E1438-Y1447 PolarHBondContact OE1-OH 3.49Å; P1439-Y1447 HydrophobicContact CB-CD1 3.98Å; P1439-Y1447 HydrophobicContact CB-CE1 3.71Å; P1439-Y1447 HydrophobicContact CG-CD1 4.23Å; P1439-Y1447 HydrophobicContact CG-CD2 4.31Å; P1439-Y1447 HydrophobicContact CG-CE1 3.97Å; P1439-Y1447 HydrophobicContact CG-CE2 4.06Å; P1439-Y1447 HydrophobicContact CG-CG 4.39Å; Y1443-Y1447 VanDerWaalsContact O-CD1 3.27Å; Y1443-Y1447 WeakPolarHBondContact O-CD1 3.46Å; Y1447-C1449 VanDerWaalsContact CD2-SG 3.52Å; Y1447-F1453 AromaticContact CE2-CE1 3.76Å; Y1447-F1453 HydrophobicContact CE2-CE1 3.76Å; Y1447-F1453 AromaticContact CE2-CZ 3.98Å; Y1447-F1453 HydrophobicContact CE2-CZ 3.98Å; Y1447-S1460 WeakPolarHBondContact CA-O 3.37Å; Y1447-F1461 VanDerWaalsContact CB-CD1 3.49Å; Y1447-F1461 HydrophobicContact CD1-CD1 4.26Å; Y1447-F1461 AromaticContact CD1-CE1 3.78Å; Y1447-F1461 HydrophobicContact CD1-CE1 3.78Å; Y1447-F1461 HydrophobicContact CD1-CZ 4.48Å; Y1447-F1461 HydrophobicContact CG-CD1 4.24Å; Y1447-F1461 AromaticContact CG-CE1 3.87Å; Y1447-F1461 HydrophobicContact CG-CE1 3.87Å; Y1447-F1461 HydrophobicContact CG-CZ 4.25Å
1448	N	81.7	Confident	82.9	Confident	115 Å²	115	58 Å²	58	62%	0.615	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	131.5	170.4	-157.8	-7.7	0	0	0	109.2	C1459 S1460	N1448-C1459 CarbonylContact O-C 3.59Å; N1448-C1459 WeakPolarHBondContact O-CA 3.39Å; N1448-S1460 PolarHBondContact N-O 3.33Å; N1448-S1460 PolarHBondContact O-N 3.15Å; N1448-S1460 PolarHBondContact O-OG 3.23Å
1449	C	86.5	Confident	83.1	Confident	22 Å²	22	51.8 Å²	51.8	15%	0.149	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.2	-168.9	-65.7	0	0	0	0	112.1	Y1447 R1451 G1452 C1459	Y1447-C1449 VanDerWaalsContact CD2-SG 3.52Å; C1449-R1451 VanDerWaalsContact C-N 3.25Å; C1449-R1451 PolarHBondContact O-N 2.84Å; C1449-R1451 VanDerWaalsContact O-N 3.12Å; C1449-G1452 VanDerWaalsContact CB-O 3.24Å; C1449-G1452 WeakPolarHBondContact CB-O 3.09Å; C1449-G1452 PolarHBondContact O-N 3.47Å; C1449-C1459 HydrophobicContact CB-CB 4.1Å; C1449-C1459 WeakPolarHBondContact CB-SG 3.36Å; C1449-C1459 WeakPolarHBondContact SG-CB 3.44Å; C1449-C1459 CovalentContact SG-SG 2.03Å; C1449-C1459 PolarHBondContact SG-SG 3.37Å
1450	T	85.2	Confident	83.5	Confident	94 Å²	94	52.7 Å²	52.7	58%	0.577	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-36.7	-175.9	48.1	0	0	0	0	114.3	Q1458	T1450-Q1458 WeakPolarHBondContact CB-O 3.32Å; T1450-Q1458 HydrophobicContact CG2-CB 4.36Å; T1450-Q1458 WeakPolarHBondContact CG2-O 3.42Å; T1450-Q1458 PolarHBondContact N-O 2.88Å; T1450-Q1458 PolarHBondContact OG1-N 2.94Å; T1450-Q1458 PolarHBondContact OG1-O 3.13Å
1451	R	79.1	Confident	83.9	Confident	149 Å²	149	48.8 Å²	48.8	56%	0.562	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.9	42.3	179.5	-66.4	-175.7	-74	-150.6	-3.3	112.5	C1449 F1453 E1454 G1456 S1457	C1449-R1451 VanDerWaalsContact C-N 3.25Å; C1449-R1451 PolarHBondContact O-N 2.84Å; C1449-R1451 VanDerWaalsContact O-N 3.12Å; R1451-F1453 PolarHBondContact O-N 3.36Å; R1451-E1454 PolarHBondContact O-N 3.42Å; R1451-G1456 PolarHBondContact NH2-O 2.68Å; R1451-S1457 PolarHBondContact N-OG 2.88Å
1452	G	80	Confident	84.2	Confident	36 Å²	36	51.2 Å²	51.2	37%	0.371	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	-128.3	-172	0	0	0	0	0	110.5	C1449 S1457	C1449-G1452 VanDerWaalsContact CB-O 3.24Å; C1449-G1452 WeakPolarHBondContact CB-O 3.09Å; C1449-G1452 PolarHBondContact O-N 3.47Å; G1452-S1457 VanDerWaalsContact O-CB 3.25Å; G1452-S1457 WeakPolarHBondContact O-CB 3.42Å; G1452-S1457 PolarHBondContact O-OG 3.38Å
1453	F	86.9	Confident	84.1	Confident	46 Å²	46	51.7 Å²	51.7	20%	0.202	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	19	-179.8	-42.6	-49.3	0	0	0	113.8	K1435 C1436 E1438 P1439 Y1447 R1451 C1472 W1478	K1435-F1453 CarbonylContact C-O 3.58Å; K1435-F1453 WeakPolarHBondContact CA-O 3.38Å; K1435-F1453 WeakPolarHBondContact CB-O 3.27Å; C1436-F1453 PolarHBondContact N-O 2.77Å; C1436-F1453 WeakPolarHBondContact O-CB 3.4Å; E1438-F1453 HydrophobicContact CB-CD2 4.19Å; E1438-F1453 HydrophobicContact CB-CE2 3.75Å; E1438-F1453 HydrophobicContact CB-CZ 4.19Å; E1438-F1453 HydrophobicContact CG-CD2 4.46Å; E1438-F1453 HydrophobicContact CG-CE2 3.57Å; E1438-F1453 HydrophobicContact CG-CZ 3.62Å; E1438-F1453 WeakPolarHBondContact OE1-CE2 3.08Å; E1438-F1453 WeakPolarHBondContact OE1-CZ 3.05Å; P1439-F1453 HydrophobicContact CG-CD1 4.49Å; P1439-F1453 HydrophobicContact CG-CE1 4.07Å; Y1447-F1453 AromaticContact CE2-CE1 3.76Å; Y1447-F1453 HydrophobicContact CE2-CE1 3.76Å; Y1447-F1453 AromaticContact CE2-CZ 3.98Å; Y1447-F1453 HydrophobicContact CE2-CZ 3.98Å; R1451-F1453 PolarHBondContact O-N 3.36Å; F1453-C1472 PolarHBondContact O-SG 3.15Å; F1453-W1478 HydrophobicContact CB-CH2 4.38Å; F1453-W1478 HydrophobicContact CB-CZ2 4Å; F1453-W1478 AromaticContact CD1-CH2 4Å; F1453-W1478 HydrophobicContact CD1-CH2 4Å; F1453-W1478 AromaticContact CD1-CZ2 3.69Å; F1453-W1478 HydrophobicContact CD1-CZ2 3.69Å; F1453-W1478 HydrophobicContact CG-CZ2 4.18Å
1454	E	82.7	Confident	83.5	Confident	59 Å²	59	55.9 Å²	55.9	28%	0.276	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-69	154.1	177.5	-60.8	-169	155.1	0	0	112.7	K1433 K1435 R1451 G1456 S1457 C1472	K1433-E1454 HydrophobicContact CD-CB 4.25Å; K1433-E1454 HydrophobicContact CD-CG 4.26Å; K1433-E1454 VanDerWaalsContact CD-OE2 3.27Å; K1433-E1454 WeakPolarHBondContact CD-OE2 2.98Å; K1433-E1454 WeakPolarHBondContact CE-OE2 3.06Å; K1433-E1454 IonicContact NZ-OE2 3.93Å; K1433-E1454 PolarHBondContact NZ-OE2 3.09Å; K1435-E1454 HydrophobicContact CG-CG 4.35Å; R1451-E1454 PolarHBondContact O-N 3.42Å; E1454-G1456 PolarHBondContact O-N 3.45Å; E1454-S1457 WeakPolarHBondContact O-CA 3.48Å; E1454-S1457 WeakPolarHBondContact O-CB 3.29Å; E1454-S1457 PolarHBondContact O-N 2.97Å; E1454-C1472 WeakPolarHBondContact O-CB 3.03Å
1455	V	85.6	Confident	83.5	Confident	32 Å²	32	54 Å²	54	19%	0.194	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	127.6	171.6	60.4	0	0	0	0	111.9	K1433 I1434 S1457	K1433-V1455 HydrophobicContact CG-CG1 4.25Å; I1434-V1455 HydrophobicContact CB-CB 4.39Å; I1434-V1455 HydrophobicContact CB-CG1 4.47Å; I1434-V1455 PolarHBondContact O-N 2.59Å; V1455-S1457 VanDerWaalsContact C-N 3.35Å
1456	G	84.4	Confident	83.9	Confident	29 Å²	29	58.4 Å²	58.4	30%	0.299	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	10	-172.8	0	0	0	0	0	115.1	R1451 E1454 C1472	R1451-G1456 PolarHBondContact NH2-O 2.68Å; E1454-G1456 PolarHBondContact O-N 3.45Å; G1456-C1472 PolarHBondContact N-O 3.33Å
1457	S	86.5	Confident	83.8	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	35%	0.345	C	S	.	.			trans	-75.3	127.9	167	-169.7	0	0	0	0	110.1	R1451 G1452 E1454 V1455 I1471 C1472	R1451-S1457 PolarHBondContact N-OG 2.88Å; G1452-S1457 VanDerWaalsContact O-CB 3.25Å; G1452-S1457 WeakPolarHBondContact O-CB 3.42Å; G1452-S1457 PolarHBondContact O-OG 3.38Å; E1454-S1457 WeakPolarHBondContact O-CA 3.48Å; E1454-S1457 WeakPolarHBondContact O-CB 3.29Å; E1454-S1457 PolarHBondContact O-N 2.97Å; V1455-S1457 VanDerWaalsContact C-N 3.35Å; S1457-I1471 CarbonylContact O-C 3.51Å; S1457-I1471 WeakPolarHBondContact O-CA 3.35Å; S1457-C1472 PolarHBondContact O-N 3.25Å
1458	Q	90.2	Very high	83.8	Confident	72 Å²	72	64.9 Å²	64.9	34%	0.336	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.2	172.8	-174.8	170.7	6.9	0	0	108.1	T1450 E1469 S1470 I1471	T1450-Q1458 WeakPolarHBondContact CB-O 3.32Å; T1450-Q1458 HydrophobicContact CG2-CB 4.36Å; T1450-Q1458 WeakPolarHBondContact CG2-O 3.42Å; T1450-Q1458 PolarHBondContact N-O 2.88Å; T1450-Q1458 PolarHBondContact OG1-N 2.94Å; T1450-Q1458 PolarHBondContact OG1-O 3.13Å; Q1458-E1469 HydrophobicContact CG-CB 4.45Å; Q1458-E1469 PolarHBondContact NE2-OE2 3.05Å; Q1458-S1470 CarbonylContact C-O 3.56Å; Q1458-S1470 WeakPolarHBondContact CA-O 3.15Å; Q1458-I1471 HydrophobicContact CB-CG1 4.26Å; Q1458-I1471 HydrophobicContact CG-CG1 4.08Å
1459	C	87.6	Confident	84.1	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	122.6	179.7	-68	0	0	0	0	110.2	N1448 C1449 F1461 E1469 S1470 W1478	N1448-C1459 CarbonylContact O-C 3.59Å; N1448-C1459 WeakPolarHBondContact O-CA 3.39Å; C1449-C1459 HydrophobicContact CB-CB 4.1Å; C1449-C1459 WeakPolarHBondContact CB-SG 3.36Å; C1449-C1459 WeakPolarHBondContact SG-CB 3.44Å; C1449-C1459 CovalentContact SG-SG 2.03Å; C1449-C1459 PolarHBondContact SG-SG 3.37Å; C1459-F1461 HydrophobicContact CB-CD2 4.24Å; C1459-F1461 HydrophobicContact CB-CE2 3.52Å; C1459-F1461 HydrophobicContact CB-CZ 4.17Å; C1459-F1461 WeakPolarHBondContact O-CD2 3.42Å; C1459-E1469 CarbonylContact O-C 3.55Å; C1459-E1469 VanDerWaalsContact O-CA 3.28Å; C1459-E1469 WeakPolarHBondContact O-CA 3.25Å; C1459-S1470 PolarHBondContact N-O 3.44Å; C1459-S1470 PolarHBondContact O-N 2.82Å; C1459-W1478 HydrophobicContact CB-CH2 4.47Å; C1459-W1478 HydrophobicContact CB-CZ3 4.29Å; C1459-W1478 WeakPolarHBondContact SG-CH2 3.16Å; C1459-W1478 VanDerWaalsContact SG-CZ3 3.58Å
1460	S	88.6	Confident	84.2	Confident	32 Å²	32	63.6 Å²	63.6	22%	0.224	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	111.9	176.9	48.8	0	0	0	0	110.7	Y1447 N1448 R1468	Y1447-S1460 WeakPolarHBondContact CA-O 3.37Å; N1448-S1460 PolarHBondContact N-O 3.33Å; N1448-S1460 PolarHBondContact O-N 3.15Å; N1448-S1460 PolarHBondContact O-OG 3.23Å; S1460-R1468 CarbonylContact C-O 3.59Å; S1460-R1468 WeakPolarHBondContact CA-O 3.3Å
1461	F	87.5	Confident	84.5	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.018	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.4	-179.1	-66	-105.6	0	0	0	109.8	P1439 Y1443 Y1447 C1459 C1463 T1467 R1468 P1483	P1439-F1461 HydrophobicContact CB-CE1 3.68Å; P1439-F1461 HydrophobicContact CB-CZ 3.68Å; P1439-F1461 HydrophobicContact CG-CE1 4.16Å; P1439-F1461 HydrophobicContact CG-CZ 3.72Å; Y1443-F1461 HydrophobicContact CD1-CD1 4.28Å; Y1443-F1461 HydrophobicContact CD2-CD1 4.38Å; Y1443-F1461 AromaticContact CD2-CE1 3.95Å; Y1443-F1461 HydrophobicContact CD2-CE1 3.95Å; Y1443-F1461 AromaticContact CG-CD1 3.97Å; Y1443-F1461 HydrophobicContact CG-CD1 3.97Å; Y1443-F1461 AromaticContact CG-CE1 3.94Å; Y1443-F1461 HydrophobicContact CG-CE1 3.94Å; Y1447-F1461 VanDerWaalsContact CB-CD1 3.49Å; Y1447-F1461 HydrophobicContact CD1-CD1 4.26Å; Y1447-F1461 AromaticContact CD1-CE1 3.78Å; Y1447-F1461 HydrophobicContact CD1-CE1 3.78Å; Y1447-F1461 HydrophobicContact CD1-CZ 4.48Å; Y1447-F1461 HydrophobicContact CG-CD1 4.24Å; Y1447-F1461 AromaticContact CG-CE1 3.87Å; Y1447-F1461 HydrophobicContact CG-CE1 3.87Å; Y1447-F1461 HydrophobicContact CG-CZ 4.25Å; C1459-F1461 HydrophobicContact CB-CD2 4.24Å; C1459-F1461 HydrophobicContact CB-CE2 3.52Å; C1459-F1461 HydrophobicContact CB-CZ 4.17Å; C1459-F1461 WeakPolarHBondContact O-CD2 3.42Å; F1461-C1463 VanDerWaalsContact C-N 3.3Å; F1461-C1463 PolarHBondContact O-N 2.92Å; F1461-T1467 CarbonylContact O-C 3.17Å; F1461-T1467 VanDerWaalsContact O-CA 3.31Å; F1461-T1467 WeakPolarHBondContact O-CA 2.94Å; F1461-R1468 PolarHBondContact N-O 2.9Å; F1461-R1468 PolarHBondContact O-N 2.95Å; F1461-P1483 HydrophobicContact CB-CB 4.2Å; F1461-P1483 HydrophobicContact CB-CG 4.11Å; F1461-P1483 HydrophobicContact CD1-CB 4.39Å; F1461-P1483 HydrophobicContact CD1-CG 3.43Å; F1461-P1483 VanDerWaalsContact CD1-CG 3.43Å; F1461-P1483 HydrophobicContact CD2-CB 3.78Å; F1461-P1483 HydrophobicContact CD2-CG 3.46Å; F1461-P1483 VanDerWaalsContact CD2-CG 3.46Å; F1461-P1483 HydrophobicContact CE1-CG 3.6Å; F1461-P1483 HydrophobicContact CE2-CB 4.26Å; F1461-P1483 HydrophobicContact CE2-CG 3.62Å; F1461-P1483 HydrophobicContact CG-CB 3.87Å; F1461-P1483 HydrophobicContact CG-CG 3.38Å; F1461-P1483 HydrophobicContact CZ-CG 3.7Å
1462	H	85.4	Confident	84.9	Confident	105 Å²	105	55.5 Å²	55.5	49%	0.486	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	75.9	177.5	-68.5	58.8	0	0	0	109.3	L1446	L1446-H1462 WeakPolarHBondContact O-CB 3.5Å; L1446-H1462 PolarHBondContact O-N 3.28Å
1463	C	81.4	Confident	85.3	Confident	15 Å²	15	57.2 Å²	57.2	10%	0.101	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	155.4	178.3	-44.7	0	0	0	0	111.1	F1461 G1465 K1466 C1484	F1461-C1463 VanDerWaalsContact C-N 3.3Å; F1461-C1463 PolarHBondContact O-N 2.92Å; C1463-G1465 PolarHBondContact O-N 3.23Å; C1463-K1466 VanDerWaalsContact CB-O 3.25Å; C1463-K1466 WeakPolarHBondContact CB-O 3.38Å; C1463-K1466 PolarHBondContact N-O 3.01Å; C1463-K1466 PolarHBondContact O-N 3.34Å; C1463-C1484 VanDerWaalsContact CA-SG 3.5Å; C1463-C1484 HydrophobicContact CB-CB 3.51Å; C1463-C1484 WeakPolarHBondContact CB-SG 3.17Å; C1463-C1484 WeakPolarHBondContact SG-CA 3.46Å; C1463-C1484 WeakPolarHBondContact SG-CB 3.04Å; C1463-C1484 CovalentContact SG-SG 2.03Å; C1463-C1484 PolarHBondContact SG-SG 2.69Å
1464	P	73.6	Confident	85.1	Confident	90 Å²	90	59.5 Å²	59.5	58%	0.584	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	116.3	173.8	-26.5	35.1	0	0	0	111.7	K1466 L1552	P1464-K1466 PolarHBondContact O-N 3.44Å; P1464-L1552 HydrophobicContact CG-CD2 4.14Å
1465	G	75.5	Confident	85.2	Confident	83 Å²	83	61 Å²	61	86%	0.856	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	-18.9	176.4	0	0	0	0	0	117.6	C1463	C1463-G1465 PolarHBondContact O-N 3.23Å
1466	K	83.4	Confident	85	Confident	156 Å²	156	60 Å²	60	68%	0.678	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153.9	137.6	176.7	-65.8	-169.5	-179.5	-175.8	0	112.3	C1463 P1464	C1463-K1466 VanDerWaalsContact CB-O 3.25Å; C1463-K1466 WeakPolarHBondContact CB-O 3.38Å; C1463-K1466 PolarHBondContact N-O 3.01Å; C1463-K1466 PolarHBondContact O-N 3.34Å; P1464-K1466 PolarHBondContact O-N 3.44Å
1467	T	82.2	Confident	85.2	Confident	85 Å²	85	61.8 Å²	61.8	52%	0.521	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	135.5	165	-48.3	0	0	0	0	110	F1461	F1461-T1467 CarbonylContact O-C 3.17Å; F1461-T1467 VanDerWaalsContact O-CA 3.31Å; F1461-T1467 WeakPolarHBondContact O-CA 2.94Å
1468	R	86.7	Confident	85.2	Confident	139 Å²	139	63.7 Å²	63.7	53%	0.525	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	155.6	176.6	-68.7	-114.8	-170.4	-172.2	3.8	110.1	S1460 F1461 P1483	S1460-R1468 CarbonylContact C-O 3.59Å; S1460-R1468 WeakPolarHBondContact CA-O 3.3Å; F1461-R1468 PolarHBondContact N-O 2.9Å; F1461-R1468 PolarHBondContact O-N 2.95Å; R1468-P1483 HydrophobicContact CB-CB 4.18Å; R1468-P1483 VanDerWaalsContact CB-O 3.26Å; R1468-P1483 WeakPolarHBondContact CB-O 3.46Å; R1468-P1483 VanDerWaalsContact CD-O 3.25Å; R1468-P1483 WeakPolarHBondContact CD-O 3.15Å; R1468-P1483 WeakPolarHBondContact CG-O 3.41Å
1469	E	87.2	Confident	85.1	Confident	110 Å²	110	63.3 Å²	63.3	51%	0.514	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	147.7	-176.5	-60	-171.8	141.4	0	0	112.6	Q1458 C1459	Q1458-E1469 HydrophobicContact CG-CB 4.45Å; Q1458-E1469 PolarHBondContact NE2-OE2 3.05Å; C1459-E1469 CarbonylContact O-C 3.55Å; C1459-E1469 VanDerWaalsContact O-CA 3.28Å; C1459-E1469 WeakPolarHBondContact O-CA 3.25Å
1470	S	89.3	Confident	85	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	139	173.2	-168.3	0	0	0	0	110.3	Q1458 C1459 S1480	Q1458-S1470 CarbonylContact C-O 3.56Å; Q1458-S1470 WeakPolarHBondContact CA-O 3.15Å; C1459-S1470 PolarHBondContact N-O 3.44Å; C1459-S1470 PolarHBondContact O-N 2.82Å; S1470-S1480 WeakPolarHBondContact CB-O 3.18Å; S1470-S1480 PolarHBondContact OG-N 2.87Å; S1470-S1480 PolarHBondContact OG-O 2.04Å
1471	I	90.5	Very high	84.4	Confident	69 Å²	69	68.5 Å²	68.5	35%	0.354	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.5	-172.4	-55.6	173.3	0	0	0	109.3	S1457 Q1458 L1473 S1479	S1457-I1471 CarbonylContact O-C 3.51Å; S1457-I1471 WeakPolarHBondContact O-CA 3.35Å; Q1458-I1471 HydrophobicContact CB-CG1 4.26Å; Q1458-I1471 HydrophobicContact CG-CG1 4.08Å; I1471-L1473 PolarHBondContact O-N 2.04Å; I1471-S1479 PolarHBondContact N-OG 3.2Å; I1471-S1479 WeakPolarHBondContact O-CB 3.39Å; I1471-S1479 PolarHBondContact O-N 2.91Å
1472	C	88.4	Confident	84	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.02	42%	0.419	C	S	.	.	B	Isolated β-bridge	trans	-75.4	120.7	176.4	179.4	0	0	0	0	111.4	C1436 F1453 E1454 G1456 S1457 W1478	C1436-C1472 HydrophobicContact CB-CB 3.86Å; C1436-C1472 WeakPolarHBondContact CB-SG 3.5Å; C1436-C1472 PolarHBondContact N-SG 3.2Å; C1436-C1472 WeakPolarHBondContact SG-CA 3.38Å; C1436-C1472 WeakPolarHBondContact SG-CB 3.44Å; C1436-C1472 CovalentContact SG-SG 2.03Å; C1436-C1472 PolarHBondContact SG-SG 3.45Å; F1453-C1472 PolarHBondContact O-SG 3.15Å; E1454-C1472 WeakPolarHBondContact O-CB 3.03Å; G1456-C1472 PolarHBondContact N-O 3.33Å; S1457-C1472 PolarHBondContact O-N 3.25Å; C1472-W1478 HydrophobicContact CB-CE3 4.06Å; C1472-W1478 HydrophobicContact CB-CH2 4.01Å; C1472-W1478 HydrophobicContact CB-CZ3 3.72Å
1473	L	88.1	Confident	83.7	Confident	73 Å²	73	68.4 Å²	68.4	38%	0.382	40%	0.398	S	S	.	.			trans	-87.2	165.4	-175.1	-58.6	178.8	0	0	0	112.4	I1471 D1475 G1476 T1477	I1471-L1473 PolarHBondContact O-N 2.04Å; L1473-D1475 WeakPolarHBondContact CB-OD1 3.34Å; L1473-D1475 PolarHBondContact O-N 3.43Å; L1473-G1476 PolarHBondContact O-N 2.73Å; L1473-G1476 VanDerWaalsContact O-N 3.1Å; L1473-T1477 VanDerWaalsContact CB-O 3.27Å; L1473-T1477 WeakPolarHBondContact CB-O 3.09Å; L1473-T1477 WeakPolarHBondContact CG-O 3.21Å; L1473-T1477 PolarHBondContact N-O 3.1Å
1474	S	82.6	Confident	83.8	Confident	93 Å²	93	68 Å²	68	65%	0.65	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-8.1	-173.2	49.1	0	0	0	0	115.8	I1434	I1434-S1474 VanDerWaalsContact CD1-O 3.31Å; I1434-S1474 WeakPolarHBondContact CD1-O 3.31Å
1475	D	84.3	Confident	84.1	Confident	91 Å²	91	69.4 Å²	69.4	49%	0.487	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-11.8	170.2	59.4	0.4	0	0	0	113	L1473 T1477	L1473-D1475 WeakPolarHBondContact CB-OD1 3.34Å; L1473-D1475 PolarHBondContact O-N 3.43Å; D1475-T1477 VanDerWaalsContact CG-OG1 3.31Å; D1475-T1477 WeakPolarHBondContact OD1-CB 3.3Å; D1475-T1477 PolarHBondContact OD1-N 2.95Å; D1475-T1477 PolarHBondContact OD1-OG1 3.18Å; D1475-T1477 PolarHBondContact OD2-OG1 3.17Å; D1475-T1477 VanDerWaalsContact OD2-OG1 3.13Å
1476	G	81.5	Confident	84.1	Confident	12 Å²	12	68.4 Å²	68.4	12%	0.124	38%	0.377	C	S	.	.	S	Bend	trans	96.1	14.3	-173.7	0	0	0	0	0	114.6	C1436 P1437 L1473	C1436-G1476 WeakPolarHBondContact CA-O 3.27Å; C1436-G1476 PolarHBondContact SG-O 3.18Å; P1437-G1476 VanDerWaalsContact CD-O 3.29Å; P1437-G1476 WeakPolarHBondContact CD-O 3.29Å; L1473-G1476 PolarHBondContact O-N 2.73Å; L1473-G1476 VanDerWaalsContact O-N 3.1Å
1477	T	88	Confident	83.7	Confident	66 Å²	66	62.7 Å²	62.7	41%	0.405	36%	0.356	S	S	.	.			trans	-105.9	156.9	177.4	69.5	0	0	0	0	113	C1436 L1473 D1475	C1436-T1477 PolarHBondContact SG-O 3.22Å; L1473-T1477 VanDerWaalsContact CB-O 3.27Å; L1473-T1477 WeakPolarHBondContact CB-O 3.09Å; L1473-T1477 WeakPolarHBondContact CG-O 3.21Å; L1473-T1477 PolarHBondContact N-O 3.1Å; D1475-T1477 VanDerWaalsContact CG-OG1 3.31Å; D1475-T1477 WeakPolarHBondContact OD1-CB 3.3Å; D1475-T1477 PolarHBondContact OD1-N 2.95Å; D1475-T1477 PolarHBondContact OD1-OG1 3.18Å; D1475-T1477 PolarHBondContact OD2-OG1 3.17Å; D1475-T1477 VanDerWaalsContact OD2-OG1 3.13Å
1478	W	87.1	Confident	83.3	Confident	40 Å²	40	66.9 Å²	66.9	15%	0.152	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-86.1	137.7	175.1	-73.6	109.1	0	0	0	111.7	C1436 P1437 P1439 F1453 C1459 C1472 S1480	C1436-W1478 HydrophobicContact CB-CD2 3.94Å; C1436-W1478 VanDerWaalsContact CB-CE2 3.48Å; C1436-W1478 HydrophobicContact CB-CG 4.23Å; C1436-W1478 HydrophobicContact CB-CH2 4.42Å; C1436-W1478 HydrophobicContact CB-CZ2 3.75Å; P1437-W1478 PolarHBondContact O-NE1 2.95Å; P1439-W1478 HydrophobicContact CG-CZ2 4.28Å; F1453-W1478 HydrophobicContact CB-CH2 4.38Å; F1453-W1478 HydrophobicContact CB-CZ2 4Å; F1453-W1478 AromaticContact CD1-CH2 4Å; F1453-W1478 HydrophobicContact CD1-CH2 4Å; F1453-W1478 AromaticContact CD1-CZ2 3.69Å; F1453-W1478 HydrophobicContact CD1-CZ2 3.69Å; F1453-W1478 HydrophobicContact CG-CZ2 4.18Å; C1459-W1478 HydrophobicContact CB-CH2 4.47Å; C1459-W1478 HydrophobicContact CB-CZ3 4.29Å; C1459-W1478 WeakPolarHBondContact SG-CH2 3.16Å; C1459-W1478 VanDerWaalsContact SG-CZ3 3.58Å; C1472-W1478 HydrophobicContact CB-CE3 4.06Å; C1472-W1478 HydrophobicContact CB-CH2 4.01Å; C1472-W1478 HydrophobicContact CB-CZ3 3.72Å; W1478-S1480 PolarHBondContact O-N 2.82Å; W1478-S1480 VanDerWaalsContact O-N 3.16Å
1479	S	88.6	Confident	82.7	Confident	64 Å²	64	63.7 Å²	63.7	45%	0.448	36%	0.36	S	S	.	.	S	Bend	trans	-62	-22.7	176.3	75.8	0	0	0	0	113.7	I1471	I1471-S1479 PolarHBondContact N-OG 3.2Å; I1471-S1479 WeakPolarHBondContact O-CB 3.39Å; I1471-S1479 PolarHBondContact O-N 2.91Å
1480	S	85.3	Confident	82.4	Confident	45 Å²	45	63.4 Å²	63.4	32%	0.315	36%	0.361	S	S	.	.			trans	-139.8	117.3	165.4	-173	0	0	0	0	109.5	S1470 W1478	S1470-S1480 WeakPolarHBondContact CB-O 3.18Å; S1470-S1480 PolarHBondContact OG-N 2.87Å; S1470-S1480 PolarHBondContact OG-O 2.04Å; W1478-S1480 PolarHBondContact O-N 2.82Å; W1478-S1480 VanDerWaalsContact O-N 3.16Å
1481	S	75.7	Confident	82.1	Confident	95 Å²	95	63.5 Å²	63.5	66%	0.664	36%	0.362	S	S	*	.	S	Bend	trans	-75.5	-29.2	179.2	50.5	0	0	0	0	113.3
1482	N	78.9	Confident	81.9	Confident	101 Å²	101	64.1 Å²	64.1	54%	0.54	37%	0.371	S	S	.	.			trans	-128.4	79.4	178.9	-79.7	-34.1	0	0	0	111.2	Y1443 C1484	Y1443-N1482 WeakPolarHBondContact OH-CA 3.47Å; Y1443-N1482 PolarHBondContact OH-OD1 3.18Å; N1482-C1484 VanDerWaalsContact C-N 3.34Å; N1482-C1484 PolarHBondContact O-N 3.03Å
1483	P	80.5	Confident	81.8	Confident	6 Å²	6	68.3 Å²	68.3	4%	0.039	39%	0.391	C	S	.	.			trans	-72	-21.6	-174.9	25.9	-33.5	0	0	0	114.4	F1461 R1468	F1461-P1483 HydrophobicContact CB-CB 4.2Å; F1461-P1483 HydrophobicContact CB-CG 4.11Å; F1461-P1483 HydrophobicContact CD1-CB 4.39Å; F1461-P1483 HydrophobicContact CD1-CG 3.43Å; F1461-P1483 VanDerWaalsContact CD1-CG 3.43Å; F1461-P1483 HydrophobicContact CD2-CB 3.78Å; F1461-P1483 HydrophobicContact CD2-CG 3.46Å; F1461-P1483 VanDerWaalsContact CD2-CG 3.46Å; F1461-P1483 HydrophobicContact CE1-CG 3.6Å; F1461-P1483 HydrophobicContact CE2-CB 4.26Å; F1461-P1483 HydrophobicContact CE2-CG 3.62Å; F1461-P1483 HydrophobicContact CG-CB 3.87Å; F1461-P1483 HydrophobicContact CG-CG 3.38Å; F1461-P1483 HydrophobicContact CZ-CG 3.7Å; R1468-P1483 HydrophobicContact CB-CB 4.18Å; R1468-P1483 VanDerWaalsContact CB-O 3.26Å; R1468-P1483 WeakPolarHBondContact CB-O 3.46Å; R1468-P1483 VanDerWaalsContact CD-O 3.25Å; R1468-P1483 WeakPolarHBondContact CD-O 3.15Å; R1468-P1483 WeakPolarHBondContact CG-O 3.41Å
1484	C	81.8	Confident	81.6	Confident	8 Å²	8	65.3 Å²	65.3	5%	0.054	38%	0.376	C	S	.	.	S	Bend	trans	-109	142.8	175.8	-54.4	0	0	0	0	112.6	Y1443 C1463 N1482 L1552	Y1443-C1484 HydrophobicContact CD1-CB 4.34Å; Y1443-C1484 HydrophobicContact CE1-CB 3.81Å; C1463-C1484 VanDerWaalsContact CA-SG 3.5Å; C1463-C1484 HydrophobicContact CB-CB 3.51Å; C1463-C1484 WeakPolarHBondContact CB-SG 3.17Å; C1463-C1484 WeakPolarHBondContact SG-CA 3.46Å; C1463-C1484 WeakPolarHBondContact SG-CB 3.04Å; C1463-C1484 CovalentContact SG-SG 2.03Å; C1463-C1484 PolarHBondContact SG-SG 2.69Å; N1482-C1484 VanDerWaalsContact C-N 3.34Å; N1482-C1484 PolarHBondContact O-N 3.03Å; C1484-L1552 HydrophobicContact CB-CD1 4.38Å
1485	V	80.7	Confident	81.7	Confident	118 Å²	118	68.1 Å²	68.1	72%	0.715	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-76.7	123.7	163.1	-176.5	0	0	0	0	107.6
1486	L	75.9	Confident	81.5	Confident	63 Å²	63	65.7 Å²	65.7	33%	0.33	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-77.6	129.1	-178.4	-55.2	-179	0	0	0	110.3	V1442 Y1443 V1510 L1552	V1442-L1486 HydrophobicContact CG1-CD1 4.25Å; V1442-L1486 HydrophobicContact CG1-CD2 3.43Å; V1442-L1486 VanDerWaalsContact CG1-CD2 3.43Å; Y1443-L1486 HydrophobicContact CE1-CD2 4.05Å; L1486-V1510 HydrophobicContact CD2-CG1 4.45Å; L1486-L1552 HydrophobicContact CD2-CD1 4.06Å; L1486-L1552 HydrophobicContact CD2-CD2 4.34Å; L1486-L1552 HydrophobicContact CD2-CG 4.17Å
1487	P	74.5	Confident	81.4	Confident	36 Å²	36	66.8 Å²	66.8	23%	0.234	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-68.1	148.8	175.1	30	-34.1	0	0	0	110.1	D1489 V1510 L1552	P1487-D1489 PolarHBondContact O-N 2.02Å; P1487-D1489 VanDerWaalsContact O-N 3.12Å; P1487-V1510 HydrophobicContact CG-CB 4.23Å; P1487-V1510 HydrophobicContact CG-CG1 4.31Å; P1487-V1510 HydrophobicContact CG-CG2 4.21Å; P1487-L1552 HydrophobicContact CG-CD2 3.92Å
1488	K	73.4	Confident	81	Confident	173 Å²	173	68.8 Å²	68.8	75%	0.752	39%	0.394	S	S	*	.			trans	-79.2	17.6	176.7	-64.8	-177.1	178.6	177.5	0	113.2
1489	D	74.4	Confident	80.8	Confident	72 Å²	72	72.5 Å²	72.5	39%	0.385	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-65.7	138.6	179.9	-67.8	-21.8	0	0	0	110.6	P1487 H1509 V1510 R1554	P1487-D1489 PolarHBondContact O-N 2.02Å; P1487-D1489 VanDerWaalsContact O-N 3.12Å; D1489-H1509 WeakPolarHBondContact O-CA 3.49Å; D1489-V1510 HydrophobicContact CB-CG2 4.5Å; D1489-V1510 PolarHBondContact O-N 3.16Å; D1489-V1510 VanDerWaalsContact O-N 3.12Å; D1489-R1554 IonicContact OD2-CZ 3.91Å; D1489-R1554 IonicContact OD2-NH1 3.48Å; D1489-R1554 PolarHBondContact OD2-NH1 3.12Å
1490	L	80.7	Confident	80.8	Confident	103 Å²	103	70 Å²	70	54%	0.539	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-79.3	137.4	175	-78.4	120.8	0	0	0	111.7	R1508	L1490-R1508 WeakPolarHBondContact CA-O 3.36Å
1491	C	82.9	Confident	80.9	Confident	3 Å²	3	72.5 Å²	72.5	2%	0.02	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-88.6	145.1	167.5	-54.2	0	0	0	0	110.3	R1508 C1550 W1556	C1491-R1508 HydrophobicContact CB-CB 4.49Å; C1491-R1508 WeakPolarHBondContact CB-O 3.23Å; C1491-R1508 PolarHBondContact N-O 3.09Å; C1491-R1508 PolarHBondContact O-NE 2.62Å; C1491-C1550 HydrophobicContact CB-CB 3.85Å; C1491-C1550 WeakPolarHBondContact CB-SG 3.19Å; C1491-C1550 WeakPolarHBondContact SG-CB 3.42Å; C1491-C1550 CovalentContact SG-SG 2.02Å; C1491-C1550 PolarHBondContact SG-SG 3.31Å; C1491-W1556 HydrophobicContact CB-CZ2 3.8Å
1492	P	86.4	Confident	81.6	Confident	82 Å²	82	69.2 Å²	69.2	53%	0.532	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-59	155.8	174.6	26.8	-34.6	0	0	0	110.5	W1556	P1492-W1556 PolarHBondContact O-NE1 3.48Å
1493	M	86.3	Confident	82.1	Confident	91 Å²	91	68.1 Å²	68.1	45%	0.448	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-62.4	130.8	172.5	-169.5	69.2	-166.3	0	0	108.6	I1495 C1504 R1508	M1493-I1495 PolarHBondContact O-N 2.77Å; M1493-C1504 HydrophobicContact CE-CB 4.04Å; M1493-C1504 HydrophobicContact SD-CB 4.24Å; M1493-R1508 PolarHBondContact SD-NH1 3.37Å
1494	P	84.8	Confident	82.5	Confident	10 Å²	10	69.1 Å²	69.1	7%	0.065	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-61.8	130.4	174.2	22.8	-31.1	0	0	0	110.5	V1502 C1504 I1548 W1556 V1560	P1494-V1502 HydrophobicContact CB-CG1 4.18Å; P1494-V1502 HydrophobicContact CG-CB 4.41Å; P1494-V1502 HydrophobicContact CG-CG1 3.49Å; P1494-V1502 VanDerWaalsContact CG-CG1 3.49Å; P1494-C1504 VanDerWaalsContact CD-SG 3.54Å; P1494-C1504 WeakPolarHBondContact CG-SG 3.32Å; P1494-I1548 HydrophobicContact CB-CD1 3.79Å; P1494-I1548 HydrophobicContact CG-CD1 4.02Å; P1494-W1556 HydrophobicContact CB-CD2 4.38Å; P1494-W1556 HydrophobicContact CB-CG 4.16Å; P1494-V1560 HydrophobicContact CB-CG2 3.73Å
1495	I	84.2	Confident	82.5	Confident	152 Å²	152	71.5 Å²	71.5	78%	0.779	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-87.6	116.8	171.4	-58.6	171.3	0	0	0	106.6	M1493	M1493-I1495 PolarHBondContact O-N 2.77Å
1496	A	79.8	Confident	82.5	Confident	40 Å²	40	71.2 Å²	71.2	33%	0.331	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-92.6	144.7	-176.5	0	0	0	0	0	111.6	I1500 V1502 V1560	A1496-I1500 VanDerWaalsContact CB-O 3.27Å; A1496-I1500 WeakPolarHBondContact CB-O 3.44Å; A1496-V1502 HydrophobicContact CB-CG2 3.55Å; A1496-V1560 HydrophobicContact CB-CG1 4.43Å
1497	P	79.4	Confident	82.6	Confident	34 Å²	34	75.5 Å²	75.5	22%	0.221	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-59.7	161.3	162.6	-22.1	33.9	0	0	0	112.2	I1500 V1560	P1497-I1500 HydrophobicContact CG-CD1 4.4Å; P1497-I1500 PolarHBondContact O-N 3.27Å; P1497-V1560 WeakPolarHBondContact CD-O 3.21Å; P1497-V1560 WeakPolarHBondContact CG-O 3.29Å
1498	P	79.4	Confident	83.2	Confident	109 Å²	109	76.6 Å²	76.6	71%	0.708	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	148.7	162.2	-23	33.9	0	0	0	111.1	I1500	P1498-I1500 PolarHBondContact O-N 2.83Å; P1498-I1500 VanDerWaalsContact O-N 3.16Å
1499	H	83.8	Confident	83.8	Confident	118 Å²	118	71 Å²	71	55%	0.546	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	-3.1	-177.3	-50.9	-60.2	0	0	0	117	C1518 D1519	H1499-C1518 CarbonylContact O-C 3.4Å; H1499-C1518 WeakPolarHBondContact O-CA 3.44Å; H1499-D1519 WeakPolarHBondContact CA-OD1 3.38Å; H1499-D1519 VanDerWaalsContact CB-OD1 3.29Å; H1499-D1519 WeakPolarHBondContact CB-OD1 3.48Å; H1499-D1519 IonicContact CE1-OD2 3.91Å; H1499-D1519 IonicContact CG-OD1 2.85Å; H1499-D1519 IonicContact CG-OD2 3.81Å; H1499-D1519 IonicContact ND1-OD1 3.21Å; H1499-D1519 PolarHBondContact ND1-OD1 2.8Å; H1499-D1519 IonicContact ND1-OD2 2.72Å; H1499-D1519 PolarHBondContact ND1-OD2 2.87Å; H1499-D1519 PolarHBondContact O-N 3.18Å
1500	I	87.8	Confident	84.3	Confident	11 Å²	11	67.9 Å²	67.9	6%	0.056	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	115.5	174.6	-62.4	-171.4	0	0	0	110.6	A1496 P1497 P1498 V1502 V1516 T1525 L1563	A1496-I1500 VanDerWaalsContact CB-O 3.27Å; A1496-I1500 WeakPolarHBondContact CB-O 3.44Å; P1497-I1500 HydrophobicContact CG-CD1 4.4Å; P1497-I1500 PolarHBondContact O-N 3.27Å; P1498-I1500 PolarHBondContact O-N 2.83Å; P1498-I1500 VanDerWaalsContact O-N 3.16Å; I1500-V1502 HydrophobicContact CG2-CG2 3.96Å; I1500-V1516 HydrophobicContact CG2-CB 4.37Å; I1500-T1525 HydrophobicContact CD1-CG2 4.03Å; I1500-T1525 HydrophobicContact CG1-CG2 4.13Å; I1500-T1525 HydrophobicContact CG2-CG2 4.34Å; I1500-L1563 HydrophobicContact CD1-CB 3.36Å; I1500-L1563 VanDerWaalsContact CD1-O 3.23Å; I1500-L1563 WeakPolarHBondContact CD1-O 3.3Å
1501	L	88.5	Confident	84.3	Confident	97 Å²	97	64 Å²	64	51%	0.508	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	129	173.6	-59.6	175.7	0	0	0	108.9	V1516 T1517 D1519	L1501-V1516 WeakPolarHBondContact O-CA 3.38Å; L1501-T1517 PolarHBondContact N-O 3.48Å; L1501-T1517 PolarHBondContact O-N 3.08Å; L1501-D1519 HydrophobicContact CD1-CB 4.14Å; L1501-D1519 HydrophobicContact CG-CB 4.18Å
1502	V	89.4	Confident	84.6	Confident	27 Å²	27	66.3 Å²	66.3	16%	0.164	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	111.9	-179.1	-173.1	0	0	0	0	110.2	P1494 A1496 I1500 C1514 Q1515 V1516 I1548 V1560	P1494-V1502 HydrophobicContact CB-CG1 4.18Å; P1494-V1502 HydrophobicContact CG-CB 4.41Å; P1494-V1502 HydrophobicContact CG-CG1 3.49Å; P1494-V1502 VanDerWaalsContact CG-CG1 3.49Å; A1496-V1502 HydrophobicContact CB-CG2 3.55Å; I1500-V1502 HydrophobicContact CG2-CG2 3.96Å; V1502-C1514 HydrophobicContact CG1-CB 3.75Å; V1502-Q1515 WeakPolarHBondContact CA-O 3.31Å; V1502-V1516 HydrophobicContact CG1-CG1 4.15Å; V1502-V1516 HydrophobicContact CG2-CG1 4Å; V1502-I1548 HydrophobicContact CG1-CD1 3.84Å; V1502-V1560 HydrophobicContact CG2-CG1 4.03Å
1503	S	90	Very high	84.6	Confident	78 Å²	78	64.1 Å²	64.1	55%	0.545	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	113.1	-179.9	-174.1	0	0	0	0	110.4	C1514 Q1515	S1503-C1514 CarbonylContact O-C 3.59Å; S1503-C1514 WeakPolarHBondContact O-CA 3.42Å; S1503-C1514 VanDerWaalsContact O-CB 3.27Å; S1503-C1514 WeakPolarHBondContact O-CB 3.44Å; S1503-Q1515 PolarHBondContact N-O 3.23Å; S1503-Q1515 PolarHBondContact O-N 3.17Å
1504	C	87.7	Confident	84.8	Confident	27 Å²	27	59.8 Å²	59.8	18%	0.182	35%	0.345	C	S	.	.			trans	-114.9	139.9	-176.8	-69	0	0	0	0	112.2	M1493 P1494 R1508 C1514	M1493-C1504 HydrophobicContact CE-CB 4.04Å; M1493-C1504 HydrophobicContact SD-CB 4.24Å; P1494-C1504 VanDerWaalsContact CD-SG 3.54Å; P1494-C1504 WeakPolarHBondContact CG-SG 3.32Å; C1504-R1508 HydrophobicContact CB-CG 4.04Å; C1504-C1514 WeakPolarHBondContact CA-SG 3Å; C1504-C1514 HydrophobicContact CB-CB 4Å; C1504-C1514 WeakPolarHBondContact CB-SG 3.42Å; C1504-C1514 WeakPolarHBondContact SG-CB 3.43Å; C1504-C1514 CovalentContact SG-SG 2.03Å; C1504-C1514 PolarHBondContact SG-SG 3.12Å
1505	P	82.3	Confident	85.1	Confident	58 Å²	58	65.5 Å²	65.5	38%	0.377	37%	0.371	S	S	.	.			trans	-62.8	142.8	167.8	27.4	-34.2	0	0	0	111	K1507 R1508 N1512 A1513	P1505-K1507 PolarHBondContact O-N 3.42Å; P1505-K1507 VanDerWaalsContact O-N 3.09Å; P1505-R1508 VanDerWaalsContact O-CG 3.31Å; P1505-R1508 WeakPolarHBondContact O-CG 3.04Å; P1505-R1508 PolarHBondContact O-N 3.38Å; P1505-N1512 HydrophobicContact CG-CB 4.14Å; P1505-A1513 VanDerWaalsContact CD-O 3.24Å; P1505-A1513 WeakPolarHBondContact CD-O 3.1Å
1506	S	81.4	Confident	85.4	Confident	112 Å²	112	58.3 Å²	58.3	78%	0.783	33%	0.334	S	S	*	.	S	Bend	trans	-56.9	-34.6	-168.6	-17.2	0	0	0	0	113.9
1507	K	77.2	Confident	85.9	Confident	152 Å²	152	59.9 Å²	59.9	66%	0.661	34%	0.339	S	S	*	.	S	Bend	trans	-97.4	81.2	174.7	-65.3	-179.1	-177.6	176.3	0	109.2	P1505 H1509 N1512	P1505-K1507 PolarHBondContact O-N 3.42Å; P1505-K1507 VanDerWaalsContact O-N 3.09Å; K1507-H1509 PolarHBondContact O-N 3.15Å; K1507-N1512 PolarHBondContact O-ND2 3.13Å
1508	R	87.7	Confident	86.3	Confident	60 Å²	60	59 Å²	59	23%	0.226	33%	0.334	C	S	.	.			trans	-69.9	62	-179	-64	174.9	-63.5	-85.4	-8	112.6	L1490 C1491 M1493 C1504 P1505 W1556	L1490-R1508 WeakPolarHBondContact CA-O 3.36Å; C1491-R1508 HydrophobicContact CB-CB 4.49Å; C1491-R1508 WeakPolarHBondContact CB-O 3.23Å; C1491-R1508 PolarHBondContact N-O 3.09Å; C1491-R1508 PolarHBondContact O-NE 2.62Å; M1493-R1508 PolarHBondContact SD-NH1 3.37Å; C1504-R1508 HydrophobicContact CB-CG 4.04Å; P1505-R1508 VanDerWaalsContact O-CG 3.31Å; P1505-R1508 WeakPolarHBondContact O-CG 3.04Å; P1505-R1508 PolarHBondContact O-N 3.38Å; R1508-W1556 HydrophobicContact CB-CH2 4.3Å; R1508-W1556 HydrophobicContact CB-CZ2 4.19Å; R1508-W1556 HydrophobicContact CG-CH2 4.41Å; R1508-W1556 HydrophobicContact CG-CZ2 4.31Å
1509	H	86.4	Confident	86.7	Confident	56 Å²	56	57.6 Å²	57.6	26%	0.259	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-68.3	157.8	177.2	-61.3	168.6	0	0	0	111.4	D1489 K1507 G1511 N1512	D1489-H1509 WeakPolarHBondContact O-CA 3.49Å; K1507-H1509 PolarHBondContact O-N 3.15Å; H1509-G1511 PolarHBondContact O-N 3.09Å; H1509-N1512 WeakPolarHBondContact O-CB 3.5Å; H1509-N1512 PolarHBondContact O-N 3.44Å
1510	V	84.8	Confident	86.4	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.03	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	128.4	163.7	168.4	0	0	0	0	109.7	L1486 P1487 D1489 L1552 R1554	L1486-V1510 HydrophobicContact CD2-CG1 4.45Å; P1487-V1510 HydrophobicContact CG-CB 4.23Å; P1487-V1510 HydrophobicContact CG-CG1 4.31Å; P1487-V1510 HydrophobicContact CG-CG2 4.21Å; D1489-V1510 HydrophobicContact CB-CG2 4.5Å; D1489-V1510 PolarHBondContact O-N 3.16Å; D1489-V1510 VanDerWaalsContact O-N 3.12Å; V1510-L1552 HydrophobicContact CG1-CB 4.24Å; V1510-L1552 HydrophobicContact CG1-CD2 3.93Å; V1510-L1552 HydrophobicContact CG1-CG 3.74Å; V1510-R1554 HydrophobicContact CG2-CG 3.96Å
1511	G	80.7	Confident	86.1	Confident	23 Å²	23	57.8 Å²	57.8	24%	0.237	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	99	-19.2	-173.8	0	0	0	0	0	115.5	H1509 C1550	H1509-G1511 PolarHBondContact O-N 3.09Å; G1511-C1550 PolarHBondContact N-O 2.71Å
1512	N	87.8	Confident	85.6	Confident	51 Å²	51	53.8 Å²	53.8	27%	0.273	31%	0.31	S	S	.	.			trans	-75.1	141.6	176.9	-71	26.1	0	0	0	110.6	P1505 K1507 H1509 C1550 W1556	P1505-N1512 HydrophobicContact CG-CB 4.14Å; K1507-N1512 PolarHBondContact O-ND2 3.13Å; H1509-N1512 WeakPolarHBondContact O-CB 3.5Å; H1509-N1512 PolarHBondContact O-N 3.44Å; N1512-C1550 PolarHBondContact O-N 3.04Å; N1512-W1556 WeakPolarHBondContact O-CZ3 3.5Å
1513	A	87.1	Confident	85.4	Confident	35 Å²	35	57.4 Å²	57.4	29%	0.289	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	150.7	168.3	0	0	0	0	0	111.2	P1505 I1548	P1505-A1513 VanDerWaalsContact CD-O 3.24Å; P1505-A1513 WeakPolarHBondContact CD-O 3.1Å; A1513-I1548 CarbonylContact C-O 3.58Å; A1513-I1548 WeakPolarHBondContact CA-O 3.07Å
1514	C	90	Very high	85.3	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.007	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	137.7	161	-53.7	0	0	0	0	108.3	V1502 S1503 C1504 Q1547 I1548 W1556	V1502-C1514 HydrophobicContact CG1-CB 3.75Å; S1503-C1514 CarbonylContact O-C 3.59Å; S1503-C1514 WeakPolarHBondContact O-CA 3.42Å; S1503-C1514 VanDerWaalsContact O-CB 3.27Å; S1503-C1514 WeakPolarHBondContact O-CB 3.44Å; C1504-C1514 WeakPolarHBondContact CA-SG 3Å; C1504-C1514 HydrophobicContact CB-CB 4Å; C1504-C1514 WeakPolarHBondContact CB-SG 3.42Å; C1504-C1514 WeakPolarHBondContact SG-CB 3.43Å; C1504-C1514 CovalentContact SG-SG 2.03Å; C1504-C1514 PolarHBondContact SG-SG 3.12Å; C1514-Q1547 WeakPolarHBondContact O-CA 3.18Å; C1514-I1548 HydrophobicContact CB-CD1 4.19Å; C1514-I1548 HydrophobicContact CB-CG1 3.83Å; C1514-I1548 PolarHBondContact N-O 2.83Å; C1514-I1548 PolarHBondContact O-N 3.07Å; C1514-W1556 HydrophobicContact CB-CZ3 4.38Å; C1514-W1556 WeakPolarHBondContact SG-CH2 3.38Å; C1514-W1556 WeakPolarHBondContact SG-CZ3 3.34Å
1515	Q	90.7	Very high	85.3	Confident	130 Å²	130	53.1 Å²	53.1	61%	0.607	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	141.6	168.6	-78.8	-179	-49.4	0	0	109.3	V1502 S1503	V1502-Q1515 WeakPolarHBondContact CA-O 3.31Å; S1503-Q1515 PolarHBondContact N-O 3.23Å; S1503-Q1515 PolarHBondContact O-N 3.17Å
1516	V	90.8	Very high	85.5	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	132.5	169.7	-59.4	0	0	0	0	108.6	I1500 L1501 V1502 T1525 V1545 D1546 I1548 L1563	I1500-V1516 HydrophobicContact CG2-CB 4.37Å; L1501-V1516 WeakPolarHBondContact O-CA 3.38Å; V1502-V1516 HydrophobicContact CG1-CG1 4.15Å; V1502-V1516 HydrophobicContact CG2-CG1 4Å; V1516-T1525 PolarHBondContact O-OG1 3.36Å; V1516-V1545 HydrophobicContact CG2-CG1 4.16Å; V1516-V1545 VanDerWaalsContact CG2-O 3.3Å; V1516-V1545 WeakPolarHBondContact CG2-O 3.46Å; V1516-D1546 PolarHBondContact N-O 2.04Å; V1516-D1546 VanDerWaalsContact N-O 3.08Å; V1516-I1548 HydrophobicContact CG1-CB 4.36Å; V1516-I1548 HydrophobicContact CG1-CD1 3.98Å; V1516-I1548 HydrophobicContact CG1-CG1 3.84Å; V1516-I1548 HydrophobicContact CG1-CG2 3.81Å; V1516-L1563 HydrophobicContact CB-CD1 4.34Å; V1516-L1563 HydrophobicContact CG1-CD1 4.24Å; V1516-L1563 HydrophobicContact CG2-CD1 4.02Å
1517	T	90.2	Very high	85.6	Confident	72 Å²	72	46.5 Å²	46.5	44%	0.442	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	156.2	178.6	58.4	0	0	0	0	109.8	L1501	L1501-T1517 PolarHBondContact N-O 3.48Å; L1501-T1517 PolarHBondContact O-N 3.08Å
1518	C	88.9	Confident	85.3	Confident	15 Å²	15	43 Å²	43	10%	0.101	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	149.5	167.3	-61.9	0	0	0	0	110.7	H1499 A1520 C1565	H1499-C1518 CarbonylContact O-C 3.4Å; H1499-C1518 WeakPolarHBondContact O-CA 3.44Å; C1518-A1520 VanDerWaalsContact C-N 3.31Å; C1518-C1565 WeakPolarHBondContact CA-SG 3.4Å; C1518-C1565 HydrophobicContact CB-CB 3.95Å; C1518-C1565 WeakPolarHBondContact CB-SG 3.3Å; C1518-C1565 VanDerWaalsContact SG-CA 3.53Å; C1518-C1565 WeakPolarHBondContact SG-CB 3.27Å; C1518-C1565 CovalentContact SG-SG 2.03Å; C1518-C1565 PolarHBondContact SG-SG 3.16Å
1519	D	87.2	Confident	84.5	Confident	81 Å²	81	43.5 Å²	43.5	43%	0.433	23%	0.234	S	C	.	.	S	Bend	trans	-69.1	-33.6	165.9	64.3	-13.2	0	0	0	111.5	H1499 L1501	H1499-D1519 WeakPolarHBondContact CA-OD1 3.38Å; H1499-D1519 VanDerWaalsContact CB-OD1 3.29Å; H1499-D1519 WeakPolarHBondContact CB-OD1 3.48Å; H1499-D1519 IonicContact CE1-OD2 3.91Å; H1499-D1519 IonicContact CG-OD1 2.85Å; H1499-D1519 IonicContact CG-OD2 3.81Å; H1499-D1519 IonicContact ND1-OD1 3.21Å; H1499-D1519 PolarHBondContact ND1-OD1 2.8Å; H1499-D1519 IonicContact ND1-OD2 2.72Å; H1499-D1519 PolarHBondContact ND1-OD2 2.87Å; H1499-D1519 PolarHBondContact O-N 3.18Å; L1501-D1519 HydrophobicContact CD1-CB 4.14Å; L1501-D1519 HydrophobicContact CG-CB 4.18Å
1520	A	78.2	Confident	83.2	Confident	40 Å²	40	46 Å²	46	33%	0.331	25%	0.248	S	C	.	.	S	Bend	trans	-80.9	126.7	176.6	0	0	0	0	0	112.9	C1518 Y1523	C1518-A1520 VanDerWaalsContact C-N 3.31Å; A1520-Y1523 HydrophobicContact CB-CD2 3.53Å; A1520-Y1523 HydrophobicContact CB-CE2 3.93Å; A1520-Y1523 HydrophobicContact CB-CG 4.14Å; A1520-Y1523 PolarHBondContact O-N 2.97Å
1521	Q	80.3	Confident	82	Confident	92 Å²	92	47.6 Å²	47.6	43%	0.43	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	138.1	174.8	-97.3	-172.7	-18.4	0	0	112.8	A457 S460 Y1523	A457-Q1521 HydrophobicContact CB-CB 3.65Å; A457-Q1521 HydrophobicContact CB-CG 3.89Å; A457-Q1521 PolarHBondContact O-OE1 2.81Å; S460-Q1521 PolarHBondContact OG-NE2 3.01Å; Q1521-Y1523 VanDerWaalsContact C-N 3.29Å; Q1521-Y1523 WeakPolarHBondContact O-CD2 3.3Å
1522	G	79.1	Confident	80.6	Confident	13 Å²	13	49.6 Å²	49.6	13%	0.134	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	15.3	-178.3	0	0	0	0	0	114.5	N455 K1568	N455-G1522 WeakPolarHBondContact ND2-CA 3.29Å; N455-G1522 PolarHBondContact ND2-O 2.81Å; G1522-K1568 VanDerWaalsContact O-CB 3.25Å; G1522-K1568 WeakPolarHBondContact O-CB 3.21Å; G1522-K1568 PolarHBondContact O-N 3.27Å
1523	Y	85.9	Confident	78.7	Confident	103 Å²	103	47.9 Å²	47.9	40%	0.404	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	138.6	165.9	-67	-108.6	0	0	0	108.8	A1520 Q1521 C1565 V1566 K1567	A1520-Y1523 HydrophobicContact CB-CD2 3.53Å; A1520-Y1523 HydrophobicContact CB-CE2 3.93Å; A1520-Y1523 HydrophobicContact CB-CG 4.14Å; A1520-Y1523 PolarHBondContact O-N 2.97Å; Q1521-Y1523 VanDerWaalsContact C-N 3.29Å; Q1521-Y1523 WeakPolarHBondContact O-CD2 3.3Å; Y1523-C1565 HydrophobicContact CD1-CB 4.41Å; Y1523-V1566 CarbonylContact C-O 3.52Å; Y1523-V1566 WeakPolarHBondContact CA-O 3.29Å; Y1523-K1567 VanDerWaalsContact CD1-N 3.33Å; Y1523-K1567 HydrophobicContact CE1-CB 4.26Å
1524	D	86.5	Confident	77	Confident	12 Å²	12	49.5 Å²	49.5	6%	0.064	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	142.2	168.1	-75.7	-31.3	0	0	0	108.9	V1526 R1544 V1566 K1568	D1524-V1526 PolarHBondContact O-N 2.9Å; D1524-R1544 HydrophobicContact CB-CG 4.49Å; D1524-R1544 VanDerWaalsContact CG-NH2 3.34Å; D1524-R1544 IonicContact OD1-CZ 3.08Å; D1524-R1544 IonicContact OD1-NH1 2.8Å; D1524-R1544 PolarHBondContact OD1-NH1 3.14Å; D1524-R1544 IonicContact OD1-NH2 2.71Å; D1524-R1544 PolarHBondContact OD1-NH2 2.81Å; D1524-R1544 IonicContact OD2-CZ 2.65Å; D1524-R1544 VanDerWaalsContact OD2-CZ 3.24Å; D1524-R1544 IonicContact OD2-NE 2.76Å; D1524-R1544 IonicContact OD2-NH1 3.2Å; D1524-R1544 PolarHBondContact OD2-NH1 2.03Å; D1524-R1544 IonicContact OD2-NH2 3.69Å; D1524-V1566 PolarHBondContact N-O 3.48Å; D1524-V1566 PolarHBondContact O-N 3.02Å; D1524-V1566 VanDerWaalsContact O-N 3.11Å; D1524-K1568 WeakPolarHBondContact OD1-CD 3.36Å; D1524-K1568 WeakPolarHBondContact OD1-CE 3.45Å; D1524-K1568 IonicContact OD1-NZ 3.62Å; D1524-K1568 PolarHBondContact OD1-NZ 2.84Å; D1524-K1568 WeakPolarHBondContact OD2-CD 3.46Å; D1524-K1568 VanDerWaalsContact OD2-CE 3.32Å; D1524-K1568 WeakPolarHBondContact OD2-CE 3.32Å; D1524-K1568 WeakPolarHBondContact OD2-CG 3.46Å; D1524-K1568 IonicContact OD2-NZ 3.1Å
1525	T	88.5	Confident	75	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.018	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	123.8	168.7	29.1	0	0	0	0	109.5	I1500 V1516 V1545 V1564	I1500-T1525 HydrophobicContact CD1-CG2 4.03Å; I1500-T1525 HydrophobicContact CG1-CG2 4.13Å; I1500-T1525 HydrophobicContact CG2-CG2 4.34Å; V1516-T1525 PolarHBondContact O-OG1 3.36Å; T1525-V1545 VanDerWaalsContact CB-O 3.27Å; T1525-V1545 WeakPolarHBondContact CB-O 3.43Å; T1525-V1545 PolarHBondContact O-N 3.44Å; T1525-V1545 PolarHBondContact OG1-O 2.81Å; T1525-V1564 WeakPolarHBondContact CA-O 3.5Å
1526	V	86.5	Confident	72.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	152.9	177.5	-60.3	0	0	0	0	111	D1524 M1542 Q1543 L1563 V1564 V1566 Y1587	D1524-V1526 PolarHBondContact O-N 2.9Å; V1526-M1542 HydrophobicContact CB-CB 4.16Å; V1526-M1542 HydrophobicContact CG1-CB 4.43Å; V1526-M1542 HydrophobicContact CG2-CB 4.09Å; V1526-M1542 HydrophobicContact CG2-CG 4.03Å; V1526-Q1543 CarbonylContact C-O 3.53Å; V1526-Q1543 WeakPolarHBondContact CA-O 3.37Å; V1526-Q1543 WeakPolarHBondContact CB-O 3.46Å; V1526-L1563 CarbonylContact O-C 3.28Å; V1526-L1563 WeakPolarHBondContact O-CA 3.43Å; V1526-V1564 HydrophobicContact CG2-CG2 3.72Å; V1526-V1564 PolarHBondContact N-O 3.36Å; V1526-V1564 PolarHBondContact O-N 3.32Å; V1526-V1566 HydrophobicContact CB-CG2 4.19Å; V1526-V1566 HydrophobicContact CG1-CG2 3.51Å; V1526-V1566 HydrophobicContact CG2-CB 4.24Å; V1526-V1566 HydrophobicContact CG2-CG1 3.67Å; V1526-V1566 HydrophobicContact CG2-CG2 3.55Å; V1526-Y1587 HydrophobicContact CG1-CD2 4.08Å; V1526-Y1587 HydrophobicContact CG1-CE2 4.33Å; V1526-Y1587 HydrophobicContact CG1-CG 4.25Å
1527	Q	83.8	Confident	71	Confident	31 Å²	31	60.8 Å²	60.8	15%	0.145	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	129.4	163.9	-173	169.1	38.3	0	0	108.2	M1542 Q1543 V1545 S1562 L1563	Q1527-M1542 CarbonylContact O-C 3.47Å; Q1527-M1542 WeakPolarHBondContact O-CA 3.48Å; Q1527-Q1543 PolarHBondContact N-O 3.16Å; Q1527-Q1543 PolarHBondContact O-N 3.09Å; Q1527-V1545 HydrophobicContact CB-CG2 3.99Å; Q1527-S1562 PolarHBondContact NE2-OG 3.47Å; Q1527-L1563 HydrophobicContact CB-CD2 4.12Å
1528	E	70.7	Confident	69	Low	78 Å²	78	61.1 Å²	61.1	36%	0.364	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	134.6	174.5	-74	-168.8	-179.5	0	0	111.9	Q1540 M1542 V1564	E1528-Q1540 PolarHBondContact OE1-NE2 2.74Å; E1528-Q1540 PolarHBondContact OE2-NE2 2.91Å; E1528-M1542 HydrophobicContact CG-CE 4.34Å; E1528-M1542 HydrophobicContact CG-CG 3.91Å; E1528-M1542 WeakPolarHBondContact OE1-CE 3.39Å; E1528-V1564 HydrophobicContact CG-CG2 3.98Å
1529	H	69.8	Low	67.5	Low	72 Å²	72	62.1 Å²	62.1	33%	0.333	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.7	169.3	-57.7	-62.8	0	0	0	109.6	V1541	H1529-V1541 WeakPolarHBondContact CA-O 3.39Å; H1529-V1541 WeakPolarHBondContact CB-O 3.5Å; H1529-V1541 PolarHBondContact N-O 3.23Å; H1529-V1541 CarbonylContact O-C 3.55Å; H1529-V1541 WeakPolarHBondContact O-CA 3.43Å; H1529-V1541 PolarHBondContact O-N 2.8Å; H1529-V1541 VanDerWaalsContact O-O 3.11Å
1530	I	59.8	Low	66.3	Low	109 Å²	109	63.8 Å²	63.8	56%	0.559	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	118.4	172.9	-60.2	176.8	0	0	0	108.5	K1538	I1530-K1538 HydrophobicContact CG2-CB 3.8Å; I1530-K1538 HydrophobicContact CG2-CD 4.11Å; I1530-K1538 HydrophobicContact CG2-CG 4.2Å
1531	V	60.5	Low	65.8	Low	38 Å²	38	62.8 Å²	62.8	23%	0.23	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	117.9	173.8	178.9	0	0	0	0	108.2	M1539 V1541 P1623	V1531-M1539 PolarHBondContact N-O 2.84Å; V1531-M1539 PolarHBondContact O-N 2.81Å; V1531-V1541 HydrophobicContact CB-CG2 3.89Å; V1531-V1541 HydrophobicContact CG2-CB 4.01Å; V1531-V1541 HydrophobicContact CG2-CG2 3.54Å; V1531-P1623 HydrophobicContact CG1-CG 4.48Å
1532	T	50.7	Low	65.5	Low	64 Å²	64	60 Å²	60	39%	0.393	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	121.1	174.7	-51.4	0	0	0	0	109	K1538	T1532-K1538 HydrophobicContact CG2-CG 4.39Å
1533	T	48.5	Very low	65.4	Low	15 Å²	15	64.8 Å²	64.8	9%	0.092	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-75.6	161.5	178.3	60.1	0	0	0	0	112.4	R1535 S1536 F1537 M1539 P1623	T1533-R1535 PolarHBondContact O-N 2.86Å; T1533-S1536 PolarHBondContact O-N 2.93Å; T1533-F1537 WeakPolarHBondContact CB-O 3.26Å; T1533-F1537 PolarHBondContact N-O 2.86Å; T1533-F1537 WeakPolarHBondContact OG1-CA 3.17Å; T1533-F1537 WeakPolarHBondContact OG1-CB 3.26Å; T1533-F1537 PolarHBondContact OG1-N 2.88Å; T1533-F1537 VanDerWaalsContact OG1-N 3.13Å; T1533-F1537 PolarHBondContact OG1-O 2.84Å; T1533-M1539 HydrophobicContact CG2-CB 4.49Å; T1533-M1539 HydrophobicContact CG2-CG 3.7Å; T1533-M1539 HydrophobicContact CG2-SD 3.57Å; T1533-M1539 VanDerWaalsContact CG2-SD 3.57Å; T1533-P1623 HydrophobicContact CG2-CB 3.79Å
1534	D	51	Low	65.2	Low	70 Å²	70	64.5 Å²	64.5	37%	0.374	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-6.9	175.2	-50	-11.2	0	0	0	114.8	R1629 N1630 V1633	D1534-R1629 WeakPolarHBondContact OD2-CA 3.32Å; D1534-N1630 HydrophobicContact CB-CB 3.98Å; D1534-N1630 PolarHBondContact O-ND2 2.6Å; D1534-N1630 PolarHBondContact OD2-N 2.81Å; D1534-V1633 WeakPolarHBondContact OD2-CG2 3.42Å
1535	R	48.4	Very low	65.1	Low	125 Å²	125	64.6 Å²	64.6	47%	0.472	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	12.7	175.1	-70.3	-172.4	-174	158.7	12.7	113	T1533 F1537 E1627	T1533-R1535 PolarHBondContact O-N 2.86Å; R1535-F1537 HydrophobicContact CB-CD2 3.68Å; R1535-F1537 HydrophobicContact CB-CE2 3.91Å; R1535-F1537 PolarHBondContact O-N 2.82Å; R1535-E1627 PolarHBondContact NH2-O 2.9Å
1536	S	46.7	Very low	65.1	Low	104 Å²	104	68 Å²	68	73%	0.727	33%	0.334	S	S	*	.	S	Bend	trans	68.2	5.6	-176.8	-45.7	0	0	0	0	115.8	T1533 K1538	T1533-S1536 PolarHBondContact O-N 2.93Å; S1536-K1538 PolarHBondContact O-N 3.13Å
1537	F	49.2	Very low	65.2	Low	139 Å²	139	73.6 Å²	73.6	61%	0.61	36%	0.361	S	S	*	.			trans	-73.1	122.5	168.6	-62.7	-82.1	0	0	0	109.3	T1533 R1535	T1533-F1537 WeakPolarHBondContact CB-O 3.26Å; T1533-F1537 PolarHBondContact N-O 2.86Å; T1533-F1537 WeakPolarHBondContact OG1-CA 3.17Å; T1533-F1537 WeakPolarHBondContact OG1-CB 3.26Å; T1533-F1537 PolarHBondContact OG1-N 2.88Å; T1533-F1537 VanDerWaalsContact OG1-N 3.13Å; T1533-F1537 PolarHBondContact OG1-O 2.84Å; R1535-F1537 HydrophobicContact CB-CD2 3.68Å; R1535-F1537 HydrophobicContact CB-CE2 3.91Å; R1535-F1537 PolarHBondContact O-N 2.82Å
1538	K	49.7	Very low	65.5	Low	79 Å²	79	72.1 Å²	72.1	34%	0.343	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	117.9	169.6	-68.8	-165.6	176.3	-156.6	0	108.8	I1530 T1532 S1536 D1644 A1646	I1530-K1538 HydrophobicContact CG2-CB 3.8Å; I1530-K1538 HydrophobicContact CG2-CD 4.11Å; I1530-K1538 HydrophobicContact CG2-CG 4.2Å; T1532-K1538 HydrophobicContact CG2-CG 4.39Å; S1536-K1538 PolarHBondContact O-N 3.13Å; K1538-D1644 IonicContact NZ-OD1 2.67Å; K1538-D1644 PolarHBondContact NZ-OD1 2.82Å; K1538-A1646 HydrophobicContact CD-CB 4.18Å
1539	M	56.2	Low	66.3	Low	36 Å²	36	69.3 Å²	69.3	18%	0.177	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	136.3	179.6	-65	-162.8	72.7	0	0	111.1	V1531 T1533 L1621 P1623	V1531-M1539 PolarHBondContact N-O 2.84Å; V1531-M1539 PolarHBondContact O-N 2.81Å; T1533-M1539 HydrophobicContact CG2-CB 4.49Å; T1533-M1539 HydrophobicContact CG2-CG 3.7Å; T1533-M1539 HydrophobicContact CG2-SD 3.57Å; T1533-M1539 VanDerWaalsContact CG2-SD 3.57Å; M1539-L1621 HydrophobicContact CE-CB 3.88Å; M1539-L1621 HydrophobicContact CE-CD2 3.95Å; M1539-L1621 HydrophobicContact CE-CG 4.48Å; M1539-L1621 WeakPolarHBondContact CE-O 3.4Å; M1539-P1623 HydrophobicContact SD-CB 4.13Å
1540	Q	61.6	Low	67.2	Low	116 Å²	116	65.9 Å²	65.9	54%	0.542	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	117.2	-178.3	-148	169.1	3.5	0	0	109	E1528	E1528-Q1540 PolarHBondContact OE1-NE2 2.74Å; E1528-Q1540 PolarHBondContact OE2-NE2 2.91Å
1541	V	68.6	Low	68.2	Low	19 Å²	19	60.9 Å²	60.9	12%	0.115	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	101.3	-179.2	-175.8	0	0	0	0	108	H1529 V1531 W1590	H1529-V1541 WeakPolarHBondContact CA-O 3.39Å; H1529-V1541 WeakPolarHBondContact CB-O 3.5Å; H1529-V1541 PolarHBondContact N-O 3.23Å; H1529-V1541 CarbonylContact O-C 3.55Å; H1529-V1541 WeakPolarHBondContact O-CA 3.43Å; H1529-V1541 PolarHBondContact O-N 2.8Å; H1529-V1541 VanDerWaalsContact O-O 3.11Å; V1531-V1541 HydrophobicContact CB-CG2 3.89Å; V1531-V1541 HydrophobicContact CG2-CB 4.01Å; V1531-V1541 HydrophobicContact CG2-CG2 3.54Å; V1541-W1590 HydrophobicContact CG1-CH2 4.12Å; V1541-W1590 HydrophobicContact CG1-CZ2 4.22Å; V1541-W1590 HydrophobicContact CG2-CZ2 4.05Å
1542	M	73.3	Confident	69.2	Low	33 Å²	33	60.1 Å²	60.1	16%	0.163	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	149.5	175.1	-69.8	151.8	-178.8	0	0	110.3	V1526 Q1527 E1528 V1566 Y1587	V1526-M1542 HydrophobicContact CB-CB 4.16Å; V1526-M1542 HydrophobicContact CG1-CB 4.43Å; V1526-M1542 HydrophobicContact CG2-CB 4.09Å; V1526-M1542 HydrophobicContact CG2-CG 4.03Å; Q1527-M1542 CarbonylContact O-C 3.47Å; Q1527-M1542 WeakPolarHBondContact O-CA 3.48Å; E1528-M1542 HydrophobicContact CG-CE 4.34Å; E1528-M1542 HydrophobicContact CG-CG 3.91Å; E1528-M1542 WeakPolarHBondContact OE1-CE 3.39Å; M1542-V1566 HydrophobicContact CE-CG1 4.03Å; M1542-V1566 HydrophobicContact SD-CG1 4.02Å; M1542-V1566 HydrophobicContact SD-CG2 4.47Å; M1542-Y1587 HydrophobicContact CB-CD1 4Å; M1542-Y1587 HydrophobicContact CB-CG 4.16Å; M1542-Y1587 WeakPolarHBondContact O-CA 3.45Å; M1542-Y1587 WeakPolarHBondContact O-CB 3.42Å; M1542-Y1587 PolarHBondContact O-N 3.25Å; M1542-Y1587 HydrophobicContact SD-CD1 4.23Å
1543	Q	76.6	Confident	70.6	Confident	115 Å²	115	61.6 Å²	61.6	54%	0.537	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	125	173	178.7	176	-19.9	0	0	110	V1526 Q1527	V1526-Q1543 CarbonylContact C-O 3.53Å; V1526-Q1543 WeakPolarHBondContact CA-O 3.37Å; V1526-Q1543 WeakPolarHBondContact CB-O 3.46Å; Q1527-Q1543 PolarHBondContact N-O 3.16Å; Q1527-Q1543 PolarHBondContact O-N 3.09Å
1544	R	83.4	Confident	72.3	Confident	97 Å²	97	67.1 Å²	67.1	37%	0.366	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	139.1	179.2	-178.7	-177.2	173.6	122.8	32.6	112.9	D1524 D1546	D1524-R1544 HydrophobicContact CB-CG 4.49Å; D1524-R1544 VanDerWaalsContact CG-NH2 3.34Å; D1524-R1544 IonicContact OD1-CZ 3.08Å; D1524-R1544 IonicContact OD1-NH1 2.8Å; D1524-R1544 PolarHBondContact OD1-NH1 3.14Å; D1524-R1544 IonicContact OD1-NH2 2.71Å; D1524-R1544 PolarHBondContact OD1-NH2 2.81Å; D1524-R1544 IonicContact OD2-CZ 2.65Å; D1524-R1544 VanDerWaalsContact OD2-CZ 3.24Å; D1524-R1544 IonicContact OD2-NE 2.76Å; D1524-R1544 IonicContact OD2-NH1 3.2Å; D1524-R1544 PolarHBondContact OD2-NH1 2.03Å; D1524-R1544 IonicContact OD2-NH2 3.69Å; R1544-D1546 IonicContact CZ-OD1 3.46Å; R1544-D1546 VanDerWaalsContact NE-CG 3.33Å; R1544-D1546 IonicContact NE-OD1 3.79Å; R1544-D1546 PolarHBondContact NE-OD1 2.96Å; R1544-D1546 IonicContact NE-OD2 3.51Å; R1544-D1546 PolarHBondContact NE-OD2 3Å; R1544-D1546 VanDerWaalsContact NE-OD2 3.08Å; R1544-D1546 IonicContact NH2-OD1 2.85Å; R1544-D1546 PolarHBondContact NH2-OD1 3.4Å
1545	V	84.6	Confident	73.9	Confident	13 Å²	13	71.5 Å²	71.5	8%	0.079	33%	0.328	C	S	.	.			trans	-137.7	108.9	178	-178.6	0	0	0	0	109.5	V1516 T1525 Q1527 P1558 L1563	V1516-V1545 HydrophobicContact CG2-CG1 4.16Å; V1516-V1545 VanDerWaalsContact CG2-O 3.3Å; V1516-V1545 WeakPolarHBondContact CG2-O 3.46Å; T1525-V1545 VanDerWaalsContact CB-O 3.27Å; T1525-V1545 WeakPolarHBondContact CB-O 3.43Å; T1525-V1545 PolarHBondContact O-N 3.44Å; T1525-V1545 PolarHBondContact OG1-O 2.81Å; Q1527-V1545 HydrophobicContact CB-CG2 3.99Å; V1545-P1558 HydrophobicContact CB-CG 4.48Å; V1545-P1558 HydrophobicContact CG1-CG 3.61Å; V1545-P1558 HydrophobicContact CG2-CG 4.03Å; V1545-L1563 HydrophobicContact CB-CD2 3.86Å; V1545-L1563 HydrophobicContact CG1-CD1 4.39Å; V1545-L1563 HydrophobicContact CG1-CD2 3.96Å; V1545-L1563 HydrophobicContact CG2-CD2 3.85Å
1546	D	86.6	Confident	75.8	Confident	74 Å²	74	66.6 Å²	66.6	40%	0.396	31%	0.31	S	S	.	.	S	Bend	trans	-96.8	-10.9	178.2	-52	-71.4	0	0	0	113.6	V1516 R1544	V1516-D1546 PolarHBondContact N-O 2.04Å; V1516-D1546 VanDerWaalsContact N-O 3.08Å; R1544-D1546 IonicContact CZ-OD1 3.46Å; R1544-D1546 VanDerWaalsContact NE-CG 3.33Å; R1544-D1546 IonicContact NE-OD1 3.79Å; R1544-D1546 PolarHBondContact NE-OD1 2.96Å; R1544-D1546 IonicContact NE-OD2 3.51Å; R1544-D1546 PolarHBondContact NE-OD2 3Å; R1544-D1546 VanDerWaalsContact NE-OD2 3.08Å; R1544-D1546 IonicContact NH2-OD1 2.85Å; R1544-D1546 PolarHBondContact NH2-OD1 3.4Å
1547	Q	89.5	Confident	77.5	Confident	119 Å²	119	64 Å²	64	56%	0.556	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-154.8	140.7	-176.5	51.9	-174.6	-40.3	0	0	112.1	C1514	C1514-Q1547 WeakPolarHBondContact O-CA 3.18Å
1548	I	89.2	Confident	79.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.5	171.5	58.5	176.7	0	0	0	109	P1494 V1502 A1513 C1514 V1516 W1556 P1558 V1560 L1563	P1494-I1548 HydrophobicContact CB-CD1 3.79Å; P1494-I1548 HydrophobicContact CG-CD1 4.02Å; V1502-I1548 HydrophobicContact CG1-CD1 3.84Å; A1513-I1548 CarbonylContact C-O 3.58Å; A1513-I1548 WeakPolarHBondContact CA-O 3.07Å; C1514-I1548 HydrophobicContact CB-CD1 4.19Å; C1514-I1548 HydrophobicContact CB-CG1 3.83Å; C1514-I1548 PolarHBondContact N-O 2.83Å; C1514-I1548 PolarHBondContact O-N 3.07Å; V1516-I1548 HydrophobicContact CG1-CB 4.36Å; V1516-I1548 HydrophobicContact CG1-CD1 3.98Å; V1516-I1548 HydrophobicContact CG1-CG1 3.84Å; V1516-I1548 HydrophobicContact CG1-CG2 3.81Å; I1548-W1556 HydrophobicContact CB-CE3 4.37Å; I1548-W1556 HydrophobicContact CD1-CB 4.23Å; I1548-W1556 HydrophobicContact CD1-CD2 4.13Å; I1548-W1556 HydrophobicContact CD1-CE3 3.99Å; I1548-W1556 HydrophobicContact CD1-CG 4.22Å; I1548-W1556 HydrophobicContact CG1-CD2 4.49Å; I1548-W1556 HydrophobicContact CG1-CE3 3.87Å; I1548-P1558 HydrophobicContact CG2-CG 4.37Å; I1548-V1560 HydrophobicContact CD1-CB 4.49Å; I1548-V1560 HydrophobicContact CD1-CG1 4.29Å; I1548-V1560 HydrophobicContact CD1-CG2 3.43Å; I1548-V1560 VanDerWaalsContact CD1-CG2 3.43Å; I1548-L1563 HydrophobicContact CG2-CD1 3.95Å
1549	T	88.4	Confident	80.7	Confident	18 Å²	18	59 Å²	59	11%	0.11	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136	-177.9	-55.3	0	0	0	0	110.6	V1442 S1551 E1557	V1442-T1549 HydrophobicContact CG2-CG2 3.57Å; T1549-S1551 PolarHBondContact O-N 2.8Å; T1549-E1557 PolarHBondContact N-O 2.85Å; T1549-E1557 PolarHBondContact O-N 3.13Å
1550	C	87.8	Confident	82.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	113.5	173.8	-169	0	0	0	0	111.1	C1491 G1511 N1512 W1556	C1491-C1550 HydrophobicContact CB-CB 3.85Å; C1491-C1550 WeakPolarHBondContact CB-SG 3.19Å; C1491-C1550 WeakPolarHBondContact SG-CB 3.42Å; C1491-C1550 CovalentContact SG-SG 2.02Å; C1491-C1550 PolarHBondContact SG-SG 3.31Å; G1511-C1550 PolarHBondContact N-O 2.71Å; N1512-C1550 PolarHBondContact O-N 3.04Å; C1550-W1556 HydrophobicContact CB-CD2 4.3Å; C1550-W1556 HydrophobicContact CB-CE3 3.93Å; C1550-W1556 HydrophobicContact CB-CH2 3.79Å; C1550-W1556 HydrophobicContact CB-CZ2 4.16Å; C1550-W1556 HydrophobicContact CB-CZ3 3.68Å
1551	S	82.3	Confident	83.2	Confident	4 Å²	4	55.5 Å²	55.5	3%	0.028	27%	0.266	C	S	.	.			trans	-65.7	160	173.7	64.1	0	0	0	0	112.7	T1549 Q1553 R1554 R1555	T1549-S1551 PolarHBondContact O-N 2.8Å; S1551-Q1553 PolarHBondContact O-N 2.87Å; S1551-R1554 WeakPolarHBondContact O-CA 3.4Å; S1551-R1554 PolarHBondContact O-N 2.79Å; S1551-R1555 WeakPolarHBondContact CB-O 3.37Å; S1551-R1555 PolarHBondContact N-O 2.84Å; S1551-R1555 PolarHBondContact OG-N 2.91Å; S1551-R1555 PolarHBondContact OG-O 2.93Å
1552	L	81.3	Confident	84	Confident	22 Å²	22	56.6 Å²	56.6	12%	0.115	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-16	169.9	-89.1	151.7	0	0	0	114.4	V1442 Y1443 L1446 P1464 C1484 L1486 P1487 V1510 R1554	V1442-L1552 HydrophobicContact CG1-CD1 4.08Å; V1442-L1552 HydrophobicContact CG1-CG 4.22Å; V1442-L1552 PolarHBondContact O-N 2.69Å; Y1443-L1552 HydrophobicContact CD1-CD1 3.59Å; Y1443-L1552 HydrophobicContact CE1-CD1 4Å; L1446-L1552 HydrophobicContact CD1-CB 3.22Å; L1446-L1552 HydrophobicContact CD1-CD1 3.71Å; L1446-L1552 HydrophobicContact CD1-CG 4.05Å; P1464-L1552 HydrophobicContact CG-CD2 4.14Å; C1484-L1552 HydrophobicContact CB-CD1 4.38Å; L1486-L1552 HydrophobicContact CD2-CD1 4.06Å; L1486-L1552 HydrophobicContact CD2-CD2 4.34Å; L1486-L1552 HydrophobicContact CD2-CG 4.17Å; P1487-L1552 HydrophobicContact CG-CD2 3.92Å; V1510-L1552 HydrophobicContact CG1-CB 4.24Å; V1510-L1552 HydrophobicContact CG1-CD2 3.93Å; V1510-L1552 HydrophobicContact CG1-CG 3.74Å; L1552-R1554 PolarHBondContact O-N 3.27Å
1553	Q	78.9	Confident	84.7	Confident	96 Å²	96	55.2 Å²	55.2	45%	0.449	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	6.9	171.3	-60.9	-170.9	0.7	0	0	113.5	S1551 R1555	S1551-Q1553 PolarHBondContact O-N 2.87Å; Q1553-R1555 VanDerWaalsContact C-N 3.27Å; Q1553-R1555 PolarHBondContact O-N 3.16Å
1554	R	84.6	Confident	85.1	Confident	131 Å²	131	52.6 Å²	52.6	49%	0.494	26%	0.26	S	S	.	.	S	Bend	trans	60.1	32.3	-174.6	-64.4	-179.6	-79.3	-156.2	-7.1	113.9	D1489 V1510 S1551 L1552	D1489-R1554 IonicContact OD2-CZ 3.91Å; D1489-R1554 IonicContact OD2-NH1 3.48Å; D1489-R1554 PolarHBondContact OD2-NH1 3.12Å; V1510-R1554 HydrophobicContact CG2-CG 3.96Å; S1551-R1554 WeakPolarHBondContact O-CA 3.4Å; S1551-R1554 PolarHBondContact O-N 2.79Å; L1552-R1554 PolarHBondContact O-N 3.27Å
1555	R	85.5	Confident	85.3	Confident	161 Å²	161	49.6 Å²	49.6	61%	0.608	25%	0.253	S	S	*	.			trans	-117.2	140.6	175.9	-65.6	178.6	175.9	-177.3	-2.4	110.8	S1551 Q1553	S1551-R1555 WeakPolarHBondContact CB-O 3.37Å; S1551-R1555 PolarHBondContact N-O 2.84Å; S1551-R1555 PolarHBondContact OG-N 2.91Å; S1551-R1555 PolarHBondContact OG-O 2.93Å; Q1553-R1555 VanDerWaalsContact C-N 3.27Å; Q1553-R1555 PolarHBondContact O-N 3.16Å
1556	W	88.4	Confident	85.1	Confident	23 Å²	23	49.9 Å²	49.9	9%	0.087	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	126.6	172.6	-64	103.4	0	0	0	110.4	C1491 P1492 P1494 R1508 N1512 C1514 I1548 C1550 P1558 V1560	C1491-W1556 HydrophobicContact CB-CZ2 3.8Å; P1492-W1556 PolarHBondContact O-NE1 3.48Å; P1494-W1556 HydrophobicContact CB-CD2 4.38Å; P1494-W1556 HydrophobicContact CB-CG 4.16Å; R1508-W1556 HydrophobicContact CB-CH2 4.3Å; R1508-W1556 HydrophobicContact CB-CZ2 4.19Å; R1508-W1556 HydrophobicContact CG-CH2 4.41Å; R1508-W1556 HydrophobicContact CG-CZ2 4.31Å; N1512-W1556 WeakPolarHBondContact O-CZ3 3.5Å; C1514-W1556 HydrophobicContact CB-CZ3 4.38Å; C1514-W1556 WeakPolarHBondContact SG-CH2 3.38Å; C1514-W1556 WeakPolarHBondContact SG-CZ3 3.34Å; I1548-W1556 HydrophobicContact CB-CE3 4.37Å; I1548-W1556 HydrophobicContact CD1-CB 4.23Å; I1548-W1556 HydrophobicContact CD1-CD2 4.13Å; I1548-W1556 HydrophobicContact CD1-CE3 3.99Å; I1548-W1556 HydrophobicContact CD1-CG 4.22Å; I1548-W1556 HydrophobicContact CG1-CD2 4.49Å; I1548-W1556 HydrophobicContact CG1-CE3 3.87Å; C1550-W1556 HydrophobicContact CB-CD2 4.3Å; C1550-W1556 HydrophobicContact CB-CE3 3.93Å; C1550-W1556 HydrophobicContact CB-CH2 3.79Å; C1550-W1556 HydrophobicContact CB-CZ2 4.16Å; C1550-W1556 HydrophobicContact CB-CZ3 3.68Å; W1556-P1558 CarbonylContact C-O 3.6Å; W1556-P1558 CarbonylContact O-C 3.48Å; W1556-V1560 HydrophobicContact CB-CG2 3.85Å; W1556-V1560 HydrophobicContact CG-CG2 4.33Å
1557	E	81.8	Confident	84.9	Confident	49 Å²	49	49.4 Å²	49.4	23%	0.229	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	126.4	-178.8	-80	-70.8	168.1	0	0	110.3	V1441 R1444 T1549	V1441-E1557 HydrophobicContact CG1-CB 3.48Å; V1441-E1557 VanDerWaalsContact CG1-CB 3.48Å; R1444-E1557 WeakPolarHBondContact CD-OE2 3.39Å; R1444-E1557 IonicContact CZ-OE2 3.78Å; R1444-E1557 IonicContact NE-OE2 3.79Å; R1444-E1557 IonicContact NH1-OE2 2.7Å; R1444-E1557 PolarHBondContact NH1-OE2 3.43Å; T1549-E1557 PolarHBondContact N-O 2.85Å; T1549-E1557 PolarHBondContact O-N 3.13Å
1558	P	83.6	Confident	84.6	Confident	16 Å²	16	47.4 Å²	47.4	10%	0.104	24%	0.239	C	C	.	.	S	Bend	cis	-62.7	163	-10.1	29	-35.8	0	0	0	112.5	V1545 I1548 W1556 V1560 L1563	V1545-P1558 HydrophobicContact CB-CG 4.48Å; V1545-P1558 HydrophobicContact CG1-CG 3.61Å; V1545-P1558 HydrophobicContact CG2-CG 4.03Å; I1548-P1558 HydrophobicContact CG2-CG 4.37Å; W1556-P1558 CarbonylContact C-O 3.6Å; W1556-P1558 CarbonylContact O-C 3.48Å; P1558-V1560 PolarHBondContact O-N 3.28Å; P1558-L1563 HydrophobicContact CG-CD2 4.14Å
1559	N	82.7	Confident	84.5	Confident	96 Å²	96	47.9 Å²	47.9	51%	0.513	24%	0.242	S	C	.	.			trans	-62	123.2	178.2	-178.1	-4.7	0	0	0	110.4	A1561 S1562	N1559-A1561 PolarHBondContact O-N 2.76Å; N1559-A1561 VanDerWaalsContact O-N 3.16Å; N1559-A1561 PolarHBondContact OD1-N 2.89Å; N1559-A1561 VanDerWaalsContact OD1-N 3.14Å; N1559-S1562 PolarHBondContact O-N 2.87Å; N1559-S1562 PolarHBondContact O-OG 2.85Å
1560	V	87	Confident	84.3	Confident	5 Å²	5	48.9 Å²	48.9	3%	0.03	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-56.8	-33	-176.6	-158.9	0	0	0	0	112.6	P1494 A1496 P1497 V1502 I1548 W1556 P1558 S1562 L1563	P1494-V1560 HydrophobicContact CB-CG2 3.73Å; A1496-V1560 HydrophobicContact CB-CG1 4.43Å; P1497-V1560 WeakPolarHBondContact CD-O 3.21Å; P1497-V1560 WeakPolarHBondContact CG-O 3.29Å; V1502-V1560 HydrophobicContact CG2-CG1 4.03Å; I1548-V1560 HydrophobicContact CD1-CB 4.49Å; I1548-V1560 HydrophobicContact CD1-CG1 4.29Å; I1548-V1560 HydrophobicContact CD1-CG2 3.43Å; I1548-V1560 VanDerWaalsContact CD1-CG2 3.43Å; W1556-V1560 HydrophobicContact CB-CG2 3.85Å; W1556-V1560 HydrophobicContact CG-CG2 4.33Å; P1558-V1560 PolarHBondContact O-N 3.28Å; V1560-S1562 PolarHBondContact O-N 2.79Å; V1560-L1563 PolarHBondContact O-N 2.91Å
1561	A	83.9	Confident	84.1	Confident	74 Å²	74	54.7 Å²	54.7	61%	0.612	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-72.3	-6.6	177.6	0	0	0	0	0	114.4	N1559	N1559-A1561 PolarHBondContact O-N 2.76Å; N1559-A1561 VanDerWaalsContact O-N 3.16Å; N1559-A1561 PolarHBondContact OD1-N 2.89Å; N1559-A1561 VanDerWaalsContact OD1-N 3.14Å
1562	S	83.7	Confident	84	Confident	43 Å²	43	60.9 Å²	60.9	30%	0.301	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-103.4	7.3	177.2	67.3	0	0	0	0	113.9	Q1527 N1559 V1560	Q1527-S1562 PolarHBondContact NE2-OG 3.47Å; N1559-S1562 PolarHBondContact O-N 2.87Å; N1559-S1562 PolarHBondContact O-OG 2.85Å; V1560-S1562 PolarHBondContact O-N 2.79Å
1563	L	88	Confident	84.1	Confident	3 Å²	3	61 Å²	61	2%	0.016	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	141.6	178	-56.5	-179.6	0	0	0	110.1	I1500 V1516 V1526 Q1527 V1545 I1548 P1558 V1560	I1500-L1563 HydrophobicContact CD1-CB 3.36Å; I1500-L1563 VanDerWaalsContact CD1-O 3.23Å; I1500-L1563 WeakPolarHBondContact CD1-O 3.3Å; V1516-L1563 HydrophobicContact CB-CD1 4.34Å; V1516-L1563 HydrophobicContact CG1-CD1 4.24Å; V1516-L1563 HydrophobicContact CG2-CD1 4.02Å; V1526-L1563 CarbonylContact O-C 3.28Å; V1526-L1563 WeakPolarHBondContact O-CA 3.43Å; Q1527-L1563 HydrophobicContact CB-CD2 4.12Å; V1545-L1563 HydrophobicContact CB-CD2 3.86Å; V1545-L1563 HydrophobicContact CG1-CD1 4.39Å; V1545-L1563 HydrophobicContact CG1-CD2 3.96Å; V1545-L1563 HydrophobicContact CG2-CD2 3.85Å; I1548-L1563 HydrophobicContact CG2-CD1 3.95Å; P1558-L1563 HydrophobicContact CG-CD2 4.14Å; V1560-L1563 PolarHBondContact O-N 2.91Å
1564	V	86.6	Confident	84.3	Confident	60 Å²	60	58.6 Å²	58.6	36%	0.364	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	164.2	174.4	-64	0	0	0	0	110.2	T1525 V1526 E1528 V1566	T1525-V1564 WeakPolarHBondContact CA-O 3.5Å; V1526-V1564 HydrophobicContact CG2-CG2 3.72Å; V1526-V1564 PolarHBondContact N-O 3.36Å; V1526-V1564 PolarHBondContact O-N 3.32Å; E1528-V1564 HydrophobicContact CG-CG2 3.98Å; V1564-V1566 HydrophobicContact CG2-CG1 4.46Å
1565	C	87.4	Confident	84.3	Confident	34 Å²	34	59 Å²	59	23%	0.23	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125	-179.7	-77.9	0	0	0	0	111.4	C1518 Y1523	C1518-C1565 WeakPolarHBondContact CA-SG 3.4Å; C1518-C1565 HydrophobicContact CB-CB 3.95Å; C1518-C1565 WeakPolarHBondContact CB-SG 3.3Å; C1518-C1565 VanDerWaalsContact SG-CA 3.53Å; C1518-C1565 WeakPolarHBondContact SG-CB 3.27Å; C1518-C1565 CovalentContact SG-SG 2.03Å; C1518-C1565 PolarHBondContact SG-SG 3.16Å; Y1523-C1565 HydrophobicContact CD1-CB 4.41Å
1566	V	80.3	Confident	84.3	Confident	19 Å²	19	54.5 Å²	54.5	12%	0.115	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.2	179.1	-59.9	0	0	0	0	111.6	Y1523 D1524 V1526 M1542 V1564 K1568 Y1587	Y1523-V1566 CarbonylContact C-O 3.52Å; Y1523-V1566 WeakPolarHBondContact CA-O 3.29Å; D1524-V1566 PolarHBondContact N-O 3.48Å; D1524-V1566 PolarHBondContact O-N 3.02Å; D1524-V1566 VanDerWaalsContact O-N 3.11Å; V1526-V1566 HydrophobicContact CB-CG2 4.19Å; V1526-V1566 HydrophobicContact CG1-CG2 3.51Å; V1526-V1566 HydrophobicContact CG2-CB 4.24Å; V1526-V1566 HydrophobicContact CG2-CG1 3.67Å; V1526-V1566 HydrophobicContact CG2-CG2 3.55Å; M1542-V1566 HydrophobicContact CE-CG1 4.03Å; M1542-V1566 HydrophobicContact SD-CG1 4.02Å; M1542-V1566 HydrophobicContact SD-CG2 4.47Å; V1564-V1566 HydrophobicContact CG2-CG1 4.46Å; V1566-K1568 PolarHBondContact O-N 2.74Å; V1566-Y1587 HydrophobicContact CG2-CD1 4.34Å; V1566-Y1587 HydrophobicContact CG2-CE1 3.72Å; V1566-Y1587 HydrophobicContact CG2-CE2 4.42Å
1567	K	81.9	Confident	84.1	Confident	65 Å²	65	54.4 Å²	54.4	28%	0.283	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	123.2	178.2	-174.2	-172	179.8	-168.1	0	109.3	N455 Y1523 Y1587	N455-K1567 WeakPolarHBondContact OD1-CE 3.28Å; Y1523-K1567 VanDerWaalsContact CD1-N 3.33Å; Y1523-K1567 HydrophobicContact CE1-CB 4.26Å; K1567-Y1587 VanDerWaalsContact C-OH 3.3Å; K1567-Y1587 PolarHBondContact O-OH 2.93Å
1568	K	84.4	Confident	84.2	Confident	77 Å²	77	54.5 Å²	54.5	34%	0.335	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-53.2	145.1	-175.5	-171	154.9	-166.6	150.5	0	112.8	G1522 D1524 V1566 Y1587	G1522-K1568 VanDerWaalsContact O-CB 3.25Å; G1522-K1568 WeakPolarHBondContact O-CB 3.21Å; G1522-K1568 PolarHBondContact O-N 3.27Å; D1524-K1568 WeakPolarHBondContact OD1-CD 3.36Å; D1524-K1568 WeakPolarHBondContact OD1-CE 3.45Å; D1524-K1568 IonicContact OD1-NZ 3.62Å; D1524-K1568 PolarHBondContact OD1-NZ 2.84Å; D1524-K1568 WeakPolarHBondContact OD2-CD 3.46Å; D1524-K1568 VanDerWaalsContact OD2-CE 3.32Å; D1524-K1568 WeakPolarHBondContact OD2-CE 3.32Å; D1524-K1568 WeakPolarHBondContact OD2-CG 3.46Å; D1524-K1568 IonicContact OD2-NZ 3.1Å; V1566-K1568 PolarHBondContact O-N 2.74Å; K1568-Y1587 WeakPolarHBondContact CA-OH 3.2Å; K1568-Y1587 PolarHBondContact N-OH 2.85Å
1569	C	85.4	Confident	84.4	Confident	9 Å²	9	53.8 Å²	53.8	6%	0.061	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-67.4	138	173.7	-46.9	0	0	0	0	110.3	Q1571 I1574 Y1587 C1588	C1569-Q1571 PolarHBondContact O-N 3.2Å; C1569-I1574 HydrophobicContact CB-CD1 3.74Å; C1569-I1574 HydrophobicContact CB-CG1 4.41Å; C1569-Y1587 PolarHBondContact N-OH 2.83Å; C1569-Y1587 WeakPolarHBondContact SG-CE2 3.31Å; C1569-C1588 HydrophobicContact CB-CB 3.85Å; C1569-C1588 WeakPolarHBondContact CB-SG 3.49Å; C1569-C1588 WeakPolarHBondContact SG-CA 3.36Å; C1569-C1588 WeakPolarHBondContact SG-CB 3.44Å; C1569-C1588 CovalentContact SG-SG 2.03Å; C1569-C1588 PolarHBondContact SG-SG 2.84Å
1570	T	84.6	Confident	84.6	Confident	39 Å²	39	49.6 Å²	49.6	24%	0.239	27%	0.269	C	S	.	.			trans	-74.7	108.9	173.2	-44.5	0	0	0	0	107.9	D1572 F1573 N1583	T1570-D1572 PolarHBondContact O-N 2.85Å; T1570-F1573 HydrophobicContact CG2-CD2 3.57Å; T1570-F1573 HydrophobicContact CG2-CE2 3.62Å; T1570-F1573 HydrophobicContact CG2-CG 4.36Å; T1570-F1573 HydrophobicContact CG2-CZ 4.45Å; T1570-F1573 PolarHBondContact O-N 3.27Å; T1570-N1583 PolarHBondContact N-OD1 3.41Å; T1570-N1583 VanDerWaalsContact N-OD1 3.13Å; T1570-N1583 PolarHBondContact O-ND2 2.94Å
1571	Q	83.3	Confident	84.4	Confident	122 Å²	122	52.8 Å²	52.8	57%	0.57	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-34.4	-169.5	-70.8	-62.6	-78.3	0	0	112.8	C1569 F1573 I1574	C1569-Q1571 PolarHBondContact O-N 3.2Å; Q1571-F1573 VanDerWaalsContact C-N 3.3Å; Q1571-F1573 PolarHBondContact O-N 3.09Å; Q1571-I1574 PolarHBondContact O-N 3.11Å
1572	D	80.3	Confident	84.2	Confident	134 Å²	134	50.9 Å²	50.9	72%	0.717	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-24.7	-172.2	-49.4	-71.6	0	0	0	113.1	T1570	T1570-D1572 PolarHBondContact O-N 2.85Å
1573	F	83.4	Confident	84.4	Confident	24 Å²	24	48.9 Å²	48.9	11%	0.105	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-17.7	174.9	-53.1	-39.4	0	0	0	112.7	C437 T1570 Q1571 K1575 D1576 D1580 N1583	C437-F1573 HydrophobicContact CB-CE2 4.33Å; C437-F1573 HydrophobicContact CB-CZ 4.22Å; T1570-F1573 HydrophobicContact CG2-CD2 3.57Å; T1570-F1573 HydrophobicContact CG2-CE2 3.62Å; T1570-F1573 HydrophobicContact CG2-CG 4.36Å; T1570-F1573 HydrophobicContact CG2-CZ 4.45Å; T1570-F1573 PolarHBondContact O-N 3.27Å; Q1571-F1573 VanDerWaalsContact C-N 3.3Å; Q1571-F1573 PolarHBondContact O-N 3.09Å; F1573-K1575 PolarHBondContact O-N 2.77Å; F1573-D1576 PolarHBondContact O-N 2.99Å; F1573-D1580 HydrophobicContact CB-CB 4.14Å; F1573-N1583 WeakPolarHBondContact CB-ND2 3.49Å
1574	I	83.6	Confident	84.3	Confident	46 Å²	46	49 Å²	49	24%	0.236	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	112.5	179.4	-60.1	-179.8	0	0	0	109.6	C1569 Q1571 N1583 C1588 D1591	C1569-I1574 HydrophobicContact CB-CD1 3.74Å; C1569-I1574 HydrophobicContact CB-CG1 4.41Å; Q1571-I1574 PolarHBondContact O-N 3.11Å; I1574-N1583 VanDerWaalsContact CG1-ND2 3.26Å; I1574-N1583 WeakPolarHBondContact CG1-ND2 3.14Å; I1574-N1583 PolarHBondContact N-ND2 3.22Å; I1574-C1588 HydrophobicContact CD1-CB 4.44Å; I1574-D1591 WeakPolarHBondContact CA-OD1 3.01Å
1575	K	85	Confident	84.1	Confident	141 Å²	141	49.9 Å²	49.9	61%	0.613	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	69	31.2	175.3	-147.3	-179.9	-177.5	170.3	0	114.5	F1573 G1577 D1591 D1594	F1573-K1575 PolarHBondContact O-N 2.77Å; K1575-G1577 VanDerWaalsContact C-N 3.25Å; K1575-D1591 PolarHBondContact N-O 3.22Å; K1575-D1594 VanDerWaalsContact C-OD2 3.3Å; K1575-D1594 VanDerWaalsContact CA-OD2 3.23Å; K1575-D1594 WeakPolarHBondContact CA-OD2 3.1Å
1576	D	85.7	Confident	83.5	Confident	65 Å²	65	48.9 Å²	48.9	35%	0.348	24%	0.24	S	C	.	.	S	Bend	trans	-79.8	-8.3	179.9	78.4	-12.6	0	0	0	113.1	F1573 W1578	F1573-D1576 PolarHBondContact O-N 2.99Å; D1576-W1578 WeakPolarHBondContact OD1-CA 3.08Å; D1576-W1578 WeakPolarHBondContact OD1-CB 3.1Å; D1576-W1578 PolarHBondContact OD1-N 2.73Å
1577	G	82.9	Confident	83.6	Confident	22 Å²	22	49.6 Å²	49.6	23%	0.227	24%	0.24	C	C	.	.	S	Bend	trans	103.6	-6.3	-177.6	0	0	0	0	0	114.6	K1575 D1594 K1606	K1575-G1577 VanDerWaalsContact C-N 3.25Å; G1577-D1594 WeakPolarHBondContact CA-OD2 3.42Å; G1577-D1594 PolarHBondContact N-OD2 2.8Å; G1577-D1594 VanDerWaalsContact N-OD2 3.09Å; G1577-K1606 WeakPolarHBondContact O-CB 3.45Å; G1577-K1606 WeakPolarHBondContact O-CD 3.26Å
1578	W	85.3	Confident	83.8	Confident	50 Å²	50	46.7 Å²	46.7	19%	0.189	23%	0.229	C	C	.	.	S	Bend	trans	-104.7	174	173.4	-57.9	94.5	0	0	0	110.9	F874 D1576 D1594 K1606 M1608	F874-W1578 HydrophobicContact CE1-CH2 4.37Å; D1576-W1578 WeakPolarHBondContact OD1-CA 3.08Å; D1576-W1578 WeakPolarHBondContact OD1-CB 3.1Å; D1576-W1578 PolarHBondContact OD1-N 2.73Å; W1578-D1594 WeakPolarHBondContact O-CB 3.48Å; W1578-K1606 CarbonylContact C-O 3.38Å; W1578-K1606 HydrophobicContact CD2-CB 4.05Å; W1578-K1606 HydrophobicContact CE3-CB 3.47Å; W1578-K1606 VanDerWaalsContact CE3-CB 3.47Å; W1578-K1606 HydrophobicContact CZ3-CB 3.84Å; W1578-M1608 HydrophobicContact CB-CB 4.23Å; W1578-M1608 HydrophobicContact CD2-CB 4.44Å; W1578-M1608 HydrophobicContact CE3-CB 4.27Å; W1578-M1608 HydrophobicContact CG-CB 4.43Å
1579	C	87.9	Confident	83.8	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.014	23%	0.227	C	C	.	.			trans	-114.1	95.7	174.8	171.7	0	0	0	0	109.4	F1581 C1595 V1605 K1606 L1607	C1579-F1581 PolarHBondContact O-N 3.08Å; C1579-C1595 WeakPolarHBondContact CA-SG 3.28Å; C1579-C1595 HydrophobicContact CB-CB 3.93Å; C1579-C1595 WeakPolarHBondContact CB-SG 3.43Å; C1579-C1595 WeakPolarHBondContact SG-CA 3.43Å; C1579-C1595 WeakPolarHBondContact SG-CB 3.47Å; C1579-C1595 CovalentContact SG-SG 2.04Å; C1579-C1595 PolarHBondContact SG-SG 3.32Å; C1579-V1605 HydrophobicContact CB-CG1 3.7Å; C1579-K1606 WeakPolarHBondContact CB-O 3.45Å; C1579-K1606 PolarHBondContact N-O 2.61Å; C1579-L1607 HydrophobicContact CB-CD2 4.09Å
1580	D	85.6	Confident	83.8	Confident	8 Å²	8	45.4 Å²	45.4	4%	0.043	23%	0.229	C	C	.	.			trans	-82.6	110.4	174.3	-83.2	-83.5	0	0	0	110.8	F1573 Q1582 N1583 N1584 D1591 M1608	F1573-D1580 HydrophobicContact CB-CB 4.14Å; D1580-Q1582 PolarHBondContact O-N 2.91Å; D1580-N1583 HydrophobicContact CB-CB 4.27Å; D1580-N1583 CarbonylContact O-C 3.58Å; D1580-N1583 WeakPolarHBondContact O-CA 3.37Å; D1580-N1583 PolarHBondContact O-N 3.15Å; D1580-N1584 PolarHBondContact O-N 3.29Å; D1580-D1591 WeakPolarHBondContact CB-OD2 3.33Å; D1580-D1591 PolarHBondContact N-OD2 2.92Å; D1580-M1608 WeakPolarHBondContact OD1-CE 3.16Å
1581	F	83.5	Confident	83.9	Confident	72 Å²	72	43.5 Å²	43.5	32%	0.316	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-28.6	175.6	78.6	-87.9	0	0	0	112.5	C1579 N1583 L1617	C1579-F1581 PolarHBondContact O-N 3.08Å; F1581-N1583 VanDerWaalsContact C-N 3.33Å; F1581-L1617 HydrophobicContact CB-CB 3.95Å; F1581-L1617 HydrophobicContact CD2-CD1 4.23Å
1582	Q	80	Confident	84.1	Confident	33 Å²	33	38.9 Å²	38.9	15%	0.154	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-32	175.8	-60.1	-160.9	43.9	0	0	112.4	D1580 R1585	D1580-Q1582 PolarHBondContact O-N 2.91Å; Q1582-R1585 PolarHBondContact O-NE 2.66Å; Q1582-R1585 PolarHBondContact O-NH2 3.4Å
1583	N	86.9	Confident	84.4	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-2.8	-179.7	-80.5	-11.2	0	0	0	113.5	T1570 F1573 I1574 D1580 F1581 R1585 C1588 D1591	T1570-N1583 PolarHBondContact N-OD1 3.41Å; T1570-N1583 VanDerWaalsContact N-OD1 3.13Å; T1570-N1583 PolarHBondContact O-ND2 2.94Å; F1573-N1583 WeakPolarHBondContact CB-ND2 3.49Å; I1574-N1583 VanDerWaalsContact CG1-ND2 3.26Å; I1574-N1583 WeakPolarHBondContact CG1-ND2 3.14Å; I1574-N1583 PolarHBondContact N-ND2 3.22Å; D1580-N1583 HydrophobicContact CB-CB 4.27Å; D1580-N1583 CarbonylContact O-C 3.58Å; D1580-N1583 WeakPolarHBondContact O-CA 3.37Å; D1580-N1583 PolarHBondContact O-N 3.15Å; F1581-N1583 VanDerWaalsContact C-N 3.33Å; N1583-R1585 PolarHBondContact O-N 2.92Å; N1583-C1588 HydrophobicContact CB-CB 4.17Å; N1583-C1588 WeakPolarHBondContact O-CB 3.17Å; N1583-D1591 HydrophobicContact CB-CB 3.84Å; N1583-D1591 WeakPolarHBondContact CB-OD1 3.26Å; N1583-D1591 PolarHBondContact ND2-OD1 3.14Å; N1583-D1591 VanDerWaalsContact ND2-OD1 3.12Å; N1583-D1591 WeakPolarHBondContact O-CA 3.28Å; N1583-D1591 PolarHBondContact O-N 3.26Å
1584	N	85.8	Confident	84.7	Confident	6 Å²	6	32 Å²	32	3%	0.032	17%	0.169	C	C	.	.			trans	-71.3	48	174.3	-164.2	13.5	0	0	0	113.1	D1580 C1595 L1617 R1619	D1580-N1584 PolarHBondContact O-N 3.29Å; N1584-C1595 HydrophobicContact CB-CB 4.41Å; N1584-C1595 VanDerWaalsContact CB-SG 3.58Å; N1584-C1595 WeakPolarHBondContact OD1-CB 3.48Å; N1584-L1617 PolarHBondContact ND2-O 3.04Å; N1584-R1619 PolarHBondContact ND2-O 2.92Å
1585	R	82.4	Confident	84.9	Confident	79 Å²	79	29.8 Å²	29.8	30%	0.298	16%	0.158	S	C	.	.	S	Bend	trans	-125.3	148.2	-178.2	-43.7	-173.4	-149	168.9	16.5	108.8	Q1582 N1583 Y1587 C1588 G1589 W1590	Q1582-R1585 PolarHBondContact O-NE 2.66Å; Q1582-R1585 PolarHBondContact O-NH2 3.4Å; N1583-R1585 PolarHBondContact O-N 2.92Å; R1585-Y1587 VanDerWaalsContact C-N 3.28Å; R1585-Y1587 HydrophobicContact CB-CD1 4.41Å; R1585-Y1587 PolarHBondContact O-N 3.38Å; R1585-Y1587 VanDerWaalsContact O-N 3.15Å; R1585-C1588 CarbonylContact O-C 3.5Å; R1585-C1588 PolarHBondContact O-N 2.95Å; R1585-G1589 PolarHBondContact O-N 2.96Å; R1585-W1590 PolarHBondContact O-N 3.16Å; R1585-W1590 VanDerWaalsContact O-N 3.09Å
1586	G	76.1	Confident	85.1	Confident	13 Å²	13	23.1 Å²	23.1	13%	0.134	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-57.6	-34.4	-174.5	0	0	0	0	0	115.4	C1588 G1589 W1590	G1586-C1588 VanDerWaalsContact C-N 3.34Å; G1586-G1589 PolarHBondContact O-N 3.5Å; G1586-G1589 VanDerWaalsContact O-N 3.16Å; G1586-W1590 VanDerWaalsContact CA-CE2 3.47Å; G1586-W1590 VanDerWaalsContact CA-CZ2 3.41Å
1587	Y	81.5	Confident	85	Confident	33 Å²	33	21.7 Å²	21.7	13%	0.129	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-79.5	-16.8	179.5	94.8	-84.7	0	0	0	114.3	V1526 M1542 V1566 K1567 K1568 C1569 R1585 G1589	V1526-Y1587 HydrophobicContact CG1-CD2 4.08Å; V1526-Y1587 HydrophobicContact CG1-CE2 4.33Å; V1526-Y1587 HydrophobicContact CG1-CG 4.25Å; M1542-Y1587 HydrophobicContact CB-CD1 4Å; M1542-Y1587 HydrophobicContact CB-CG 4.16Å; M1542-Y1587 WeakPolarHBondContact O-CA 3.45Å; M1542-Y1587 WeakPolarHBondContact O-CB 3.42Å; M1542-Y1587 PolarHBondContact O-N 3.25Å; M1542-Y1587 HydrophobicContact SD-CD1 4.23Å; V1566-Y1587 HydrophobicContact CG2-CD1 4.34Å; V1566-Y1587 HydrophobicContact CG2-CE1 3.72Å; V1566-Y1587 HydrophobicContact CG2-CE2 4.42Å; K1567-Y1587 VanDerWaalsContact C-OH 3.3Å; K1567-Y1587 PolarHBondContact O-OH 2.93Å; K1568-Y1587 WeakPolarHBondContact CA-OH 3.2Å; K1568-Y1587 PolarHBondContact N-OH 2.85Å; C1569-Y1587 PolarHBondContact N-OH 2.83Å; C1569-Y1587 WeakPolarHBondContact SG-CE2 3.31Å; R1585-Y1587 VanDerWaalsContact C-N 3.28Å; R1585-Y1587 HydrophobicContact CB-CD1 4.41Å; R1585-Y1587 PolarHBondContact O-N 3.38Å; R1585-Y1587 VanDerWaalsContact O-N 3.15Å; Y1587-G1589 VanDerWaalsContact C-N 3.29Å
1588	C	86.3	Confident	85.1	Confident	5 Å²	5	22.6 Å²	22.6	3%	0.034	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-90.7	5	168.8	-51.3	0	0	0	0	111.7	C1569 I1574 N1583 R1585 G1586 G1592	C1569-C1588 HydrophobicContact CB-CB 3.85Å; C1569-C1588 WeakPolarHBondContact CB-SG 3.49Å; C1569-C1588 WeakPolarHBondContact SG-CA 3.36Å; C1569-C1588 WeakPolarHBondContact SG-CB 3.44Å; C1569-C1588 CovalentContact SG-SG 2.03Å; C1569-C1588 PolarHBondContact SG-SG 2.84Å; I1574-C1588 HydrophobicContact CD1-CB 4.44Å; N1583-C1588 HydrophobicContact CB-CB 4.17Å; N1583-C1588 WeakPolarHBondContact O-CB 3.17Å; R1585-C1588 CarbonylContact O-C 3.5Å; R1585-C1588 PolarHBondContact O-N 2.95Å; G1586-C1588 VanDerWaalsContact C-N 3.34Å; C1588-G1592 PolarHBondContact O-N 2.95Å
1589	G	83.6	Confident	85.1	Confident	30 Å²	30	22.9 Å²	22.9	31%	0.309	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	27.2	179.4	0	0	0	0	0	114.7	R1585 G1586 Y1587 D1591 G1592 G1593	R1585-G1589 PolarHBondContact O-N 2.96Å; G1586-G1589 PolarHBondContact O-N 3.5Å; G1586-G1589 VanDerWaalsContact O-N 3.16Å; Y1587-G1589 VanDerWaalsContact C-N 3.29Å; G1589-D1591 VanDerWaalsContact C-N 3.32Å; G1589-G1592 CarbonylContact O-C 3.58Å; G1589-G1592 PolarHBondContact O-N 3.1Å; G1589-G1593 PolarHBondContact O-N 3.01Å; G1589-G1593 VanDerWaalsContact O-N 3.16Å
1590	W	85.1	Confident	84.9	Confident	28 Å²	28	23.2 Å²	23.2	11%	0.106	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	53.5	-171.6	-57.1	-84.6	0	0	0	111.3	V1541 R1585 G1586 G1592 G1593 L1621 D1622 P1623 Y1624	V1541-W1590 HydrophobicContact CG1-CH2 4.12Å; V1541-W1590 HydrophobicContact CG1-CZ2 4.22Å; V1541-W1590 HydrophobicContact CG2-CZ2 4.05Å; R1585-W1590 PolarHBondContact O-N 3.16Å; R1585-W1590 VanDerWaalsContact O-N 3.09Å; G1586-W1590 VanDerWaalsContact CA-CE2 3.47Å; G1586-W1590 VanDerWaalsContact CA-CZ2 3.41Å; W1590-G1592 PolarHBondContact O-N 3.44Å; W1590-G1593 WeakPolarHBondContact O-CA 3.35Å; W1590-G1593 PolarHBondContact O-N 3.14Å; W1590-L1621 VanDerWaalsContact CD1-O 3.25Å; W1590-L1621 PolarHBondContact NE1-O 2.93Å; W1590-D1622 HydrophobicContact CB-CB 3.88Å; W1590-D1622 VanDerWaalsContact CD1-N 3.34Å; W1590-D1622 HydrophobicContact CD2-CB 3.76Å; W1590-D1622 HydrophobicContact CE3-CB 4.21Å; W1590-D1622 HydrophobicContact CG-CB 3.58Å; W1590-P1623 HydrophobicContact CZ2-CG 3.98Å; W1590-Y1624 AromaticContact CH2-CD2 3.96Å; W1590-Y1624 HydrophobicContact CH2-CD2 3.96Å; W1590-Y1624 AromaticContact CH2-CE2 3.55Å; W1590-Y1624 HydrophobicContact CH2-CE2 3.55Å; W1590-Y1624 HydrophobicContact CZ2-CE2 4.43Å; W1590-Y1624 AromaticContact CZ3-CD2 3.96Å; W1590-Y1624 HydrophobicContact CZ3-CD2 3.96Å; W1590-Y1624 AromaticContact CZ3-CE2 3.91Å; W1590-Y1624 HydrophobicContact CZ3-CE2 3.91Å
1591	D	87.8	Confident	84.4	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	54	50.9	-174.2	-158.5	29.8	0	0	0	113.2	I1574 K1575 D1580 N1583 G1589 G1593 D1594	I1574-D1591 WeakPolarHBondContact CA-OD1 3.01Å; K1575-D1591 PolarHBondContact N-O 3.22Å; D1580-D1591 WeakPolarHBondContact CB-OD2 3.33Å; D1580-D1591 PolarHBondContact N-OD2 2.92Å; N1583-D1591 HydrophobicContact CB-CB 3.84Å; N1583-D1591 WeakPolarHBondContact CB-OD1 3.26Å; N1583-D1591 PolarHBondContact ND2-OD1 3.14Å; N1583-D1591 VanDerWaalsContact ND2-OD1 3.12Å; N1583-D1591 WeakPolarHBondContact O-CA 3.28Å; N1583-D1591 PolarHBondContact O-N 3.26Å; G1589-D1591 VanDerWaalsContact C-N 3.32Å; D1591-G1593 PolarHBondContact O-N 2.88Å; D1591-D1594 PolarHBondContact O-N 3.11Å; D1591-D1594 VanDerWaalsContact O-N 3.12Å
1592	G	86.8	Confident	83.7	Confident	24 Å²	24	30 Å²	30	25%	0.247	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	65.9	-1	-175.5	0	0	0	0	0	115.9	C1588 G1589 W1590	C1588-G1592 PolarHBondContact O-N 2.95Å; G1589-G1592 CarbonylContact O-C 3.58Å; G1589-G1592 PolarHBondContact O-N 3.1Å; W1590-G1592 PolarHBondContact O-N 3.44Å
1593	G	86.8	Confident	83.4	Confident	7 Å²	7	29.5 Å²	29.5	7%	0.072	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	113.4	-2.9	-177.1	0	0	0	0	0	114.7	G1589 W1590 D1591 C1595 T1599 A1600	G1589-G1593 PolarHBondContact O-N 3.01Å; G1589-G1593 VanDerWaalsContact O-N 3.16Å; W1590-G1593 WeakPolarHBondContact O-CA 3.35Å; W1590-G1593 PolarHBondContact O-N 3.14Å; D1591-G1593 PolarHBondContact O-N 2.88Å; G1593-C1595 PolarHBondContact O-N 3.37Å; G1593-T1599 CarbonylContact O-C 3.59Å; G1593-T1599 VanDerWaalsContact O-C 3.26Å; G1593-T1599 VanDerWaalsContact O-CB 3.3Å; G1593-T1599 WeakPolarHBondContact O-CB 3.28Å; G1593-T1599 PolarHBondContact O-OG1 3.09Å; G1593-A1600 WeakPolarHBondContact O-CA 3.45Å; G1593-A1600 PolarHBondContact O-N 3.34Å
1594	D	90.1	Very high	82.6	Confident	6 Å²	6	36.8 Å²	36.8	3%	0.032	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-13.2	-167.5	-71.2	-37.3	0	0	0	114.5	K1575 G1577 W1578 D1591 C1596 A1600 A1601	K1575-D1594 VanDerWaalsContact C-OD2 3.3Å; K1575-D1594 VanDerWaalsContact CA-OD2 3.23Å; K1575-D1594 WeakPolarHBondContact CA-OD2 3.1Å; G1577-D1594 WeakPolarHBondContact CA-OD2 3.42Å; G1577-D1594 PolarHBondContact N-OD2 2.8Å; G1577-D1594 VanDerWaalsContact N-OD2 3.09Å; W1578-D1594 WeakPolarHBondContact O-CB 3.48Å; D1591-D1594 PolarHBondContact O-N 3.11Å; D1591-D1594 VanDerWaalsContact O-N 3.12Å; D1594-C1596 VanDerWaalsContact C-N 3.33Å; D1594-C1596 PolarHBondContact O-N 2.91Å; D1594-A1600 WeakPolarHBondContact OD1-CA 3.22Å; D1594-A1601 PolarHBondContact OD1-N 2.84Å
1595	C	88.7	Confident	82.4	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.007	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-2.1	173.8	-72.8	0	0	0	0	116.9	C1579 N1584 G1593 C1620	C1579-C1595 WeakPolarHBondContact CA-SG 3.28Å; C1579-C1595 HydrophobicContact CB-CB 3.93Å; C1579-C1595 WeakPolarHBondContact CB-SG 3.43Å; C1579-C1595 WeakPolarHBondContact SG-CA 3.43Å; C1579-C1595 WeakPolarHBondContact SG-CB 3.47Å; C1579-C1595 CovalentContact SG-SG 2.04Å; C1579-C1595 PolarHBondContact SG-SG 3.32Å; N1584-C1595 HydrophobicContact CB-CB 4.41Å; N1584-C1595 VanDerWaalsContact CB-SG 3.58Å; N1584-C1595 WeakPolarHBondContact OD1-CB 3.48Å; G1593-C1595 PolarHBondContact O-N 3.37Å; C1595-C1620 VanDerWaalsContact O-CA 3.29Å; C1595-C1620 WeakPolarHBondContact O-CA 3.26Å
1596	C	88.2	Confident	82.2	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.007	23%	0.233	C	C	.	.	S	Bend	trans	-130.6	131.6	173.5	-62.7	0	0	0	0	111	D1594 S1598 T1599 A1600 V1605 C1620 A1625	D1594-C1596 VanDerWaalsContact C-N 3.33Å; D1594-C1596 PolarHBondContact O-N 2.91Å; C1596-S1598 PolarHBondContact O-N 2.86Å; C1596-T1599 WeakPolarHBondContact CB-OG1 3.44Å; C1596-T1599 PolarHBondContact O-N 2.65Å; C1596-T1599 PolarHBondContact O-OG1 2.89Å; C1596-A1600 WeakPolarHBondContact O-CB 3.23Å; C1596-A1600 PolarHBondContact O-N 3.29Å; C1596-V1605 VanDerWaalsContact C-CG2 3.5Å; C1596-C1620 HydrophobicContact CB-CB 3.87Å; C1596-C1620 WeakPolarHBondContact CB-SG 3.38Å; C1596-C1620 WeakPolarHBondContact SG-CA 3.18Å; C1596-C1620 WeakPolarHBondContact SG-CB 3.34Å; C1596-C1620 CovalentContact SG-SG 2.03Å; C1596-C1620 PolarHBondContact SG-SG 2.58Å; C1596-A1625 HydrophobicContact CB-CB 3.63Å; C1596-A1625 VanDerWaalsContact SG-CB 3.56Å
1597	A	83.3	Confident	82.2	Confident	35 Å²	35	40 Å²	40	29%	0.289	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-13.4	-179.8	0	0	0	0	0	114.5	G1603 V1605 E1627	A1597-G1603 CarbonylContact O-C 3.53Å; A1597-G1603 VanDerWaalsContact O-C 3.28Å; A1597-G1603 WeakPolarHBondContact O-CA 3.27Å; A1597-V1605 HydrophobicContact CB-CG2 4.22Å; A1597-V1605 VanDerWaalsContact N-CG2 3.27Å; A1597-E1627 VanDerWaalsContact CA-OE1 3.23Å; A1597-E1627 WeakPolarHBondContact CA-OE1 3.48Å; A1597-E1627 WeakPolarHBondContact CB-OE1 3.43Å; A1597-E1627 PolarHBondContact N-OE1 2.89Å
1598	S	84.8	Confident	81.1	Confident	41 Å²	41	40 Å²	40	29%	0.287	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-15.1	172.6	72.3	0	0	0	0	115.4	C1596 A1625 I1626 E1627	C1596-S1598 PolarHBondContact O-N 2.86Å; S1598-A1625 WeakPolarHBondContact OG-CA 3.31Å; S1598-A1625 WeakPolarHBondContact OG-CB 3.5Å; S1598-I1626 PolarHBondContact OG-N 3.32Å; S1598-E1627 WeakPolarHBondContact CB-OE2 3.19Å; S1598-E1627 PolarHBondContact N-OE1 2.81Å; S1598-E1627 PolarHBondContact OG-OE2 3.12Å
1599	T	85.3	Confident	79.6	Confident	56 Å²	56	42 Å²	42	34%	0.344	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-28.3	177.8	49	0	0	0	0	112.8	G1593 C1596 A1625	G1593-T1599 CarbonylContact O-C 3.59Å; G1593-T1599 VanDerWaalsContact O-C 3.26Å; G1593-T1599 VanDerWaalsContact O-CB 3.3Å; G1593-T1599 WeakPolarHBondContact O-CB 3.28Å; G1593-T1599 PolarHBondContact O-OG1 3.09Å; C1596-T1599 WeakPolarHBondContact CB-OG1 3.44Å; C1596-T1599 PolarHBondContact O-N 2.65Å; C1596-T1599 PolarHBondContact O-OG1 2.89Å; T1599-A1625 HydrophobicContact CG2-CB 4.25Å
1600	A	84.7	Confident	78.2	Confident	9 Å²	9	43.7 Å²	43.7	7%	0.074	26%	0.256	C	S	.	.	S	Bend	trans	-58.6	139.1	175.3	0	0	0	0	0	111.2	G1593 D1594 C1596 E1602 G1603 K1604	G1593-A1600 WeakPolarHBondContact O-CA 3.45Å; G1593-A1600 PolarHBondContact O-N 3.34Å; D1594-A1600 WeakPolarHBondContact OD1-CA 3.22Å; C1596-A1600 WeakPolarHBondContact O-CB 3.23Å; C1596-A1600 PolarHBondContact O-N 3.29Å; A1600-E1602 PolarHBondContact O-N 3.49Å; A1600-E1602 VanDerWaalsContact O-N 3.09Å; A1600-G1603 PolarHBondContact O-N 2.79Å; A1600-K1604 WeakPolarHBondContact CB-O 3.25Å
1601	A	74.6	Confident	76.5	Confident	94 Å²	94	47.2 Å²	47.2	78%	0.777	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-33.7	-167.3	0	0	0	0	0	114.4	D1594	D1594-A1601 PolarHBondContact OD1-N 2.84Å
1602	E	68.6	Low	74.6	Confident	129 Å²	129	50.5 Å²	50.5	60%	0.603	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-8.5	-177.9	-69.9	179.7	-164.5	0	0	114.3	A1600 K1604 K1606	A1600-E1602 PolarHBondContact O-N 3.49Å; A1600-E1602 VanDerWaalsContact O-N 3.09Å; E1602-K1604 VanDerWaalsContact C-N 3.32Å; E1602-K1606 VanDerWaalsContact CD-CE 3.5Å; E1602-K1606 VanDerWaalsContact CD-NZ 3.28Å; E1602-K1606 WeakPolarHBondContact OE1-CE 3.24Å; E1602-K1606 IonicContact OE1-NZ 2.75Å; E1602-K1606 PolarHBondContact OE1-NZ 2.86Å; E1602-K1606 WeakPolarHBondContact OE2-CE 3.39Å; E1602-K1606 IonicContact OE2-NZ 2.75Å; E1602-K1606 PolarHBondContact OE2-NZ 2.74Å
1603	G	73.8	Confident	73.1	Confident	21 Å²	21	50.2 Å²	50.2	22%	0.216	30%	0.297	C	S	.	.	S	Bend	trans	79.2	14.5	-171.2	0	0	0	0	0	114.5	A1597 A1600	A1597-G1603 CarbonylContact O-C 3.53Å; A1597-G1603 VanDerWaalsContact O-C 3.28Å; A1597-G1603 WeakPolarHBondContact O-CA 3.27Å; A1600-G1603 PolarHBondContact O-N 2.79Å
1604	K	71.3	Confident	71.1	Confident	155 Å²	155	54 Å²	54	67%	0.674	33%	0.327	S	S	*	.	S	Bend	trans	-136.6	143.7	174	-68.3	-176.1	176	-173.8	0	107.6	A1600 E1602	A1600-K1604 WeakPolarHBondContact CB-O 3.25Å; E1602-K1604 VanDerWaalsContact C-N 3.32Å
1605	V	79.5	Confident	69.3	Low	50 Å²	50	55.7 Å²	55.7	30%	0.303	34%	0.34	S	S	.	.			trans	-82.4	133.4	168.1	-179.5	0	0	0	0	107.9	C1579 C1596 A1597 L1607	C1579-V1605 HydrophobicContact CB-CG1 3.7Å; C1596-V1605 VanDerWaalsContact C-CG2 3.5Å; A1597-V1605 HydrophobicContact CB-CG2 4.22Å; A1597-V1605 VanDerWaalsContact N-CG2 3.27Å; V1605-L1607 HydrophobicContact CG1-CD2 3.77Å; V1605-L1607 HydrophobicContact CG1-CG 4.43Å
1606	K	78.7	Confident	68.1	Low	55 Å²	55	61.4 Å²	61.4	24%	0.239	37%	0.366	C	S	.	.			trans	-103.1	135.8	166.1	-54.1	179.7	-173.1	169.4	0	107.3	G1577 W1578 C1579 E1602	G1577-K1606 WeakPolarHBondContact O-CB 3.45Å; G1577-K1606 WeakPolarHBondContact O-CD 3.26Å; W1578-K1606 CarbonylContact C-O 3.38Å; W1578-K1606 HydrophobicContact CD2-CB 4.05Å; W1578-K1606 HydrophobicContact CE3-CB 3.47Å; W1578-K1606 VanDerWaalsContact CE3-CB 3.47Å; W1578-K1606 HydrophobicContact CZ3-CB 3.84Å; C1579-K1606 WeakPolarHBondContact CB-O 3.45Å; C1579-K1606 PolarHBondContact N-O 2.61Å; E1602-K1606 VanDerWaalsContact CD-CE 3.5Å; E1602-K1606 VanDerWaalsContact CD-NZ 3.28Å; E1602-K1606 WeakPolarHBondContact OE1-CE 3.24Å; E1602-K1606 IonicContact OE1-NZ 2.75Å; E1602-K1606 PolarHBondContact OE1-NZ 2.86Å; E1602-K1606 WeakPolarHBondContact OE2-CE 3.39Å; E1602-K1606 IonicContact OE2-NZ 2.75Å; E1602-K1606 PolarHBondContact OE2-NZ 2.74Å
1607	L	76.1	Confident	67.2	Low	60 Å²	60	64.8 Å²	64.8	31%	0.314	38%	0.384	S	S	.	.			trans	-108.5	120.7	-179.5	-59.3	174.3	0	0	0	107.6	C1579 V1605 F1609 P1610 C1613 C1618	C1579-L1607 HydrophobicContact CB-CD2 4.09Å; V1605-L1607 HydrophobicContact CG1-CD2 3.77Å; V1605-L1607 HydrophobicContact CG1-CG 4.43Å; L1607-F1609 PolarHBondContact O-N 2.88Å; L1607-P1610 HydrophobicContact CB-CG 4.49Å; L1607-C1613 HydrophobicContact CB-CB 4.37Å; L1607-C1613 HydrophobicContact CD1-CB 3.9Å; L1607-C1613 HydrophobicContact CD2-CB 4.11Å; L1607-C1613 HydrophobicContact CG-CB 4.35Å; L1607-C1618 HydrophobicContact CD2-CB 4.09Å
1608	M	58.2	Low	66.7	Low	34 Å²	34	63.6 Å²	63.6	17%	0.167	37%	0.373	C	S	.	.	S	Bend	trans	-64.2	-32.8	-177.1	-170	156.8	67.2	0	0	111.4	W1578 D1580	W1578-M1608 HydrophobicContact CB-CB 4.23Å; W1578-M1608 HydrophobicContact CD2-CB 4.44Å; W1578-M1608 HydrophobicContact CE3-CB 4.27Å; W1578-M1608 HydrophobicContact CG-CB 4.43Å; D1580-M1608 WeakPolarHBondContact OD1-CE 3.16Å
1609	F	55.7	Low	66.4	Low	46 Å²	46	69.5 Å²	69.5	20%	0.202	39%	0.389	C	S	.	.			trans	-136.9	93.1	174.8	-55.8	-72.8	0	0	0	110.9	I439 L1607 S1611 L1612 C1613	I439-F1609 HydrophobicContact CG1-CE2 4.49Å; L1607-F1609 PolarHBondContact O-N 2.88Å; F1609-S1611 PolarHBondContact O-N 3.42Å; F1609-L1612 HydrophobicContact CB-CB 4.15Å; F1609-L1612 HydrophobicContact CB-CD1 3.61Å; F1609-L1612 HydrophobicContact CB-CG 3.97Å; F1609-L1612 HydrophobicContact CD2-CD1 3.93Å; F1609-L1612 HydrophobicContact CG-CD1 3.86Å; F1609-L1612 PolarHBondContact O-N 2.73Å; F1609-L1612 VanDerWaalsContact O-N 3.16Å; F1609-C1613 WeakPolarHBondContact O-CB 3.38Å; F1609-C1613 PolarHBondContact O-N 2.72Å; F1609-C1613 VanDerWaalsContact O-N 3.13Å
1610	P	53.5	Low	66.5	Low	65 Å²	65	68.1 Å²	68.1	42%	0.422	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-34.7	-179	-27.9	35.8	0	0	0	114	L1607 C1613	L1607-P1610 HydrophobicContact CB-CG 4.49Å; P1610-C1613 PolarHBondContact O-N 2.82Å
1611	S	49.4	Very low	66.3	Low	103 Å²	103	70 Å²	70	72%	0.72	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-38.1	178.2	48.5	0	0	0	0	113.9	F1609	F1609-S1611 PolarHBondContact O-N 3.42Å
1612	L	49.4	Very low	66.6	Low	68 Å²	68	66.1 Å²	66.1	36%	0.356	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-79.7	-27.4	175.7	-59.3	170.3	0	0	0	112	I439 F1609 A1614 S1615	I439-L1612 HydrophobicContact CB-CD1 4.46Å; I439-L1612 HydrophobicContact CD1-CD1 3.45Å; I439-L1612 VanDerWaalsContact CD1-CD1 3.45Å; I439-L1612 HydrophobicContact CD1-CD2 4.06Å; I439-L1612 HydrophobicContact CD1-CG 4.26Å; I439-L1612 HydrophobicContact CG1-CD1 3.52Å; F1609-L1612 HydrophobicContact CB-CB 4.15Å; F1609-L1612 HydrophobicContact CB-CD1 3.61Å; F1609-L1612 HydrophobicContact CB-CG 3.97Å; F1609-L1612 HydrophobicContact CD2-CD1 3.93Å; F1609-L1612 HydrophobicContact CG-CD1 3.86Å; F1609-L1612 PolarHBondContact O-N 2.73Å; F1609-L1612 VanDerWaalsContact O-N 3.16Å; L1612-A1614 PolarHBondContact O-N 3Å; L1612-S1615 PolarHBondContact O-N 2.91Å; L1612-S1615 PolarHBondContact O-OG 2.83Å
1613	C	54.7	Low	66.8	Low	19 Å²	19	60.4 Å²	60.4	13%	0.128	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-81.6	9.7	-176.7	-75.6	0	0	0	0	115.3	L1607 F1609 P1610 S1615 C1618	L1607-C1613 HydrophobicContact CB-CB 4.37Å; L1607-C1613 HydrophobicContact CD1-CB 3.9Å; L1607-C1613 HydrophobicContact CD2-CB 4.11Å; L1607-C1613 HydrophobicContact CG-CB 4.35Å; F1609-C1613 WeakPolarHBondContact O-CB 3.38Å; F1609-C1613 PolarHBondContact O-N 2.72Å; F1609-C1613 VanDerWaalsContact O-N 3.13Å; P1610-C1613 PolarHBondContact O-N 2.82Å; C1613-S1615 PolarHBondContact O-N 2.79Å; C1613-C1618 WeakPolarHBondContact CA-SG 3.23Å; C1613-C1618 HydrophobicContact CB-CB 3.33Å; C1613-C1618 WeakPolarHBondContact CB-SG 3.23Å; C1613-C1618 WeakPolarHBondContact SG-CB 3.39Å; C1613-C1618 CovalentContact SG-SG 2.04Å; C1613-C1618 PolarHBondContact SG-SG 2.92Å
1614	A	44.1	Very low	66.9	Low	86 Å²	86	64.3 Å²	64.3	71%	0.711	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-61.3	-24.5	159.7	0	0	0	0	0	112.3	L1612	L1612-A1614 PolarHBondContact O-N 3Å
1615	S	53.2	Low	67.3	Low	42 Å²	42	57 Å²	57	29%	0.294	31%	0.308	S	S	.	.	S	Bend	trans	-68.5	157.9	177.2	74.1	0	0	0	0	113.2	L1612 C1613 L1617 C1618	L1612-S1615 PolarHBondContact O-N 2.91Å; L1612-S1615 PolarHBondContact O-OG 2.83Å; C1613-S1615 PolarHBondContact O-N 2.79Å; S1615-L1617 PolarHBondContact O-N 2.82Å; S1615-L1617 VanDerWaalsContact O-N 3.08Å; S1615-C1618 PolarHBondContact O-N 3.22Å
1616	H	63.5	Low	67.1	Low	120 Å²	120	60.3 Å²	60.3	56%	0.556	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-63.9	-12.1	175.4	61	-93.6	0	0	0	113.7	R1619	H1616-R1619 WeakPolarHBondContact O-CB 3.26Å; H1616-R1619 PolarHBondContact O-N 3.02Å
1617	L	67.9	Low	66.5	Low	73 Å²	73	60.6 Å²	60.6	38%	0.382	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-75.4	-23.1	-176.1	-57.3	170.2	0	0	0	113.6	F1581 N1584 S1615	F1581-L1617 HydrophobicContact CB-CB 3.95Å; F1581-L1617 HydrophobicContact CD2-CD1 4.23Å; N1584-L1617 PolarHBondContact ND2-O 3.04Å; S1615-L1617 PolarHBondContact O-N 2.82Å; S1615-L1617 VanDerWaalsContact O-N 3.08Å
1618	C	74.3	Confident	66.1	Low	10 Å²	10	59.2 Å²	59.2	7%	0.068	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-98.5	5.4	172.7	-55.5	0	0	0	0	113.5	L1607 C1613 S1615	L1607-C1618 HydrophobicContact CD2-CB 4.09Å; C1613-C1618 WeakPolarHBondContact CA-SG 3.23Å; C1613-C1618 HydrophobicContact CB-CB 3.33Å; C1613-C1618 WeakPolarHBondContact CB-SG 3.23Å; C1613-C1618 WeakPolarHBondContact SG-CB 3.39Å; C1613-C1618 CovalentContact SG-SG 2.04Å; C1613-C1618 PolarHBondContact SG-SG 2.92Å; S1615-C1618 PolarHBondContact O-N 3.22Å
1619	R	78.3	Confident	66.2	Low	164 Å²	164	63.2 Å²	63.2	62%	0.619	33%	0.331	S	S	*	.	S	Bend	trans	-69.1	162	173.2	-66.7	-178.4	-179.1	174.7	0.9	109.4	N1584 H1616 L1621	N1584-R1619 PolarHBondContact ND2-O 2.92Å; H1616-R1619 WeakPolarHBondContact O-CB 3.26Å; H1616-R1619 PolarHBondContact O-N 3.02Å; R1619-L1621 WeakPolarHBondContact O-CG 3.44Å; R1619-L1621 PolarHBondContact O-N 3.2Å
1620	C	86.2	Confident	65.6	Low	28 Å²	28	64.2 Å²	64.2	19%	0.189	34%	0.338	C	S	.	.			trans	-60.9	102.7	170	172.4	0	0	0	0	110.1	C1595 C1596 N1628	C1595-C1620 VanDerWaalsContact O-CA 3.29Å; C1595-C1620 WeakPolarHBondContact O-CA 3.26Å; C1596-C1620 HydrophobicContact CB-CB 3.87Å; C1596-C1620 WeakPolarHBondContact CB-SG 3.38Å; C1596-C1620 WeakPolarHBondContact SG-CA 3.18Å; C1596-C1620 WeakPolarHBondContact SG-CB 3.34Å; C1596-C1620 CovalentContact SG-SG 2.03Å; C1596-C1620 PolarHBondContact SG-SG 2.58Å; C1620-N1628 PolarHBondContact O-ND2 2.82Å; C1620-N1628 PolarHBondContact SG-ND2 2.86Å
1621	L	81.1	Confident	65	Low	48 Å²	48	70.7 Å²	70.7	25%	0.251	36%	0.363	S	S	.	.			trans	-102.1	-0.8	-180	-64.4	-177.9	0	0	0	113.3	M1539 W1590 R1619 P1623	M1539-L1621 HydrophobicContact CE-CB 3.88Å; M1539-L1621 HydrophobicContact CE-CD2 3.95Å; M1539-L1621 HydrophobicContact CE-CG 4.48Å; M1539-L1621 WeakPolarHBondContact CE-O 3.4Å; W1590-L1621 VanDerWaalsContact CD1-O 3.25Å; W1590-L1621 PolarHBondContact NE1-O 2.93Å; R1619-L1621 WeakPolarHBondContact O-CG 3.44Å; R1619-L1621 PolarHBondContact O-N 3.2Å; L1621-P1623 VanDerWaalsContact O-CD 3.23Å; L1621-P1623 WeakPolarHBondContact O-CD 3.5Å
1622	D	81.6	Confident	64.5	Low	12 Å²	12	72.1 Å²	72.1	6%	0.064	36%	0.361	C	S	.	.			trans	-72.6	114	173.2	-179	0.3	0	0	0	110	W1590 Y1624 A1625 N1628	W1590-D1622 HydrophobicContact CB-CB 3.88Å; W1590-D1622 VanDerWaalsContact CD1-N 3.34Å; W1590-D1622 HydrophobicContact CD2-CB 3.76Å; W1590-D1622 HydrophobicContact CE3-CB 4.21Å; W1590-D1622 HydrophobicContact CG-CB 3.58Å; D1622-Y1624 PolarHBondContact O-N 2.74Å; D1622-Y1624 WeakPolarHBondContact OD1-CA 2.89Å; D1622-Y1624 VanDerWaalsContact OD1-CB 3.23Å; D1622-Y1624 WeakPolarHBondContact OD1-CB 3.47Å; D1622-Y1624 VanDerWaalsContact OD1-CD2 3.25Å; D1622-Y1624 WeakPolarHBondContact OD1-CD2 3.33Å; D1622-Y1624 PolarHBondContact OD1-N 3.37Å; D1622-A1625 HydrophobicContact CB-CB 3.9Å; D1622-A1625 WeakPolarHBondContact O-CB 3.43Å; D1622-A1625 PolarHBondContact O-N 2.93Å; D1622-N1628 PolarHBondContact O-ND2 2.89Å
1623	P	71.5	Confident	64	Low	10 Å²	10	72.4 Å²	72.4	7%	0.065	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-13.1	177.6	32.4	-37.4	0	0	0	112.8	V1531 T1533 M1539 W1590 L1621	V1531-P1623 HydrophobicContact CG1-CG 4.48Å; T1533-P1623 HydrophobicContact CG2-CB 3.79Å; M1539-P1623 HydrophobicContact SD-CB 4.13Å; W1590-P1623 HydrophobicContact CZ2-CG 3.98Å; L1621-P1623 VanDerWaalsContact O-CD 3.23Å; L1621-P1623 WeakPolarHBondContact O-CD 3.5Å
1624	Y	76.5	Confident	63.2	Low	103 Å²	103	82.7 Å²	82.7	40%	0.404	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-11.2	177.8	-48.3	-54.9	0	0	0	113.3	W1590 D1622 R1629	W1590-Y1624 AromaticContact CH2-CD2 3.96Å; W1590-Y1624 HydrophobicContact CH2-CD2 3.96Å; W1590-Y1624 AromaticContact CH2-CE2 3.55Å; W1590-Y1624 HydrophobicContact CH2-CE2 3.55Å; W1590-Y1624 HydrophobicContact CZ2-CE2 4.43Å; W1590-Y1624 AromaticContact CZ3-CD2 3.96Å; W1590-Y1624 HydrophobicContact CZ3-CD2 3.96Å; W1590-Y1624 AromaticContact CZ3-CE2 3.91Å; W1590-Y1624 HydrophobicContact CZ3-CE2 3.91Å; D1622-Y1624 PolarHBondContact O-N 2.74Å; D1622-Y1624 WeakPolarHBondContact OD1-CA 2.89Å; D1622-Y1624 VanDerWaalsContact OD1-CB 3.23Å; D1622-Y1624 WeakPolarHBondContact OD1-CB 3.47Å; D1622-Y1624 VanDerWaalsContact OD1-CD2 3.25Å; D1622-Y1624 WeakPolarHBondContact OD1-CD2 3.33Å; D1622-Y1624 PolarHBondContact OD1-N 3.37Å; Y1624-R1629 WeakPolarHBondContact O-CD 3.28Å; Y1624-R1629 PolarHBondContact O-NE 2.78Å; Y1624-R1629 PolarHBondContact O-NH1 2.89Å
1625	A	79.4	Confident	62.5	Low	1 Å²	1	87.2 Å²	87.2	1%	0.008	41%	0.408	C	S	.	.	S	Bend	trans	-66.5	148	174.5	0	0	0	0	0	111.9	C1596 S1598 T1599 D1622 E1627 N1628 R1629	C1596-A1625 HydrophobicContact CB-CB 3.63Å; C1596-A1625 VanDerWaalsContact SG-CB 3.56Å; S1598-A1625 WeakPolarHBondContact OG-CA 3.31Å; S1598-A1625 WeakPolarHBondContact OG-CB 3.5Å; T1599-A1625 HydrophobicContact CG2-CB 4.25Å; D1622-A1625 HydrophobicContact CB-CB 3.9Å; D1622-A1625 WeakPolarHBondContact O-CB 3.43Å; D1622-A1625 PolarHBondContact O-N 2.93Å; A1625-E1627 VanDerWaalsContact C-N 3.26Å; A1625-E1627 WeakPolarHBondContact CB-OE2 3.34Å; A1625-E1627 PolarHBondContact O-N 3.01Å; A1625-N1628 PolarHBondContact O-N 2.7Å; A1625-R1629 WeakPolarHBondContact O-CG 3.42Å; A1625-R1629 PolarHBondContact O-N 3.17Å
1626	I	75.4	Confident	61.3	Low	119 Å²	119	87.2 Å²	87.2	61%	0.61	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.7	-175.1	-63.4	178.2	0	0	0	112.1	S1598 N1628 R1629	S1598-I1626 PolarHBondContact OG-N 3.32Å; I1626-N1628 VanDerWaalsContact C-N 3.31Å; I1626-N1628 PolarHBondContact O-N 2.63Å; I1626-R1629 VanDerWaalsContact O-O 3.11Å
1627	E	66.6	Low	59.7	Low	62 Å²	62	89.7 Å²	89.7	29%	0.29	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-32.9	177.9	-54.5	92.4	142.9	0	0	112.4	R1535 A1597 S1598 A1625	R1535-E1627 PolarHBondContact NH2-O 2.9Å; A1597-E1627 VanDerWaalsContact CA-OE1 3.23Å; A1597-E1627 WeakPolarHBondContact CA-OE1 3.48Å; A1597-E1627 WeakPolarHBondContact CB-OE1 3.43Å; A1597-E1627 PolarHBondContact N-OE1 2.89Å; S1598-E1627 WeakPolarHBondContact CB-OE2 3.19Å; S1598-E1627 PolarHBondContact N-OE1 2.81Å; S1598-E1627 PolarHBondContact OG-OE2 3.12Å; A1625-E1627 VanDerWaalsContact C-N 3.26Å; A1625-E1627 WeakPolarHBondContact CB-OE2 3.34Å; A1625-E1627 PolarHBondContact O-N 3.01Å
1628	N	68.3	Low	57.8	Low	31 Å²	31	91.2 Å²	91.2	17%	0.166	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-21.6	-179.9	-72.6	-22.1	0	0	0	112.6	C1620 D1622 A1625 I1626	C1620-N1628 PolarHBondContact O-ND2 2.82Å; C1620-N1628 PolarHBondContact SG-ND2 2.86Å; D1622-N1628 PolarHBondContact O-ND2 2.89Å; A1625-N1628 PolarHBondContact O-N 2.7Å; I1626-N1628 VanDerWaalsContact C-N 3.31Å; I1626-N1628 PolarHBondContact O-N 2.63Å
1629	R	59.9	Low	55.7	Low	117 Å²	117	101.1 Å²	101.1	44%	0.442	48%	0.479	S	S	.	.	S	Bend	trans	-77.7	131.8	172.3	-77	177.1	163.9	158.6	-0.5	112	D1534 Y1624 A1625 I1626	D1534-R1629 WeakPolarHBondContact OD2-CA 3.32Å; Y1624-R1629 WeakPolarHBondContact O-CD 3.28Å; Y1624-R1629 PolarHBondContact O-NE 2.78Å; Y1624-R1629 PolarHBondContact O-NH1 2.89Å; A1625-R1629 WeakPolarHBondContact O-CG 3.42Å; A1625-R1629 PolarHBondContact O-N 3.17Å; I1626-R1629 VanDerWaalsContact O-O 3.11Å
1630	N	43.8	Very low	53.1	Low	67 Å²	67	105 Å²	105	36%	0.358	49%	0.494	S	S	.	.			trans	-74.7	143.6	168.9	-94.9	-40	0	0	0	110.1	D1534 I1632 V1633	D1534-N1630 HydrophobicContact CB-CB 3.98Å; D1534-N1630 PolarHBondContact O-ND2 2.6Å; D1534-N1630 PolarHBondContact OD2-N 2.81Å; N1630-I1632 PolarHBondContact O-N 3.28Å; N1630-V1633 PolarHBondContact O-N 3.31Å
1631	E	39.2	Very low	50.5	Low	201 Å²	201	107.8 Å²	107.8	94%	0.939	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	5.6	-176	-128.4	-175.3	169.5	0	0	115
1632	I	38.9	Very low	48.2	Very low	133 Å²	133	112.4 Å²	112.4	68%	0.682	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-29	-176.5	-59.4	177.6	0	0	0	111.6	N1630 R1634 Q1635	N1630-I1632 PolarHBondContact O-N 3.28Å; I1632-R1634 VanDerWaalsContact C-N 3.25Å; I1632-R1634 PolarHBondContact O-N 3Å; I1632-R1634 VanDerWaalsContact O-N 3.17Å; I1632-Q1635 PolarHBondContact O-N 2.75Å
1633	V	39.1	Very low	45.7	Very low	75 Å²	75	116.8 Å²	116.8	46%	0.455	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-73.1	-11.1	-172.1	-175.9	0	0	0	0	113.6	D1534 N1630 Q1635 G1636	D1534-V1633 WeakPolarHBondContact OD2-CG2 3.42Å; N1630-V1633 PolarHBondContact O-N 3.31Å; V1633-Q1635 PolarHBondContact O-N 3.02Å; V1633-G1636 WeakPolarHBondContact O-CA 3.4Å; V1633-G1636 PolarHBondContact O-N 3.25Å
1634	R	38.8	Very low	43.6	Very low	235 Å²	235	121.8 Å²	121.8	89%	0.887	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-76.3	3.2	165.9	-91.6	-171.5	177.9	173.9	4.8	115.2	I1632	I1632-R1634 VanDerWaalsContact C-N 3.25Å; I1632-R1634 PolarHBondContact O-N 3Å; I1632-R1634 VanDerWaalsContact O-N 3.17Å
1635	Q	28.3	Very low	41.5	Very low	180 Å²	180	123.2 Å²	123.2	84%	0.841	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-106.7	-4.1	154.3	-61.8	-167.7	19.2	0	0	113	I1632 V1633 L1637	I1632-Q1635 PolarHBondContact O-N 2.75Å; V1633-Q1635 PolarHBondContact O-N 3.02Å; Q1635-L1637 VanDerWaalsContact C-N 3.32Å; Q1635-L1637 PolarHBondContact O-N 2.65Å
1636	G	28.9	Very low	39	Very low	42 Å²	42	125.8 Å²	125.8	43%	0.433	64%	0.637	S	S	.	*			trans	-82.4	18	-174.5	0	0	0	0	0	116.5	V1633 V1638	V1633-G1636 WeakPolarHBondContact O-CA 3.4Å; V1633-G1636 PolarHBondContact O-N 3.25Å; G1636-V1638 PolarHBondContact O-N 2.74Å
1637	L	30.8	Very low	36.7	Very low	172 Å²	172	125.4 Å²	125.4	90%	0.901	65%	0.645	S	S	*	*	S	Bend	trans	-85.5	32.1	166.5	-129	174.1	0	0	0	112.2	Q1635	Q1635-L1637 VanDerWaalsContact C-N 3.32Å; Q1635-L1637 PolarHBondContact O-N 2.65Å
1638	V	27.2	Very low	35	Very low	105 Å²	105	131.7 Å²	131.7	64%	0.636	67%	0.672	S	S	*	*	S	Bend	trans	-142.1	93.4	161	-176	0	0	0	0	109.2	G1636	G1636-V1638 PolarHBondContact O-N 2.74Å
1639	R	29	Very low	33.1	Very low	219 Å²	219	137.7 Å²	137.7	83%	0.826	70%	0.699	S	S	*	*			trans	74.6	119.7	161.4	-51.7	162.8	-164.9	-149.7	0.2	114.8
1640	R	25.3	Very low	31.6	Very low	246 Å²	246	139.4 Å²	139.4	93%	0.928	72%	0.716	S	S	*	*				79	134.6	52.2	-81.2	-171.6	167.7	162.5	-4.6	113.9
1641	A	30.9	Very low	31	Very low	86 Å²	86	139.9 Å²	139.9	71%	0.711	73%	0.729	S	S	*	*			trans	69.7	136.8	179.8	0	0	0	0	0	115.4
1642	D	32.5	Very low	30.6	Very low	144 Å²	144	141.4 Å²	141.4	77%	0.77	73%	0.726	S	S	*	*			cis	-151.9	156.1	-16.8	-88	-35.4	0	0	0	106.5
1643	V	28.8	Very low	30.1	Very low	105 Å²	105	140.1 Å²	140.1	64%	0.636	73%	0.725	S	S	*	*			cis	91.5	115.2	31.8	179	0	0	0	0	114
1644	D	28.1	Very low	29.8	Very low	114 Å²	114	142.6 Å²	142.6	61%	0.61	74%	0.736	S	S	*	*			trans	60.7	146.7	177.1	-70.5	-45.2	0	0	0	117.8	K1538	K1538-D1644 IonicContact NZ-OD1 2.67Å; K1538-D1644 PolarHBondContact NZ-OD1 2.82Å
1645	V	32.5	Very low	29.5	Very low	133 Å²	133	138.1 Å²	138.1	81%	0.806	73%	0.725	S	S	*	*			cis	-141.3	158.4	43.6	171	0	0	0	0	111.8
1646	A	26.7	Very low	29.8	Very low	55 Å²	55	135.4 Å²	135.4	46%	0.455	72%	0.716	S	S	.	*			trans	-129.7	174.5	165.3	0	0	0	0	0	109.9	K1538	K1538-A1646 HydrophobicContact CD-CB 4.18Å
1647	S	28	Very low	30	Very low	111 Å²	111	137.9 Å²	137.9	78%	0.776	73%	0.727	S	S	*	*			trans	90.8	150.5	165.3	-47.8	0	0	0	0	119
1648	F	30.5	Very low	30.1	Very low	195 Å²	195	137.4 Å²	137.4	86%	0.855	73%	0.725	S	S	*	*			trans	89.5	90.7	-177.1	-74.3	-86.8	0	0	0	115.6
1649	Q	28.6	Very low	30.4	Very low	157 Å²	157	135.9 Å²	135.9	73%	0.734	73%	0.731	S	S	*	*			cis	78.4	123	42.5	-130.3	-163.7	8.6	0	0	115.1
1650	L	27.2	Very low	30.5	Very low	153 Å²	153	130.6 Å²	130.6	80%	0.801	73%	0.728	S	S	*	*			trans	65.5	134.6	158.3	-64.8	153.8	0	0	0	117.6
1651	A	32.1	Very low	30.7	Very low	77 Å²	77	125.4 Å²	125.4	64%	0.636	72%	0.717	S	S	*	*			cis	-172.6	157.9	36.9	0	0	0	0	0	112.7
1652	R	30.3	Very low	30.7	Very low	232 Å²	232	131 Å²	131	88%	0.875	72%	0.72	S	S	*	*			trans	56.4	147.5	139.2	-73.8	-179.5	-174.2	174.2	2	120.6
1653	T	29.3	Very low	30.5	Very low	107 Å²	107	133.7 Å²	133.7	66%	0.656	73%	0.725	S	S	*	*			cis	-175.8	160.9	-13.3	19.9	0	0	0	0	107.3
1654	N	31.9	Very low	30.6	Very low	126 Å²	126	132.4 Å²	132.4	67%	0.674	73%	0.733	S	S	*	*			trans	69.7	149.7	155.5	-65	13.5	0	0	0	117.3
1655	E	32.9	Very low	30.6	Very low	141 Å²	141	131.1 Å²	131.1	66%	0.659	75%	0.747	S	S	*	*			cis	-165.2	159.1	-6.4	-116.9	171.1	-147.6	0	0	111.8
1656	N	34.2	Very low	30.6	Very low	124 Å²	124	128.2 Å²	128.2	66%	0.663	74%	0.744	S	S	*	*			trans	59.4	101.6	140.7	-64	-27.1	0	0	0	123.8
1657	S	32.6	Very low	30.8	Very low	93 Å²	93	135.2 Å²	135.2	65%	0.65	76%	0.764	S	S	*	*				96.6	147.8	103.1	78.8	0	0	0	0	123.5
1658	N	34.4	Very low	30.9	Very low	162 Å²	162	139 Å²	139	87%	0.866	77%	0.767	S	S	*	*			trans	78.6	129.7	154.1	-63.1	-22.9	0	0	0	121.5
1659	G	33	Very low	31	Very low	74 Å²	74	137.2 Å²	137.2	76%	0.763	77%	0.765	S	S	*	*			trans	153.1	47.8	143.7	0	0	0	0	0	123.5
1660	S	30.9	Very low	31.1	Very low	108 Å²	108	136 Å²	136	76%	0.755	76%	0.763	S	S	*	*			trans	51.8	124.2	137.2	-83.1	0	0	0	0	125.2
1661	L	30.3	Very low	31.2	Very low	136 Å²	136	139.8 Å²	139.8	71%	0.712	77%	0.767	S	S	*	*				86.5	116.5	120.2	-66.7	170.5	0	0	0	123.9
1662	R	29.7	Very low	31.1	Very low	204 Å²	204	141.5 Å²	141.5	77%	0.77	77%	0.774	S	S	*	*				89.4	116.6	127.3	-69.7	-173.1	176.4	-177.4	2	123.2
1663	F	29.4	Very low	31.1	Very low	201 Å²	201	135 Å²	135	88%	0.882	77%	0.765	S	S	*	*			trans	43.3	132.9	131.1	-63.7	-74.6	0	0	0	122.4
1664	G	29.6	Very low	31.3	Very low	78 Å²	78	135.2 Å²	135.2	80%	0.804	76%	0.762	S	S	*	*				124.9	97.3	118.6	0	0	0	0	0	118.4
1665	G	29.2	Very low	31.3	Very low	87 Å²	87	139.1 Å²	139.1	90%	0.897	77%	0.767	S	S	*	*			trans	26.3	136.7	143.3	0	0	0	0	0	123.5
1666	G	31.1	Very low	31.3	Very low	72 Å²	72	138.6 Å²	138.6	74%	0.742	77%	0.773	S	S	*	*			trans	137.4	106.1	140.7	0	0	0	0	0	118.5
1667	K	31.7	Very low	31.3	Very low	201 Å²	201	137.3 Å²	137.3	87%	0.874	77%	0.774	S	S	*	*			trans	40.2	120.4	141	-66.5	176.3	178.4	173	0	120.9
1668	K	29.3	Very low	31.4	Very low	192 Å²	192	137.5 Å²	137.5	84%	0.835	78%	0.776	S	S	*	*			trans	41.8	117.5	133	-62.3	-176.7	175.3	-174.9	0	119
1669	L	32.9	Very low	31.3	Very low	157 Å²	157	136.7 Å²	136.7	82%	0.822	77%	0.771	S	S	*	*				178.3	138.8	108.8	-98.2	150.6	0	0	0	114.3
1670	N	31.6	Very low	31.2	Very low	130 Å²	130	139.6 Å²	139.6	70%	0.695	76%	0.764	S	S	*	*			trans	29.5	123	146.6	-74.8	-11.5	0	0	0	123.7
1671	R	29.4	Very low	31.3	Very low	234 Å²	234	138 Å²	138	88%	0.883	77%	0.765	S	S	*	*				61.9	122.9	124.9	-71.6	-176.1	168.9	178.4	-3.5	121.4
1672	S	28.9	Very low	31.2	Very low	112 Å²	112	141.2 Å²	141.2	78%	0.783	77%	0.767	S	S	*	*				89	111.5	123.2	-173.7	0	0	0	0	121
1673	S	31	Very low	31.2	Very low	96 Å²	96	138.5 Å²	138.5	67%	0.671	77%	0.767	S	S	*	*			trans	48.2	113.9	132.1	-158.7	0	0	0	0	120.3
1674	D	33.4	Very low	31.2	Very low	112 Å²	112	135.1 Å²	135.1	60%	0.599	76%	0.757	S	S	*	*				-170	137	102.3	-105.2	4.9	0	0	0	110.3
1675	R	32.2	Very low	31.3	Very low	208 Å²	208	138.8 Å²	138.8	79%	0.785	76%	0.757	S	S	*	*				62.8	146	100.1	-62.5	-176.8	-164.9	-144.6	-1.8	114.3
1676	T	32.7	Very low	31.3	Very low	129 Å²	129	138.1 Å²	138.1	79%	0.791	74%	0.744	S	S	*	*			cis	-168.4	171.2	3.7	10.4	0	0	0	0	108.2
1677	S	34.8	Very low	31.1	Very low	97 Å²	97	142 Å²	142	68%	0.678	74%	0.743	S	S	*	*			cis	-170.7	-174.1	-0.6	51.2	0	0	0	0	109.8
1678	S	34.6	Very low	31	Very low	98 Å²	98	141.9 Å²	141.9	69%	0.685	74%	0.736	S	S	*	*			trans	99.1	145.3	141.6	86.8	0	0	0	0	116.3
1679	L	32.1	Very low	30.9	Very low	144 Å²	144	141.5 Å²	141.5	75%	0.754	74%	0.735	S	S	*	*			cis	-143.5	170.6	-3.2	-89.5	111.8	0	0	0	107.6
1680	Q	31	Very low	30.6	Very low	136 Å²	136	140.3 Å²	140.3	64%	0.636	73%	0.73	S	S	*	*			cis	-164.7	148.7	-40.9	-114.1	-160.5	81.9	0	0	107.8
1681	G	31.3	Very low	30.4	Very low	74 Å²	74	141.2 Å²	141.2	76%	0.763	73%	0.73	S	S	*	*			trans	153.3	71.4	176.5	0	0	0	0	0	112.6
1682	R	28.5	Very low	30.3	Very low	203 Å²	203	137.4 Å²	137.4	77%	0.766	73%	0.725	S	S	*	*			cis	81.8	148.2	47.8	-145.6	-178.1	-158.3	-172.7	6.7	111.7
1683	I	30.4	Very low	30.3	Very low	147 Å²	147	136.6 Å²	136.6	75%	0.754	72%	0.719	S	S	*	*			trans	81.7	126.6	170	-63.3	165.1	0	0	0	114
1684	L	30	Very low	30.1	Very low	131 Å²	131	137.5 Å²	137.5	69%	0.686	72%	0.717	S	S	*	*			cis	-162.1	157.1	-0.3	-100.7	169.8	0	0	0	111.1
1685	L	30.2	Very low	29.8	Very low	154 Å²	154	140.3 Å²	140.3	81%	0.806	72%	0.724	S	S	*	*			trans	55.7	170.1	144.7	-62.6	164.7	0	0	0	120.5
1686	A	29.2	Very low	29.4	Very low	74 Å²	74	135 Å²	135	61%	0.612	72%	0.718	S	S	*	*			cis	172.5	141.8	-42.7	0	0	0	0	0	107.5
1687	E	28.8	Very low	29	Very low	153 Å²	153	135.2 Å²	135.2	72%	0.715	71%	0.714	S	S	*	*			trans	44.5	141.8	145.4	-71.5	-167.9	-160.8	0	0	125.2
1688	R	28.3	Very low	28.6	Very low	198 Å²	198	139.9 Å²	139.9	75%	0.747	72%	0.717	S	S	*	*			trans	91.5	148.2	145	-74.7	158.8	-167.8	-121.3	-0.4	122
1689	F	27.4	Very low	28.2	Very low	184 Å²	184	144.1 Å²	144.1	81%	0.807	73%	0.725	S	S	*	*			trans	64.1	101.3	176.4	-61.2	-74	0	0	0	115.1
1690	D	26.4	Very low	28	Very low	132 Å²	132	142.3 Å²	142.3	71%	0.706	73%	0.725	S	S	*	*			cis	76.6	132.1	31.6	-154	24.1	0	0	0	115
1691	Q	27.7	Very low	28	Very low	150 Å²	150	141.5 Å²	141.5	70%	0.701	73%	0.729	S	S	*	*			trans	76.5	147.2	167.8	-45.1	-165.2	-3.3	0	0	121.7
1692	I	28.2	Very low	27.7	Very low	154 Å²	154	145.6 Å²	145.6	79%	0.79	73%	0.733	S	S	*	*			trans	68.1	128.2	161.4	-58.2	145.3	0	0	0	115.2
1693	S	27.9	Very low	27.9	Very low	94 Å²	94	141.1 Å²	141.1	66%	0.657	73%	0.73	S	S	*	*			cis	-177.6	138.3	-11	61.8	0	0	0	0	103.6
1694	D	26.3	Very low	27.8	Very low	115 Å²	115	138.3 Å²	138.3	62%	0.615	73%	0.728	S	S	*	*				57.1	141.2	100.5	-159.7	19.8	0	0	0	116.9
1695	K	26.8	Very low	27.7	Very low	172 Å²	172	142.3 Å²	142.3	75%	0.748	74%	0.736	S	S	*	*			trans	64.9	150.1	164.9	-76.1	149.6	-173	138.7	0	120.9
1696	S	25.8	Very low	27.7	Very low	95 Å²	95	141.7 Å²	141.7	66%	0.664	73%	0.733	S	S	*	*			trans	73.6	111.4	147.7	-160.1	0	0	0	0	117.3
1697	L	24.2	Very low	27.6	Very low	135 Å²	135	150.1 Å²	150.1	71%	0.707	75%	0.749	S	S	*	*				58.1	130.3	72.7	-84.7	158.1	0	0	0	114.6
1698	R	25.8	Very low	27.9	Very low	194 Å²	194	148.9 Å²	148.9	73%	0.732	75%	0.752	S	S	*	*			trans	85	123.1	153	-60.4	150.4	-159.2	-97.5	4.5	118.3
1699	H	25.3	Very low	28	Very low	188 Å²	188	143.3 Å²	143.3	87%	0.87	75%	0.749	S	S	*	*			trans	39	109.8	130.9	-64.5	-92.1	0	0	0	120.1
1700	S	28.2	Very low	28.6	Very low	106 Å²	106	139.7 Å²	139.7	74%	0.741	74%	0.737	S	S	*	*			trans	-153.4	109.1	135.7	19.4	0	0	0	0	107.8
1701	T	30.5	Very low	28.9	Very low	118 Å²	118	142.8 Å²	142.8	72%	0.724	74%	0.74	S	S	*	*				60.7	108.7	107.1	57.3	0	0	0	0	113.2
1702	L	26.8	Very low	29.2	Very low	161 Å²	161	142 Å²	142	84%	0.843	74%	0.739	S	S	*	*				63.4	148.2	84.3	-88.3	90	0	0	0	113.5
1703	P	31.1	Very low	29.7	Very low	109 Å²	109	141 Å²	141	71%	0.708	73%	0.731	S	S	*	*			cis	-138.3	177.8	-16.6	35	-14.5	0	0	0	115.8
1704	A	28.4	Very low	30	Very low	87 Å²	87	142.7 Å²	142.7	72%	0.719	73%	0.729	S	S	*	*			trans	-21.4	134.6	164.5	0	0	0	0	0	119.5
1705	Y	29.3	Very low	30.3	Very low	215 Å²	215	141.7 Å²	141.7	84%	0.843	72%	0.719	S	S	*	*			trans	-149.1	139.7	140.5	-91	-72.2	0	0	0	111.4
1706	L	30.5	Very low	31	Very low	142 Å²	142	138 Å²	138	74%	0.743	71%	0.711	S	S	*	*			trans	43.1	109.1	147.5	-61.5	156.7	0	0	0	118.4
1707	W	25.7	Very low	31.5	Very low	250 Å²	250	138.5 Å²	138.5	95%	0.947	71%	0.706	S	S	*	*				39.5	93.2	77.6	-76.3	62.5	0	0	0	115
1708	T	35.8	Very low	32	Very low	128 Å²	128	137.6 Å²	137.6	79%	0.785	70%	0.701	S	S	*	*			trans	-156.9	162.5	139.7	45.5	0	0	0	0	110.2	N1710	T1708-N1710 PolarHBondContact O-N 3.35Å
1709	A	31.1	Very low	32.7	Very low	81 Å²	81	132 Å²	132	67%	0.669	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-11.6	-169.6	0	0	0	0	0	115.7	W1711 L1712	A1709-W1711 VanDerWaalsContact C-N 3.27Å; A1709-W1711 PolarHBondContact O-N 3.15Å; A1709-W1711 VanDerWaalsContact O-N 3.12Å; A1709-L1712 PolarHBondContact O-N 2.81Å
1710	N	38.8	Very low	33.5	Very low	107 Å²	107	126.2 Å²	126.2	57%	0.572	67%	0.672	S	S	*	*	H	α-helix	trans	-62.9	-23.2	-169.2	-74.7	18	0	0	0	115.5	T1708 L1712 E1713 Q1714	T1708-N1710 PolarHBondContact O-N 3.35Å; N1710-L1712 PolarHBondContact O-N 3.39Å; N1710-E1713 PolarHBondContact O-N 2.94Å; N1710-Q1714 PolarHBondContact O-N 3.47Å
1711	W	32.7	Very low	34.2	Very low	198 Å²	198	128.1 Å²	128.1	75%	0.75	67%	0.67	S	S	*	*	H	α-helix	trans	-71.2	-20.7	-176.1	-143.5	81.6	0	0	0	113.1	A1709 F1715	A1709-W1711 VanDerWaalsContact C-N 3.27Å; A1709-W1711 PolarHBondContact O-N 3.15Å; A1709-W1711 VanDerWaalsContact O-N 3.12Å; W1711-F1715 HydrophobicContact CZ3-CD2 4.21Å
1712	L	34.4	Very low	34.7	Very low	132 Å²	132	127.4 Å²	127.4	69%	0.691	66%	0.661	S	S	*	*	H	α-helix	trans	-79	-33.3	172.5	-95.2	153.4	0	0	0	112.3	A1709 N1710 F1715 V1716	A1709-L1712 PolarHBondContact O-N 2.81Å; N1710-L1712 PolarHBondContact O-N 3.39Å; L1712-F1715 PolarHBondContact O-N 3.28Å; L1712-V1716 VanDerWaalsContact O-CG2 3.31Å; L1712-V1716 WeakPolarHBondContact O-CG2 3.45Å; L1712-V1716 PolarHBondContact O-N 3.21Å
1713	E	37.7	Very low	35.7	Very low	133 Å²	133	125.5 Å²	125.5	62%	0.621	65%	0.647	S	S	*	*	H	α-helix	trans	-66.5	-40	177.2	-68	-172	153.3	0	0	112.3	N1710 F1715 V1716 N1717	N1710-E1713 PolarHBondContact O-N 2.94Å; E1713-F1715 VanDerWaalsContact C-N 3.32Å; E1713-F1715 PolarHBondContact O-N 3.47Å; E1713-V1716 PolarHBondContact O-N 3.14Å; E1713-N1717 PolarHBondContact O-N 3.09Å
1714	Q	35	Very low	36.5	Very low	130 Å²	130	122.4 Å²	122.4	61%	0.607	63%	0.628	S	S	*	*	H	α-helix	trans	-65.7	-35.3	174.8	-69.9	-173.2	-9.4	0	0	112.5	N1710 V1716 N1717 L1718	N1710-Q1714 PolarHBondContact O-N 3.47Å; Q1714-V1716 VanDerWaalsContact C-N 3.34Å; Q1714-N1717 PolarHBondContact O-N 3.16Å; Q1714-L1718 WeakPolarHBondContact O-CD1 3.16Å; Q1714-L1718 PolarHBondContact O-N 2.81Å; Q1714-L1718 VanDerWaalsContact O-N 3.13Å
1715	F	32.9	Very low	37	Very low	95 Å²	95	120.9 Å²	120.9	42%	0.417	61%	0.612	S	S	.	*	H	α-helix	trans	-71.7	-29.8	176.2	-147.6	-87.7	0	0	0	112.4	W1711 L1712 E1713 F1797	W1711-F1715 HydrophobicContact CZ3-CD2 4.21Å; L1712-F1715 PolarHBondContact O-N 3.28Å; E1713-F1715 VanDerWaalsContact C-N 3.32Å; E1713-F1715 PolarHBondContact O-N 3.47Å; F1715-F1797 HydrophobicContact CE1-CE1 4.05Å; F1715-F1797 AromaticContact CE1-CZ 3.8Å; F1715-F1797 HydrophobicContact CE1-CZ 3.8Å; F1715-F1797 HydrophobicContact CZ-CE1 4.02Å; F1715-F1797 AromaticContact CZ-CZ 3.77Å; F1715-F1797 HydrophobicContact CZ-CZ 3.77Å
1716	V	40.2	Very low	37.7	Very low	94 Å²	94	115 Å²	115	57%	0.57	59%	0.594	S	S	*	*	H	α-helix	trans	-74.1	-36.2	172.1	170.2	0	0	0	0	111.5	L1712 E1713 Q1714 S1719 S1720	L1712-V1716 VanDerWaalsContact O-CG2 3.31Å; L1712-V1716 WeakPolarHBondContact O-CG2 3.45Å; L1712-V1716 PolarHBondContact O-N 3.21Å; E1713-V1716 PolarHBondContact O-N 3.14Å; Q1714-V1716 VanDerWaalsContact C-N 3.34Å; V1716-S1719 VanDerWaalsContact O-CB 3.25Å; V1716-S1719 WeakPolarHBondContact O-CB 3.49Å; V1716-S1719 PolarHBondContact O-N 2.86Å; V1716-S1719 VanDerWaalsContact O-N 3.1Å; V1716-S1720 PolarHBondContact O-N 2.75Å
1717	N	37.8	Very low	38.5	Very low	106 Å²	106	113.1 Å²	113.1	57%	0.567	58%	0.583	S	S	*	*	H	α-helix	trans	-67.4	-34.9	174.1	-88.5	-17.1	0	0	0	113.6	E1713 Q1714 S1719 S1720 E1721	E1713-N1717 PolarHBondContact O-N 3.09Å; Q1714-N1717 PolarHBondContact O-N 3.16Å; N1717-S1719 PolarHBondContact O-N 2.74Å; N1717-S1720 PolarHBondContact O-N 2.83Å; N1717-S1720 PolarHBondContact O-OG 3.21Å; N1717-E1721 PolarHBondContact O-N 2.87Å
1718	L	33.7	Very low	39.4	Very low	116 Å²	116	110.6 Å²	110.6	61%	0.607	57%	0.574	S	S	*	*	H	α-helix	trans	-64.5	-25.7	170.5	-96.5	84	0	0	0	112.7	Q1714 L1722	Q1714-L1718 WeakPolarHBondContact O-CD1 3.16Å; Q1714-L1718 PolarHBondContact O-N 2.81Å; Q1714-L1718 VanDerWaalsContact O-N 3.13Å; L1718-L1722 PolarHBondContact O-N 3.12Å
1719	S	40.3	Very low	39.7	Very low	76 Å²	76	108.6 Å²	108.6	53%	0.531	57%	0.565	S	S	.	*	H	α-helix	trans	-71.8	-30.8	175.2	-170.3	0	0	0	0	112.6	V1716 N1717 H1723	V1716-S1719 VanDerWaalsContact O-CB 3.25Å; V1716-S1719 WeakPolarHBondContact O-CB 3.49Å; V1716-S1719 PolarHBondContact O-N 2.86Å; V1716-S1719 VanDerWaalsContact O-N 3.1Å; N1717-S1719 PolarHBondContact O-N 2.74Å; S1719-H1723 WeakPolarHBondContact O-CB 3.42Å; S1719-H1723 PolarHBondContact O-N 2.8Å
1720	S	42.4	Very low	40.1	Very low	66 Å²	66	111.1 Å²	111.1	46%	0.462	57%	0.567	S	S	.	*	H	α-helix	trans	-78.6	-36.8	-179.2	62.8	0	0	0	0	112.2	V1716 N1717 H1723 S1724	V1716-S1720 PolarHBondContact O-N 2.75Å; N1717-S1720 PolarHBondContact O-N 2.83Å; N1717-S1720 PolarHBondContact O-OG 3.21Å; S1720-H1723 PolarHBondContact O-N 2.89Å; S1720-S1724 VanDerWaalsContact O-CB 3.32Å; S1720-S1724 WeakPolarHBondContact O-CB 3.24Å; S1720-S1724 PolarHBondContact O-N 2.76Å
1721	E	43.7	Very low	40.2	Very low	147 Å²	147	113.5 Å²	113.5	69%	0.687	57%	0.574	S	S	*	*	H	α-helix	trans	-65.2	-41.1	172.8	-68.5	-163.9	156.2	0	0	112.4	N1717 H1723 S1724 C1725	N1717-E1721 PolarHBondContact O-N 2.87Å; E1721-H1723 VanDerWaalsContact C-N 3.33Å; E1721-H1723 PolarHBondContact O-N 2.91Å; E1721-S1724 WeakPolarHBondContact O-CB 3.37Å; E1721-S1724 PolarHBondContact O-N 3.38Å; E1721-C1725 PolarHBondContact O-N 2.83Å
1722	L	40.6	Very low	40.2	Very low	102 Å²	102	108.7 Å²	108.7	53%	0.534	57%	0.568	S	S	.	*	H	α-helix	trans	-63.9	-39.5	176.3	-159.6	78.1	0	0	0	111.7	L1718 C1725 I1726	L1718-L1722 PolarHBondContact O-N 3.12Å; L1722-C1725 PolarHBondContact O-N 2.8Å; L1722-I1726 HydrophobicContact CG-CD1 4.31Å; L1722-I1726 WeakPolarHBondContact O-CG1 3.37Å; L1722-I1726 PolarHBondContact O-N 3.17Å; L1722-I1726 VanDerWaalsContact O-N 3.17Å
1723	H	46.8	Very low	40.4	Very low	122 Å²	122	110.2 Å²	110.2	57%	0.565	58%	0.577	S	S	*	*	H	α-helix	trans	-66.9	-42.2	175.2	-136	68.2	0	0	0	111.6	S1719 S1720 E1721 C1725 I1726 I1727	S1719-H1723 WeakPolarHBondContact O-CB 3.42Å; S1719-H1723 PolarHBondContact O-N 2.8Å; S1720-H1723 PolarHBondContact O-N 2.89Å; E1721-H1723 VanDerWaalsContact C-N 3.33Å; E1721-H1723 PolarHBondContact O-N 2.91Å; H1723-C1725 PolarHBondContact O-N 2.8Å; H1723-I1726 PolarHBondContact O-N 2.88Å; H1723-I1727 VanDerWaalsContact CD2-CD1 3.42Å; H1723-I1727 WeakPolarHBondContact CD2-CD1 3.45Å; H1723-I1727 WeakPolarHBondContact O-CB 3.44Å; H1723-I1727 WeakPolarHBondContact O-CG1 3.44Å; H1723-I1727 PolarHBondContact O-N 2.77Å
1724	S	48.8	Very low	40.1	Very low	43 Å²	43	107.1 Å²	107.1	30%	0.301	58%	0.581	S	S	.	*	H	α-helix	trans	-58.4	-43.9	175.2	-178.5	0	0	0	0	111.9	S1720 E1721 R1728	S1720-S1724 VanDerWaalsContact O-CB 3.32Å; S1720-S1724 WeakPolarHBondContact O-CB 3.24Å; S1720-S1724 PolarHBondContact O-N 2.76Å; E1721-S1724 WeakPolarHBondContact O-CB 3.37Å; E1721-S1724 PolarHBondContact O-N 3.38Å; S1724-R1728 WeakPolarHBondContact O-CB 3.45Å; S1724-R1728 WeakPolarHBondContact O-CD 3.44Å; S1724-R1728 WeakPolarHBondContact O-CG 3.39Å; S1724-R1728 PolarHBondContact O-N 2.95Å; S1724-R1728 VanDerWaalsContact O-N 3.14Å; S1724-R1728 PolarHBondContact OG-NE 3.33Å; S1724-R1728 PolarHBondContact OG-NH2 2.81Å
1725	C	38.4	Very low	40.1	Very low	56 Å²	56	109.6 Å²	109.6	38%	0.378	60%	0.597	S	S	.	*	H	α-helix	trans	-69.7	-38.1	179.7	-162.8	0	0	0	0	112.8	E1721 L1722 H1723 S1729	E1721-C1725 PolarHBondContact O-N 2.83Å; L1722-C1725 PolarHBondContact O-N 2.8Å; H1723-C1725 PolarHBondContact O-N 2.8Å; C1725-S1729 PolarHBondContact O-N 3.13Å; C1725-S1729 PolarHBondContact O-OG 2.69Å
1726	I	43.4	Very low	40.2	Very low	91 Å²	91	111.6 Å²	111.6	47%	0.467	61%	0.612	S	S	.	*	H	α-helix	trans	-71.7	-46.1	179.5	-67.8	168.5	0	0	0	110.9	L1722 H1723 R1728 S1729 L1730	L1722-I1726 HydrophobicContact CG-CD1 4.31Å; L1722-I1726 WeakPolarHBondContact O-CG1 3.37Å; L1722-I1726 PolarHBondContact O-N 3.17Å; L1722-I1726 VanDerWaalsContact O-N 3.17Å; H1723-I1726 PolarHBondContact O-N 2.88Å; I1726-R1728 VanDerWaalsContact C-N 3.33Å; I1726-R1728 PolarHBondContact O-N 3.38Å; I1726-S1729 PolarHBondContact O-N 3.26Å; I1726-S1729 VanDerWaalsContact O-N 3.15Å; I1726-S1729 PolarHBondContact O-OG 2.91Å; I1726-L1730 HydrophobicContact CG2-CD1 4.4Å
1727	I	48	Very low	40.1	Very low	102 Å²	102	111.8 Å²	111.8	52%	0.523	62%	0.617	S	S	.	*	H	α-helix	trans	-62.7	-39.4	178.9	-71	177.5	0	0	0	111.4	H1723 S1729 L1730	H1723-I1727 VanDerWaalsContact CD2-CD1 3.42Å; H1723-I1727 WeakPolarHBondContact CD2-CD1 3.45Å; H1723-I1727 WeakPolarHBondContact O-CB 3.44Å; H1723-I1727 WeakPolarHBondContact O-CG1 3.44Å; H1723-I1727 PolarHBondContact O-N 2.77Å; I1727-S1729 PolarHBondContact O-N 3.17Å; I1727-L1730 PolarHBondContact O-N 2.77Å
1728	R	45.4	Very low	40.1	Very low	197 Å²	197	113.7 Å²	113.7	74%	0.743	63%	0.627	S	S	*	*	H	α-helix	trans	-69.7	-14.5	178.1	-69.6	173.1	-162.1	-143.3	1.8	114.3	S1724 I1726	S1724-R1728 WeakPolarHBondContact O-CB 3.45Å; S1724-R1728 WeakPolarHBondContact O-CD 3.44Å; S1724-R1728 WeakPolarHBondContact O-CG 3.39Å; S1724-R1728 PolarHBondContact O-N 2.95Å; S1724-R1728 VanDerWaalsContact O-N 3.14Å; S1724-R1728 PolarHBondContact OG-NE 3.33Å; S1724-R1728 PolarHBondContact OG-NH2 2.81Å; I1726-R1728 VanDerWaalsContact C-N 3.33Å; I1726-R1728 PolarHBondContact O-N 3.38Å
1729	S	42.1	Very low	40.5	Very low	86 Å²	86	115.4 Å²	115.4	60%	0.601	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-4.3	-179.3	65.7	0	0	0	0	115.1	C1725 I1726 I1727	C1725-S1729 PolarHBondContact O-N 3.13Å; C1725-S1729 PolarHBondContact O-OG 2.69Å; I1726-S1729 PolarHBondContact O-N 3.26Å; I1726-S1729 VanDerWaalsContact O-N 3.15Å; I1726-S1729 PolarHBondContact O-OG 2.91Å; I1727-S1729 PolarHBondContact O-N 3.17Å
1730	L	39.9	Very low	40.2	Very low	135 Å²	135	116.7 Å²	116.7	71%	0.707	65%	0.645	S	S	*	*	S	Bend	trans	-125	12.9	-170.1	-72.9	170.7	0	0	0	114.6	I1726 I1727 P1732	I1726-L1730 HydrophobicContact CG2-CD1 4.4Å; I1727-L1730 PolarHBondContact O-N 2.77Å; L1730-P1732 WeakPolarHBondContact O-CD 3.42Å
1731	H	39.1	Very low	40	Very low	157 Å²	157	120.1 Å²	120.1	73%	0.727	66%	0.663	S	S	*	*			trans	-83.5	122.2	178.2	-141.9	-73.5	0	0	0	111.6
1732	P	33.5	Very low	39.6	Very low	96 Å²	96	117.8 Å²	117.8	62%	0.623	66%	0.662	S	S	*	*	S	Bend	trans	-76	142.8	172	31.4	-32.8	0	0	0	110.2	L1730	L1730-P1732 WeakPolarHBondContact O-CD 3.42Å
1733	N	38.4	Very low	39.7	Very low	164 Å²	164	115.3 Å²	115.3	88%	0.877	65%	0.653	S	S	*	*	S	Bend	trans	90.2	111.6	-172.4	-54.1	-29.6	0	0	0	113.9
1734	G	32.6	Very low	39.3	Very low	69 Å²	69	117.3 Å²	117.3	71%	0.711	67%	0.667	S	S	*	*			trans	-102.4	-173.3	-176.3	0	0	0	0	0	114.8
1735	L	33.5	Very low	39.1	Very low	181 Å²	181	118.4 Å²	118.4	95%	0.948	68%	0.679	S	S	*	*			trans	105.4	134.8	-179.8	-62.5	160.3	0	0	0	114.8
1736	D	36.2	Very low	39.6	Very low	137 Å²	137	119.5 Å²	119.5	73%	0.733	68%	0.681	S	S	*	*			trans	55.7	89.1	178.9	-78	-30.5	0	0	0	121	N1738	D1736-N1738 PolarHBondContact OD1-ND2 3.17Å
1737	C	36.5	Very low	39.5	Very low	98 Å²	98	118.2 Å²	118.2	66%	0.662	68%	0.68	S	S	*	*			trans	-149.9	86.5	139.7	-152.9	0	0	0	0	112.1	N1739	C1737-N1739 PolarHBondContact O-N 3.1Å
1738	N	37.8	Very low	39.4	Very low	147 Å²	147	116.2 Å²	116.2	79%	0.786	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	32.1	-170.5	-79.2	-46.4	0	0	0	116.4	D1736	D1736-N1738 PolarHBondContact OD1-ND2 3.17Å
1739	N	42.3	Very low	39.6	Very low	151 Å²	151	115.5 Å²	115.5	81%	0.807	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156	18.2	175.4	-122.3	-12.7	0	0	0	116.9	C1737 T1741	C1737-N1739 PolarHBondContact O-N 3.1Å; N1739-T1741 PolarHBondContact O-N 2.95Å
1740	C	34.5	Very low	39.6	Very low	104 Å²	104	117 Å²	117	70%	0.703	67%	0.673	S	S	*	*			trans	-100.4	77.6	-173.8	-70.7	0	0	0	0	113.1	C1742	C1740-C1742 PolarHBondContact O-N 3.12Å
1741	T	38.2	Very low	39.8	Very low	137 Å²	137	118.3 Å²	118.3	84%	0.84	67%	0.669	S	S	*	*			trans	-81.1	91.2	174.1	54.6	0	0	0	0	112.3	N1739	N1739-T1741 PolarHBondContact O-N 2.95Å
1742	C	35.4	Very low	40	Very low	99 Å²	99	118.6 Å²	118.6	67%	0.669	67%	0.665	S	S	*	*			trans	-108.5	110.1	156.8	-81.2	0	0	0	0	108.3	C1740	C1740-C1742 PolarHBondContact O-N 3.12Å
1743	S	42.1	Very low	40.5	Very low	50 Å²	50	118.2 Å²	118.2	35%	0.35	66%	0.657	S	S	.	*			trans	-81	151.3	-180	85.6	0	0	0	0	111.4	A1745 D1746 S1747	S1743-A1745 PolarHBondContact O-N 2.63Å; S1743-A1745 VanDerWaalsContact O-N 3.1Å; S1743-A1745 PolarHBondContact OG-N 3.03Å; S1743-D1746 VanDerWaalsContact CB-OD2 3.29Å; S1743-D1746 WeakPolarHBondContact CB-OD2 3.33Å; S1743-D1746 PolarHBondContact N-OD2 3.04Å; S1743-D1746 PolarHBondContact O-N 2.88Å; S1743-D1746 VanDerWaalsContact OG-CG 3.26Å; S1743-D1746 PolarHBondContact OG-N 3.3Å; S1743-D1746 VanDerWaalsContact OG-N 3.14Å; S1743-D1746 PolarHBondContact OG-OD2 3.34Å; S1743-S1747 PolarHBondContact O-N 3.47Å
1744	L	38.5	Very low	40.9	Very low	163 Å²	163	114.3 Å²	114.3	85%	0.853	64%	0.64	S	S	*	*	H	α-helix	trans	-54.5	-28.8	170.1	-119.7	89.5	0	0	0	112.2	A1748	L1744-A1748 WeakPolarHBondContact O-CB 3.34Å; L1744-A1748 PolarHBondContact O-N 3.04Å; L1744-A1748 VanDerWaalsContact O-N 3.09Å
1745	A	45.4	Very low	41.5	Very low	66 Å²	66	113.8 Å²	113.8	55%	0.545	62%	0.62	S	S	.	*	H	α-helix	trans	-73.2	-29.6	178.5	0	0	0	0	0	112.8	S1743 A1748 R1749	S1743-A1745 PolarHBondContact O-N 2.63Å; S1743-A1745 VanDerWaalsContact O-N 3.1Å; S1743-A1745 PolarHBondContact OG-N 3.03Å; A1745-A1748 PolarHBondContact O-N 2.97Å; A1745-R1749 WeakPolarHBondContact O-CB 3.25Å; A1745-R1749 PolarHBondContact O-N 3.04Å
1746	D	47.8	Very low	42.4	Very low	79 Å²	79	112.7 Å²	112.7	42%	0.422	60%	0.604	S	S	.	*	H	α-helix	trans	-76.1	-39.6	177.1	-60.7	-55.4	0	0	0	111.3	S1743 A1748 R1749 H1750	S1743-D1746 VanDerWaalsContact CB-OD2 3.29Å; S1743-D1746 WeakPolarHBondContact CB-OD2 3.33Å; S1743-D1746 PolarHBondContact N-OD2 3.04Å; S1743-D1746 PolarHBondContact O-N 2.88Å; S1743-D1746 VanDerWaalsContact OG-CG 3.26Å; S1743-D1746 PolarHBondContact OG-N 3.3Å; S1743-D1746 VanDerWaalsContact OG-N 3.14Å; S1743-D1746 PolarHBondContact OG-OD2 3.34Å; D1746-A1748 VanDerWaalsContact C-N 3.3Å; D1746-A1748 PolarHBondContact O-N 3.39Å; D1746-R1749 PolarHBondContact O-N 2.92Å; D1746-H1750 PolarHBondContact O-N 2.83Å
1747	S	42.4	Very low	42.7	Very low	64 Å²	64	110.8 Å²	110.8	45%	0.448	59%	0.593	S	S	.	*	H	α-helix	trans	-58.9	-41.8	168.7	-58.9	0	0	0	0	111.6	S1743 W1751	S1743-S1747 PolarHBondContact O-N 3.47Å; S1747-W1751 PolarHBondContact O-N 3.2Å; S1747-W1751 VanDerWaalsContact O-N 3.14Å
1748	A	45	Very low	43.4	Very low	60 Å²	60	107.8 Å²	107.8	50%	0.496	57%	0.571	S	S	.	*	H	α-helix	trans	-67.8	-37.3	174.6	0	0	0	0	0	113	L1744 A1745 D1746 W1751 Y1752	L1744-A1748 WeakPolarHBondContact O-CB 3.34Å; L1744-A1748 PolarHBondContact O-N 3.04Å; L1744-A1748 VanDerWaalsContact O-N 3.09Å; A1745-A1748 PolarHBondContact O-N 2.97Å; D1746-A1748 VanDerWaalsContact C-N 3.3Å; D1746-A1748 PolarHBondContact O-N 3.39Å; A1748-W1751 PolarHBondContact O-N 3.29Å; A1748-Y1752 PolarHBondContact O-N 2.75Å
1749	R	49.2	Very low	44.1	Very low	182 Å²	182	107.8 Å²	107.8	69%	0.687	56%	0.561	S	S	*	*	H	α-helix	trans	-66.5	-39.9	176.1	-113.5	177.5	178.5	177.4	-0	112.5	A1745 D1746 Y1752 N1753	A1745-R1749 WeakPolarHBondContact O-CB 3.25Å; A1745-R1749 PolarHBondContact O-N 3.04Å; D1746-R1749 PolarHBondContact O-N 2.92Å; R1749-Y1752 PolarHBondContact O-N 2.84Å; R1749-N1753 PolarHBondContact O-N 2.86Å
1750	H	43.9	Very low	44.4	Very low	118 Å²	118	105.5 Å²	105.5	55%	0.546	55%	0.548	S	S	.	.	H	α-helix	trans	-64.2	-43	173.7	-99.8	100.6	0	0	0	111.7	D1746 Y1752 N1753 V1754	D1746-H1750 PolarHBondContact O-N 2.83Å; H1750-Y1752 VanDerWaalsContact C-N 3.32Å; H1750-Y1752 PolarHBondContact O-N 3.06Å; H1750-N1753 PolarHBondContact O-N 3.21Å; H1750-V1754 WeakPolarHBondContact O-CG2 3.35Å; H1750-V1754 PolarHBondContact O-N 2.81Å
1751	W	43	Very low	44.9	Very low	162 Å²	162	104.5 Å²	104.5	61%	0.614	53%	0.534	S	S	*	.	H	α-helix	trans	-57	-43.5	171.7	-109.2	96.9	0	0	0	112.9	S1747 A1748 N1753 V1754 D1755	S1747-W1751 PolarHBondContact O-N 3.2Å; S1747-W1751 VanDerWaalsContact O-N 3.14Å; A1748-W1751 PolarHBondContact O-N 3.29Å; W1751-N1753 VanDerWaalsContact C-N 3.35Å; W1751-N1753 PolarHBondContact O-N 2.83Å; W1751-V1754 PolarHBondContact O-N 3.38Å; W1751-D1755 PolarHBondContact O-N 2.6Å
1752	Y	43.8	Very low	45.4	Very low	164 Å²	164	103.7 Å²	103.7	64%	0.643	52%	0.519	S	S	*	.	H	α-helix	trans	-64.4	-37.3	177.4	-158.3	-88.9	0	0	0	112.7	A1748 R1749 H1750 R1756	A1748-Y1752 PolarHBondContact O-N 2.75Å; R1749-Y1752 PolarHBondContact O-N 2.84Å; H1750-Y1752 VanDerWaalsContact C-N 3.32Å; H1750-Y1752 PolarHBondContact O-N 3.06Å; Y1752-R1756 WeakPolarHBondContact O-CB 3.14Å; Y1752-R1756 PolarHBondContact O-N 3.21Å
1753	N	43.9	Very low	46.2	Very low	87 Å²	87	104.5 Å²	104.5	47%	0.465	51%	0.513	S	S	.	.	H	α-helix	trans	-71.3	-39.3	176.2	-79.7	-24.6	0	0	0	112.7	R1749 H1750 W1751 R1756 L1757	R1749-N1753 PolarHBondContact O-N 2.86Å; H1750-N1753 PolarHBondContact O-N 3.21Å; W1751-N1753 VanDerWaalsContact C-N 3.35Å; W1751-N1753 PolarHBondContact O-N 2.83Å; N1753-R1756 PolarHBondContact O-N 3.31Å; N1753-L1757 WeakPolarHBondContact O-CB 3.46Å; N1753-L1757 PolarHBondContact O-N 3.06Å
1754	V	46.2	Very low	46.4	Very low	83 Å²	83	106 Å²	106	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-63.1	-43.3	174.6	172	0	0	0	0	110.9	H1750 W1751 L1757 T1758	H1750-V1754 WeakPolarHBondContact O-CG2 3.35Å; H1750-V1754 PolarHBondContact O-N 2.81Å; W1751-V1754 PolarHBondContact O-N 3.38Å; V1754-L1757 PolarHBondContact O-N 3.41Å; V1754-T1758 WeakPolarHBondContact O-CB 3.18Å; V1754-T1758 PolarHBondContact O-N 3.46Å; V1754-T1758 PolarHBondContact O-OG1 3.39Å
1755	D	46.3	Very low	46.8	Very low	57 Å²	57	99.9 Å²	99.9	31%	0.305	49%	0.494	S	S	.	.	H	α-helix	trans	-65.4	-38.9	174.2	-174.2	44.3	0	0	0	111.5	W1751 L1757 T1758 R1759	W1751-D1755 PolarHBondContact O-N 2.6Å; D1755-L1757 PolarHBondContact O-N 3.09Å; D1755-T1758 PolarHBondContact O-N 3.33Å; D1755-R1759 WeakPolarHBondContact O-CB 3.43Å; D1755-R1759 VanDerWaalsContact O-CG 3.28Å; D1755-R1759 WeakPolarHBondContact O-CG 3.45Å; D1755-R1759 PolarHBondContact O-N 3.04Å; D1755-R1759 IonicContact OD1-NE 2.88Å; D1755-R1759 IonicContact OD2-CZ 2.64Å; D1755-R1759 IonicContact OD2-NE 3.15Å; D1755-R1759 PolarHBondContact OD2-NE 3.09Å; D1755-R1759 IonicContact OD2-NH2 3.92Å; D1755-R1759 PolarHBondContact OD2-NH2 2.91Å
1756	R	52.1	Low	46.9	Very low	159 Å²	159	99.9 Å²	99.9	60%	0.6	48%	0.48	S	S	*	.	H	α-helix	trans	-61.2	-41.7	174.5	-164.7	178.6	-170.9	-159.5	2.4	112.7	Y1752 N1753 R1759 L1760	Y1752-R1756 WeakPolarHBondContact O-CB 3.14Å; Y1752-R1756 PolarHBondContact O-N 3.21Å; N1753-R1756 PolarHBondContact O-N 3.31Å; R1756-R1759 PolarHBondContact O-N 3.43Å; R1756-L1760 WeakPolarHBondContact O-CG 3.38Å; R1756-L1760 PolarHBondContact O-N 2.77Å
1757	L	43.3	Very low	47	Very low	97 Å²	97	101.7 Å²	101.7	51%	0.508	49%	0.489	S	S	.	.	H	α-helix	trans	-68.1	-38.8	176.6	-129.2	149.8	0	0	0	111.3	N1753 V1754 D1755 L1760 M1761	N1753-L1757 WeakPolarHBondContact O-CB 3.46Å; N1753-L1757 PolarHBondContact O-N 3.06Å; V1754-L1757 PolarHBondContact O-N 3.41Å; D1755-L1757 PolarHBondContact O-N 3.09Å; L1757-L1760 PolarHBondContact O-N 3.21Å; L1757-M1761 HydrophobicContact CD2-CE 4Å; L1757-M1761 PolarHBondContact O-N 2.88Å
1758	T	50.1	Low	47.2	Very low	34 Å²	34	104.6 Å²	104.6	21%	0.209	50%	0.497	C	S	.	.	H	α-helix	trans	-65.8	-39.4	174.3	-54.5	0	0	0	0	111.8	V1754 D1755 K1762	V1754-T1758 WeakPolarHBondContact O-CB 3.18Å; V1754-T1758 PolarHBondContact O-N 3.46Å; V1754-T1758 PolarHBondContact O-OG1 3.39Å; D1755-T1758 PolarHBondContact O-N 3.33Å; T1758-K1762 HydrophobicContact CG2-CD 4.4Å; T1758-K1762 WeakPolarHBondContact O-CB 3.3Å; T1758-K1762 WeakPolarHBondContact O-CG 3.46Å; T1758-K1762 PolarHBondContact O-N 3.3Å
1759	R	51.9	Low	47.3	Very low	148 Å²	148	105.6 Å²	105.6	56%	0.558	49%	0.494	S	S	*	.	H	α-helix	trans	-64.1	-46.1	172.2	-72.5	177.8	-162.5	-153.9	7.3	111.4	D1755 R1756 M1761 K1762 Q1763	D1755-R1759 WeakPolarHBondContact O-CB 3.43Å; D1755-R1759 VanDerWaalsContact O-CG 3.28Å; D1755-R1759 WeakPolarHBondContact O-CG 3.45Å; D1755-R1759 PolarHBondContact O-N 3.04Å; D1755-R1759 IonicContact OD1-NE 2.88Å; D1755-R1759 IonicContact OD2-CZ 2.64Å; D1755-R1759 IonicContact OD2-NE 3.15Å; D1755-R1759 PolarHBondContact OD2-NE 3.09Å; D1755-R1759 IonicContact OD2-NH2 3.92Å; D1755-R1759 PolarHBondContact OD2-NH2 2.91Å; R1756-R1759 PolarHBondContact O-N 3.43Å; R1759-M1761 PolarHBondContact O-N 2.85Å; R1759-K1762 CarbonylContact O-C 3.52Å; R1759-K1762 PolarHBondContact O-N 3.26Å; R1759-Q1763 VanDerWaalsContact O-CB 3.32Å; R1759-Q1763 WeakPolarHBondContact O-CB 3.26Å; R1759-Q1763 PolarHBondContact O-N 2.75Å
1760	L	50.4	Low	47.1	Very low	102 Å²	102	101.1 Å²	101.1	53%	0.534	49%	0.487	S	S	.	.	H	α-helix	trans	-61.4	-44.2	177.9	-76.7	167.4	0	0	0	112.4	R1756 L1757 Q1763 S1764	R1756-L1760 WeakPolarHBondContact O-CG 3.38Å; R1756-L1760 PolarHBondContact O-N 2.77Å; L1757-L1760 PolarHBondContact O-N 3.21Å; L1760-Q1763 PolarHBondContact O-N 2.85Å; L1760-S1764 PolarHBondContact O-N 2.94Å
1761	M	44.9	Very low	46.8	Very low	84 Å²	84	107.9 Å²	107.9	41%	0.414	51%	0.508	S	S	.	.	H	α-helix	trans	-64.8	-40.2	174.5	-74.2	-155.3	-94.7	0	0	112.4	L1757 R1759 S1765 F1797	L1757-M1761 HydrophobicContact CD2-CE 4Å; L1757-M1761 PolarHBondContact O-N 2.88Å; R1759-M1761 PolarHBondContact O-N 2.85Å; M1761-S1765 WeakPolarHBondContact O-CB 3.49Å; M1761-S1765 PolarHBondContact O-N 3.24Å; M1761-F1797 HydrophobicContact CE-CE2 4.26Å; M1761-F1797 HydrophobicContact CE-CZ 4.28Å
1762	K	47.3	Very low	47.2	Very low	120 Å²	120	108.1 Å²	108.1	52%	0.522	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-40.2	171.9	-78.2	174	179.2	171.9	0	111.8	T1758 R1759 S1765 R1766	T1758-K1762 HydrophobicContact CG2-CD 4.4Å; T1758-K1762 WeakPolarHBondContact O-CB 3.3Å; T1758-K1762 WeakPolarHBondContact O-CG 3.46Å; T1758-K1762 PolarHBondContact O-N 3.3Å; R1759-K1762 CarbonylContact O-C 3.52Å; R1759-K1762 PolarHBondContact O-N 3.26Å; K1762-S1765 PolarHBondContact O-N 3.17Å; K1762-R1766 VanDerWaalsContact O-CD 3.25Å; K1762-R1766 WeakPolarHBondContact O-CD 3.48Å; K1762-R1766 WeakPolarHBondContact O-CG 3.14Å; K1762-R1766 PolarHBondContact O-N 3Å
1763	Q	52.4	Low	47.2	Very low	116 Å²	116	109.5 Å²	109.5	54%	0.542	52%	0.521	S	S	.	.	H	α-helix	trans	-70.9	-42	-177.2	-156	164.7	11.8	0	0	112	R1759 L1760 R1766 N1767	R1759-Q1763 VanDerWaalsContact O-CB 3.32Å; R1759-Q1763 WeakPolarHBondContact O-CB 3.26Å; R1759-Q1763 PolarHBondContact O-N 2.75Å; L1760-Q1763 PolarHBondContact O-N 2.85Å; Q1763-R1766 PolarHBondContact O-N 3.26Å; Q1763-N1767 PolarHBondContact O-N 3.22Å
1764	S	47.3	Very low	47.2	Very low	80 Å²	80	109.3 Å²	109.3	56%	0.559	52%	0.518	S	S	*	.	H	α-helix	trans	-61.8	-42.9	171.9	-172.8	0	0	0	0	112.1	L1760 R1766 N1767	L1760-S1764 PolarHBondContact O-N 2.94Å; S1764-R1766 PolarHBondContact O-N 3.47Å; S1764-N1767 PolarHBondContact O-N 2.86Å
1765	S	45.2	Very low	46.8	Very low	35 Å²	35	109.9 Å²	109.9	25%	0.245	52%	0.523	C	S	.	.	H	α-helix	trans	-62.1	-24	176.4	-178.6	0	0	0	0	114.4	M1761 K1762 L1769	M1761-S1765 WeakPolarHBondContact O-CB 3.49Å; M1761-S1765 PolarHBondContact O-N 3.24Å; K1762-S1765 PolarHBondContact O-N 3.17Å; S1765-L1769 WeakPolarHBondContact O-CD1 3.38Å
1766	R	48.7	Very low	47	Very low	67 Å²	67	116 Å²	116	25%	0.253	55%	0.55	S	S	.	.	H	α-helix	trans	-83.8	-42.9	-179.1	-69.1	160.8	174.3	-140.5	-8.7	111.8	C1296 P1297 D1298 G1299 K1762 Q1763 S1764 M1768 L1769	C1296-R1766 PolarHBondContact O-NH2 3.24Å; P1297-R1766 HydrophobicContact CB-CG 4.36Å; P1297-R1766 WeakPolarHBondContact O-CD 3.47Å; P1297-R1766 WeakPolarHBondContact O-CG 3.47Å; P1297-R1766 PolarHBondContact O-NE 3.47Å; P1297-R1766 PolarHBondContact O-NH1 3.37Å; D1298-R1766 PolarHBondContact O-NH1 2.04Å; G1299-R1766 VanDerWaalsContact CA-NH2 3.26Å; K1762-R1766 VanDerWaalsContact O-CD 3.25Å; K1762-R1766 WeakPolarHBondContact O-CD 3.48Å; K1762-R1766 WeakPolarHBondContact O-CG 3.14Å; K1762-R1766 PolarHBondContact O-N 3Å; Q1763-R1766 PolarHBondContact O-N 3.26Å; S1764-R1766 PolarHBondContact O-N 3.47Å; R1766-M1768 PolarHBondContact O-N 3.35Å; R1766-L1769 PolarHBondContact O-N 2.99Å
1767	N	49	Very low	46.7	Very low	117 Å²	117	112.3 Å²	112.3	63%	0.626	54%	0.54	S	S	*	.	H	α-helix	trans	-65.7	-21.8	-178.3	-71.2	-3	0	0	0	113.3	Q1763 S1764 T1770	Q1763-N1767 PolarHBondContact O-N 3.22Å; S1764-N1767 PolarHBondContact O-N 2.86Å; N1767-T1770 PolarHBondContact O-OG1 3.41Å
1768	M	46.5	Very low	47.1	Very low	124 Å²	124	114.1 Å²	114.1	61%	0.611	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-5.3	172.4	-80.8	-165.2	167.1	0	0	115.3	R1766 L1790	R1766-M1768 PolarHBondContact O-N 3.35Å; M1768-L1790 HydrophobicContact SD-CD1 4.32Å
1769	L	48.9	Very low	47.3	Very low	81 Å²	81	114.6 Å²	114.6	42%	0.424	56%	0.563	S	S	.	*	S	Bend	trans	-99.5	-2.8	-177.7	-77.4	170.5	0	0	0	114.2	S1765 R1766 V1787	S1765-L1769 WeakPolarHBondContact O-CD1 3.38Å; R1766-L1769 PolarHBondContact O-N 2.99Å; L1769-V1787 HydrophobicContact CD2-CG1 4.45Å
1770	T	43.6	Very low	47.5	Very low	89 Å²	89	112.7 Å²	112.7	55%	0.546	57%	0.569	S	S	.	*	S	Bend	trans	-85.3	145.9	175.1	50.7	0	0	0	0	112.1	N1767 Q1772	N1767-T1770 PolarHBondContact O-OG1 3.41Å; T1770-Q1772 PolarHBondContact O-N 2.93Å
1771	R	37.9	Very low	48.1	Very low	260 Å²	260	115.5 Å²	115.5	98%	0.981	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	12.4	-158.1	-139.6	178.7	-169.5	-178.7	2.6	116.4
1772	Q	51	Low	48.9	Very low	166 Å²	166	115.8 Å²	115.8	78%	0.776	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-16	-168.4	-80.8	176.8	-33.7	0	0	115.9	T1770	T1770-Q1772 PolarHBondContact O-N 2.93Å
1773	Y	45.3	Very low	49.6	Very low	194 Å²	194	114.1 Å²	114.1	76%	0.761	57%	0.573	S	S	*	*	S	Bend	trans	-112	21.4	-162.5	-88.3	-81.5	0	0	0	117.6
1774	M	42.9	Very low	50.1	Low	83 Å²	83	111.5 Å²	111.5	41%	0.409	57%	0.571	S	S	.	*			trans	-140.6	100.2	168.3	-68.3	-166.8	176.1	0	0	113.8	R1783	M1774-R1783 VanDerWaalsContact C-NH2 3.3Å; M1774-R1783 PolarHBondContact O-NH1 3.08Å; M1774-R1783 PolarHBondContact O-NH2 3.33Å
1775	P	37.8	Very low	51.1	Low	94 Å²	94	110.2 Å²	110.2	61%	0.61	57%	0.565	S	S	*	*			trans	-95.6	173	152.2	9.5	11.8	0	0	0	111
1776	H	49.8	Very low	52.1	Low	186 Å²	186	111.4 Å²	111.4	86%	0.861	57%	0.568	S	S	*	*			trans	62.9	35.7	169	-50.1	-67.1	0	0	0	120.8
1777	M	46.3	Very low	52.8	Low	81 Å²	81	110.6 Å²	110.6	40%	0.399	57%	0.57	S	S	.	*			trans	-108.7	115.3	159.1	-88.9	-168.7	171.6	0	0	110.9	S1779 L1782 I1786	M1777-S1779 VanDerWaalsContact C-N 3.28Å; M1777-S1779 PolarHBondContact O-N 3.48Å; M1777-L1782 HydrophobicContact SD-CD2 4.5Å; M1777-I1786 HydrophobicContact CE-CD1 3.7Å; M1777-I1786 HydrophobicContact SD-CD1 3.83Å
1778	P	52	Low	53.5	Low	136 Å²	136	112.8 Å²	112.8	88%	0.883	57%	0.574	S	S	*	*	S	Bend	trans	-68.8	-16.5	-172	-22.9	33.6	0	0	0	116.2
1779	S	53.4	Low	54.2	Low	44 Å²	44	109.3 Å²	109.3	31%	0.308	57%	0.566	S	S	.	*			trans	-111.5	114.6	-175.3	173.1	0	0	0	0	111.3	M1777 H1781 L1782 R1783	M1777-S1779 VanDerWaalsContact C-N 3.28Å; M1777-S1779 PolarHBondContact O-N 3.48Å; S1779-H1781 PolarHBondContact O-N 3.36Å; S1779-H1781 PolarHBondContact OG-N 3.48Å; S1779-L1782 PolarHBondContact O-N 3.21Å; S1779-L1782 VanDerWaalsContact O-N 3.13Å; S1779-L1782 PolarHBondContact OG-N 3.39Å; S1779-L1782 VanDerWaalsContact OG-N 3.09Å; S1779-R1783 PolarHBondContact O-N 3.25Å; S1779-R1783 VanDerWaalsContact O-N 3.08Å
1780	P	57.6	Low	54.3	Low	107 Å²	107	109.2 Å²	109.2	70%	0.695	57%	0.565	S	S	*	*	H	α-helix	trans	-57.4	-36.9	171.8	-24.2	33.9	0	0	0	112	A1784	P1780-A1784 VanDerWaalsContact O-CB 3.3Å; P1780-A1784 WeakPolarHBondContact O-CB 3.46Å; P1780-A1784 PolarHBondContact O-N 2.95Å
1781	H	61.9	Low	54.8	Low	161 Å²	161	112 Å²	112	75%	0.745	57%	0.565	S	S	*	*	H	α-helix	trans	-64.4	-39.9	176	-71	-63	0	0	0	112.4	S1779 A1785	S1779-H1781 PolarHBondContact O-N 3.36Å; S1779-H1781 PolarHBondContact OG-N 3.48Å; H1781-A1785 VanDerWaalsContact O-CB 3.23Å; H1781-A1785 WeakPolarHBondContact O-CB 3.35Å; H1781-A1785 PolarHBondContact O-N 3.08Å
1782	L	61.4	Low	55.5	Low	91 Å²	91	106.9 Å²	106.9	48%	0.476	55%	0.55	S	S	.	*	H	α-helix	trans	-69.6	-43.4	178.4	-163.3	75.6	0	0	0	111.5	M1777 S1779 A1784 A1785 I1786	M1777-L1782 HydrophobicContact SD-CD2 4.5Å; S1779-L1782 PolarHBondContact O-N 3.21Å; S1779-L1782 VanDerWaalsContact O-N 3.13Å; S1779-L1782 PolarHBondContact OG-N 3.39Å; S1779-L1782 VanDerWaalsContact OG-N 3.09Å; L1782-A1784 VanDerWaalsContact C-N 3.34Å; L1782-A1784 PolarHBondContact O-N 2.82Å; L1782-A1785 PolarHBondContact O-N 3.04Å; L1782-A1785 VanDerWaalsContact O-N 3.17Å; L1782-I1786 HydrophobicContact CG-CD1 4.17Å; L1782-I1786 WeakPolarHBondContact O-CG1 3.41Å; L1782-I1786 PolarHBondContact O-N 3.39Å
1783	R	62	Low	55.4	Low	85 Å²	85	104.9 Å²	104.9	32%	0.321	54%	0.544	S	S	.	.	H	α-helix	trans	-61.3	-43.4	175.2	-173.9	178.8	-77.6	-159.6	-5	111.3	M1774 S1779 V1787	M1774-R1783 VanDerWaalsContact C-NH2 3.3Å; M1774-R1783 PolarHBondContact O-NH1 3.08Å; M1774-R1783 PolarHBondContact O-NH2 3.33Å; S1779-R1783 PolarHBondContact O-N 3.25Å; S1779-R1783 VanDerWaalsContact O-N 3.08Å; R1783-V1787 WeakPolarHBondContact O-CG2 3.37Å; R1783-V1787 PolarHBondContact O-N 3.46Å; R1783-V1787 VanDerWaalsContact O-N 3.13Å
1784	A	64.4	Low	55.6	Low	60 Å²	60	99.1 Å²	99.1	50%	0.496	53%	0.53	S	S	.	.	H	α-helix	trans	-63.6	-40.1	173.7	0	0	0	0	0	112.3	P1780 L1782 K1788	P1780-A1784 VanDerWaalsContact O-CB 3.3Å; P1780-A1784 WeakPolarHBondContact O-CB 3.46Å; P1780-A1784 PolarHBondContact O-N 2.95Å; L1782-A1784 VanDerWaalsContact C-N 3.34Å; L1782-A1784 PolarHBondContact O-N 2.82Å; A1784-K1788 WeakPolarHBondContact O-CB 3.32Å; A1784-K1788 PolarHBondContact O-N 3.31Å
1785	A	67.7	Low	55.8	Low	53 Å²	53	99.6 Å²	99.6	44%	0.438	53%	0.529	S	S	.	.	H	α-helix	trans	-64.7	-43.5	178.2	0	0	0	0	0	112.4	H1781 L1782 K1788 A1789	H1781-A1785 VanDerWaalsContact O-CB 3.23Å; H1781-A1785 WeakPolarHBondContact O-CB 3.35Å; H1781-A1785 PolarHBondContact O-N 3.08Å; L1782-A1785 PolarHBondContact O-N 3.04Å; L1782-A1785 VanDerWaalsContact O-N 3.17Å; A1785-K1788 CarbonylContact O-C 3.55Å; A1785-K1788 PolarHBondContact O-N 3.37Å; A1785-A1789 WeakPolarHBondContact O-CB 3.43Å; A1785-A1789 PolarHBondContact O-N 2.91Å
1786	I	65.3	Low	56.5	Low	60 Å²	60	101 Å²	101	31%	0.308	53%	0.532	S	S	.	.	H	α-helix	trans	-65.6	-46.8	178.4	-68	167.1	0	0	0	110.9	M1777 L1782 K1788 A1789 L1790	M1777-I1786 HydrophobicContact CE-CD1 3.7Å; M1777-I1786 HydrophobicContact SD-CD1 3.83Å; L1782-I1786 HydrophobicContact CG-CD1 4.17Å; L1782-I1786 WeakPolarHBondContact O-CG1 3.41Å; L1782-I1786 PolarHBondContact O-N 3.39Å; I1786-K1788 VanDerWaalsContact C-N 3.27Å; I1786-K1788 PolarHBondContact O-N 3.09Å; I1786-A1789 PolarHBondContact O-N 3.32Å; I1786-A1789 VanDerWaalsContact O-N 3.17Å; I1786-L1790 HydrophobicContact CG2-CD1 4.07Å; I1786-L1790 PolarHBondContact O-N 2.89Å
1787	V	65.3	Low	55.9	Low	50 Å²	50	97.9 Å²	97.9	30%	0.303	52%	0.516	S	S	.	.	H	α-helix	trans	-61.9	-37.4	175	173.4	0	0	0	0	111.1	L1769 R1783 R1791	L1769-V1787 HydrophobicContact CD2-CG1 4.45Å; R1783-V1787 WeakPolarHBondContact O-CG2 3.37Å; R1783-V1787 PolarHBondContact O-N 3.46Å; R1783-V1787 VanDerWaalsContact O-N 3.13Å; V1787-R1791 VanDerWaalsContact O-CB 3.31Å; V1787-R1791 WeakPolarHBondContact O-CB 3.31Å; V1787-R1791 WeakPolarHBondContact O-CG 3.37Å; V1787-R1791 PolarHBondContact O-N 3.31Å
1788	K	63.6	Low	55.4	Low	163 Å²	163	100.8 Å²	100.8	71%	0.709	53%	0.528	S	S	*	.	H	α-helix	trans	-70	-32.7	176.2	-166.1	171.4	-171.2	173.3	0	112.4	A1784 A1785 I1786 K1792	A1784-K1788 WeakPolarHBondContact O-CB 3.32Å; A1784-K1788 PolarHBondContact O-N 3.31Å; A1785-K1788 CarbonylContact O-C 3.55Å; A1785-K1788 PolarHBondContact O-N 3.37Å; I1786-K1788 VanDerWaalsContact C-N 3.27Å; I1786-K1788 PolarHBondContact O-N 3.09Å; K1788-K1792 WeakPolarHBondContact O-CB 3.35Å; K1788-K1792 PolarHBondContact O-N 2.76Å
1789	A	59.5	Low	54.4	Low	52 Å²	52	101.4 Å²	101.4	43%	0.43	53%	0.529	S	S	.	.	H	α-helix	trans	-71.6	-48.5	175.3	0	0	0	0	0	111.9	A1785 I1786 R1791 K1792 L1793	A1785-A1789 WeakPolarHBondContact O-CB 3.43Å; A1785-A1789 PolarHBondContact O-N 2.91Å; I1786-A1789 PolarHBondContact O-N 3.32Å; I1786-A1789 VanDerWaalsContact O-N 3.17Å; A1789-R1791 VanDerWaalsContact C-N 3.35Å; A1789-R1791 PolarHBondContact O-N 3.4Å; A1789-K1792 WeakPolarHBondContact O-CA 3.25Å; A1789-K1792 WeakPolarHBondContact O-CB 3.28Å; A1789-K1792 PolarHBondContact O-N 2.96Å; A1789-L1793 PolarHBondContact O-N 3.47Å
1790	L	51.3	Low	53.1	Low	78 Å²	78	108.7 Å²	108.7	41%	0.408	56%	0.555	S	S	.	*	H	α-helix	trans	-60.1	-42.6	175.8	-74	167.1	0	0	0	111.8	M1768 I1786 K1792 L1793 T1794	M1768-L1790 HydrophobicContact SD-CD1 4.32Å; I1786-L1790 HydrophobicContact CG2-CD1 4.07Å; I1786-L1790 PolarHBondContact O-N 2.89Å; L1790-K1792 PolarHBondContact O-N 3.38Å; L1790-L1793 PolarHBondContact O-N 2.86Å; L1790-T1794 PolarHBondContact O-N 2.78Å; L1790-T1794 PolarHBondContact O-OG1 2.63Å
1791	R	55.1	Low	51.7	Low	147 Å²	147	111.1 Å²	111.1	56%	0.555	58%	0.575	S	S	*	*	H	α-helix	trans	-66.3	-17.3	171.9	-77.1	179.9	171.1	178.5	-2.9	114.5	V1787 A1789	V1787-R1791 VanDerWaalsContact O-CB 3.31Å; V1787-R1791 WeakPolarHBondContact O-CB 3.31Å; V1787-R1791 WeakPolarHBondContact O-CG 3.37Å; V1787-R1791 PolarHBondContact O-N 3.31Å; A1789-R1791 VanDerWaalsContact C-N 3.35Å; A1789-R1791 PolarHBondContact O-N 3.4Å
1792	K	52	Low	51.2	Low	154 Å²	154	108.7 Å²	108.7	67%	0.67	57%	0.566	S	S	*	*	H	α-helix	trans	-84.2	-42.2	176.3	-143.8	-179.5	-176.8	-167.2	0	110.8	K1788 A1789 L1790 K1795	K1788-K1792 WeakPolarHBondContact O-CB 3.35Å; K1788-K1792 PolarHBondContact O-N 2.76Å; A1789-K1792 WeakPolarHBondContact O-CA 3.25Å; A1789-K1792 WeakPolarHBondContact O-CB 3.28Å; A1789-K1792 PolarHBondContact O-N 2.96Å; L1790-K1792 PolarHBondContact O-N 3.38Å; K1792-K1795 PolarHBondContact O-N 2.98Å
1793	L	48	Very low	50.7	Low	124 Å²	124	109.6 Å²	109.6	65%	0.649	57%	0.571	S	S	*	*	H	α-helix	trans	-60.2	-46.2	176.3	-82	159.3	0	0	0	112.2	A1789 L1790 K1795	A1789-L1793 PolarHBondContact O-N 3.47Å; L1790-L1793 PolarHBondContact O-N 2.86Å; L1793-K1795 PolarHBondContact O-N 3.25Å
1794	T	50.2	Low	50	Low	73 Å²	73	110.9 Å²	110.9	45%	0.448	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71	-12.5	-179.7	51.5	0	0	0	0	114.6	L1790	L1790-T1794 PolarHBondContact O-N 2.78Å; L1790-T1794 PolarHBondContact O-OG1 2.63Å
1795	K	48.4	Very low	49.2	Very low	93 Å²	93	113.9 Å²	113.9	40%	0.404	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.7	-6.4	-177.1	-112.6	-177.8	179.1	-176.9	0	115.4	K1293 K1792 L1793	K1293-K1795 PolarHBondContact NZ-O 2.79Å; K1792-K1795 PolarHBondContact O-N 2.98Å; L1793-K1795 PolarHBondContact O-N 3.25Å
1796	N	51.1	Low	48	Very low	124 Å²	124	117.8 Å²	117.8	66%	0.663	60%	0.6	S	S	*	*	S	Bend	trans	-106.5	-9.5	-171	-76.6	7.8	0	0	0	115.2	H1798	N1796-H1798 VanDerWaalsContact C-N 3.31Å; N1796-H1798 PolarHBondContact O-N 3.08Å; N1796-H1798 VanDerWaalsContact O-N 3.07Å
1797	F	37.3	Very low	46.9	Very low	120 Å²	120	121.6 Å²	121.6	53%	0.526	62%	0.619	S	S	.	*			trans	-84.6	59.4	179	-96.5	-84.5	0	0	0	113.1	F1715 M1761	F1715-F1797 HydrophobicContact CE1-CE1 4.05Å; F1715-F1797 AromaticContact CE1-CZ 3.8Å; F1715-F1797 HydrophobicContact CE1-CZ 3.8Å; F1715-F1797 HydrophobicContact CZ-CE1 4.02Å; F1715-F1797 AromaticContact CZ-CZ 3.77Å; F1715-F1797 HydrophobicContact CZ-CZ 3.77Å; M1761-F1797 HydrophobicContact CE-CE2 4.26Å; M1761-F1797 HydrophobicContact CE-CZ 4.28Å
1798	H	36.8	Very low	45.6	Very low	142 Å²	142	126.7 Å²	126.7	66%	0.657	64%	0.642	S	S	*	*			trans	-122.1	117.4	171.3	-97.1	-84.7	0	0	0	110.3	N1796	N1796-H1798 VanDerWaalsContact C-N 3.31Å; N1796-H1798 PolarHBondContact O-N 3.08Å; N1796-H1798 VanDerWaalsContact O-N 3.07Å
1799	V	30.7	Very low	44.2	Very low	149 Å²	149	123.9 Å²	123.9	90%	0.903	64%	0.637	S	S	*	*			trans	-134.4	150.9	166.2	-179.5	0	0	0	0	108.1
1800	K	26.6	Very low	42.9	Very low	196 Å²	196	129.9 Å²	129.9	85%	0.852	65%	0.654	S	S	*	*			trans	-64.1	138.9	-172.8	-65.1	173.8	174.1	-179.9	0	113.4
1801	S	27.5	Very low	42.1	Very low	159 Å²	159	134.6 Å²	134.6	100%	1.112	68%	0.676	S	S	*	*				-116.9	0	123.8	62.6	0	0	0	0	106.5

Retrieved 1,801 of 1,801 residues in 4424.4 ms (Link to these results)

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